#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3n8f s TRP 2 N 0.00 3.46 0.00 7.33 0.52 -1.26 -5.04 118.94 123.95 3n8f s TRP 2 Ca 0.00 0.67 0.00 0.00 0.02 0.00 0.00 56.10 56.79 3n8f s TRP 2 Cb 0.00 -2.10 0.00 0.00 -1.15 0.00 0.00 33.47 30.22 3n8f s TRP 2 CO 0.00 0.33 0.50 0.39 0.02 0.00 0.00 176.95 178.19 3n8f n GLU 3 N -0.21 0.52 -3.05 4.98 -0.58 -1.26 -4.90 120.64 116.14 3n8f n GLU 3 Ca -0.01 -0.62 -0.24 0.00 -0.42 0.00 0.00 57.16 55.86 3n8f n GLU 3 Cb 0.52 -0.74 -0.04 0.00 -0.57 0.00 0.00 31.44 30.62 3n8f n GLU 3 CO 0.00 0.00 0.00 1.55 -0.48 0.00 0.00 177.13 178.20 3n8f n VAL 4 N -0.12 1.92 0.00 2.62 3.14 -1.26 -4.57 118.33 120.05 3n8f n VAL 4 Ca 0.00 -5.21 0.00 0.00 -2.96 0.00 0.00 64.34 56.17 3n8f n VAL 4 Cb 0.26 -1.10 0.00 0.00 -1.06 0.00 0.00 33.84 31.94 3n8f n VAL 4 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 3n8f n GLY 5 N 0.03 1.60 7.00 7.55 0.00 -1.26 -5.03 105.19 115.08 3n8f n GLY 5 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.31 3n8f n GLY 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n8f n GLY 7 N 0.00 -0.60 3.12 0.00 0.00 -1.26 -4.93 105.19 101.52 3n8f n GLY 7 Ca 0.00 -1.08 -0.33 0.00 0.00 0.00 0.00 46.02 44.61 3n8f n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n8f s ALA 8 N -0.11 2.31 0.00 4.61 0.00 -1.26 -4.95 121.76 122.37 3n8f s ALA 8 Ca 0.00 -1.20 0.00 0.00 0.00 0.00 0.00 51.96 50.76 3n8f s ALA 8 Cb 0.00 -1.16 0.00 0.00 0.00 0.00 0.00 23.12 21.96 3n8f s ALA 8 CO 0.00 -0.33 0.00 -0.35 0.00 0.00 0.00 175.76 175.08 3n8f n PRO 9 N 4.58 0.00 -2.79 0.00 -0.04 -1.26 -4.97 135.00 130.52 3n8f n PRO 9 Ca -0.21 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 62.82 3n8f n PRO 9 Cb 0.50 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.92 3n8f n PRO 9 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 3n8f s VAL 10 N 3.41 4.36 0.41 0.52 0.11 -1.26 -4.87 120.40 123.07 3n8f s VAL 10 Ca 0.00 0.54 0.13 0.00 -2.93 0.00 0.00 61.98 59.72 3n8f s VAL 10 Cb 0.00 -4.54 0.33 0.00 -1.53 0.00 0.00 36.38 30.65 3n8f s VAL 10 CO 0.00 -1.06 1.94 -0.65 -3.33 0.00 0.00 175.10 172.00 3n8f h PRO 11 N 9.27 0.48 -3.59 1.54 0.11 -2.00 -3.39 132.00 134.42 3n8f h PRO 11 Ca -0.25 -0.03 -0.58 0.00 0.11 0.00 0.00 66.00 65.25 3n8f h PRO 11 Cb 1.07 -0.11 -0.40 0.00 0.11 0.00 0.00 31.00 31.67 3n8f h PRO 11 CO 1.08 0.32 -0.76 -0.51 -0.21 0.00 0.00 178.00 177.93 3n8f s LEU 12 N -9.46 2.19 -0.17 2.35 1.02 -1.26 -5.07 118.68 108.27 3n8f s LEU 12 Ca -0.08 -1.56 -0.04 0.00 0.02 0.00 0.00 54.13 52.47 3n8f s LEU 12 Cb 0.20 -0.86 0.06 0.00 0.02 0.00 0.00 46.19 45.61 3n8f s LEU 12 CO 0.76 -0.40 0.07 -0.69 0.02 0.00 0.00 176.35 176.12 3n8f s VAL 13 N 1.62 0.09 0.15 -1.59 1.01 -1.26 -5.15 120.40 115.27 3n8f s VAL 13 Ca 0.08 -0.24 0.10 0.00 0.00 0.00 0.00 61.98 61.92 3n8f s VAL 13 Cb -0.17 -0.68 -0.04 0.00 0.00 0.00 0.00 36.38 35.49 3n8f s VAL 13 CO -0.23 -0.23 -0.18 -0.89 0.00 0.00 0.00 175.10 173.57 3n8f s THR 14 N 2.06 2.79 0.50 3.92 2.01 -1.26 -5.01 115.64 120.65 3n8f s THR 14 Ca 0.01 -1.67 -0.09 0.00 0.31 0.00 0.00 61.69 60.25 3n8f s THR 14 Cb -0.16 -2.32 -0.05 0.00 0.01 0.00 0.00 72.50 69.98 3n8f s THR 14 CO -0.08 0.00 0.86 0.00 -0.69 0.00 0.00 174.62 174.71 3n8f s ASP 16 N -3.79 5.38 0.16 0.00 -1.08 -1.26 -5.02 116.67 111.05 3n8f s ASP 16 Ca 0.51 -0.00 -0.04 0.00 -0.52 0.00 0.00 52.55 52.50 3n8f s ASP 16 Cb -0.10 -1.92 0.02 0.00 -1.46 0.00 0.00 42.92 39.46 3n8f s ASP 16 CO 0.42 0.15 1.42 -0.33 0.52 0.00 0.00 175.17 177.35 3n8f h GLU 17 N 6.88 0.52 0.00 4.34 3.07 -1.99 -3.37 114.58 124.02 3n8f h GLU 17 Ca -0.36 -0.41 -0.00 0.00 -0.50 0.00 0.00 59.36 58.09 3n8f h GLU 17 Cb 1.17 0.08 -0.01 0.00 -0.84 0.00 0.00 28.75 29.15 3n8f h GLU 17 CO 0.67 1.03 -0.35 1.04 -1.40 0.00 0.00 179.01 180.01 3n8f n GLN 18 N -3.88 1.42 -4.14 2.33 6.02 -1.26 -5.00 117.38 112.87 3n8f n GLN 18 Ca -0.05 -3.00 -0.36 0.00 -0.01 0.00 0.00 57.00 53.58 3n8f n GLN 18 Cb 0.70 -1.52 -0.08 0.00 1.02 0.00 0.00 30.24 30.36 3n8f n GLN 18 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 3n8f s SER 19 N -3.06 5.75 -0.02 1.08 1.04 -1.26 -5.01 113.70 112.22 3n8f s SER 19 Ca 0.35 0.28 0.03 0.00 0.48 0.00 0.00 55.95 57.10 3n8f s SER 19 Cb 0.34 -1.75 0.13 0.00 0.10 0.00 0.00 66.02 64.83 3n8f s SER 19 CO -0.04 0.38 0.92 -0.81 0.98 0.00 0.00 173.24 174.67 3n8f n PRO 20 N 2.12 1.48 -5.11 4.02 -0.04 -1.26 -4.88 135.00 131.33 3n8f n PRO 20 Ca -0.19 -0.50 -0.32 0.00 -0.04 0.00 0.00 63.50 62.45 3n8f n PRO 20 Cb 0.54 -1.35 -0.15 0.00 -0.04 0.00 0.00 33.50 32.50 3n8f n PRO 20 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 3n8f s TYR 21 N -1.58 2.53 0.70 0.54 2.02 -1.26 -5.05 117.35 115.24 3n8f s TYR 21 Ca 0.09 -0.45 -0.17 0.00 -0.37 0.00 0.00 57.07 56.18 3n8f s TYR 21 Cb 0.06 -1.60 0.02 0.00 -0.40 0.00 0.00 41.96 40.03 3n8f s TYR 21 CO 0.04 -0.03 1.25 0.54 -1.57 0.00 0.00 175.55 175.79 3n8f n ARG 22 N 2.65 0.83 -2.03 -0.62 1.74 -1.26 -5.04 116.66 112.92 3n8f n ARG 22 Ca -0.17 0.35 -0.28 0.00 -0.77 0.00 0.00 57.85 56.98 3n8f n ARG 22 Cb 0.52 -2.49 0.08 0.00 -1.02 0.00 0.00 32.46 29.54 3n8f n ARG 22 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 3n8f s THR 23 N -1.61 2.21 0.06 0.55 -4.23 -1.26 -5.01 115.64 106.36 3n8f s THR 23 Ca 0.80 -0.09 -0.13 0.00 -1.18 0.00 0.00 61.69 61.09 3n8f s THR 23 Cb -0.35 -3.03 -0.28 0.00 1.34 0.00 0.00 72.50 70.17 3n8f s THR 23 CO 0.44 -0.04 1.12 0.40 -0.54 0.00 0.00 174.62 176.00 3n8f h ILE 24 N -0.83 1.32 0.00 2.99 1.08 -1.92 -3.28 117.51 116.86 3n8f h ILE 24 Ca -0.45 -2.53 -0.05 0.00 -0.39 0.00 0.00 64.86 61.43 3n8f h ILE 24 Cb 1.32 2.71 -0.01 0.00 -3.07 0.00 0.00 36.82 37.77 3n8f h ILE 24 CO 0.63 0.77 -0.26 0.71 -0.69 0.00 0.00 178.15 179.31 3n8f h THR 25 N 0.25 1.09 0.00 -0.27 1.35 -1.90 -3.41 112.91 110.02 3n8f h THR 25 Ca -0.18 -0.92 0.00 0.00 -0.55 0.00 0.00 66.41 64.76 3n8f h THR 25 Cb 1.90 1.51 0.00 0.00 -1.73 0.00 0.00 68.15 69.84 3n8f h THR 25 CO 0.23 0.26 0.00 0.61 -0.25 0.00 0.00 175.52 176.37 3n8f n GLY 26 N -0.68 0.77 3.78 5.82 0.00 -1.24 -2.20 105.19 111.45 3n8f n GLY 26 Ca -0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.69 3n8f n GLY 26 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3n8f s ASP 27 N -2.41 4.73 -1.32 1.61 1.01 -1.26 -4.03 116.67 115.00 3n8f s ASP 27 Ca 0.00 1.78 0.00 0.00 0.71 0.00 0.00 52.55 55.04 3n8f s ASP 27 Cb 0.00 -2.52 0.00 0.00 1.01 0.00 0.00 42.92 41.41 3n8f s ASP 27 CO 0.00 -1.89 0.00 0.00 0.21 0.00 0.00 175.17 173.49 3n8f h ASN 29 N 0.00 -0.23 -3.37 0.00 -0.73 -1.81 -3.42 115.58 106.03 3n8f h ASN 29 Ca -0.25 -0.30 -0.58 0.00 1.87 0.00 0.00 56.30 57.03 3n8f h ASN 29 Cb 0.95 0.06 -0.08 0.00 0.27 0.00 0.00 38.32 39.52 3n8f h ASN 29 CO 0.37 0.27 -0.04 0.21 -0.37 0.00 0.00 177.43 177.88 3n8f s ASN 30 N -5.36 6.73 -0.05 1.15 3.84 -1.26 -4.64 114.94 115.35 3n8f s ASN 30 Ca -0.13 0.88 -0.25 0.00 0.21 0.00 0.00 52.86 53.57 3n8f s ASN 30 Cb 0.01 -2.32 -0.20 0.00 -0.55 0.00 0.00 41.25 38.19 3n8f s ASN 30 CO 0.50 -0.09 1.07 0.03 -2.79 0.00 0.00 177.10 175.82 3n8f h ARG 31 N 6.95 -0.08 0.16 0.43 3.08 -1.96 -3.22 114.38 119.73 3n8f h ARG 31 Ca -0.38 0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.67 3n8f h ARG 31 Cb 1.17 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 31.21 3n8f h ARG 31 CO 0.76 0.45 -0.37 -0.09 -1.07 0.00 0.00 179.97 179.64 3n8f h ARG 32 N -0.69 -0.56 -3.44 0.04 2.43 -1.94 -3.36 114.38 106.86 3n8f h ARG 32 Ca -0.01 0.04 -0.68 0.00 -0.81 0.00 0.00 59.98 58.52 3n8f h ARG 32 Cb 0.57 0.13 -0.37 0.00 -0.42 0.00 0.00 29.97 29.88 3n8f h ARG 32 CO 0.01 -0.37 -0.38 0.45 -1.51 0.00 0.00 179.97 178.17 3n8f s SER 33 N -3.93 5.16 0.48 -3.80 0.15 -1.26 -4.99 113.70 105.50 3n8f s SER 33 Ca -0.12 -3.14 0.32 0.00 0.70 0.00 0.00 55.95 53.71 3n8f s SER 33 Cb 0.04 -1.81 1.72 0.00 -1.71 0.00 0.00 66.02 64.26 3n8f s SER 33 CO 0.43 -0.28 1.99 -0.65 1.20 0.00 0.00 173.24 175.92 3n8f h PRO 34 N 6.59 0.00 0.00 5.44 0.11 -1.71 -2.21 132.00 140.22 3n8f h PRO 34 Ca 0.02 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.13 3n8f h PRO 34 Cb 0.90 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.01 3n8f h PRO 34 CO 0.73 0.00 -1.01 0.00 -0.21 0.00 0.00 178.00 177.51 3n8f n ALA 35 N -1.92 2.88 -1.91 -0.75 0.00 -1.26 -2.13 120.51 115.41 3n8f n ALA 35 Ca -0.02 -0.31 -0.42 0.00 0.00 0.00 0.00 53.44 52.69 3n8f n ALA 35 Cb 0.07 -1.05 -0.03 0.00 0.00 0.00 0.00 19.45 18.44 3n8f n ALA 35 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3n8f s LEU 36 N -4.64 4.10 0.00 0.00 2.96 -0.83 -1.06 118.68 119.21 3n8f s LEU 36 Ca 0.01 2.10 0.00 0.00 -0.22 0.00 0.00 54.13 56.03 3n8f s LEU 36 Cb 0.12 -3.53 0.00 0.00 0.50 0.00 0.00 46.19 43.28 3n8f s LEU 36 CO 0.79 -1.19 0.00 0.61 -1.32 0.00 0.00 176.35 175.24 3n8f n GLY 37 N 4.59 0.70 0.00 7.98 0.00 -1.26 -4.59 105.19 112.61 3n8f n GLY 37 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 3n8f n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n8f n ALA 38 N -1.78 0.00 -2.46 4.61 0.00 -0.23 -2.63 120.51 118.01 3n8f n ALA 38 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.19 3n8f n ALA 38 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 3n8f n ALA 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3n8f s ALA 39 N -3.91 2.69 -1.17 0.00 0.00 -0.93 -4.26 121.76 114.18 3n8f s ALA 39 Ca 0.00 -1.74 -0.03 0.00 0.00 0.00 0.00 51.96 50.20 3n8f s ALA 39 Cb 0.00 -0.35 -0.02 0.00 0.00 0.00 0.00 23.12 22.75 3n8f s ALA 39 CO 0.00 0.36 0.93 0.09 0.00 0.00 0.00 175.76 177.13 3n8f n ASN 40 N -0.19 -3.48 -4.08 0.00 3.02 0.76 -4.83 115.26 106.47 3n8f n ASN 40 Ca -0.09 -0.69 -0.11 0.00 -0.03 0.00 0.00 54.58 53.66 3n8f n ASN 40 Cb 0.58 -4.93 -0.08 0.00 -0.61 0.00 0.00 39.78 34.73 3n8f n ASN 40 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3n8f s ARG 41 N -5.17 1.36 0.35 3.52 0.52 -0.96 -4.68 118.95 113.88 3n8f s ARG 41 Ca 0.16 -1.51 -0.29 0.00 -0.52 0.00 0.00 55.73 53.57 3n8f s ARG 41 Cb -0.03 0.35 -0.11 0.00 0.52 0.00 0.00 34.95 35.68 3n8f s ARG 41 CO 0.75 -0.50 1.52 0.00 0.02 0.00 0.00 175.30 177.09 3n8f n ALA 42 N -0.33 2.44 -1.77 2.13 0.00 -1.26 0.36 120.51 122.08 3n8f n ALA 42 Ca 0.01 0.35 -0.37 0.00 0.00 0.00 0.00 53.44 53.43 3n8f n ALA 42 Cb 0.64 -2.43 -0.00 0.00 0.00 0.00 0.00 19.45 17.66 3n8f n ALA 42 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3n8f s LEU 43 N -1.56 3.93 0.48 0.00 1.43 0.15 -4.79 118.68 118.31 3n8f s LEU 43 Ca 0.57 2.30 -0.20 0.00 -1.03 0.00 0.00 54.13 55.77 3n8f s LEU 43 Cb -0.48 -4.34 -0.09 0.00 0.03 0.00 0.00 46.19 41.31 3n8f s LEU 43 CO 0.59 -1.05 1.01 0.00 0.23 0.00 0.00 176.35 177.13 3n8f s ALA 44 N -1.59 2.93 -0.34 4.21 0.00 -0.69 -4.64 121.76 121.63 3n8f s ALA 44 Ca 0.67 0.49 -0.00 0.00 0.00 0.00 0.00 51.96 53.11 3n8f s ALA 44 Cb -0.28 -3.21 0.08 0.00 0.00 0.00 0.00 23.12 19.71 3n8f s ALA 44 CO 0.33 -0.21 0.06 1.03 0.00 0.00 0.00 175.76 176.97 3n8f s ARG 45 N -3.36 2.06 0.46 0.00 1.81 -1.26 0.16 118.95 118.83 3n8f s ARG 45 Ca 0.65 -1.58 0.26 0.00 -1.72 0.00 0.00 55.73 53.33 3n8f s ARG 45 Cb -0.13 -3.28 0.93 0.00 -0.45 0.00 0.00 34.95 32.02 3n8f s ARG 45 CO 0.20 -0.83 1.83 -1.49 -0.68 0.00 0.00 175.30 174.33 3n8f h TRP 46 N 7.90 0.00 -3.53 -0.53 6.55 -1.98 -3.45 115.95 120.92 3n8f h TRP 46 Ca -0.14 0.00 -0.19 0.00 0.95 0.00 0.00 58.89 59.51 3n8f h TRP 46 Cb 1.05 0.00 -0.25 0.00 -0.86 0.00 0.00 29.16 29.09 3n8f h TRP 46 CO 0.56 0.16 -0.58 -0.51 -1.05 0.00 0.00 178.44 177.03 3n8f s LEU 47 N -6.56 1.64 0.44 -4.49 1.43 -1.26 -5.15 118.68 104.73 3n8f s LEU 47 Ca 0.01 0.07 -0.24 0.00 -1.03 0.00 0.00 54.13 52.94 3n8f s LEU 47 Cb 0.09 0.41 -0.10 0.00 0.03 0.00 0.00 46.19 46.62 3n8f s LEU 47 CO 0.62 -0.13 1.06 -2.65 0.23 0.00 0.00 176.35 175.48 3n8f n PRO 48 N 2.58 1.42 -1.42 1.29 -0.02 -1.26 -4.95 135.00 132.63 3n8f n PRO 48 Ca -0.15 0.51 -0.35 0.00 -2.02 0.00 0.00 63.50 61.48 3n8f n PRO 48 Cb 0.58 -2.12 0.10 0.00 -0.02 0.00 0.00 33.50 32.03 3n8f n PRO 48 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3n8f n ALA 49 N -0.57 0.55 -3.78 3.55 0.00 -1.26 -4.70 120.51 114.29 3n8f n ALA 49 Ca 0.09 -0.16 -0.30 0.00 0.00 0.00 0.00 53.44 53.08 3n8f n ALA 49 Cb 0.40 -2.28 -0.13 0.00 0.00 0.00 0.00 19.45 17.43 3n8f n ALA 49 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 3n8f s GLU 50 N -3.71 1.42 0.31 0.00 2.02 -0.84 -4.92 118.70 112.97 3n8f s GLU 50 Ca 0.78 -2.08 0.08 0.00 0.02 0.00 0.00 54.97 53.77 3n8f s GLU 50 Cb -0.34 -2.58 -0.04 0.00 0.10 0.00 0.00 34.13 31.28 3n8f s GLU 50 CO 0.45 -1.13 0.16 0.71 0.02 0.00 0.00 175.26 175.47 3n8f s TYR 51 N 0.31 2.82 -0.00 1.61 2.02 -1.26 -3.72 117.35 119.13 3n8f s TYR 51 Ca 0.17 -0.29 -0.16 0.00 -0.37 0.00 0.00 57.07 56.42 3n8f s TYR 51 Cb -0.24 -1.55 -0.09 0.00 -0.40 0.00 0.00 41.96 39.68 3n8f s TYR 51 CO -0.02 0.39 0.86 1.49 -1.57 0.00 0.00 175.55 176.70 3n8f h GLU 52 N 1.53 -0.55 0.00 -0.62 4.81 -0.80 -3.17 114.58 115.78 3n8f h GLU 52 Ca -0.45 0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.82 3n8f h GLU 52 Cb 1.25 0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.76 3n8f h GLU 52 CO 0.61 -0.37 0.00 -0.40 -0.73 0.00 0.00 179.01 178.12 3n8f n ASP 53 N -4.24 0.00 0.00 1.04 5.75 -1.26 -4.85 116.55 112.98 3n8f n ASP 53 Ca -0.07 -0.70 0.00 0.00 -0.01 0.00 0.00 54.79 54.01 3n8f n ASP 53 Cb 0.23 -0.03 0.00 0.00 -1.03 0.00 0.00 41.12 40.29 3n8f n ASP 53 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3n8f n GLY 54 N 0.55 3.08 0.00 6.12 0.00 -1.20 -4.83 105.19 108.91 3n8f n GLY 54 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 3n8f n GLY 54 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3n8f n LEU 55 N 0.00 0.09 0.00 0.99 4.77 -1.26 -4.56 117.00 117.03 3n8f n LEU 55 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 3n8f n LEU 55 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 3n8f n LEU 55 CO 0.00 0.02 0.00 0.00 -1.33 0.00 0.00 177.39 176.08 3n8f n ALA 56 N -1.32 0.00 -2.67 -1.18 0.00 -1.26 -2.43 120.51 111.65 3n8f n ALA 56 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.04 3n8f n ALA 56 Cb 0.26 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.65 3n8f n ALA 56 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3n8f s VAL 57 N 0.00 5.07 0.33 0.00 1.01 -1.26 -4.98 120.40 120.57 3n8f s VAL 57 Ca 0.00 1.12 -0.27 0.00 0.00 0.00 0.00 61.98 62.83 3n8f s VAL 57 Cb 0.00 -3.91 -0.09 0.00 0.00 0.00 0.00 36.38 32.38 3n8f s VAL 57 CO 0.00 0.17 1.11 -2.84 0.00 0.00 0.00 175.10 173.53 3n8f s PRO 58 N 1.57 4.40 0.15 2.72 0.02 -1.26 -0.11 135.00 142.49 3n8f s PRO 58 Ca 0.28 1.75 -0.33 0.00 0.02 0.00 0.00 61.00 62.72 3n8f s PRO 58 Cb -0.16 -2.93 -0.13 0.00 0.02 0.00 0.00 34.50 31.30 3n8f s PRO 58 CO 0.11 0.01 1.66 1.19 -0.33 0.00 0.00 177.00 179.64 3n8f n PHE 59 N 0.65 2.40 -1.18 6.54 3.01 -1.26 -1.86 117.46 125.77 3n8f n PHE 59 Ca 0.01 0.16 0.00 0.00 1.01 0.00 0.00 57.45 58.64 3n8f n PHE 59 Cb 0.46 -2.60 0.00 0.00 -0.01 0.00 0.00 39.48 37.34 3n8f n PHE 59 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3n8f n GLY 60 N 3.68 0.99 0.07 1.37 0.00 -1.26 -4.96 105.19 105.07 3n8f n GLY 60 Ca 0.17 -0.55 -0.06 0.00 0.00 0.00 0.00 46.02 45.59 3n8f n GLY 60 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 3n8f h TRP 61 N 0.00 0.00 -4.20 1.61 7.01 -1.74 -3.47 115.95 115.16 3n8f h TRP 61 Ca 0.00 0.00 -0.51 0.00 2.11 0.00 0.00 58.89 60.49 3n8f h TRP 61 Cb 0.57 0.00 0.05 0.00 -2.10 0.00 0.00 29.16 27.68 3n8f h TRP 61 CO 0.00 0.11 0.36 0.95 -2.79 0.00 0.00 178.44 177.07 3n8f s THR 62 N -2.22 4.74 -0.14 2.65 -4.23 -1.26 -5.03 115.64 110.15 3n8f s THR 62 Ca -0.15 0.74 -0.28 0.00 -1.18 0.00 0.00 61.69 60.82 3n8f s THR 62 Cb 0.02 -3.87 -0.25 0.00 1.34 0.00 0.00 72.50 69.75 3n8f s THR 62 CO 0.24 -1.08 0.73 1.56 -0.54 0.00 0.00 174.62 175.52 3n8f h GLN 63 N -0.21 0.00 0.00 3.99 1.08 -2.02 -3.37 115.11 114.58 3n8f h GLN 63 Ca -0.45 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 56.74 3n8f h GLN 63 Cb 1.19 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.62 3n8f h GLN 63 CO 0.62 0.97 -0.08 0.07 -0.95 0.00 0.00 178.83 179.46 3n8f h ARG 64 N -1.00 0.00 -6.81 1.46 0.11 -2.02 -3.45 114.38 102.67 3n8f h ARG 64 Ca -0.01 0.00 -0.49 0.00 0.10 0.00 0.00 59.98 59.57 3n8f h ARG 64 Cb 0.98 0.00 0.02 0.00 1.11 0.00 0.00 29.97 32.08 3n8f h ARG 64 CO -0.01 0.08 0.05 0.15 0.10 0.00 0.00 179.97 180.34 3n8f s LYS 65 N -4.52 3.61 0.01 0.08 1.02 -1.26 -5.07 119.74 113.62 3n8f s LYS 65 Ca -0.04 0.20 0.01 0.00 0.02 0.00 0.00 55.97 56.16 3n8f s LYS 65 Cb 0.15 -2.44 -0.01 0.00 -0.52 0.00 0.00 37.83 35.00 3n8f s LYS 65 CO 0.60 -0.07 -0.05 0.95 -0.92 0.00 0.00 175.35 175.86 3n8f s THR 66 N -2.51 0.32 -0.37 2.17 -4.23 -1.26 -4.77 115.64 104.99 3n8f s THR 66 Ca 0.47 -0.51 -0.24 0.00 -1.18 0.00 0.00 61.69 60.23 3n8f s THR 66 Cb -0.10 -0.34 0.01 0.00 1.34 0.00 0.00 72.50 73.41 3n8f s THR 66 CO 0.38 -0.13 0.85 -0.60 -0.54 0.00 0.00 174.62 174.59 3n8f s ARG 67 N -0.68 3.78 -1.37 3.99 3.52 -0.94 -4.32 118.95 122.93 3n8f s ARG 67 Ca -0.04 0.42 -0.09 0.00 -0.13 0.00 0.00 55.73 55.89 3n8f s ARG 67 Cb -0.05 -3.81 0.02 0.00 -1.56 0.00 0.00 34.95 29.55 3n8f s ARG 67 CO -0.00 -0.91 1.14 0.09 -0.81 0.00 0.00 175.30 174.81 3n8f n ASN 68 N 6.60 -5.78 0.00 -2.12 3.02 -1.26 -2.87 115.26 112.86 3n8f n ASN 68 Ca 0.05 -0.58 0.00 0.00 -0.03 0.00 0.00 54.58 54.02 3n8f n ASN 68 Cb 0.48 -4.89 0.00 0.00 -0.61 0.00 0.00 39.78 34.76 3n8f n ASN 68 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3n8f n GLY 69 N -1.90 0.85 3.08 7.41 0.00 -1.26 -5.03 105.19 108.34 3n8f n GLY 69 Ca -0.01 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.83 3n8f n GLY 69 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3n8f s PHE 70 N -3.32 0.94 -0.11 1.61 0.08 -1.14 -5.01 117.98 111.04 3n8f s PHE 70 Ca 0.00 -0.32 -0.29 0.00 0.12 0.00 0.00 56.93 56.44 3n8f s PHE 70 Cb 0.00 -0.57 -0.04 0.00 -0.57 0.00 0.00 43.02 41.85 3n8f s PHE 70 CO 0.00 -0.00 1.47 0.50 -0.10 0.00 0.00 175.22 177.09 3n8f s ARG 71 N -0.96 4.21 0.30 0.44 3.52 -1.26 -2.21 118.95 122.98 3n8f s ARG 71 Ca -0.01 1.94 -0.29 0.00 -0.13 0.00 0.00 55.73 57.24 3n8f s ARG 71 Cb -0.07 -3.88 -0.10 0.00 -1.56 0.00 0.00 34.95 29.34 3n8f s ARG 71 CO 0.01 -0.78 1.34 0.14 -0.81 0.00 0.00 175.30 175.20 3n8f s VAL 72 N 3.77 2.73 0.40 7.11 -7.23 -1.26 -4.93 120.40 121.00 3n8f s VAL 72 Ca 0.65 0.70 -0.23 0.00 -1.81 0.00 0.00 61.98 61.29 3n8f s VAL 72 Cb -0.28 -3.44 -0.10 0.00 0.56 0.00 0.00 36.38 33.11 3n8f s VAL 72 CO 0.23 0.15 0.97 -2.16 -0.31 0.00 0.00 175.10 173.97 3n8f s PRO 73 N -1.35 4.28 0.47 4.82 0.04 -1.26 -4.96 135.00 137.04 3n8f s PRO 73 Ca 0.52 1.23 -0.24 0.00 0.04 0.00 0.00 61.00 62.55 3n8f s PRO 73 Cb -0.40 -2.37 -0.07 0.00 0.04 0.00 0.00 34.50 31.70 3n8f s PRO 73 CO 0.50 0.00 1.41 -0.51 0.04 0.00 0.00 177.00 178.44 3n8f s LEU 74 N -2.86 4.05 0.15 -3.56 1.43 -1.26 -4.86 118.68 111.77 3n8f s LEU 74 Ca 0.59 2.88 -0.16 0.00 -1.03 0.00 0.00 54.13 56.40 3n8f s LEU 74 Cb -0.13 -4.02 0.01 0.00 0.03 0.00 0.00 46.19 42.08 3n8f s LEU 74 CO 0.18 -1.26 1.77 0.00 0.23 0.00 0.00 176.35 177.26 3n8f h ALA 75 N 2.13 0.52 0.00 4.21 0.00 -1.89 -1.79 119.26 122.44 3n8f h ALA 75 Ca -0.51 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.28 3n8f h ALA 75 Cb 1.27 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 3n8f h ALA 75 CO 0.60 0.03 -0.28 -0.09 0.00 0.00 0.00 179.25 179.51 3n8f h ARG 76 N 0.53 0.00 -0.03 0.00 9.65 -1.84 -1.09 114.38 121.60 3n8f h ARG 76 Ca 0.14 0.00 -0.09 0.00 -1.10 0.00 0.00 59.98 58.93 3n8f h ARG 76 Cb 0.03 0.00 0.01 0.00 -1.39 0.00 0.00 29.97 28.61 3n8f h ARG 76 CO -0.03 0.28 -0.34 1.49 2.80 0.00 0.00 179.97 184.17 3n8f h GLU 77 N 0.00 0.28 -0.67 0.20 4.81 -1.79 0.40 114.58 117.80 3n8f h GLU 77 Ca -0.00 -0.27 0.13 0.00 -0.13 0.00 0.00 59.36 59.09 3n8f h GLU 77 Cb 0.50 0.07 -0.09 0.00 0.63 0.00 0.00 28.75 29.86 3n8f h GLU 77 CO 0.04 0.95 0.21 0.28 -0.73 0.00 0.00 179.01 179.75 3n8f h VAL 78 N -0.29 0.64 0.58 0.32 2.07 -1.17 -0.42 116.25 117.98 3n8f h VAL 78 Ca -0.04 -0.12 -0.02 0.00 0.82 0.00 0.00 66.70 67.34 3n8f h VAL 78 Cb 1.05 0.27 -0.00 0.00 -1.52 0.00 0.00 31.29 31.08 3n8f h VAL 78 CO 0.07 0.06 -0.38 -1.28 0.02 0.00 0.00 177.57 176.06 3n8f h SER 79 N 0.34 -0.96 -1.27 0.57 0.87 -1.13 -1.74 113.55 110.23 3n8f h SER 79 Ca 0.36 0.06 0.37 0.00 -1.23 0.00 0.00 61.79 61.35 3n8f h SER 79 Cb 0.54 0.29 -0.09 0.00 -0.44 0.00 0.00 62.40 62.70 3n8f h SER 79 CO -0.41 -0.57 0.86 0.78 -0.53 0.00 0.00 176.83 176.96 3n8f h ASN 80 N -0.90 0.22 0.00 6.23 2.35 0.46 -2.00 115.58 121.94 3n8f h ASN 80 Ca -0.08 0.07 -0.08 0.00 -0.55 0.00 0.00 56.30 55.66 3n8f h ASN 80 Cb 0.73 0.04 -0.02 0.00 0.05 0.00 0.00 38.32 39.12 3n8f h ASN 80 CO 0.06 -0.03 -1.87 0.29 -1.65 0.00 0.00 177.43 174.23 3n8f n LYS 81 N -4.45 0.78 -0.04 0.81 5.02 -0.23 -4.72 118.16 115.33 3n8f n LYS 81 Ca 0.31 -0.11 -0.08 0.00 -2.02 0.00 0.00 58.31 56.41 3n8f n LYS 81 Cb 1.27 -1.41 -0.03 0.00 -0.02 0.00 0.00 35.03 34.84 3n8f n LYS 81 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 3n8f n ILE 82 N -2.24 0.44 0.10 -0.18 -0.00 -0.66 -4.96 119.36 111.85 3n8f n ILE 82 Ca -0.10 -0.13 -0.04 0.00 -0.00 0.00 0.00 62.75 62.48 3n8f n ILE 82 Cb 0.61 -1.33 -0.02 0.00 -0.00 0.00 0.00 39.64 38.90 3n8f n ILE 82 CO 0.00 0.00 0.00 0.58 -0.00 0.00 0.00 176.55 177.13 3n8f h VAL 83 N -0.19 0.00 -3.61 1.39 2.07 -1.46 -3.44 116.25 111.00 3n8f h VAL 83 Ca -0.19 -0.30 -0.44 0.00 0.82 0.00 0.00 66.70 66.58 3n8f h VAL 83 Cb 1.21 0.00 0.18 0.00 -1.52 0.00 0.00 31.29 31.16 3n8f h VAL 83 CO -0.09 0.00 0.11 -0.83 0.02 0.00 0.00 177.57 176.78 3n8f s GLY 84 N -2.27 1.55 -0.08 2.17 0.00 -1.23 -1.93 107.32 105.53 3n8f s GLY 84 Ca -0.04 -0.29 -0.29 0.00 0.00 0.00 0.00 44.72 44.10 3n8f s GLY 84 CO 0.12 0.38 0.66 -2.52 0.00 0.00 0.00 173.10 171.75 3n8f s TYR 85 N -2.76 -0.65 -0.18 1.90 1.13 -1.26 -4.70 117.35 110.82 3n8f s TYR 85 Ca 0.67 1.21 -0.24 0.00 -1.41 0.00 0.00 57.07 57.30 3n8f s TYR 85 Cb -0.21 0.37 -0.22 0.00 -1.10 0.00 0.00 41.96 40.80 3n8f s TYR 85 CO 0.61 -0.56 0.43 -0.07 -2.51 0.00 0.00 175.55 173.45 3n8f h LEU 86 N 3.40 0.00 -8.77 -3.49 3.38 -1.98 -3.42 115.31 104.42 3n8f h LEU 86 Ca -0.27 -0.69 -0.58 0.00 0.09 0.00 0.00 57.88 56.42 3n8f h LEU 86 Cb 1.15 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.81 3n8f h LEU 86 CO 0.33 1.29 0.73 -0.62 0.09 0.00 0.00 178.44 180.26 3n8f s ASP 87 N -6.59 6.65 0.43 -0.43 -1.08 -1.26 -4.89 116.67 109.50 3n8f s ASP 87 Ca -0.25 0.49 0.24 0.00 -0.52 0.00 0.00 52.55 52.51 3n8f s ASP 87 Cb 0.02 -2.50 0.68 0.00 -1.46 0.00 0.00 42.92 39.67 3n8f s ASP 87 CO 0.62 -1.03 1.72 -0.33 0.52 0.00 0.00 175.17 176.68 3n8f h GLU 88 N 8.80 0.00 -6.36 4.34 4.39 -2.05 -3.46 114.58 120.24 3n8f h GLU 88 Ca -0.23 0.00 -0.57 0.00 0.34 0.00 0.00 59.36 58.90 3n8f h GLU 88 Cb 1.07 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.74 3n8f h GLU 88 CO 1.04 0.17 1.14 -1.91 -1.16 0.00 0.00 179.01 178.29 3n8f n GLU 89 N -3.21 2.56 -2.47 2.33 4.07 -1.26 -3.34 120.64 119.32 3n8f n GLU 89 Ca 0.02 0.94 -0.05 0.00 -0.06 0.00 0.00 57.16 58.00 3n8f n GLU 89 Cb 0.49 -2.83 0.03 0.00 -0.06 0.00 0.00 31.44 29.07 3n8f n GLU 89 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3n8f n GLY 90 N 4.38 0.24 0.03 8.31 0.00 -1.26 -4.98 105.19 111.91 3n8f n GLY 90 Ca 0.21 -0.32 0.01 0.00 0.00 0.00 0.00 46.02 45.92 3n8f n GLY 90 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3n8f n VAL 91 N -2.09 0.31 -1.64 1.61 0.24 -1.21 -5.05 118.33 110.49 3n8f n VAL 91 Ca -0.08 -0.35 -0.49 0.00 -2.04 0.00 0.00 64.34 61.37 3n8f n VAL 91 Cb 0.55 -0.15 -0.05 0.00 -1.47 0.00 0.00 33.84 32.71 3n8f n VAL 91 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 3n8f n LEU 92 N -2.12 2.53 -4.69 1.34 4.77 -1.26 -1.05 117.00 116.52 3n8f n LEU 92 Ca -0.09 1.08 -0.42 0.00 -0.03 0.00 0.00 56.01 56.56 3n8f n LEU 92 Cb 0.54 -1.31 -0.03 0.00 -2.33 0.00 0.00 43.42 40.29 3n8f n LEU 92 CO 0.25 -0.56 1.36 -0.62 -1.33 0.00 0.00 177.39 176.48 3n8f s ASP 93 N 1.31 6.55 0.00 -1.43 -1.08 0.21 -4.62 116.67 117.61 3n8f s ASP 93 Ca 0.84 2.57 0.29 0.00 -0.52 0.00 0.00 52.55 55.74 3n8f s ASP 93 Cb -0.82 -2.57 1.38 0.00 -1.46 0.00 0.00 42.92 39.45 3n8f s ASP 93 CO 0.45 -0.91 1.94 0.00 0.52 0.00 0.00 175.17 177.17 3n8f n GLN 94 N 5.47 0.78 -0.39 4.34 1.13 -1.26 -3.75 117.38 123.70 3n8f n GLN 94 Ca 0.16 -0.22 0.02 0.00 -1.94 0.00 0.00 57.00 55.03 3n8f n GLN 94 Cb 0.40 -1.50 0.03 0.00 0.11 0.00 0.00 30.24 29.29 3n8f n GLN 94 CO 0.00 0.00 0.00 -1.71 -1.44 0.00 0.00 177.06 173.91 3n8f n ASN 95 N -0.92 0.59 -3.72 1.08 2.85 -1.26 -4.59 115.26 109.28 3n8f n ASN 95 Ca 0.16 -2.26 -0.17 0.00 -0.11 0.00 0.00 54.58 52.20 3n8f n ASN 95 Cb 0.25 -0.26 -0.17 0.00 1.24 0.00 0.00 39.78 40.84 3n8f n ASN 95 CO 0.00 0.00 0.00 -0.13 -2.11 0.00 0.00 177.26 175.02 3n8f s ARG 96 N -0.72 -0.06 0.64 1.20 1.81 -1.25 -2.96 118.95 117.62 3n8f s ARG 96 Ca 0.08 0.28 -0.09 0.00 -1.72 0.00 0.00 55.73 54.27 3n8f s ARG 96 Cb 0.07 -0.37 -0.00 0.00 -0.45 0.00 0.00 34.95 34.20 3n8f s ARG 96 CO 0.01 -0.24 1.01 -1.54 -0.68 0.00 0.00 175.30 173.85 3n8f s SER 97 N 1.58 5.70 0.54 0.23 1.04 -1.19 -2.65 113.70 118.95 3n8f s SER 97 Ca -0.03 1.05 0.29 0.00 0.48 0.00 0.00 55.95 57.75 3n8f s SER 97 Cb -0.13 -1.99 1.46 0.00 0.10 0.00 0.00 66.02 65.46 3n8f s SER 97 CO -0.03 -1.12 1.92 -0.07 0.98 0.00 0.00 173.24 174.93 3n8f h LEU 98 N -0.39 0.00 -1.60 2.42 3.38 -0.70 0.23 115.31 118.66 3n8f h LEU 98 Ca -0.45 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.51 3n8f h LEU 98 Cb 1.24 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.97 3n8f h LEU 98 CO 0.62 0.00 0.13 0.25 0.09 0.00 0.00 178.44 179.54 3n8f h LEU 99 N 0.00 0.35 -0.15 1.67 5.85 -1.81 0.50 115.31 121.72 3n8f h LEU 99 Ca 0.35 -0.02 0.02 0.00 0.84 0.00 0.00 57.88 59.07 3n8f h LEU 99 Cb 1.45 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 42.37 3n8f h LEU 99 CO -0.00 0.31 0.02 0.15 -0.34 0.00 0.00 178.44 178.58 3n8f h PHE 100 N 0.40 0.03 -0.33 1.25 3.57 -0.78 0.15 116.94 121.23 3n8f h PHE 100 Ca 0.10 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.62 3n8f h PHE 100 Cb 0.06 0.01 -0.02 0.00 2.79 0.00 0.00 35.95 38.79 3n8f h PHE 100 CO 0.00 0.00 0.22 1.98 -2.23 0.00 0.00 178.31 178.28 3n8f h MET 101 N 0.08 0.43 0.00 1.11 4.05 -1.49 -3.09 114.93 116.02 3n8f h MET 101 Ca 0.07 -0.03 -0.11 0.00 -0.28 0.00 0.00 59.70 59.35 3n8f h MET 101 Cb 0.07 -0.10 -0.02 0.00 -0.80 0.00 0.00 31.60 30.76 3n8f h MET 101 CO -0.10 0.29 -0.54 0.37 0.23 0.00 0.00 176.91 177.16 3n8f h GLN 102 N 0.44 0.00 0.00 0.39 5.75 -0.27 -2.15 115.11 119.27 3n8f h GLN 102 Ca 0.12 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.62 3n8f h GLN 102 Cb -0.05 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.50 3n8f h GLN 102 CO -0.03 0.54 -0.02 2.35 -2.65 0.00 0.00 178.83 179.02 3n8f h TRP 103 N 0.00 0.00 -0.80 3.99 2.91 -0.77 -3.02 115.95 118.26 3n8f h TRP 103 Ca -0.01 0.00 -0.02 0.00 1.13 0.00 0.00 58.89 59.99 3n8f h TRP 103 Cb 0.95 0.00 -0.04 0.00 -0.51 0.00 0.00 29.16 29.57 3n8f h TRP 103 CO 0.00 0.00 0.41 0.78 -1.03 0.00 0.00 178.44 178.60 3n8f h GLY 104 N 4.12 1.21 1.16 2.65 0.00 -1.30 -2.47 103.07 108.45 3n8f h GLY 104 Ca 0.00 -0.58 -0.21 0.00 0.00 0.00 0.00 47.33 46.55 3n8f h GLY 104 CO 0.00 0.55 -0.66 -1.61 0.00 0.00 0.00 176.54 174.82 3n8f h GLN 105 N 1.12 0.84 0.52 4.80 4.15 -1.50 -2.50 115.11 122.55 3n8f h GLN 105 Ca 0.28 -0.61 -0.02 0.00 0.77 0.00 0.00 58.65 59.07 3n8f h GLN 105 Cb 0.07 0.10 -0.00 0.00 0.21 0.00 0.00 27.48 27.86 3n8f h GLN 105 CO -0.04 1.23 -0.32 0.82 -1.93 0.00 0.00 178.83 178.59 3n8f h ILE 106 N 0.61 0.35 -0.63 2.39 1.08 -1.46 0.52 117.51 120.37 3n8f h ILE 106 Ca -0.02 0.00 0.06 0.00 -0.39 0.00 0.00 64.86 64.51 3n8f h ILE 106 Cb 1.28 0.35 -0.06 0.00 -3.07 0.00 0.00 36.82 35.33 3n8f h ILE 106 CO 0.14 0.00 0.33 0.58 -0.69 0.00 0.00 178.15 178.51 3n8f h VAL 107 N -0.80 0.93 0.13 1.67 2.07 -1.53 -1.42 116.25 117.31 3n8f h VAL 107 Ca -0.06 -0.21 -0.00 0.00 0.82 0.00 0.00 66.70 67.25 3n8f h VAL 107 Cb 0.65 0.28 -0.00 0.00 -1.52 0.00 0.00 31.29 30.69 3n8f h VAL 107 CO 0.07 0.11 -0.09 -0.78 0.02 0.00 0.00 177.57 176.90 3n8f h ASP 108 N 0.61 -0.22 0.50 0.57 1.82 -1.30 -2.25 116.42 116.15 3n8f h ASP 108 Ca 0.29 0.02 0.00 0.00 -0.39 0.00 0.00 57.03 56.94 3n8f h ASP 108 Cb 0.21 0.07 0.00 0.00 0.68 0.00 0.00 39.33 40.29 3n8f h ASP 108 CO -0.20 -0.14 0.00 0.45 -1.61 0.00 0.00 179.24 177.74 3n8f h HIS 109 N -0.21 0.00 0.00 0.28 3.86 -0.48 0.17 115.15 118.76 3n8f h HIS 109 Ca -0.01 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 59.11 3n8f h HIS 109 Cb 0.19 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.64 3n8f h HIS 109 CO -0.09 0.00 -0.42 0.22 0.86 0.00 0.00 177.93 178.50 3n8f h ASP 110 N 0.00 0.00 0.00 2.45 1.82 -0.67 -3.40 116.42 116.62 3n8f h ASP 110 Ca 0.00 0.00 -0.26 0.00 -0.39 0.00 0.00 57.03 56.38 3n8f h ASP 110 Cb 0.25 0.00 -0.05 0.00 0.68 0.00 0.00 39.33 40.21 3n8f h ASP 110 CO 0.00 0.42 -1.99 0.18 -1.61 0.00 0.00 179.24 176.24 3n8f n LEU 111 N -3.38 0.70 -3.76 2.28 4.77 0.53 -4.50 117.00 113.64 3n8f n LEU 111 Ca 0.01 -0.02 -0.13 0.00 -0.03 0.00 0.00 56.01 55.83 3n8f n LEU 111 Cb 0.60 0.12 -0.10 0.00 -2.33 0.00 0.00 43.42 41.71 3n8f n LEU 111 CO 0.38 0.46 0.02 1.51 -1.33 0.00 0.00 177.39 178.43 3n8f s ASP 112 N -4.98 -0.27 -0.30 -1.43 -4.77 -0.79 -4.28 116.67 99.86 3n8f s ASP 112 Ca -0.11 0.37 -0.11 0.00 -3.30 0.00 0.00 52.55 49.40 3n8f s ASP 112 Cb 0.05 0.50 0.13 0.00 -1.09 0.00 0.00 42.92 42.50 3n8f s ASP 112 CO 0.54 -0.29 0.70 0.12 0.70 0.00 0.00 175.17 176.94 3n8f s PHE 113 N -0.61 -1.23 -0.41 2.11 5.36 -1.26 -4.64 117.98 117.30 3n8f s PHE 113 Ca -0.07 2.16 -0.06 0.00 -0.96 0.00 0.00 56.93 57.99 3n8f s PHE 113 Cb -0.04 0.74 0.09 0.00 -0.34 0.00 0.00 43.02 43.47 3n8f s PHE 113 CO 0.02 -0.61 0.22 0.00 -1.46 0.00 0.00 175.22 173.39 3n8f s ALA 114 N 2.71 3.20 0.28 11.12 0.00 -1.26 -0.66 121.76 137.15 3n8f s ALA 114 Ca -0.06 -2.29 -0.29 0.00 0.00 0.00 0.00 51.96 49.32 3n8f s ALA 114 Cb -0.11 -2.50 -0.10 0.00 0.00 0.00 0.00 23.12 20.42 3n8f s ALA 114 CO -0.19 -1.69 1.30 -2.14 0.00 0.00 0.00 175.76 173.04 3n8f s PRO 115 N 1.29 4.39 0.58 0.00 0.02 -1.26 -4.73 135.00 135.29 3n8f s PRO 115 Ca 0.04 2.13 -0.18 0.00 0.02 0.00 0.00 61.00 63.02 3n8f s PRO 115 Cb -0.23 -3.12 -0.04 0.00 0.02 0.00 0.00 34.50 31.13 3n8f s PRO 115 CO -0.01 -0.18 1.11 -2.00 -0.33 0.00 0.00 177.00 175.59 3n8f s GLU 116 N -1.13 3.21 -0.62 5.54 2.12 -1.26 -1.15 118.70 125.41 3n8f s GLU 116 Ca 0.52 1.49 -0.27 0.00 0.36 0.00 0.00 54.97 57.07 3n8f s GLU 116 Cb -0.38 -2.00 0.03 0.00 0.26 0.00 0.00 34.13 32.04 3n8f s GLU 116 CO 0.46 -0.94 1.18 -0.08 -0.54 0.00 0.00 175.26 175.34 3n8f s THR 117 N -2.01 3.99 -0.67 -1.70 -1.32 -0.83 -4.68 115.64 108.41 3n8f s THR 117 Ca 0.70 0.66 -0.02 0.00 -1.21 0.00 0.00 61.69 61.82 3n8f s THR 117 Cb -0.22 -4.76 0.17 0.00 -1.51 0.00 0.00 72.50 66.18 3n8f s THR 117 CO 0.32 -1.46 0.49 -0.70 -2.21 0.00 0.00 174.62 171.05 3n8f s GLU 118 N 5.03 2.65 -0.11 7.08 2.56 -1.26 -4.74 118.70 129.91 3n8f s GLU 118 Ca 0.39 -2.69 0.05 0.00 0.00 0.00 0.00 54.97 52.72 3n8f s GLU 118 Cb -0.08 -3.74 0.32 0.00 2.00 0.00 0.00 34.13 32.63 3n8f s GLU 118 CO 0.21 -1.19 1.05 -0.11 -0.56 0.00 0.00 175.26 174.66 3n8f n LEU 119 N 3.22 3.11 -4.08 2.70 7.94 -1.26 -4.86 117.00 123.77 3n8f n LEU 119 Ca 0.10 -1.58 -0.29 0.00 -1.11 0.00 0.00 56.01 53.13 3n8f n LEU 119 Cb 0.37 -0.58 -0.17 0.00 0.53 0.00 0.00 43.42 43.57 3n8f n LEU 119 CO 0.34 0.44 -0.50 -0.83 -1.11 0.00 0.00 177.39 175.73 3n8f s GLY 120 N -0.25 1.10 -0.23 -3.96 0.00 -1.26 -5.09 107.32 97.63 3n8f s GLY 120 Ca 0.22 -0.80 -0.26 0.00 0.00 0.00 0.00 44.72 43.87 3n8f s GLY 120 CO 0.06 0.17 0.83 -0.56 0.00 0.00 0.00 173.10 173.60 3n8f s SER 121 N 0.94 -0.62 -1.20 1.64 0.01 -1.26 -4.94 113.70 108.26 3n8f s SER 121 Ca -0.07 1.09 -0.06 0.00 1.31 0.00 0.00 55.95 58.21 3n8f s SER 121 Cb -0.15 1.06 -0.02 0.00 0.21 0.00 0.00 66.02 67.12 3n8f s SER 121 CO -0.01 -0.28 0.79 -0.24 0.41 0.00 0.00 173.24 173.90 3n8f n SER 122 N 2.12 -3.43 -4.16 2.44 2.88 -1.26 -4.96 113.62 107.26 3n8f n SER 122 Ca -0.14 -0.83 -0.15 0.00 -1.33 0.00 0.00 58.87 56.42 3n8f n SER 122 Cb 0.56 -4.21 -0.11 0.00 -0.75 0.00 0.00 64.21 59.69 3n8f n SER 122 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 3n8f s GLU 123 N -5.59 0.79 -0.02 -1.46 2.56 -1.26 -5.05 118.70 108.67 3n8f s GLU 123 Ca 0.22 -1.07 0.21 0.00 0.00 0.00 0.00 54.97 54.33 3n8f s GLU 123 Cb -0.05 -0.52 -0.30 0.00 2.00 0.00 0.00 34.13 35.26 3n8f s GLU 123 CO 0.80 0.09 0.59 -2.39 -0.56 0.00 0.00 175.26 173.79 3n8f n HIS 124 N 0.79 0.00 0.05 5.30 -0.00 -1.26 -4.30 115.22 115.80 3n8f n HIS 124 Ca -0.18 0.00 -0.08 0.00 -0.00 0.00 0.00 57.72 57.46 3n8f n HIS 124 Cb 0.57 -0.34 0.06 0.00 -0.00 0.00 0.00 29.99 30.28 3n8f n HIS 124 CO 0.00 0.00 0.00 0.77 -0.00 0.00 0.00 176.34 177.11 3n8f h SER 125 N 0.00 0.46 -0.76 4.39 0.02 -1.97 1.03 113.55 116.73 3n8f h SER 125 Ca 0.00 -0.28 -0.01 0.00 -0.84 0.00 0.00 61.79 60.66 3n8f h SER 125 Cb 0.82 -0.13 -0.04 0.00 0.14 0.00 0.00 62.40 63.19 3n8f h SER 125 CO 0.00 0.99 0.43 0.11 -1.14 0.00 0.00 176.83 177.22 3n8f h LYS 126 N 0.29 1.05 -0.20 3.45 1.57 -1.98 -1.87 116.57 118.88 3n8f h LYS 126 Ca -0.01 -0.11 -0.15 0.00 -1.87 0.00 0.00 60.65 58.50 3n8f h LYS 126 Cb 1.20 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 33.30 3n8f h LYS 126 CO 0.11 0.76 -0.48 0.28 -0.57 0.00 0.00 179.45 179.56 3n8f h VAL 127 N 1.07 1.32 0.00 0.50 2.07 -1.59 -1.40 116.25 118.22 3n8f h VAL 127 Ca 0.27 -1.71 -0.04 0.00 0.82 0.00 0.00 66.70 66.05 3n8f h VAL 127 Cb 0.00 1.88 -0.01 0.00 -1.52 0.00 0.00 31.29 31.64 3n8f h VAL 127 CO -0.05 0.53 -0.17 -0.61 0.02 0.00 0.00 177.57 177.29 3n8f h GLN 128 N 0.37 0.00 0.02 1.57 4.15 0.12 0.38 115.11 121.72 3n8f h GLN 128 Ca -0.00 0.00 -0.12 0.00 0.77 0.00 0.00 58.65 59.30 3n8f h GLN 128 Cb 1.09 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.77 3n8f h GLN 128 CO 0.10 0.17 -0.62 0.00 -1.93 0.00 0.00 178.83 176.55 3n8f h GLU 130 N -0.88 -1.01 0.19 0.00 4.57 -1.10 -3.09 114.58 113.26 3n8f h GLU 130 Ca -0.16 0.07 -0.01 0.00 -1.18 0.00 0.00 59.36 58.08 3n8f h GLU 130 Cb 1.23 0.23 0.00 0.00 -0.16 0.00 0.00 28.75 30.05 3n8f h GLU 130 CO -0.05 -0.67 -0.09 0.93 -1.18 0.00 0.00 179.01 177.94 3n8f h GLU 131 N -1.05 -0.25 -0.02 1.92 4.39 -0.47 -3.37 114.58 115.74 3n8f h GLU 131 Ca -0.11 0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.61 3n8f h GLU 131 Cb 0.80 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.51 3n8f h GLU 131 CO 0.17 0.15 -0.28 0.66 -1.16 0.00 0.00 179.01 178.56 3n8f n TYR 132 N -4.97 0.00 -3.99 4.33 4.02 -1.24 -4.97 117.16 110.35 3n8f n TYR 132 Ca -0.08 0.00 -0.27 0.00 -0.01 0.00 0.00 57.90 57.54 3n8f n TYR 132 Cb 0.26 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.56 3n8f n TYR 132 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3n8f s VAL 134 N -3.84 4.62 0.45 0.00 1.01 -1.07 -5.00 120.40 116.58 3n8f s VAL 134 Ca 0.14 -0.57 -0.24 0.00 0.00 0.00 0.00 61.98 61.32 3n8f s VAL 134 Cb -0.08 -3.44 -0.08 0.00 0.00 0.00 0.00 36.38 32.79 3n8f s VAL 134 CO 0.89 -0.04 1.20 -1.58 0.00 0.00 0.00 175.10 175.57 3n8f s GLN 135 N 1.60 3.79 0.00 2.72 0.74 -1.26 -4.66 119.66 122.59 3n8f s GLN 135 Ca 0.04 1.88 0.00 0.00 0.05 0.00 0.00 55.36 57.33 3n8f s GLN 135 Cb -0.18 -2.50 0.00 0.00 1.10 0.00 0.00 33.01 31.43 3n8f s GLN 135 CO 0.07 -0.55 0.00 0.41 -0.55 0.00 0.00 175.29 174.66 3n8f n GLY 136 N 0.54 4.09 7.00 2.59 0.00 0.70 -5.01 105.19 115.11 3n8f n GLY 136 Ca 0.06 -1.25 0.00 0.00 0.00 0.00 0.00 46.02 44.84 3n8f n GLY 136 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3n8f n ASP 137 N 0.00 0.00 -0.32 1.61 8.00 -1.26 -1.62 116.55 122.96 3n8f n ASP 137 Ca 0.00 0.00 0.12 0.00 0.71 0.00 0.00 54.79 55.62 3n8f n ASP 137 Cb 0.00 0.00 0.14 0.00 -0.02 0.00 0.00 41.12 41.24 3n8f n ASP 137 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 3n8f n GLU 138 N 13.67 0.88 -2.81 -1.24 -0.58 -1.26 -4.77 120.64 124.53 3n8f n GLU 138 Ca 0.00 -0.65 -0.43 0.00 -0.42 0.00 0.00 57.16 55.66 3n8f n GLU 138 Cb 0.00 -1.49 -0.04 0.00 -0.57 0.00 0.00 31.44 29.35 3n8f n GLU 138 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3n8f s PHE 140 N 4.26 3.50 0.43 0.00 5.36 -0.69 -0.21 117.98 130.63 3n8f s PHE 140 Ca 0.25 -2.71 -0.05 0.00 -0.96 0.00 0.00 56.93 53.46 3n8f s PHE 140 Cb -0.15 -3.12 -0.04 0.00 -0.34 0.00 0.00 43.02 39.37 3n8f s PHE 140 CO 0.12 -0.90 0.72 -1.25 -1.46 0.00 0.00 175.22 172.45 3n8f s PRO 141 N 0.53 3.58 -0.48 10.12 0.04 -1.26 -4.17 135.00 143.36 3n8f s PRO 141 Ca 0.13 0.13 -0.15 0.00 0.04 0.00 0.00 61.00 61.14 3n8f s PRO 141 Cb -0.22 -2.46 0.08 0.00 0.04 0.00 0.00 34.50 31.95 3n8f s PRO 141 CO -0.04 -0.07 0.41 0.42 0.04 0.00 0.00 177.00 177.76 3n8f s ILE 142 N -2.54 5.20 0.63 0.56 1.01 -0.95 -4.94 121.20 120.18 3n8f s ILE 142 Ca 0.46 -1.14 -0.14 0.00 0.00 0.00 0.00 60.65 59.83 3n8f s ILE 142 Cb -0.10 -4.14 -0.02 0.00 0.01 0.00 0.00 42.46 38.20 3n8f s ILE 142 CO 0.40 -0.62 1.06 -0.04 0.00 0.00 0.00 174.94 175.74 3n8f s MET 143 N 1.63 3.14 -0.06 2.79 -1.94 -1.26 -0.43 119.30 123.17 3n8f s MET 143 Ca 0.04 1.14 -0.13 0.00 -1.71 0.00 0.00 55.69 55.03 3n8f s MET 143 Cb -0.25 -2.01 -0.05 0.00 2.01 0.00 0.00 34.83 34.53 3n8f s MET 143 CO 0.06 -0.95 0.33 -0.06 -0.01 0.00 0.00 175.02 174.40 3n8f s PHE 144 N -2.63 3.64 0.93 -0.03 0.08 -0.46 -4.54 117.98 114.96 3n8f s PHE 144 Ca 0.62 0.81 -0.13 0.00 0.12 0.00 0.00 56.93 58.36 3n8f s PHE 144 Cb -0.16 -2.24 0.15 0.00 -0.57 0.00 0.00 43.02 40.20 3n8f s PHE 144 CO 0.43 0.55 1.14 -1.25 -0.10 0.00 0.00 175.22 176.00 3n8f s PRO 145 N -0.65 0.98 0.34 0.24 0.04 -1.26 -4.98 135.00 129.71 3n8f s PRO 145 Ca 0.21 0.24 -0.28 0.00 0.04 0.00 0.00 61.00 61.20 3n8f s PRO 145 Cb -0.15 -1.83 -0.12 0.00 0.04 0.00 0.00 34.50 32.44 3n8f s PRO 145 CO 0.09 -2.29 1.28 1.17 0.04 0.00 0.00 177.00 177.29 3n8f n LYS 146 N -3.82 2.10 -2.26 4.56 4.81 -1.26 -2.87 118.16 119.42 3n8f n LYS 146 Ca 0.07 0.74 -0.20 0.00 -0.87 0.00 0.00 58.31 58.05 3n8f n LYS 146 Cb 0.59 -2.31 -0.02 0.00 0.02 0.00 0.00 35.03 33.31 3n8f n LYS 146 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 3n8f n ASN 147 N 0.83 -5.61 -4.75 3.14 5.03 -1.26 -4.99 115.26 107.65 3n8f n ASN 147 Ca 0.05 0.05 -0.40 0.00 0.87 0.00 0.00 54.58 55.16 3n8f n ASN 147 Cb 0.36 -4.67 -0.05 0.00 -1.02 0.00 0.00 39.78 34.39 3n8f n ASN 147 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 3n8f s ASP 148 N -2.21 7.27 0.00 6.41 -1.08 -1.14 -4.97 116.67 120.96 3n8f s ASP 148 Ca 0.00 1.51 0.25 0.00 -0.52 0.00 0.00 52.55 53.79 3n8f s ASP 148 Cb 0.00 -2.48 1.42 0.00 -1.46 0.00 0.00 42.92 40.40 3n8f s ASP 148 CO 0.00 0.04 1.85 -0.81 0.52 0.00 0.00 175.17 176.77 3n8f n PRO 149 N 2.62 0.65 0.21 4.34 -0.04 -1.26 -2.67 135.00 138.84 3n8f n PRO 149 Ca -0.03 0.02 0.09 0.00 -0.04 0.00 0.00 63.50 63.54 3n8f n PRO 149 Cb 0.50 -1.50 0.34 0.00 -0.04 0.00 0.00 33.50 32.80 3n8f n PRO 149 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 3n8f h LYS 150 N 0.00 0.00 -0.39 0.54 1.79 -1.94 -3.27 116.57 113.29 3n8f h LYS 150 Ca 0.00 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.46 3n8f h LYS 150 Cb 0.07 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 30.70 3n8f h LYS 150 CO 0.00 0.25 0.22 -0.07 -1.08 0.00 0.00 179.45 178.77 3n8f h LEU 151 N 0.00 0.49 -1.57 2.94 3.38 -1.69 0.82 115.31 119.68 3n8f h LEU 151 Ca -0.00 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 57.84 3n8f h LEU 151 Cb 0.91 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.53 3n8f h LEU 151 CO 0.03 0.43 -0.19 0.11 0.09 0.00 0.00 178.44 178.91 3n8f h LYS 152 N 0.51 0.00 0.00 1.13 1.57 -1.76 -3.33 116.57 114.69 3n8f h LYS 152 Ca 0.14 0.00 -0.23 0.00 -1.87 0.00 0.00 60.65 58.69 3n8f h LYS 152 Cb 0.05 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.31 3n8f h LYS 152 CO -0.02 0.19 -1.87 2.41 -0.57 0.00 0.00 179.45 179.59 3n8f n THR 153 N -3.62 0.87 -0.03 -0.16 -1.04 -0.86 -4.91 114.28 104.53 3n8f n THR 153 Ca -0.01 -0.46 -0.06 0.00 -2.04 0.00 0.00 64.05 61.48 3n8f n THR 153 Cb 0.32 -0.82 -0.02 0.00 -1.82 0.00 0.00 70.33 68.00 3n8f n THR 153 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3n8f n GLN 154 N -2.65 0.12 0.00 -2.82 6.02 0.28 -5.10 117.38 113.24 3n8f n GLN 154 Ca -0.23 0.05 0.00 0.00 -0.01 0.00 0.00 57.00 56.81 3n8f n GLN 154 Cb 0.86 -0.75 0.00 0.00 1.02 0.00 0.00 30.24 31.37 3n8f n GLN 154 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3n8f n GLY 155 N 2.71 -0.39 0.03 1.08 0.00 -1.18 -4.96 105.19 102.48 3n8f n GLY 155 Ca -0.11 -0.50 0.02 0.00 0.00 0.00 0.00 46.02 45.43 3n8f n GLY 155 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3n8f n LYS 156 N 0.00 0.90 -3.94 1.61 5.02 -1.26 -4.28 118.16 116.21 3n8f n LYS 156 Ca 0.00 -0.09 -0.09 0.00 -2.02 0.00 0.00 58.31 56.10 3n8f n LYS 156 Cb 0.00 -1.38 -0.07 0.00 -0.02 0.00 0.00 35.03 33.55 3n8f n LYS 156 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3n8f s MET 158 N -3.93 2.90 0.41 0.00 -1.94 0.43 -4.96 119.30 112.21 3n8f s MET 158 Ca 0.13 -1.01 -0.23 0.00 -1.71 0.00 0.00 55.69 52.86 3n8f s MET 158 Cb 0.04 -3.59 -0.12 0.00 2.01 0.00 0.00 34.83 33.17 3n8f s MET 158 CO -0.05 -0.61 0.73 -0.35 -0.01 0.00 0.00 175.02 174.73 3n8f n PRO 159 N 4.93 0.84 -3.61 2.03 -0.04 -1.26 -2.24 135.00 135.65 3n8f n PRO 159 Ca -0.13 0.30 -0.07 0.00 -0.04 0.00 0.00 63.50 63.57 3n8f n PRO 159 Cb 0.46 -1.69 -0.08 0.00 -0.04 0.00 0.00 33.50 32.15 3n8f n PRO 159 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 3n8f s PHE 160 N -1.37 -0.89 -0.11 0.54 2.19 -1.26 -4.78 117.98 112.30 3n8f s PHE 160 Ca 0.63 1.57 -0.06 0.00 0.33 0.00 0.00 56.93 59.40 3n8f s PHE 160 Cb -0.60 0.35 -0.04 0.00 -1.31 0.00 0.00 43.02 41.42 3n8f s PHE 160 CO 0.57 -0.54 0.12 -0.06 1.83 0.00 0.00 175.22 177.14 3n8f s PHE 161 N 2.65 3.53 0.29 10.12 0.40 -1.26 -1.70 117.98 132.01 3n8f s PHE 161 Ca -0.00 0.47 -0.29 0.00 -0.60 0.00 0.00 56.93 56.51 3n8f s PHE 161 Cb -0.12 -1.91 -0.10 0.00 0.51 0.00 0.00 43.02 41.40 3n8f s PHE 161 CO -0.14 0.69 1.25 1.03 0.70 0.00 0.00 175.22 178.76 3n8f s ARG 162 N -1.07 4.44 0.71 0.44 0.52 -0.55 -4.71 118.95 118.73 3n8f s ARG 162 Ca 0.16 2.08 -0.14 0.00 -0.52 0.00 0.00 55.73 57.31 3n8f s ARG 162 Cb -0.12 -3.13 0.03 0.00 0.52 0.00 0.00 34.95 32.25 3n8f s ARG 162 CO 0.05 -0.10 1.12 0.00 0.02 0.00 0.00 175.30 176.39 3n8f s ALA 163 N -0.90 2.30 0.69 2.13 0.00 -1.26 -1.97 121.76 122.75 3n8f s ALA 163 Ca 0.49 0.53 -0.16 0.00 0.00 0.00 0.00 51.96 52.82 3n8f s ALA 163 Cb -0.37 -3.34 0.02 0.00 0.00 0.00 0.00 23.12 19.43 3n8f s ALA 163 CO 0.47 -1.59 1.24 0.20 0.00 0.00 0.00 175.76 176.08 3n8f s GLY 164 N -2.70 2.56 0.19 0.00 0.00 -0.30 -4.69 107.32 102.37 3n8f s GLY 164 Ca 0.67 1.01 0.03 0.00 0.00 0.00 0.00 44.72 46.43 3n8f s GLY 164 CO 0.47 1.43 -0.03 -0.11 0.00 0.00 0.00 173.10 174.86 3n8f s PHE 165 N -1.74 1.36 0.72 1.90 -0.71 -1.26 -2.49 117.98 115.75 3n8f s PHE 165 Ca 0.78 -0.91 0.01 0.00 -1.04 0.00 0.00 56.93 55.76 3n8f s PHE 165 Cb -0.32 -0.76 0.13 0.00 -1.21 0.00 0.00 43.02 40.86 3n8f s PHE 165 CO 0.42 -0.07 0.99 0.14 -1.34 0.00 0.00 175.22 175.36 3n8f s VAL 166 N -3.48 2.06 0.00 -2.49 -7.23 -1.19 -4.48 120.40 103.60 3n8f s VAL 166 Ca 0.24 -0.66 0.00 0.00 -1.81 0.00 0.00 61.98 59.74 3n8f s VAL 166 Cb 0.05 -2.40 0.00 0.00 0.56 0.00 0.00 36.38 34.59 3n8f s VAL 166 CO 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 175.10 174.84 3n8f s PRO 168 N 0.00 0.05 0.36 0.00 0.05 -1.26 -4.70 135.00 129.50 3n8f s PRO 168 Ca 0.00 0.06 0.19 0.00 0.05 0.00 0.00 61.00 61.30 3n8f s PRO 168 Cb 0.00 0.02 0.30 0.00 0.05 0.00 0.00 34.50 34.88 3n8f s PRO 168 CO 0.00 -0.01 1.56 0.00 0.05 0.00 0.00 177.00 178.61 3n8f h THR 169 N 3.14 0.54 -4.12 1.26 1.03 -1.84 -3.46 112.91 109.46 3n8f h THR 169 Ca -0.27 -1.66 -0.47 0.00 -0.01 0.00 0.00 66.41 64.00 3n8f h THR 169 Cb 1.20 2.18 0.14 0.00 -1.07 0.00 0.00 68.15 70.59 3n8f h THR 169 CO 0.18 0.30 0.27 -2.16 -0.01 0.00 0.00 175.52 174.10 3n8f s PRO 170 N -3.15 1.20 -0.05 0.00 0.04 -1.26 -4.93 135.00 126.85 3n8f s PRO 170 Ca 0.04 0.56 -0.40 0.00 0.04 0.00 0.00 61.00 61.24 3n8f s PRO 170 Cb 0.07 -1.82 -0.19 0.00 0.04 0.00 0.00 34.50 32.60 3n8f s PRO 170 CO 0.70 -2.21 1.20 -2.30 0.04 0.00 0.00 177.00 174.43 3n8f n PRO 171 N -3.82 0.25 -3.55 0.56 -0.01 -1.26 -4.99 135.00 122.17 3n8f n PRO 171 Ca 0.06 0.09 -0.17 0.00 -0.01 0.00 0.00 63.50 63.47 3n8f n PRO 171 Cb 0.57 -1.62 -0.06 0.00 -0.01 0.00 0.00 33.50 32.37 3n8f n PRO 171 CO 0.00 0.00 0.00 -0.47 -0.01 0.00 0.00 175.50 175.02 3n8f s TYR 172 N 0.52 -0.66 -0.09 6.00 6.14 -1.26 -5.12 117.35 122.88 3n8f s TYR 172 Ca 0.92 1.24 0.03 0.00 0.64 0.00 0.00 57.07 59.89 3n8f s TYR 172 Cb -1.23 0.37 0.01 0.00 0.42 0.00 0.00 41.96 41.53 3n8f s TYR 172 CO 0.58 -0.56 -0.17 -1.14 0.64 0.00 0.00 175.55 174.90 3n8f s GLN 173 N -0.90 2.30 0.00 4.97 0.74 -1.26 -5.08 119.66 120.43 3n8f s GLN 173 Ca -0.09 -0.61 0.00 0.00 0.05 0.00 0.00 55.36 54.71 3n8f s GLN 173 Cb -0.01 -1.84 0.00 0.00 1.10 0.00 0.00 33.01 32.26 3n8f s GLN 173 CO 0.08 0.06 0.00 0.45 -0.55 0.00 0.00 175.29 175.33 3n8f n SER 174 N 3.81 0.00 0.00 6.67 2.88 -1.26 -5.16 113.62 120.57 3n8f n SER 174 Ca -0.21 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.33 3n8f n SER 174 Cb 0.52 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.98 3n8f n SER 174 CO 0.00 0.00 0.00 -0.11 -1.23 0.00 0.00 175.04 173.70 3n8f n LEU 175 N 0.00 0.00 -3.78 2.46 7.94 -1.26 -4.53 117.00 117.82 3n8f n LEU 175 Ca 0.00 0.00 -0.18 0.00 -1.11 0.00 0.00 56.01 54.72 3n8f n LEU 175 Cb 0.00 0.00 -0.17 0.00 0.53 0.00 0.00 43.42 43.78 3n8f n LEU 175 CO 0.00 0.00 -0.37 0.00 -1.11 0.00 0.00 177.39 175.91 3n8f s ALA 176 N -1.74 0.33 -0.15 1.96 0.00 -1.26 -4.70 121.76 116.21 3n8f s ALA 176 Ca 0.00 0.14 -0.37 0.00 0.00 0.00 0.00 51.96 51.73 3n8f s ALA 176 Cb 0.00 -0.42 -0.14 0.00 0.00 0.00 0.00 23.12 22.56 3n8f s ALA 176 CO 0.00 -0.19 1.75 0.54 0.00 0.00 0.00 175.76 177.86 3n8f n ARG 177 N 4.46 1.61 -4.94 0.00 1.74 -1.02 -4.98 116.66 113.53 3n8f n ARG 177 Ca -0.20 0.59 -0.33 0.00 -0.77 0.00 0.00 57.85 57.14 3n8f n ARG 177 Cb 0.50 -2.34 -0.14 0.00 -1.02 0.00 0.00 32.46 29.46 3n8f n ARG 177 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 3n8f s ASP 178 N 3.34 3.81 0.15 0.55 1.01 -1.26 -4.93 116.67 119.34 3n8f s ASP 178 Ca 0.94 -0.31 -0.17 0.00 0.71 0.00 0.00 52.55 53.72 3n8f s ASP 178 Cb -0.89 -1.08 -0.07 0.00 1.01 0.00 0.00 42.92 41.88 3n8f s ASP 178 CO 0.57 0.27 0.60 -1.10 0.21 0.00 0.00 175.17 175.72 3n8f s GLN 179 N -0.27 4.11 0.72 8.23 1.11 -1.26 -3.14 119.66 129.16 3n8f s GLN 179 Ca 0.01 0.66 -0.11 0.00 0.01 0.00 0.00 55.36 55.93 3n8f s GLN 179 Cb -0.13 -2.99 0.02 0.00 -1.01 0.00 0.00 33.01 28.90 3n8f s GLN 179 CO 0.03 0.49 1.07 -1.50 0.01 0.00 0.00 175.29 175.39 3n8f s ILE 180 N -1.39 3.84 -0.12 1.08 1.10 -1.04 0.29 121.20 124.95 3n8f s ILE 180 Ca 0.37 0.60 -0.01 0.00 -0.51 0.00 0.00 60.65 61.10 3n8f s ILE 180 Cb -0.17 -3.33 0.04 0.00 0.15 0.00 0.00 42.46 39.15 3n8f s ILE 180 CO 0.20 -0.78 -0.02 0.21 -2.11 0.00 0.00 174.94 172.43 3n8f s ASN 181 N -3.80 2.25 0.00 4.50 3.04 0.16 -4.04 114.94 117.05 3n8f s ASN 181 Ca 0.59 -0.40 0.27 0.00 0.04 0.00 0.00 52.86 53.35 3n8f s ASN 181 Cb -0.14 -0.67 0.83 0.00 -1.54 0.00 0.00 41.25 39.72 3n8f s ASN 181 CO 0.55 -0.19 1.61 0.00 -3.04 0.00 0.00 177.10 176.03 3n8f n ALA 182 N 5.02 2.80 -2.54 1.71 0.00 0.17 0.27 120.51 127.93 3n8f n ALA 182 Ca -0.10 -0.46 -0.21 0.00 0.00 0.00 0.00 53.44 52.67 3n8f n ALA 182 Cb 0.49 -1.11 -0.12 0.00 0.00 0.00 0.00 19.45 18.71 3n8f n ALA 182 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 3n8f s VAL 183 N -2.21 1.54 0.30 0.00 -7.23 -1.26 -4.35 120.40 107.19 3n8f s VAL 183 Ca 0.31 -1.62 -0.29 0.00 -1.81 0.00 0.00 61.98 58.58 3n8f s VAL 183 Cb 0.20 -1.52 -0.10 0.00 0.56 0.00 0.00 36.38 35.52 3n8f s VAL 183 CO 0.41 -0.22 1.39 0.42 -0.31 0.00 0.00 175.10 176.79 3n8f s THR 184 N -1.58 2.61 -1.44 5.32 -4.23 -1.26 -4.62 115.64 110.44 3n8f s THR 184 Ca 0.07 0.57 0.22 0.00 -1.18 0.00 0.00 61.69 61.37 3n8f s THR 184 Cb -0.08 -3.36 0.38 0.00 1.34 0.00 0.00 72.50 70.78 3n8f s THR 184 CO 0.04 0.12 1.70 -1.20 -0.54 0.00 0.00 174.62 174.73 3n8f n SER 185 N 1.42 0.00 -4.91 3.99 7.64 -1.08 -4.31 113.62 116.38 3n8f n SER 185 Ca 0.03 -0.04 -0.30 0.00 1.01 0.00 0.00 58.87 59.57 3n8f n SER 185 Cb 0.41 -0.28 -0.04 0.00 -1.01 0.00 0.00 64.21 63.29 3n8f n SER 185 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3n8f s PHE 186 N -2.56 3.48 -0.78 1.43 0.08 -1.26 -4.75 117.98 113.62 3n8f s PHE 186 Ca 0.21 0.49 -0.25 0.00 0.12 0.00 0.00 56.93 57.50 3n8f s PHE 186 Cb 0.15 -1.96 -0.02 0.00 -0.57 0.00 0.00 43.02 40.61 3n8f s PHE 186 CO 0.33 0.42 1.82 -0.51 -0.10 0.00 0.00 175.22 177.17 3n8f s LEU 187 N -2.85 3.24 -0.02 -0.37 1.43 -1.26 -4.66 118.68 114.20 3n8f s LEU 187 Ca 0.40 -0.31 0.02 0.00 -1.03 0.00 0.00 54.13 53.21 3n8f s LEU 187 Cb -0.12 -2.55 0.03 0.00 0.03 0.00 0.00 46.19 43.59 3n8f s LEU 187 CO 0.26 -2.42 0.87 -0.90 0.23 0.00 0.00 176.35 174.38 3n8f n ASP 188 N 12.70 0.41 -3.55 2.29 5.75 -1.26 -4.78 116.55 128.11 3n8f n ASP 188 Ca 0.29 -1.82 -0.19 0.00 -0.01 0.00 0.00 54.79 53.05 3n8f n ASP 188 Cb 0.50 -0.15 0.06 0.00 -1.03 0.00 0.00 41.12 40.50 3n8f n ASP 188 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3n8f n ALA 189 N -0.20 -2.01 -0.16 2.12 0.00 -1.26 -4.73 120.51 114.26 3n8f n ALA 189 Ca 0.02 -0.11 -0.03 0.00 0.00 0.00 0.00 53.44 53.32 3n8f n ALA 189 Cb 0.60 -2.21 0.17 0.00 0.00 0.00 0.00 19.45 18.00 3n8f n ALA 189 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 3n8f h SER 190 N -1.89 0.84 0.55 0.00 0.02 -1.85 -2.75 113.55 108.47 3n8f h SER 190 Ca -0.60 -0.15 0.00 0.00 -0.84 0.00 0.00 61.79 60.20 3n8f h SER 190 Cb 1.35 -0.22 0.00 0.00 0.14 0.00 0.00 62.40 63.67 3n8f h SER 190 CO 0.53 0.80 0.00 0.00 -1.14 0.00 0.00 176.83 177.02 3n8f n LEU 191 N -4.27 0.46 -0.03 5.07 -0.00 -1.26 -0.03 117.00 116.94 3n8f n LEU 191 Ca 0.04 0.63 0.02 0.00 -0.00 0.00 0.00 56.01 56.71 3n8f n LEU 191 Cb 0.22 -0.58 -0.11 0.00 -0.00 0.00 0.00 43.42 42.95 3n8f n LEU 191 CO 0.40 -0.53 -0.75 0.52 -0.00 0.00 0.00 177.39 177.03 3n8f n VAL 192 N -2.02 0.30 0.06 1.47 0.31 -1.11 -2.12 118.33 115.21 3n8f n VAL 192 Ca 0.02 -0.39 0.02 0.00 -0.01 0.00 0.00 64.34 63.98 3n8f n VAL 192 Cb 0.18 -0.10 -0.03 0.00 -0.91 0.00 0.00 33.84 32.98 3n8f n VAL 192 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 3n8f n TYR 193 N -2.15 0.00 0.00 3.52 4.02 -1.04 -4.17 117.16 117.34 3n8f n TYR 193 Ca -0.09 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.80 3n8f n TYR 193 Cb 0.55 -0.06 0.00 0.00 -0.02 0.00 0.00 39.34 39.80 3n8f n TYR 193 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3n8f n GLY 194 N 1.88 0.91 0.00 2.72 0.00 0.96 -4.23 105.19 107.43 3n8f n GLY 194 Ca -0.00 -1.90 0.00 0.00 0.00 0.00 0.00 46.02 44.12 3n8f n GLY 194 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3n8f n SER 195 N -0.41 0.07 -4.48 1.61 7.64 -1.26 -4.72 113.62 112.07 3n8f n SER 195 Ca 0.00 -0.38 -0.35 0.00 1.01 0.00 0.00 58.87 59.15 3n8f n SER 195 Cb 0.00 0.52 -0.12 0.00 -1.01 0.00 0.00 64.21 63.60 3n8f n SER 195 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 3n8f s GLU 196 N -0.52 3.69 0.00 1.43 2.02 -1.26 -3.94 118.70 120.12 3n8f s GLU 196 Ca 0.00 -0.48 0.00 0.00 0.02 0.00 0.00 54.97 54.51 3n8f s GLU 196 Cb 0.00 -3.20 0.00 0.00 0.10 0.00 0.00 34.13 31.03 3n8f s GLU 196 CO 0.00 -0.03 0.00 -0.35 0.02 0.00 0.00 175.26 174.90 3n8f n PRO 197 N 4.40 0.00 0.00 0.39 -0.04 -1.26 -1.49 135.00 137.00 3n8f n PRO 197 Ca -0.17 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.29 3n8f n PRO 197 Cb 0.52 -0.93 0.00 0.00 -0.04 0.00 0.00 33.50 33.05 3n8f n PRO 197 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 3n8f n LEU 199 N 0.69 0.00 0.21 1.53 7.94 -1.26 -2.91 117.00 123.19 3n8f n LEU 199 Ca 0.00 0.00 0.06 0.00 -1.11 0.00 0.00 56.01 54.96 3n8f n LEU 199 Cb 0.00 0.00 0.44 0.00 0.53 0.00 0.00 43.42 44.39 3n8f n LEU 199 CO 0.00 0.00 0.76 0.00 -1.11 0.00 0.00 177.39 177.04 3n8f h ALA 200 N 0.00 1.17 -0.03 1.96 0.00 -1.44 -2.82 119.26 118.10 3n8f h ALA 200 Ca 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.62 3n8f h ALA 200 Cb 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.74 3n8f h ALA 200 CO 0.00 0.39 0.00 0.45 0.00 0.00 0.00 179.25 180.09 3n8f n SER 201 N -3.71 1.58 -0.05 0.00 2.88 -1.15 -3.81 113.62 109.36 3n8f n SER 201 Ca -0.01 -1.53 0.01 0.00 -1.33 0.00 0.00 58.87 56.00 3n8f n SER 201 Cb 0.42 -0.01 -0.15 0.00 -0.75 0.00 0.00 64.21 63.72 3n8f n SER 201 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 3n8f n ARG 202 N 0.23 0.78 0.00 -1.46 0.63 -1.07 -4.23 116.66 111.55 3n8f n ARG 202 Ca 0.19 -0.10 0.15 0.00 -0.92 0.00 0.00 57.85 57.17 3n8f n ARG 202 Cb 0.36 -1.48 0.79 0.00 0.45 0.00 0.00 32.46 32.59 3n8f n ARG 202 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 3n8f n LEU 203 N -2.44 0.33 -4.90 6.15 4.77 -1.21 -4.87 117.00 114.83 3n8f n LEU 203 Ca -0.17 -0.04 -0.28 0.00 -0.03 0.00 0.00 56.01 55.49 3n8f n LEU 203 Cb 0.81 -0.07 -0.04 0.00 -2.33 0.00 0.00 43.42 41.79 3n8f n LEU 203 CO 0.41 0.06 -0.15 -0.13 -1.33 0.00 0.00 177.39 176.25 3n8f s ARG 204 N -2.17 3.32 -0.91 3.23 0.52 -1.26 0.36 118.95 122.05 3n8f s ARG 204 Ca 0.40 -0.58 -0.14 0.00 -0.52 0.00 0.00 55.73 54.89 3n8f s ARG 204 Cb 0.21 -2.93 0.21 0.00 0.52 0.00 0.00 34.95 32.96 3n8f s ARG 204 CO 0.40 0.55 0.91 1.21 0.02 0.00 0.00 175.30 178.39 3n8f s ASN 205 N -2.88 6.85 -0.01 0.23 2.47 -0.56 -4.34 114.94 116.70 3n8f s ASN 205 Ca 0.34 -2.74 0.07 0.00 0.42 0.00 0.00 52.86 50.95 3n8f s ASN 205 Cb -0.12 -2.25 0.23 0.00 -1.45 0.00 0.00 41.25 37.67 3n8f s ASN 205 CO 0.27 -0.62 1.14 0.18 -3.72 0.00 0.00 177.10 174.35 3n8f n LEU 206 N 4.27 1.59 -0.03 3.21 4.77 -1.26 -3.45 117.00 126.10 3n8f n LEU 206 Ca 0.18 -0.80 -0.12 0.00 -0.03 0.00 0.00 56.01 55.25 3n8f n LEU 206 Cb 0.46 -0.24 0.01 0.00 -2.33 0.00 0.00 43.42 41.32 3n8f n LEU 206 CO 0.39 0.35 0.45 0.28 -1.33 0.00 0.00 177.39 177.53 3n8f h SER 207 N 1.46 0.78 -3.84 -1.43 0.02 -1.98 -3.46 113.55 105.10 3n8f h SER 207 Ca 0.00 -0.42 -0.40 0.00 -0.84 0.00 0.00 61.79 60.13 3n8f h SER 207 Cb 0.46 -0.22 -0.30 0.00 0.14 0.00 0.00 62.40 62.47 3n8f h SER 207 CO 0.03 1.18 -0.78 -0.94 -1.14 0.00 0.00 176.83 175.18 3n8f s SER 208 N -6.94 1.04 -1.51 3.07 1.04 -1.22 -5.06 113.70 104.12 3n8f s SER 208 Ca -0.09 -0.16 -0.09 0.00 0.48 0.00 0.00 55.95 56.09 3n8f s SER 208 Cb 0.11 -0.25 -0.00 0.00 0.10 0.00 0.00 66.02 65.98 3n8f s SER 208 CO 0.86 0.06 2.67 -0.81 0.98 0.00 0.00 173.24 177.00 3n8f n PRO 209 N 3.23 3.86 -0.01 4.02 -0.04 -1.26 -3.85 135.00 140.95 3n8f n PRO 209 Ca -0.17 -2.67 0.00 0.00 -0.04 0.00 0.00 63.50 60.63 3n8f n PRO 209 Cb 0.55 -2.81 0.01 0.00 -0.04 0.00 0.00 33.50 31.20 3n8f n PRO 209 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3n8f n LEU 210 N 3.36 2.03 -3.52 1.53 4.32 -1.26 -4.31 117.00 119.15 3n8f n LEU 210 Ca 0.69 -2.03 -0.21 0.00 -0.02 0.00 0.00 56.01 54.44 3n8f n LEU 210 Cb 0.26 -0.02 0.02 0.00 -1.62 0.00 0.00 43.42 42.07 3n8f n LEU 210 CO 0.81 0.51 0.01 0.61 -1.22 0.00 0.00 177.39 178.11 3n8f n GLY 211 N -0.51 -1.14 3.48 -0.72 0.00 -1.23 -4.66 105.19 100.41 3n8f n GLY 211 Ca 0.01 0.50 -0.26 0.00 0.00 0.00 0.00 46.02 46.27 3n8f n GLY 211 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3n8f s LEU 212 N -5.41 2.63 -0.16 0.99 1.02 -1.26 -3.73 118.68 112.75 3n8f s LEU 212 Ca 0.24 -0.81 -0.23 0.00 0.02 0.00 0.00 54.13 53.35 3n8f s LEU 212 Cb -0.08 -1.31 -0.02 0.00 0.02 0.00 0.00 46.19 44.80 3n8f s LEU 212 CO 0.83 0.10 0.73 -0.32 0.02 0.00 0.00 176.35 177.71 3n8f s MET 213 N -2.88 4.29 0.04 1.70 1.75 -1.26 -1.49 119.30 121.44 3n8f s MET 213 Ca 0.24 0.83 -0.34 0.00 -1.25 0.00 0.00 55.69 55.16 3n8f s MET 213 Cb -0.08 -3.55 -0.13 0.00 2.84 0.00 0.00 34.83 33.91 3n8f s MET 213 CO 0.12 -0.22 1.70 0.00 -0.65 0.00 0.00 175.02 175.98 3n8f n ALA 214 N 4.90 1.00 -3.83 4.11 0.00 0.16 -4.71 120.51 122.14 3n8f n ALA 214 Ca 0.01 0.38 -0.28 0.00 0.00 0.00 0.00 53.44 53.55 3n8f n ALA 214 Cb 0.50 -2.40 0.01 0.00 0.00 0.00 0.00 19.45 17.55 3n8f n ALA 214 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3n8f n VAL 215 N 4.16 0.00 -2.55 0.00 0.24 -1.26 -4.35 118.33 114.57 3n8f n VAL 215 Ca 0.20 -2.12 -0.40 0.00 -2.04 0.00 0.00 64.34 59.98 3n8f n VAL 215 Cb 0.28 -0.07 -0.05 0.00 -1.47 0.00 0.00 33.84 32.54 3n8f n VAL 215 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 3n8f s ASN 216 N -4.18 7.36 0.02 -1.34 3.84 -0.68 -4.60 114.94 115.37 3n8f s ASN 216 Ca 0.32 2.17 0.22 0.00 0.21 0.00 0.00 52.86 55.78 3n8f s ASN 216 Cb -0.03 -2.62 -0.24 0.00 -0.55 0.00 0.00 41.25 37.82 3n8f s ASN 216 CO 0.21 -0.08 0.66 0.00 -2.79 0.00 0.00 177.10 175.09 3n8f n GLN 217 N 1.42 0.58 -0.01 0.43 1.13 -1.26 -4.67 117.38 115.01 3n8f n GLN 217 Ca -0.01 -0.11 0.00 0.00 -1.94 0.00 0.00 57.00 54.94 3n8f n GLN 217 Cb 0.45 -1.59 -0.02 0.00 0.11 0.00 0.00 30.24 29.20 3n8f n GLN 217 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 3n8f n GLU 218 N -2.28 1.79 -4.72 -1.09 1.02 -1.26 -4.98 120.64 109.11 3n8f n GLU 218 Ca -0.02 -0.01 -0.31 0.00 -0.02 0.00 0.00 57.16 56.80 3n8f n GLU 218 Cb 0.54 -1.06 -0.13 0.00 -0.02 0.00 0.00 31.44 30.77 3n8f n GLU 218 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3n8f s ALA 219 N -2.11 2.49 0.04 0.62 0.00 -1.26 -5.14 121.76 116.40 3n8f s ALA 219 Ca -0.01 -1.22 -0.00 0.00 0.00 0.00 0.00 51.96 50.73 3n8f s ALA 219 Cb 0.01 -0.65 -0.03 0.00 0.00 0.00 0.00 23.12 22.45 3n8f s ALA 219 CO 0.09 0.56 -0.04 -1.58 0.00 0.00 0.00 175.76 174.80 3n8f s TRP 220 N -0.89 0.46 -0.51 0.00 0.52 -1.26 -4.60 118.94 112.65 3n8f s TRP 220 Ca 0.14 -0.78 0.04 0.00 0.02 0.00 0.00 56.10 55.51 3n8f s TRP 220 Cb -0.10 -0.32 0.16 0.00 -1.15 0.00 0.00 33.47 32.06 3n8f s TRP 220 CO 0.04 -0.25 0.36 0.34 0.02 0.00 0.00 176.95 177.46 3n8f s ASP 221 N -2.21 3.15 -1.49 2.95 2.15 -0.11 -4.87 116.67 116.23 3n8f s ASP 221 Ca -0.04 -3.19 -0.05 0.00 0.43 0.00 0.00 52.55 49.70 3n8f s ASP 221 Cb -0.01 -0.98 0.04 0.00 -0.30 0.00 0.00 42.92 41.67 3n8f s ASP 221 CO -0.05 -0.17 0.51 1.41 -0.17 0.00 0.00 175.17 176.70 3n8f n HIS 222 N 2.76 -1.68 0.00 -5.34 8.25 -1.26 -0.45 115.22 117.51 3n8f n HIS 222 Ca 0.21 0.76 0.00 0.00 -0.26 0.00 0.00 57.72 58.43 3n8f n HIS 222 Cb 0.40 -3.51 0.00 0.00 1.12 0.00 0.00 29.99 28.00 3n8f n HIS 222 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3n8f n GLY 223 N -1.86 2.95 3.85 -1.41 0.00 -1.26 -5.01 105.19 102.46 3n8f n GLY 223 Ca -0.20 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.50 3n8f n GLY 223 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3n8f s LEU 224 N 0.00 3.88 0.60 0.99 1.43 0.41 -5.06 118.68 120.93 3n8f s LEU 224 Ca 0.00 1.34 0.01 0.00 -1.03 0.00 0.00 54.13 54.45 3n8f s LEU 224 Cb 0.00 -4.20 0.06 0.00 0.03 0.00 0.00 46.19 42.08 3n8f s LEU 224 CO 0.00 -0.37 0.84 0.00 0.23 0.00 0.00 176.35 177.05 3n8f s ALA 225 N -2.27 3.90 0.19 4.21 0.00 -1.26 -0.94 121.76 125.59 3n8f s ALA 225 Ca 0.55 -1.50 0.07 0.00 0.00 0.00 0.00 51.96 51.09 3n8f s ALA 225 Cb -0.10 -2.01 -0.05 0.00 0.00 0.00 0.00 23.12 20.96 3n8f s ALA 225 CO 0.24 -0.96 -0.14 0.71 0.00 0.00 0.00 175.76 175.62 3n8f s TYR 226 N -2.86 1.64 0.91 0.00 4.12 -1.26 -4.79 117.35 115.10 3n8f s TYR 226 Ca 0.60 -0.60 -0.11 0.00 0.02 0.00 0.00 57.07 56.99 3n8f s TYR 226 Cb -0.09 -0.77 0.14 0.00 -1.52 0.00 0.00 41.96 39.72 3n8f s TYR 226 CO 0.40 0.31 1.11 -2.14 0.02 0.00 0.00 175.55 175.25 3n8f s PRO 227 N -3.62 1.14 0.75 -1.71 0.02 -1.26 -1.68 135.00 128.63 3n8f s PRO 227 Ca 0.21 1.24 -0.11 0.00 0.02 0.00 0.00 61.00 62.36 3n8f s PRO 227 Cb -0.00 -1.76 0.04 0.00 0.02 0.00 0.00 34.50 32.79 3n8f s PRO 227 CO 0.06 -2.45 1.08 -2.14 -0.33 0.00 0.00 177.00 173.22 3n8f s PRO 228 N -4.74 2.47 0.10 5.54 0.02 -1.26 -4.16 135.00 132.97 3n8f s PRO 228 Ca 0.65 0.88 -0.25 0.00 0.02 0.00 0.00 61.00 62.30 3n8f s PRO 228 Cb -0.21 -1.94 -0.07 0.00 0.02 0.00 0.00 34.50 32.30 3n8f s PRO 228 CO 0.58 -1.41 0.78 -0.06 -0.33 0.00 0.00 177.00 176.56 3n8f s PHE 229 N -3.05 3.82 -0.83 6.54 0.08 -1.26 0.15 117.98 123.43 3n8f s PHE 229 Ca 0.60 1.56 -0.25 0.00 0.12 0.00 0.00 56.93 58.96 3n8f s PHE 229 Cb -0.15 -2.81 0.02 0.00 -0.57 0.00 0.00 43.02 39.51 3n8f s PHE 229 CO 0.55 0.38 1.54 1.21 -0.10 0.00 0.00 175.22 178.80 3n8f s ASN 230 N -0.56 5.96 -0.35 1.36 2.47 -0.69 -4.68 114.94 118.45 3n8f s ASN 230 Ca 0.38 -0.67 -0.06 0.00 0.42 0.00 0.00 52.86 52.93 3n8f s ASN 230 Cb -0.22 -2.56 -0.12 0.00 -1.45 0.00 0.00 41.25 36.90 3n8f s ASN 230 CO 0.25 -1.97 3.21 0.59 -3.72 0.00 0.00 177.10 175.47 3n8f n ASN 231 N 10.51 6.09 -4.28 -4.21 3.02 -1.26 -4.59 115.26 120.53 3n8f n ASN 231 Ca 0.21 -2.78 -0.34 0.00 -0.03 0.00 0.00 54.58 51.65 3n8f n ASN 231 Cb 0.50 -1.36 -0.15 0.00 -0.61 0.00 0.00 39.78 38.16 3n8f n ASN 231 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3n8f s VAL 232 N -0.18 2.85 -0.16 2.41 0.11 -1.26 -5.12 120.40 119.06 3n8f s VAL 232 Ca 0.64 -0.70 -0.08 0.00 -2.93 0.00 0.00 61.98 58.91 3n8f s VAL 232 Cb 0.33 -2.23 -0.04 0.00 -1.53 0.00 0.00 36.38 32.90 3n8f s VAL 232 CO -0.09 0.50 0.12 -0.75 -3.33 0.00 0.00 175.10 171.55 3n8f s LYS 233 N 0.97 3.78 0.70 1.54 2.20 -1.26 -4.13 119.74 123.53 3n8f s LYS 233 Ca -0.02 -0.21 -0.11 0.00 -0.36 0.00 0.00 55.97 55.27 3n8f s LYS 233 Cb -0.15 -3.26 0.01 0.00 -1.51 0.00 0.00 37.83 32.92 3n8f s LYS 233 CO -0.02 0.52 1.06 -1.25 -0.36 0.00 0.00 175.35 175.31 3n8f s PRO 234 N -0.29 2.95 -0.10 4.03 0.04 -1.26 -5.20 135.00 135.17 3n8f s PRO 234 Ca 0.11 0.76 -0.02 0.00 0.04 0.00 0.00 61.00 61.89 3n8f s PRO 234 Cb -0.12 -2.01 0.04 0.00 0.04 0.00 0.00 34.50 32.46 3n8f s PRO 234 CO 0.01 -1.04 0.02 0.45 0.04 0.00 0.00 177.00 176.48 3n8f s SER 235 N -4.01 1.90 0.58 6.66 0.15 -1.26 -5.02 113.70 112.70 3n8f s SER 235 Ca 0.58 -0.28 0.28 0.00 0.70 0.00 0.00 55.95 57.23 3n8f s SER 235 Cb -0.13 -0.42 1.50 0.00 -1.71 0.00 0.00 66.02 65.26 3n8f s SER 235 CO 0.54 -0.24 1.96 -0.65 1.20 0.00 0.00 173.24 176.05 3n8f h PRO 236 N 8.33 0.00 0.14 5.44 0.11 -1.94 -1.51 132.00 142.58 3n8f h PRO 236 Ca -0.18 0.00 -0.29 0.00 0.11 0.00 0.00 66.00 65.64 3n8f h PRO 236 Cb 1.13 0.00 0.02 0.00 0.11 0.00 0.00 31.00 32.26 3n8f h PRO 236 CO 0.27 0.00 -1.26 0.00 -0.21 0.00 0.00 178.00 176.80 3n8f h GLU 238 N 0.19 0.21 -0.81 0.00 5.08 -1.36 -3.25 114.58 114.64 3n8f h GLU 238 Ca -0.18 -0.07 -0.02 0.00 -1.00 0.00 0.00 59.36 58.10 3n8f h GLU 238 Cb 1.94 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 31.14 3n8f h GLU 238 CO 0.23 0.46 0.43 0.35 -1.00 0.00 0.00 179.01 179.48 3n8f h PHE 239 N 0.19 1.13 0.00 4.33 3.57 -1.51 -3.10 116.94 121.56 3n8f h PHE 239 Ca 0.03 -0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.50 3n8f h PHE 239 Cb 0.56 -0.36 0.00 0.00 2.79 0.00 0.00 35.95 38.94 3n8f h PHE 239 CO 0.01 0.79 -0.07 0.44 -2.23 0.00 0.00 178.31 177.25 3n8f n ILE 240 N -4.33 0.10 -3.22 1.41 -5.35 -1.22 -4.37 119.36 102.38 3n8f n ILE 240 Ca 0.08 -0.05 -0.01 0.00 -0.27 0.00 0.00 62.75 62.50 3n8f n ILE 240 Cb 0.11 -0.43 -0.03 0.00 -1.74 0.00 0.00 39.64 37.55 3n8f n ILE 240 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 3n8f s ASN 241 N -3.27 -0.82 0.04 7.28 3.84 -1.19 -5.06 114.94 115.76 3n8f s ASN 241 Ca 0.13 0.37 0.08 0.00 0.21 0.00 0.00 52.86 53.65 3n8f s ASN 241 Cb 0.18 1.75 -0.23 0.00 -0.55 0.00 0.00 41.25 42.40 3n8f s ASN 241 CO 0.56 -0.29 0.98 0.71 -2.79 0.00 0.00 177.10 176.27 3n8f h THR 242 N 6.06 1.30 -0.94 -5.21 1.35 -1.74 -3.33 112.91 110.41 3n8f h THR 242 Ca -0.15 -3.06 0.18 0.00 -0.55 0.00 0.00 66.41 62.83 3n8f h THR 242 Cb 1.16 2.66 -0.11 0.00 -1.73 0.00 0.00 68.15 70.14 3n8f h THR 242 CO 0.24 0.76 0.52 0.74 -0.25 0.00 0.00 175.52 177.53 3n8f h THR 243 N 0.01 0.68 -3.60 6.82 2.02 -1.97 -3.17 112.91 113.69 3n8f h THR 243 Ca -0.15 -0.23 -0.65 0.00 0.77 0.00 0.00 66.41 66.15 3n8f h THR 243 Cb 1.90 -0.04 -0.24 0.00 -1.74 0.00 0.00 68.15 68.02 3n8f h THR 243 CO 0.11 0.12 -0.64 0.00 0.37 0.00 0.00 175.52 175.48 3n8f s ALA 244 N -5.90 3.09 -0.47 6.16 0.00 -1.25 -5.01 121.76 118.39 3n8f s ALA 244 Ca -0.12 -1.18 -0.13 0.00 0.00 0.00 0.00 51.96 50.53 3n8f s ALA 244 Cb 0.24 -2.03 0.09 0.00 0.00 0.00 0.00 23.12 21.42 3n8f s ALA 244 CO 0.79 -0.54 0.38 -3.38 0.00 0.00 0.00 175.76 173.01 3n8f s HIS 245 N 1.58 3.29 -0.27 0.00 -3.43 -1.20 -4.79 115.29 110.46 3n8f s HIS 245 Ca 0.06 -1.24 0.03 0.00 -0.80 0.00 0.00 55.06 53.10 3n8f s HIS 245 Cb -0.15 -3.29 0.07 0.00 -1.43 0.00 0.00 32.58 27.78 3n8f s HIS 245 CO 0.02 -0.88 -0.07 0.08 -2.00 0.00 0.00 174.74 171.90 3n8f s VAL 246 N 1.55 2.00 1.07 -5.38 1.01 -1.26 -5.03 120.40 114.37 3n8f s VAL 246 Ca 0.04 -1.65 -0.15 0.00 0.00 0.00 0.00 61.98 60.21 3n8f s VAL 246 Cb -0.25 -2.22 0.23 0.00 0.00 0.00 0.00 36.38 34.14 3n8f s VAL 246 CO 0.04 -0.16 1.12 -2.16 0.00 0.00 0.00 175.10 173.95 3n8f s PRO 247 N 1.15 -0.17 1.08 2.72 0.04 -1.26 -3.68 135.00 134.88 3n8f s PRO 247 Ca -0.05 0.16 -0.15 0.00 0.04 0.00 0.00 61.00 61.00 3n8f s PRO 247 Cb -0.19 -1.70 0.23 0.00 0.04 0.00 0.00 34.50 32.88 3n8f s PRO 247 CO -0.06 -3.06 1.09 0.00 0.04 0.00 0.00 177.00 175.01 3n8f s PHE 249 N -2.96 3.53 -0.19 0.00 0.08 -1.26 -1.71 117.98 115.47 3n8f s PHE 249 Ca 0.67 0.97 -0.14 0.00 0.12 0.00 0.00 56.93 58.55 3n8f s PHE 249 Cb -0.16 -2.31 -0.04 0.00 -0.57 0.00 0.00 43.02 39.94 3n8f s PHE 249 CO 0.57 0.37 0.32 -1.14 -0.10 0.00 0.00 175.22 175.25 3n8f s GLN 250 N -2.31 4.19 0.31 0.44 0.74 0.40 -4.57 119.66 118.87 3n8f s GLN 250 Ca 0.41 0.09 -0.01 0.00 0.05 0.00 0.00 55.36 55.90 3n8f s GLN 250 Cb -0.13 -3.50 -0.01 0.00 1.10 0.00 0.00 33.01 30.47 3n8f s GLN 250 CO 0.20 0.07 0.39 0.00 -0.55 0.00 0.00 175.29 175.39 3n8f s ALA 251 N 0.99 1.00 -1.20 1.58 0.00 -1.26 -4.10 121.76 118.77 3n8f s ALA 251 Ca 0.16 -1.62 0.08 0.00 0.00 0.00 0.00 51.96 50.58 3n8f s ALA 251 Cb -0.14 1.26 0.39 0.00 0.00 0.00 0.00 23.12 24.63 3n8f s ALA 251 CO 0.06 -0.74 1.21 0.41 0.00 0.00 0.00 175.76 176.70 3n8f n GLY 252 N -0.53 -0.69 3.02 0.00 0.00 -0.90 -4.62 105.19 101.48 3n8f n GLY 252 Ca 0.02 -0.03 -0.15 0.00 0.00 0.00 0.00 46.02 45.86 3n8f n GLY 252 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3n8f s ASP 253 N -2.80 0.83 0.53 1.61 2.15 -1.19 -3.58 116.67 114.22 3n8f s ASP 253 Ca 0.06 -0.33 0.23 0.00 0.43 0.00 0.00 52.55 52.94 3n8f s ASP 253 Cb 0.06 -0.03 1.46 0.00 -0.30 0.00 0.00 42.92 44.11 3n8f s ASP 253 CO 0.14 -0.06 2.14 0.28 -0.17 0.00 0.00 175.17 177.51 3n8f h SER 254 N 5.23 0.00 -0.30 -0.34 0.02 -1.95 -3.19 113.55 113.02 3n8f h SER 254 Ca -0.32 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.63 3n8f h SER 254 Cb 1.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.73 3n8f h SER 254 CO 0.45 0.06 0.00 0.54 -1.14 0.00 0.00 176.83 176.74 3n8f n ARG 255 N -4.05 2.06 -0.17 3.45 1.74 -1.26 -4.40 116.66 114.02 3n8f n ARG 255 Ca -0.03 -1.60 0.29 0.00 -0.77 0.00 0.00 57.85 55.74 3n8f n ARG 255 Cb 0.15 -1.43 0.72 0.00 -1.02 0.00 0.00 32.46 30.88 3n8f n ARG 255 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3n8f h ALA 256 N 4.17 2.79 -0.44 7.54 0.00 -1.88 -1.03 119.26 130.41 3n8f h ALA 256 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3n8f h ALA 256 Cb 0.68 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.53 3n8f h ALA 256 CO 0.00 -1.15 0.00 0.43 0.00 0.00 0.00 179.25 178.53 3n8f n SER 257 N -4.09 3.20 0.15 0.00 7.64 -1.26 -2.88 113.62 116.38 3n8f n SER 257 Ca 0.18 -1.97 0.18 0.00 1.01 0.00 0.00 58.87 58.27 3n8f n SER 257 Cb 1.00 -0.29 0.78 0.00 -1.01 0.00 0.00 64.21 64.69 3n8f n SER 257 CO 0.00 0.00 0.00 -0.08 -3.01 0.00 0.00 175.04 171.95 3n8f h GLU 258 N 2.83 0.00 -2.46 1.43 4.22 -1.50 -3.04 114.58 116.06 3n8f h GLU 258 Ca 0.00 0.00 -0.09 0.00 0.08 0.00 0.00 59.36 59.35 3n8f h GLU 258 Cb 0.81 0.00 -0.20 0.00 0.50 0.00 0.00 28.75 29.86 3n8f h GLU 258 CO 0.00 0.00 -0.02 -1.14 -2.18 0.00 0.00 179.01 175.67 3n8f s GLN 259 N -4.73 0.88 0.13 1.92 0.74 -1.26 -2.73 119.66 114.61 3n8f s GLN 259 Ca -0.05 0.07 -0.28 0.00 0.05 0.00 0.00 55.36 55.15 3n8f s GLN 259 Cb 0.16 0.41 -0.05 0.00 1.10 0.00 0.00 33.01 34.62 3n8f s GLN 259 CO 0.59 -0.26 1.59 0.82 -0.55 0.00 0.00 175.29 177.48 3n8f h ILE 260 N 3.41 0.20 -0.44 -2.34 1.08 -1.78 -2.58 117.51 115.06 3n8f h ILE 260 Ca -0.28 0.00 -0.11 0.00 -0.39 0.00 0.00 64.86 64.08 3n8f h ILE 260 Cb 1.16 0.20 -0.02 0.00 -3.07 0.00 0.00 36.82 35.09 3n8f h ILE 260 CO 0.39 0.00 -0.18 -0.07 -0.69 0.00 0.00 178.15 177.60 3n8f h LEU 261 N -0.50 0.85 -0.67 1.44 3.38 -1.95 -2.29 115.31 115.58 3n8f h LEU 261 Ca 0.07 -0.29 0.07 0.00 0.09 0.00 0.00 57.88 57.82 3n8f h LEU 261 Cb 0.61 -0.23 -0.06 0.00 0.09 0.00 0.00 40.66 41.07 3n8f h LEU 261 CO -0.34 1.02 0.35 0.25 0.09 0.00 0.00 178.44 179.80 3n8f h LEU 262 N 0.74 0.48 -1.92 1.67 5.85 -1.84 0.20 115.31 120.49 3n8f h LEU 262 Ca 0.11 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.86 3n8f h LEU 262 Cb 0.70 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.69 3n8f h LEU 262 CO 0.05 0.30 -0.09 0.00 -0.34 0.00 0.00 178.44 178.36 3n8f h ALA 263 N 1.38 1.16 0.14 1.25 0.00 -1.03 -2.74 119.26 119.42 3n8f h ALA 263 Ca 0.31 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 3n8f h ALA 263 Cb 0.27 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3n8f h ALA 263 CO -0.22 0.11 -0.07 1.15 0.00 0.00 0.00 179.25 180.22 3n8f h THR 264 N 0.00 0.69 0.00 0.00 2.02 -0.10 -2.53 112.91 112.99 3n8f h THR 264 Ca -0.00 -1.21 0.00 0.00 0.77 0.00 0.00 66.41 65.97 3n8f h THR 264 Cb 0.35 1.21 0.00 0.00 -1.74 0.00 0.00 68.15 67.97 3n8f h THR 264 CO 0.01 0.20 0.00 0.52 0.37 0.00 0.00 175.52 176.62 3n8f n VAL 265 N -4.88 1.11 0.04 3.16 0.31 -0.74 -1.38 118.33 115.96 3n8f n VAL 265 Ca -0.06 0.34 -0.01 0.00 -0.01 0.00 0.00 64.34 64.59 3n8f n VAL 265 Cb 0.23 -1.21 -0.08 0.00 -0.91 0.00 0.00 33.84 31.88 3n8f n VAL 265 CO 0.00 0.00 0.00 -0.74 -1.32 0.00 0.00 176.83 174.77 3n8f h HIS 266 N 0.00 0.00 0.00 3.52 2.76 -1.51 -2.91 115.15 117.00 3n8f h HIS 266 Ca 0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 3n8f h HIS 266 Cb 0.22 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.18 3n8f h HIS 266 CO 0.00 0.65 -0.54 1.15 -1.30 0.00 0.00 177.93 177.89 3n8f h THR 267 N 0.00 0.00 0.12 6.26 2.02 -0.77 -2.62 112.91 117.93 3n8f h THR 267 Ca -0.15 -0.52 -0.29 0.00 0.77 0.00 0.00 66.41 66.22 3n8f h THR 267 Cb 1.63 1.16 0.03 0.00 -1.74 0.00 0.00 68.15 69.23 3n8f h THR 267 CO 0.06 0.00 -1.25 -0.07 0.37 0.00 0.00 175.52 174.63 3n8f h LEU 268 N 0.00 0.80 -0.51 2.58 3.38 -1.41 -2.98 115.31 117.17 3n8f h LEU 268 Ca 0.00 -0.75 -0.08 0.00 0.09 0.00 0.00 57.88 57.13 3n8f h LEU 268 Cb 0.76 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 3n8f h LEU 268 CO 0.00 1.56 -0.01 -0.07 0.09 0.00 0.00 178.44 180.01 3n8f h LEU 269 N 0.24 0.89 -0.37 1.67 3.38 -1.50 -1.65 115.31 117.97 3n8f h LEU 269 Ca -0.18 -0.31 -0.04 0.00 0.09 0.00 0.00 57.88 57.44 3n8f h LEU 269 Cb 1.92 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 42.42 3n8f h LEU 269 CO 0.23 0.99 0.08 0.25 0.09 0.00 0.00 178.44 180.08 3n8f h LEU 270 N 0.77 0.58 -1.07 1.67 5.85 -1.60 -2.92 115.31 118.59 3n8f h LEU 270 Ca 0.14 -0.24 -0.06 0.00 0.84 0.00 0.00 57.88 58.56 3n8f h LEU 270 Cb 0.54 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 3n8f h LEU 270 CO 0.03 0.67 0.05 0.03 -0.34 0.00 0.00 178.44 178.88 3n8f h ARG 271 N 0.46 0.71 -0.53 1.25 3.08 -1.48 -2.62 114.38 115.25 3n8f h ARG 271 Ca 0.12 -0.16 -0.04 0.00 0.07 0.00 0.00 59.98 59.97 3n8f h ARG 271 Cb 0.33 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.25 3n8f h ARG 271 CO 0.00 0.69 0.16 1.49 -1.07 0.00 0.00 179.97 181.24 3n8f h GLU 272 N 0.68 0.79 0.31 0.04 4.57 -1.20 -1.90 114.58 117.87 3n8f h GLU 272 Ca 0.14 -0.14 -0.02 0.00 -1.18 0.00 0.00 59.36 58.16 3n8f h GLU 272 Cb 0.35 -0.13 0.00 0.00 -0.16 0.00 0.00 28.75 28.81 3n8f h GLU 272 CO 0.01 0.70 -0.15 1.25 -1.18 0.00 0.00 179.01 179.64 3n8f h HIS 273 N 0.77 -0.38 0.00 0.92 2.76 -1.28 -1.61 115.15 116.33 3n8f h HIS 273 Ca 0.18 -0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.32 3n8f h HIS 273 Cb 0.24 0.13 -0.00 0.00 1.55 0.00 0.00 27.41 29.33 3n8f h HIS 273 CO 0.01 -0.19 -0.07 -0.91 -1.30 0.00 0.00 177.93 175.47 3n8f h ASN 274 N -0.48 0.00 0.00 3.26 2.35 -1.42 0.51 115.58 119.80 3n8f h ASN 274 Ca -0.04 0.00 -0.17 0.00 -0.55 0.00 0.00 56.30 55.54 3n8f h ASN 274 Cb 0.36 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.74 3n8f h ASN 274 CO 0.07 0.07 -0.67 -0.09 -1.65 0.00 0.00 177.43 175.17 3n8f h ARG 275 N 0.00 0.45 -0.13 0.81 2.43 -1.17 -2.42 114.38 114.35 3n8f h ARG 275 Ca -0.00 -0.48 -0.04 0.00 -0.81 0.00 0.00 59.98 58.65 3n8f h ARG 275 Cb 0.27 0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 29.96 3n8f h ARG 275 CO 0.01 1.14 -0.07 -0.07 -1.51 0.00 0.00 179.97 179.47 3n8f h LEU 276 N -0.04 0.28 -1.61 3.80 3.38 -0.85 -0.50 115.31 119.76 3n8f h LEU 276 Ca -0.08 -0.42 -0.03 0.00 0.09 0.00 0.00 57.88 57.44 3n8f h LEU 276 Cb 1.37 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 42.03 3n8f h LEU 276 CO 0.13 0.64 -0.03 0.00 0.09 0.00 0.00 178.44 179.27 3n8f h ALA 277 N 0.65 1.69 0.43 1.53 0.00 -1.04 0.21 119.26 122.73 3n8f h ALA 277 Ca 0.03 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 3n8f h ALA 277 Cb 0.54 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.26 3n8f h ALA 277 CO 0.02 0.24 -0.21 0.00 0.00 0.00 0.00 179.25 179.30 3n8f h ARG 278 N 0.21 -0.55 -0.84 0.00 3.08 -1.29 -3.18 114.38 111.80 3n8f h ARG 278 Ca 0.05 0.04 0.24 0.00 0.07 0.00 0.00 59.98 60.38 3n8f h ARG 278 Cb 0.19 0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.33 3n8f h ARG 278 CO 0.01 -0.26 0.65 1.49 -1.07 0.00 0.00 179.97 180.78 3n8f h GLU 279 N -1.03 0.00 0.00 0.04 4.57 -0.72 -1.91 114.58 115.53 3n8f h GLU 279 Ca -0.06 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 3n8f h GLU 279 Cb 0.55 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.14 3n8f h GLU 279 CO 0.10 0.00 -0.38 1.28 -1.18 0.00 0.00 179.01 178.83 3n8f n LEU 280 N -4.13 0.43 0.08 1.64 4.77 0.03 -2.63 117.00 117.19 3n8f n LEU 280 Ca 0.17 0.19 0.03 0.00 -0.03 0.00 0.00 56.01 56.37 3n8f n LEU 280 Cb 0.95 -0.30 -0.03 0.00 -2.33 0.00 0.00 43.42 41.71 3n8f n LEU 280 CO 0.37 0.05 0.00 0.50 -1.33 0.00 0.00 177.39 176.98 3n8f h LYS 281 N 0.00 0.00 -0.53 3.23 3.64 -1.33 -3.18 116.57 118.41 3n8f h LYS 281 Ca 0.00 0.00 -0.05 0.00 -1.27 0.00 0.00 60.65 59.33 3n8f h LYS 281 Cb 0.55 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.35 3n8f h LYS 281 CO 0.00 0.29 0.11 -0.09 -2.27 0.00 0.00 179.45 177.50 3n8f h ARG 282 N 0.00 0.82 0.14 1.90 2.43 -1.37 -2.96 114.38 115.33 3n8f h ARG 282 Ca -0.09 -0.17 -0.34 0.00 -0.81 0.00 0.00 59.98 58.57 3n8f h ARG 282 Cb 1.42 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.85 3n8f h ARG 282 CO 0.04 0.75 -1.77 -0.07 -1.51 0.00 0.00 179.97 177.42 3n8f h LEU 283 N 0.79 0.46 -6.81 3.80 3.38 -1.68 -3.43 115.31 111.81 3n8f h LEU 283 Ca 0.17 -0.91 -0.61 0.00 0.09 0.00 0.00 57.88 56.62 3n8f h LEU 283 Cb 0.31 -0.15 -0.40 0.00 0.09 0.00 0.00 40.66 40.51 3n8f h LEU 283 CO 0.00 1.77 -0.74 0.20 0.09 0.00 0.00 178.44 179.76 3n8f s ASN 284 N -7.12 3.42 0.06 -0.43 -0.87 -1.20 -4.81 114.94 103.99 3n8f s ASN 284 Ca -0.20 -3.40 0.23 0.00 -1.57 0.00 0.00 52.86 47.92 3n8f s ASN 284 Cb 0.06 -1.12 0.93 0.00 -0.02 0.00 0.00 41.25 41.10 3n8f s ASN 284 CO 0.79 -0.14 1.71 -0.81 -2.57 0.00 0.00 177.10 176.08 3n8f n PRO 285 N 2.51 0.06 0.09 -0.60 -0.04 -1.12 -2.75 135.00 133.14 3n8f n PRO 285 Ca 0.22 0.18 0.11 0.00 -0.04 0.00 0.00 63.50 63.96 3n8f n PRO 285 Cb 0.40 -1.59 0.44 0.00 -0.04 0.00 0.00 33.50 32.70 3n8f n PRO 285 CO 0.00 0.00 0.00 -2.39 -0.04 0.00 0.00 175.50 173.07 3n8f n HIS 286 N -1.71 0.56 -2.29 0.54 1.44 -1.26 -4.83 115.22 107.67 3n8f n HIS 286 Ca 0.05 0.22 -0.39 0.00 -2.01 0.00 0.00 57.72 55.59 3n8f n HIS 286 Cb 0.28 -0.85 -0.02 0.00 0.12 0.00 0.00 29.99 29.51 3n8f n HIS 286 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 3n8f s TRP 287 N -3.21 3.11 0.93 -1.40 0.52 -1.11 -5.08 118.94 112.70 3n8f s TRP 287 Ca 0.05 1.55 -0.14 0.00 0.02 0.00 0.00 56.10 57.58 3n8f s TRP 287 Cb 0.10 -3.41 0.16 0.00 -1.15 0.00 0.00 33.47 29.16 3n8f s TRP 287 CO 0.36 -1.31 1.24 0.16 0.02 0.00 0.00 176.95 177.42 3n8f s ASP 288 N -1.04 3.43 0.24 2.95 -4.77 -1.26 -4.95 116.67 111.26 3n8f s ASP 288 Ca 0.55 0.55 -0.03 0.00 -3.30 0.00 0.00 52.55 50.33 3n8f s ASP 288 Cb -0.32 -0.83 0.27 0.00 -1.09 0.00 0.00 42.92 40.95 3n8f s ASP 288 CO 0.40 -2.56 1.69 1.23 0.70 0.00 0.00 175.17 176.64 3n8f h GLY 289 N -1.51 0.82 1.45 2.12 0.00 -1.95 -3.00 103.07 101.00 3n8f h GLY 289 Ca -0.46 -0.63 -0.20 0.00 0.00 0.00 0.00 47.33 46.04 3n8f h GLY 289 CO 0.50 0.58 -0.75 -2.09 0.00 0.00 0.00 176.54 174.78 3n8f h GLU 290 N 0.69 0.54 0.00 4.80 4.81 -1.95 -2.41 114.58 121.06 3n8f h GLU 290 Ca 0.11 -0.44 0.00 0.00 -0.13 0.00 0.00 59.36 58.90 3n8f h GLU 290 Cb 0.60 0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.08 3n8f h GLU 290 CO 0.04 1.07 0.00 1.98 -0.73 0.00 0.00 179.01 181.37 3n8f h MET 291 N 0.36 0.00 0.24 1.92 4.05 -1.95 0.99 114.93 120.55 3n8f h MET 291 Ca -0.04 0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 59.37 3n8f h MET 291 Cb 1.35 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 32.15 3n8f h MET 291 CO 0.14 0.00 -0.11 -0.07 0.23 0.00 0.00 176.91 177.09 3n8f h LEU 292 N 0.00 -0.27 -0.50 3.39 3.38 -1.36 -3.00 115.31 116.95 3n8f h LEU 292 Ca 0.00 -0.00 0.10 0.00 0.09 0.00 0.00 57.88 58.07 3n8f h LEU 292 Cb 0.38 0.07 -0.09 0.00 0.09 0.00 0.00 40.66 41.11 3n8f h LEU 292 CO 0.00 0.19 -0.05 0.22 0.09 0.00 0.00 178.44 178.89 3n8f h TYR 293 N -1.08 -0.13 -0.53 1.13 3.20 -1.23 -2.01 116.97 116.32 3n8f h TYR 293 Ca -0.03 0.04 -0.09 0.00 3.14 0.00 0.00 58.73 61.78 3n8f h TYR 293 Cb 0.25 0.13 -0.02 0.00 1.54 0.00 0.00 36.73 38.64 3n8f h TYR 293 CO 0.00 -0.16 -0.04 1.96 -1.64 0.00 0.00 178.16 178.28 3n8f h GLN 294 N 0.06 0.96 -0.40 1.82 1.08 -0.96 0.39 115.11 118.06 3n8f h GLN 294 Ca 0.25 -0.33 -0.15 0.00 -1.45 0.00 0.00 58.65 56.97 3n8f h GLN 294 Cb 0.38 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 27.73 3n8f h GLN 294 CO -0.46 0.99 -0.35 0.93 -0.95 0.00 0.00 178.83 178.99 3n8f h GLU 295 N 0.83 0.93 -0.25 1.46 4.39 -1.37 -1.69 114.58 118.89 3n8f h GLU 295 Ca 0.15 -0.47 -0.10 0.00 0.34 0.00 0.00 59.36 59.28 3n8f h GLU 295 Cb 0.58 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 29.23 3n8f h GLU 295 CO 0.03 1.13 -0.27 0.00 -1.16 0.00 0.00 179.01 178.74 3n8f h ALA 296 N 0.82 1.07 -0.08 3.43 0.00 -1.27 -2.19 119.26 121.04 3n8f h ALA 296 Ca 0.07 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 3n8f h ALA 296 Cb 0.94 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 3n8f h ALA 296 CO 0.09 0.57 0.03 -0.09 0.00 0.00 0.00 179.25 179.85 3n8f h ARG 297 N 0.43 0.12 -0.63 0.00 2.43 -0.80 -1.85 114.38 114.09 3n8f h ARG 297 Ca 0.06 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.22 3n8f h ARG 297 Cb 0.70 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.20 3n8f h ARG 297 CO 0.05 0.25 0.41 -0.22 -1.51 0.00 0.00 179.97 178.96 3n8f h LYS 298 N -0.04 0.82 0.00 0.20 3.64 -1.17 -1.38 116.57 118.64 3n8f h LYS 298 Ca 0.03 -0.05 -0.10 0.00 -1.27 0.00 0.00 60.65 59.26 3n8f h LYS 298 Cb 0.18 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.80 3n8f h LYS 298 CO -0.00 0.54 -0.46 0.97 -2.27 0.00 0.00 179.45 178.23 3n8f h ILE 299 N 0.84 1.11 -0.15 2.00 2.10 -1.40 -1.82 117.51 120.20 3n8f h ILE 299 Ca 0.23 -1.72 -0.19 0.00 1.08 0.00 0.00 64.86 64.26 3n8f h ILE 299 Cb -0.09 1.99 0.00 0.00 -1.09 0.00 0.00 36.82 37.63 3n8f h ILE 299 CO -0.06 0.45 -0.68 0.25 -1.08 0.00 0.00 178.15 177.04 3n8f h LEU 300 N 0.00 0.73 -0.42 2.19 5.85 -0.94 -1.99 115.31 120.73 3n8f h LEU 300 Ca -0.00 -0.44 -0.01 0.00 0.84 0.00 0.00 57.88 58.26 3n8f h LEU 300 Cb 0.95 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.75 3n8f h LEU 300 CO 0.06 1.21 0.21 1.23 -0.34 0.00 0.00 178.44 180.80 3n8f h GLY 301 N 0.92 0.64 0.18 3.75 0.00 -1.19 -2.15 103.07 105.23 3n8f h GLY 301 Ca -0.02 -0.31 0.12 0.00 0.00 0.00 0.00 47.33 47.11 3n8f h GLY 301 CO 0.13 0.30 0.15 0.00 0.00 0.00 0.00 176.54 177.12 3n8f h ALA 302 N 1.06 0.75 -0.12 3.60 0.00 -1.29 -1.52 119.26 121.74 3n8f h ALA 302 Ca 0.14 0.13 0.05 0.00 0.00 0.00 0.00 54.91 55.23 3n8f h ALA 302 Cb 0.10 0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.99 3n8f h ALA 302 CO -0.02 -0.29 -0.30 0.35 0.00 0.00 0.00 179.25 178.99 3n8f h PHE 303 N 0.29 -0.83 -0.31 0.00 3.57 -0.81 -1.22 116.94 117.62 3n8f h PHE 303 Ca 0.33 0.04 -0.09 0.00 3.53 0.00 0.00 57.97 61.77 3n8f h PHE 303 Cb 0.48 0.38 -0.02 0.00 2.79 0.00 0.00 35.95 39.59 3n8f h PHE 303 CO -0.24 -0.38 -0.18 0.82 -2.23 0.00 0.00 178.31 176.10 3n8f h ILE 304 N -0.38 1.25 -0.40 1.41 2.04 -0.94 -2.04 117.51 118.44 3n8f h ILE 304 Ca 0.09 -1.17 -0.13 0.00 1.00 0.00 0.00 64.86 64.66 3n8f h ILE 304 Cb 0.53 1.21 -0.01 0.00 -0.74 0.00 0.00 36.82 37.80 3n8f h ILE 304 CO -0.33 0.38 -0.24 1.56 0.00 0.00 0.00 178.15 179.52 3n8f h GLN 305 N 0.51 0.88 -0.14 2.37 4.20 -1.10 -2.05 115.11 119.78 3n8f h GLN 305 Ca 0.08 -0.40 -0.02 0.00 0.06 0.00 0.00 58.65 58.37 3n8f h GLN 305 Cb 0.60 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.36 3n8f h GLN 305 CO 0.04 1.05 -0.00 0.82 -0.67 0.00 0.00 178.83 180.06 3n8f h ILE 306 N 0.69 1.26 -0.10 2.54 2.04 -1.00 -2.41 117.51 120.53 3n8f h ILE 306 Ca 0.09 -0.84 -0.01 0.00 1.00 0.00 0.00 64.86 65.09 3n8f h ILE 306 Cb 0.81 1.54 -0.00 0.00 -0.74 0.00 0.00 36.82 38.42 3n8f h ILE 306 CO 0.07 0.25 0.03 0.40 0.00 0.00 0.00 178.15 178.89 3n8f h ILE 307 N -0.02 1.18 -0.41 -0.67 2.04 -1.43 -0.69 117.51 117.51 3n8f h ILE 307 Ca 0.04 -0.55 0.08 0.00 1.00 0.00 0.00 64.86 65.43 3n8f h ILE 307 Cb 0.38 1.37 -0.07 0.00 -0.74 0.00 0.00 36.82 37.75 3n8f h ILE 307 CO 0.01 0.16 -0.06 0.74 0.00 0.00 0.00 178.15 179.00 3n8f h THR 308 N -0.04 0.63 0.00 -0.27 2.02 -1.41 -1.07 112.91 112.77 3n8f h THR 308 Ca 0.03 -0.01 -0.18 0.00 0.77 0.00 0.00 66.41 67.02 3n8f h THR 308 Cb 0.23 0.58 -0.03 0.00 -1.74 0.00 0.00 68.15 67.19 3n8f h THR 308 CO -0.00 0.01 -1.11 -0.26 0.37 0.00 0.00 175.52 174.53 3n8f h PHE 309 N 0.04 0.00 0.00 3.16 -1.00 -1.40 -0.70 116.94 117.04 3n8f h PHE 309 Ca 0.20 0.00 -0.32 0.00 2.81 0.00 0.00 57.97 60.66 3n8f h PHE 309 Cb 0.30 0.00 -0.06 0.00 3.61 0.00 0.00 35.95 39.80 3n8f h PHE 309 CO -0.33 0.73 -2.03 -2.13 -1.61 0.00 0.00 178.31 172.94 3n8f n ARG 310 N -3.12 0.66 -0.02 1.51 0.63 -0.27 -4.53 116.66 111.53 3n8f n ARG 310 Ca -0.05 0.15 -0.02 0.00 -0.92 0.00 0.00 57.85 57.00 3n8f n ARG 310 Cb 0.87 -1.66 -0.02 0.00 0.45 0.00 0.00 32.46 32.09 3n8f n ARG 310 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 3n8f n ASP 311 N -2.89 4.06 -0.07 6.15 8.00 -0.43 -4.76 116.55 126.60 3n8f n ASP 311 Ca -0.24 -0.01 -0.06 0.00 0.71 0.00 0.00 54.79 55.20 3n8f n ASP 311 Cb 1.09 0.38 -0.02 0.00 -0.02 0.00 0.00 41.12 42.55 3n8f n ASP 311 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3n8f n TYR 312 N -2.27 0.66 -0.29 1.24 9.36 -1.05 -4.27 117.16 120.55 3n8f n TYR 312 Ca -0.06 0.29 0.08 0.00 3.32 0.00 0.00 57.90 61.53 3n8f n TYR 312 Cb 0.59 -0.68 0.23 0.00 -0.63 0.00 0.00 39.34 38.85 3n8f n TYR 312 CO 0.00 0.00 0.00 -0.07 0.22 0.00 0.00 176.86 177.01 3n8f h LEU 313 N -0.97 0.41 -1.70 2.98 3.38 -1.36 -0.46 115.31 117.59 3n8f h LEU 313 Ca 0.00 0.11 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 3n8f h LEU 313 Cb 0.62 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.43 3n8f h LEU 313 CO 0.00 0.14 -0.18 -0.65 0.09 0.00 0.00 178.44 177.84 3n8f h PRO 314 N 0.52 0.00 -0.00 1.13 0.11 -1.81 0.54 132.00 132.49 3n8f h PRO 314 Ca 0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.58 3n8f h PRO 314 Cb 0.74 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.85 3n8f h PRO 314 CO -0.41 0.18 -0.38 0.44 -0.21 0.00 0.00 178.00 177.62 3n8f n ILE 315 N -3.95 0.00 -0.11 4.15 -5.35 -0.28 -2.25 119.36 111.57 3n8f n ILE 315 Ca -0.02 -0.08 -0.19 0.00 -0.27 0.00 0.00 62.75 62.20 3n8f n ILE 315 Cb 0.27 0.37 -0.07 0.00 -1.74 0.00 0.00 39.64 38.48 3n8f n ILE 315 CO 0.00 0.00 0.00 0.52 -1.76 0.00 0.00 176.55 175.31 3n8f n VAL 316 N -1.00 1.51 -0.06 7.28 0.31 -0.64 -3.72 118.33 122.01 3n8f n VAL 316 Ca 0.09 -0.09 -0.15 0.00 -0.01 0.00 0.00 64.34 64.18 3n8f n VAL 316 Cb 0.34 -2.13 -0.06 0.00 -0.91 0.00 0.00 33.84 31.09 3n8f n VAL 316 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 3n8f h LEU 317 N -1.00 0.82 0.00 7.52 3.38 -0.12 -0.67 115.31 125.25 3n8f h LEU 317 Ca -0.33 -0.56 0.00 0.00 0.09 0.00 0.00 57.88 57.08 3n8f h LEU 317 Cb 1.25 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.76 3n8f h LEU 317 CO -0.20 1.23 0.00 0.61 0.09 0.00 0.00 178.44 180.17 3n8f n GLY 318 N 0.45 1.71 0.33 0.83 0.00 -0.95 -3.14 105.19 104.41 3n8f n GLY 318 Ca -0.06 -0.60 0.11 0.00 0.00 0.00 0.00 46.02 45.47 3n8f n GLY 318 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3n8f h SER 319 N 7.58 0.00 -0.01 1.61 0.02 -1.57 0.35 113.55 121.52 3n8f h SER 319 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3n8f h SER 319 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 3n8f h SER 319 CO 0.00 0.00 -0.02 -0.62 -1.14 0.00 0.00 176.83 175.05 3n8f n GLU 320 N -2.76 1.81 0.22 3.45 -0.58 -1.19 -4.31 120.64 117.29 3n8f n GLU 320 Ca -0.01 -1.21 -0.15 0.00 -0.42 0.00 0.00 57.16 55.36 3n8f n GLU 320 Cb 0.53 -1.47 -0.08 0.00 -0.57 0.00 0.00 31.44 29.84 3n8f n GLU 320 CO 0.00 0.00 0.00 1.98 -0.48 0.00 0.00 177.13 178.63 3n8f h MET 321 N 2.95 -0.51 -0.01 3.49 4.05 -0.47 -2.69 114.93 121.75 3n8f h MET 321 Ca 0.00 0.03 -0.01 0.00 -0.28 0.00 0.00 59.70 59.45 3n8f h MET 321 Cb 0.64 0.11 -0.00 0.00 -0.80 0.00 0.00 31.60 31.55 3n8f h MET 321 CO 0.00 -0.29 -0.04 1.96 0.23 0.00 0.00 176.91 178.77 3n8f h GLN 322 N -0.60 0.01 -0.53 0.39 4.20 -1.75 0.52 115.11 117.35 3n8f h GLN 322 Ca -0.05 -0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.54 3n8f h GLN 322 Cb 0.44 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.21 3n8f h GLN 322 CO 0.09 0.05 -0.14 -0.22 -0.67 0.00 0.00 178.83 177.94 3n8f h LYS 323 N 0.01 1.04 0.00 1.46 3.64 -1.76 -3.37 116.57 117.59 3n8f h LYS 323 Ca 0.00 -0.40 -0.16 0.00 -1.27 0.00 0.00 60.65 58.82 3n8f h LYS 323 Cb 0.07 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 31.81 3n8f h LYS 323 CO 0.00 1.09 -1.61 0.91 -2.27 0.00 0.00 179.45 177.58 3n8f n TRP 324 N -4.14 0.00 -3.66 1.91 7.02 -0.77 -4.73 117.44 113.06 3n8f n TRP 324 Ca 0.01 0.00 -0.37 0.00 -1.02 0.00 0.00 57.50 56.12 3n8f n TRP 324 Cb 0.42 -0.43 -0.08 0.00 -2.42 0.00 0.00 31.31 28.80 3n8f n TRP 324 CO 0.00 0.00 0.00 0.42 -2.02 0.00 0.00 177.69 176.09 3n8f s ILE 325 N -2.21 4.09 0.75 -0.99 -1.09 0.17 -4.67 121.20 117.24 3n8f s ILE 325 Ca -0.07 -3.31 -0.11 0.00 -2.23 0.00 0.00 60.65 54.93 3n8f s ILE 325 Cb 0.03 -3.60 0.04 0.00 -1.58 0.00 0.00 42.46 37.35 3n8f s ILE 325 CO 0.33 -0.97 1.08 -2.84 -1.23 0.00 0.00 174.94 171.30 3n8f s PRO 326 N -0.59 2.50 0.90 2.79 0.02 -1.26 -4.31 135.00 135.05 3n8f s PRO 326 Ca 0.21 1.00 -0.13 0.00 0.02 0.00 0.00 61.00 62.10 3n8f s PRO 326 Cb -0.14 -1.94 0.04 0.00 0.02 0.00 0.00 34.50 32.48 3n8f s PRO 326 CO -0.07 -1.42 0.55 -2.30 -0.33 0.00 0.00 177.00 173.42 3n8f n PRO 327 N -3.35 -0.17 -2.27 5.54 -0.02 -1.26 -4.90 135.00 128.57 3n8f n PRO 327 Ca 0.08 -0.00 -0.41 0.00 -2.02 0.00 0.00 63.50 61.15 3n8f n PRO 327 Cb 0.54 -1.94 -0.03 0.00 -0.02 0.00 0.00 33.50 32.05 3n8f n PRO 327 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 3n8f s TYR 328 N -2.31 3.29 -0.36 6.00 5.04 -1.26 -4.98 117.35 122.77 3n8f s TYR 328 Ca 0.60 1.37 0.14 0.00 -2.44 0.00 0.00 57.07 56.74 3n8f s TYR 328 Cb -0.24 -3.54 0.38 0.00 0.35 0.00 0.00 41.96 38.91 3n8f s TYR 328 CO 0.64 -1.54 0.81 1.04 -1.34 0.00 0.00 175.55 175.15 3n8f n GLN 329 N 2.00 1.11 0.00 4.97 6.02 -1.26 -5.13 117.38 125.08 3n8f n GLN 329 Ca 0.03 -3.39 0.00 0.00 -0.01 0.00 0.00 57.00 53.63 3n8f n GLN 329 Cb 0.43 -1.59 0.00 0.00 1.02 0.00 0.00 30.24 30.10 3n8f n GLN 329 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3n8f n GLY 330 N 0.16 -0.94 3.33 1.08 0.00 -1.26 -4.96 105.19 102.61 3n8f n GLY 330 Ca 0.21 -1.27 -0.27 0.00 0.00 0.00 0.00 46.02 44.68 3n8f n GLY 330 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3n8f s TYR 331 N 0.00 2.09 -0.23 1.61 5.04 -1.26 -4.87 117.35 119.73 3n8f s TYR 331 Ca 0.00 -0.40 -0.00 0.00 -2.44 0.00 0.00 57.07 54.23 3n8f s TYR 331 Cb 0.00 -1.17 0.06 0.00 0.35 0.00 0.00 41.96 41.20 3n8f s TYR 331 CO 0.00 0.24 -0.03 1.21 -1.34 0.00 0.00 175.55 175.62 3n8f s ASN 332 N -1.79 3.65 0.00 4.32 3.84 -0.82 -5.00 114.94 119.15 3n8f s ASN 332 Ca 0.11 -1.10 0.18 0.00 0.21 0.00 0.00 52.86 52.25 3n8f s ASN 332 Cb -0.10 -1.05 0.83 0.00 -0.55 0.00 0.00 41.25 40.38 3n8f s ASN 332 CO 0.04 -0.25 1.57 -0.46 -2.79 0.00 0.00 177.10 175.21 3n8f n ASN 333 N 4.75 0.00 -0.69 -4.21 6.94 -1.26 -3.13 115.26 117.66 3n8f n ASN 333 Ca -0.11 0.32 0.12 0.00 -0.02 0.00 0.00 54.58 54.89 3n8f n ASN 333 Cb 0.45 -0.42 0.13 0.00 -2.36 0.00 0.00 39.78 37.57 3n8f n ASN 333 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 3n8f n SER 334 N -1.42 2.35 -4.81 0.53 7.64 -1.26 -4.93 113.62 111.73 3n8f n SER 334 Ca 0.06 -1.69 -0.38 0.00 1.01 0.00 0.00 58.87 57.87 3n8f n SER 334 Cb 0.19 0.18 -0.06 0.00 -1.01 0.00 0.00 64.21 63.51 3n8f n SER 334 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 3n8f s VAL 335 N -2.21 5.09 -0.27 0.44 0.11 -1.18 -5.04 120.40 117.33 3n8f s VAL 335 Ca 0.25 0.81 -0.29 0.00 -2.93 0.00 0.00 61.98 59.82 3n8f s VAL 335 Cb 0.19 -3.71 -0.01 0.00 -1.53 0.00 0.00 36.38 31.33 3n8f s VAL 335 CO 0.42 0.53 1.36 -0.62 -3.33 0.00 0.00 175.10 173.46 3n8f s ASP 336 N -0.71 6.65 0.00 3.54 -1.08 -1.26 -4.76 116.67 119.05 3n8f s ASP 336 Ca 0.23 1.35 0.28 0.00 -0.52 0.00 0.00 52.55 53.88 3n8f s ASP 336 Cb -0.16 -2.54 1.22 0.00 -1.46 0.00 0.00 42.92 39.98 3n8f s ASP 336 CO 0.12 -1.08 1.84 -0.81 0.52 0.00 0.00 175.17 175.76 3n8f n PRO 337 N 7.30 1.49 -2.56 4.34 -0.04 -1.26 -4.67 135.00 139.61 3n8f n PRO 337 Ca 0.15 -0.72 -0.32 0.00 -0.04 0.00 0.00 63.50 62.58 3n8f n PRO 337 Cb 0.46 -1.47 -0.03 0.00 -0.04 0.00 0.00 33.50 32.42 3n8f n PRO 337 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 3n8f s ARG 338 N -1.98 3.89 -0.18 0.54 0.52 -1.26 -4.53 118.95 115.96 3n8f s ARG 338 Ca 0.39 0.79 -0.29 0.00 -0.52 0.00 0.00 55.73 56.10 3n8f s ARG 338 Cb 0.21 -2.22 -0.00 0.00 0.52 0.00 0.00 34.95 33.45 3n8f s ARG 338 CO 0.33 -0.19 1.13 0.42 0.02 0.00 0.00 175.30 177.01 3n8f s ILE 339 N -2.53 4.52 0.62 1.52 -1.09 -1.26 -4.88 121.20 118.09 3n8f s ILE 339 Ca 0.56 1.83 -0.13 0.00 -2.23 0.00 0.00 60.65 60.68 3n8f s ILE 339 Cb -0.10 -4.18 -0.03 0.00 -1.58 0.00 0.00 42.46 36.57 3n8f s ILE 339 CO 0.31 -0.13 1.03 -0.94 -1.23 0.00 0.00 174.94 173.98 3n8f s SER 340 N 1.48 6.01 0.09 3.58 1.04 -1.26 -1.70 113.70 122.93 3n8f s SER 340 Ca 0.49 1.56 -0.29 0.00 0.48 0.00 0.00 55.95 58.19 3n8f s SER 340 Cb -0.19 -2.49 -0.15 0.00 0.10 0.00 0.00 66.02 63.29 3n8f s SER 340 CO 0.12 -1.01 1.65 -1.13 0.98 0.00 0.00 173.24 173.85 3n8f h ASN 341 N -0.08 -0.61 -0.94 7.02 -1.24 -0.55 -2.81 115.58 116.37 3n8f h ASN 341 Ca -0.45 0.04 0.27 0.00 0.71 0.00 0.00 56.30 56.87 3n8f h ASN 341 Cb 1.20 0.19 -0.04 0.00 0.73 0.00 0.00 38.32 40.40 3n8f h ASN 341 CO 0.60 -0.37 0.68 1.62 -1.29 0.00 0.00 177.43 178.66 3n8f h VAL 342 N -0.58 0.53 -0.56 2.57 3.04 -1.95 -0.33 116.25 118.97 3n8f h VAL 342 Ca -0.03 -0.01 -0.02 0.00 -1.01 0.00 0.00 66.70 65.63 3n8f h VAL 342 Cb 0.49 0.51 -0.03 0.00 -2.01 0.00 0.00 31.29 30.25 3n8f h VAL 342 CO 0.02 0.00 0.28 0.15 -1.01 0.00 0.00 177.57 177.01 3n8f h PHE 343 N 0.02 0.81 0.00 3.17 3.57 -1.87 0.19 116.94 122.84 3n8f h PHE 343 Ca 0.45 -0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.91 3n8f h PHE 343 Cb 1.77 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 40.26 3n8f h PHE 343 CO -0.00 0.62 0.00 0.25 -2.23 0.00 0.00 178.31 176.95 3n8f n THR 344 N -4.56 0.48 -0.01 4.41 -2.24 -0.13 -1.33 114.28 110.90 3n8f n THR 344 Ca 0.03 0.12 -0.02 0.00 -2.27 0.00 0.00 64.05 61.91 3n8f n THR 344 Cb 0.12 -1.11 -0.02 0.00 -2.10 0.00 0.00 70.33 67.22 3n8f n THR 344 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 3n8f n PHE 345 N -1.12 0.00 -0.22 4.78 3.01 -0.54 -4.52 117.46 118.84 3n8f n PHE 345 Ca 0.00 0.00 -0.08 0.00 1.01 0.00 0.00 57.45 58.39 3n8f n PHE 345 Cb 0.00 -0.12 0.03 0.00 -0.01 0.00 0.00 39.48 39.38 3n8f n PHE 345 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3n8f h ALA 346 N 0.05 0.82 0.00 4.37 0.00 -0.07 -2.87 119.26 121.56 3n8f h ALA 346 Ca -0.07 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.62 3n8f h ALA 346 Cb 1.13 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.68 3n8f h ALA 346 CO -0.00 0.52 0.00 0.34 0.00 0.00 0.00 179.25 180.10 3n8f n PHE 347 N -4.35 0.00 0.98 0.00 7.35 -0.44 -2.39 117.46 118.61 3n8f n PHE 347 Ca 0.04 0.00 0.09 0.00 -0.76 0.00 0.00 57.45 56.81 3n8f n PHE 347 Cb 0.23 -0.44 0.48 0.00 0.35 0.00 0.00 39.48 40.11 3n8f n PHE 347 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 3n8f n ARG 348 N -1.44 0.42 -0.07 -4.13 1.74 -1.08 -3.57 116.66 108.54 3n8f n ARG 348 Ca 0.07 0.05 0.25 0.00 -0.77 0.00 0.00 57.85 57.46 3n8f n ARG 348 Cb 0.25 -1.50 0.70 0.00 -1.02 0.00 0.00 32.46 30.89 3n8f n ARG 348 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 3n8f h PHE 349 N 0.00 0.00 0.00 -1.55 -0.00 -1.65 0.60 116.94 114.34 3n8f h PHE 349 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 57.97 57.96 3n8f h PHE 349 Cb 0.07 0.00 -0.00 0.00 -0.00 0.00 0.00 35.95 36.02 3n8f h PHE 349 CO 0.00 0.00 -0.04 0.78 -0.00 0.00 0.00 178.31 179.05 3n8f h GLY 350 N 0.00 0.00 1.78 6.09 0.00 -1.87 -2.70 103.07 106.37 3n8f h GLY 350 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.67 3n8f h GLY 350 CO -0.00 0.00 0.10 0.45 0.00 0.00 0.00 176.54 177.09 3n8f h HIS 351 N 0.00 0.00 -0.49 5.60 3.86 -1.18 0.53 115.15 123.47 3n8f h HIS 351 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3n8f h HIS 351 Cb 0.13 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.60 3n8f h HIS 351 CO 0.00 0.00 0.00 -1.33 0.86 0.00 0.00 177.93 177.46 3n8f n MET 352 N -2.79 2.35 0.00 2.45 2.81 -1.02 -3.97 117.12 116.95 3n8f n MET 352 Ca -0.02 -2.08 0.04 0.00 -1.81 0.00 0.00 57.70 53.82 3n8f n MET 352 Cb 0.16 -1.48 0.01 0.00 -0.71 0.00 0.00 33.22 31.20 3n8f n MET 352 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 3n8f n GLU 353 N 1.23 1.79 -2.83 0.03 1.02 0.19 -3.91 120.64 118.15 3n8f n GLU 353 Ca 0.20 -0.63 -0.42 0.00 -0.02 0.00 0.00 57.16 56.28 3n8f n GLU 353 Cb 0.52 -1.05 -0.04 0.00 -0.02 0.00 0.00 31.44 30.85 3n8f n GLU 353 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3n8f s VAL 354 N -1.08 4.84 0.56 2.62 1.01 -1.19 -1.31 120.40 125.85 3n8f s VAL 354 Ca 0.07 1.74 -0.05 0.00 0.00 0.00 0.00 61.98 63.74 3n8f s VAL 354 Cb 0.07 -4.18 -0.00 0.00 0.00 0.00 0.00 36.38 32.26 3n8f s VAL 354 CO 0.18 -0.00 0.86 -2.16 0.00 0.00 0.00 175.10 173.98 3n8f s PRO 355 N 2.25 3.04 0.33 2.72 0.04 -1.26 -4.54 135.00 137.58 3n8f s PRO 355 Ca 0.40 -0.00 0.03 0.00 0.04 0.00 0.00 61.00 61.47 3n8f s PRO 355 Cb -0.17 -2.31 0.56 0.00 0.04 0.00 0.00 34.50 32.62 3n8f s PRO 355 CO 0.12 -0.58 1.88 0.66 0.04 0.00 0.00 177.00 179.13 3n8f h SER 356 N -0.06 0.59 -3.04 6.66 4.64 -1.98 -3.45 113.55 116.92 3n8f h SER 356 Ca -0.46 -0.10 -0.65 0.00 -0.47 0.00 0.00 61.79 60.12 3n8f h SER 356 Cb 1.25 -0.15 -0.18 0.00 -0.31 0.00 0.00 62.40 63.00 3n8f h SER 356 CO 0.60 0.60 -0.81 0.42 -0.87 0.00 0.00 176.83 176.78 3n8f s THR 357 N -5.13 2.38 -0.15 2.95 -4.23 -1.26 -1.07 115.64 109.14 3n8f s THR 357 Ca -0.08 -2.09 0.01 0.00 -1.18 0.00 0.00 61.69 58.35 3n8f s THR 357 Cb 0.16 -2.16 0.02 0.00 1.34 0.00 0.00 72.50 71.86 3n8f s THR 357 CO 0.77 -0.16 -0.17 -0.69 -0.54 0.00 0.00 174.62 173.83 3n8f s VAL 358 N -1.80 1.77 0.32 2.29 1.01 0.85 -4.83 120.40 120.00 3n8f s VAL 358 Ca 0.22 -0.77 0.07 0.00 0.00 0.00 0.00 61.98 61.50 3n8f s VAL 358 Cb -0.07 -1.61 -0.03 0.00 0.00 0.00 0.00 36.38 34.66 3n8f s VAL 358 CO 0.11 0.49 0.28 -0.94 0.00 0.00 0.00 175.10 175.03 3n8f s SER 359 N 1.23 5.30 -0.15 3.32 1.04 -1.26 -1.14 113.70 122.04 3n8f s SER 359 Ca 0.01 -0.47 -0.03 0.00 0.48 0.00 0.00 55.95 55.94 3n8f s SER 359 Cb -0.14 -1.02 0.05 0.00 0.10 0.00 0.00 66.02 65.01 3n8f s SER 359 CO -0.08 -0.31 0.03 -0.60 0.98 0.00 0.00 173.24 173.26 3n8f s ARG 360 N -3.97 0.54 0.07 4.02 3.52 -1.18 -4.54 118.95 117.41 3n8f s ARG 360 Ca 0.40 -0.19 0.04 0.00 -0.13 0.00 0.00 55.73 55.84 3n8f s ARG 360 Cb -0.06 -1.69 -0.04 0.00 -1.56 0.00 0.00 34.95 31.60 3n8f s ARG 360 CO 0.26 -0.53 0.01 -0.51 -0.81 0.00 0.00 175.30 173.72 3n8f s LEU 361 N 1.94 3.51 0.00 -0.88 1.43 -0.49 -0.52 118.68 123.67 3n8f s LEU 361 Ca 0.01 -0.12 -0.04 0.00 -1.03 0.00 0.00 54.13 52.95 3n8f s LEU 361 Cb -0.15 -2.18 0.12 0.00 0.03 0.00 0.00 46.19 44.00 3n8f s LEU 361 CO -0.07 0.20 0.76 -0.90 0.23 0.00 0.00 176.35 176.57 3n8f n ASP 362 N 0.75 0.58 0.00 2.29 5.75 0.43 -4.12 116.55 122.24 3n8f n ASP 362 Ca -0.11 -1.60 0.06 0.00 -0.01 0.00 0.00 54.79 53.13 3n8f n ASP 362 Cb 0.52 -0.54 0.37 0.00 -1.03 0.00 0.00 41.12 40.44 3n8f n ASP 362 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3n8f n GLU 363 N -2.51 0.37 -0.26 0.11 1.02 -1.26 -0.44 120.64 117.68 3n8f n GLU 363 Ca 0.11 0.02 0.08 0.00 -0.02 0.00 0.00 57.16 57.35 3n8f n GLU 363 Cb 0.40 -1.50 0.17 0.00 -0.02 0.00 0.00 31.44 30.49 3n8f n GLU 363 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3n8f n ASN 364 N -1.03 2.52 -2.99 1.62 3.02 -1.26 -4.96 115.26 112.17 3n8f n ASN 364 Ca 0.09 -3.24 -0.21 0.00 -0.03 0.00 0.00 54.58 51.19 3n8f n ASN 364 Cb 0.05 -0.48 0.01 0.00 -0.61 0.00 0.00 39.78 38.76 3n8f n ASN 364 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 3n8f n TYR 365 N -1.22 -1.75 -4.25 3.10 4.01 0.42 -4.98 117.16 112.49 3n8f n TYR 365 Ca 0.18 0.39 -0.25 0.00 -0.16 0.00 0.00 57.90 58.06 3n8f n TYR 365 Cb 0.71 -3.73 -0.08 0.00 -0.31 0.00 0.00 39.34 35.94 3n8f n TYR 365 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 3n8f s GLN 366 N -5.65 2.32 0.34 -0.72 -1.52 -1.25 -4.81 119.66 108.37 3n8f s GLN 366 Ca 0.26 -1.23 -0.28 0.00 -1.95 0.00 0.00 55.36 52.17 3n8f s GLN 366 Cb -0.13 -2.27 -0.12 0.00 -0.22 0.00 0.00 33.01 30.27 3n8f s GLN 366 CO 0.33 0.42 1.23 -2.30 -0.25 0.00 0.00 175.29 174.72 3n8f n PRO 367 N -0.35 1.95 -3.22 2.91 -0.01 -1.26 -0.43 135.00 134.60 3n8f n PRO 367 Ca -0.09 0.69 -0.45 0.00 -0.01 0.00 0.00 63.50 63.63 3n8f n PRO 367 Cb 0.56 -2.23 -0.01 0.00 -0.01 0.00 0.00 33.50 31.82 3n8f n PRO 367 CO 0.00 0.00 0.00 -0.46 -0.01 0.00 0.00 175.50 175.03 3n8f s TRP 368 N -1.10 3.86 0.00 6.00 -0.00 0.32 -4.45 118.94 123.57 3n8f s TRP 368 Ca 0.56 -2.24 0.00 0.00 -0.00 0.00 0.00 56.10 54.42 3n8f s TRP 368 Cb -0.59 -3.97 0.00 0.00 -0.00 0.00 0.00 33.47 28.91 3n8f s TRP 368 CO 0.62 -1.10 0.00 0.41 -0.00 0.00 0.00 176.95 176.87 3n8f n GLY 369 N 3.64 -1.74 0.15 5.86 0.00 -1.26 -4.13 105.19 107.72 3n8f n GLY 369 Ca 0.23 -1.59 -0.11 0.00 0.00 0.00 0.00 46.02 44.55 3n8f n GLY 369 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3n8f h PRO 370 N 0.00 0.34 -0.38 1.61 0.13 -2.00 -3.29 132.00 128.41 3n8f h PRO 370 Ca 0.00 -0.34 -0.23 0.00 -0.87 0.00 0.00 66.00 64.56 3n8f h PRO 370 Cb 0.00 0.09 -0.14 0.00 0.13 0.00 0.00 31.00 31.08 3n8f h PRO 370 CO 0.00 1.02 -0.19 0.39 -0.23 0.00 0.00 178.00 178.99 3n8f n GLU 371 N -3.75 2.05 -0.32 0.86 1.02 -1.26 -4.87 120.64 114.37 3n8f n GLU 371 Ca -0.05 -3.34 -0.09 0.00 -0.02 0.00 0.00 57.16 53.66 3n8f n GLU 371 Cb 0.79 -1.87 -0.06 0.00 -0.02 0.00 0.00 31.44 30.28 3n8f n GLU 371 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3n8f h ALA 372 N 1.19 -0.41 -1.99 0.62 0.00 -1.71 -3.37 119.26 113.59 3n8f h ALA 372 Ca 0.23 0.13 -0.67 0.00 0.00 0.00 0.00 54.91 54.60 3n8f h ALA 372 Cb 1.51 1.18 -0.17 0.00 0.00 0.00 0.00 17.79 20.31 3n8f h ALA 372 CO 0.44 -0.89 0.19 -2.00 0.00 0.00 0.00 179.25 176.99 3n8f s GLU 373 N -5.68 3.16 -0.15 0.00 2.12 -1.26 -3.10 118.70 113.79 3n8f s GLU 373 Ca -0.13 -0.80 -0.11 0.00 0.36 0.00 0.00 54.97 54.29 3n8f s GLU 373 Cb 0.13 -4.11 -0.05 0.00 0.26 0.00 0.00 34.13 30.36 3n8f s GLU 373 CO 0.64 -1.34 0.21 -0.51 -0.54 0.00 0.00 175.26 173.73 3n8f s LEU 374 N 2.98 4.28 0.21 2.70 1.43 -0.29 -4.92 118.68 125.08 3n8f s LEU 374 Ca 0.18 0.44 -0.32 0.00 -1.03 0.00 0.00 54.13 53.40 3n8f s LEU 374 Cb -0.18 -2.22 -0.14 0.00 0.03 0.00 0.00 46.19 43.67 3n8f s LEU 374 CO 0.13 0.21 1.27 -2.65 0.23 0.00 0.00 176.35 175.54 3n8f n PRO 375 N 3.06 1.59 0.30 1.29 -0.02 -1.26 -0.11 135.00 139.85 3n8f n PRO 375 Ca -0.15 0.56 0.17 0.00 -2.02 0.00 0.00 63.50 62.07 3n8f n PRO 375 Cb 0.53 -2.13 0.94 0.00 -0.02 0.00 0.00 33.50 32.82 3n8f n PRO 375 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3n8f h LEU 376 N 3.67 0.00 -0.48 2.45 5.85 -1.41 -2.54 115.31 122.84 3n8f h LEU 376 Ca -0.44 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.25 3n8f h LEU 376 Cb 1.31 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.34 3n8f h LEU 376 CO 0.72 0.04 -0.13 1.12 -0.34 0.00 0.00 178.44 179.85 3n8f h HIS 377 N 0.00 0.00 -0.11 1.25 2.07 -1.82 -2.35 115.15 114.19 3n8f h HIS 377 Ca -0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 3n8f h HIS 377 Cb 0.17 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.15 3n8f h HIS 377 CO 0.00 0.13 0.00 0.25 -3.07 0.00 0.00 177.93 175.24 3n8f n THR 378 N -3.17 0.15 0.19 6.12 -2.24 -0.96 -4.06 114.28 110.31 3n8f n THR 378 Ca 0.02 -0.18 0.03 0.00 -2.27 0.00 0.00 64.05 61.66 3n8f n THR 378 Cb 0.51 0.05 -0.04 0.00 -2.10 0.00 0.00 70.33 68.74 3n8f n THR 378 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3n8f n LEU 379 N -0.18 0.19 -4.68 3.22 4.77 -0.88 -4.81 117.00 114.61 3n8f n LEU 379 Ca 0.10 -0.31 -0.42 0.00 -0.03 0.00 0.00 56.01 55.34 3n8f n LEU 379 Cb 0.15 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.21 3n8f n LEU 379 CO 0.07 0.05 1.32 -0.36 -1.33 0.00 0.00 177.39 177.14 3n8f s PHE 380 N -1.91 2.37 -1.33 -1.77 0.08 -1.24 -2.39 117.98 111.79 3n8f s PHE 380 Ca 0.01 0.33 -0.02 0.00 0.12 0.00 0.00 56.93 57.36 3n8f s PHE 380 Cb 0.05 -3.94 0.01 0.00 -0.57 0.00 0.00 43.02 38.57 3n8f s PHE 380 CO 0.26 -3.78 0.79 1.19 -0.10 0.00 0.00 175.22 173.58 3n8f n PHE 381 N 5.85 -2.03 -3.73 0.36 3.01 -1.11 -4.96 117.46 114.85 3n8f n PHE 381 Ca 0.16 0.87 -0.37 0.00 1.01 0.00 0.00 57.45 59.12 3n8f n PHE 381 Cb 0.41 -4.45 -0.11 0.00 -0.01 0.00 0.00 39.48 35.33 3n8f n PHE 381 CO 0.00 0.00 0.00 1.21 1.01 0.00 0.00 176.76 178.98 3n8f s ASN 382 N -4.19 5.34 -0.01 4.37 3.84 -1.00 -4.12 114.94 119.17 3n8f s ASN 382 Ca 0.11 -2.13 0.18 0.00 0.21 0.00 0.00 52.86 51.24 3n8f s ASN 382 Cb -0.05 -1.87 -0.23 0.00 -0.55 0.00 0.00 41.25 38.55 3n8f s ASN 382 CO 0.80 -0.55 0.64 0.35 -2.79 0.00 0.00 177.10 175.55 3n8f n THR 383 N 4.50 0.00 0.11 -5.21 -2.24 -1.26 -4.48 114.28 105.70 3n8f n THR 383 Ca -0.02 -0.20 -0.03 0.00 -2.27 0.00 0.00 64.05 61.53 3n8f n THR 383 Cb 0.41 0.66 0.14 0.00 -2.10 0.00 0.00 70.33 69.44 3n8f n THR 383 CO 0.00 0.00 0.00 4.11 -0.57 0.00 0.00 175.07 178.61 3n8f h TRP 384 N 0.00 0.13 0.00 4.78 5.08 -1.90 -2.63 115.95 121.40 3n8f h TRP 384 Ca 0.00 -0.05 0.00 0.00 1.08 0.00 0.00 58.89 59.92 3n8f h TRP 384 Cb 0.58 -0.02 0.00 0.00 -3.00 0.00 0.00 29.16 26.72 3n8f h TRP 384 CO 0.00 0.70 0.00 0.54 -1.28 0.00 0.00 178.44 178.40 3n8f n ARG 385 N -3.81 0.19 -0.02 0.12 5.12 -1.26 -1.15 116.66 115.84 3n8f n ARG 385 Ca -0.02 0.16 -0.03 0.00 -1.93 0.00 0.00 57.85 56.04 3n8f n ARG 385 Cb 0.63 -1.50 -0.02 0.00 -1.16 0.00 0.00 32.46 30.41 3n8f n ARG 385 CO 0.00 0.00 0.00 0.44 -1.93 0.00 0.00 177.63 176.14 3n8f n ILE 386 N -1.29 0.24 -0.00 0.55 -5.35 -1.12 -3.57 119.36 108.82 3n8f n ILE 386 Ca 0.06 -0.11 -0.10 0.00 -0.27 0.00 0.00 62.75 62.33 3n8f n ILE 386 Cb 0.11 -0.75 0.05 0.00 -1.74 0.00 0.00 39.64 37.31 3n8f n ILE 386 CO 0.00 0.00 0.00 0.40 -1.76 0.00 0.00 176.55 175.19 3n8f h ILE 387 N 0.00 1.32 0.00 7.28 5.03 -1.54 -2.15 117.51 127.45 3n8f h ILE 387 Ca -0.10 -1.79 0.00 0.00 -0.12 0.00 0.00 64.86 62.86 3n8f h ILE 387 Cb 1.17 1.75 0.00 0.00 -3.03 0.00 0.00 36.82 36.71 3n8f h ILE 387 CO -0.01 0.56 -1.50 0.29 -0.68 0.00 0.00 178.15 176.81 3n8f n LYS 388 N -3.96 0.80 -2.30 2.37 4.76 -0.30 -4.67 118.16 114.85 3n8f n LYS 388 Ca -0.03 -0.11 -0.26 0.00 -2.87 0.00 0.00 58.31 55.04 3n8f n LYS 388 Cb 0.60 -1.33 0.01 0.00 -1.84 0.00 0.00 35.03 32.47 3n8f n LYS 388 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 3n8f n ASP 389 N -1.89 4.83 0.00 4.39 2.03 -1.22 -4.94 116.55 119.74 3n8f n ASP 389 Ca -0.02 -3.73 0.00 0.00 0.52 0.00 0.00 54.79 51.56 3n8f n ASP 389 Cb 0.37 -0.42 0.00 0.00 -0.72 0.00 0.00 41.12 40.34 3n8f n ASP 389 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3n8f n GLY 390 N -0.57 0.89 7.00 0.27 0.00 -1.26 -4.76 105.19 106.76 3n8f n GLY 390 Ca 0.41 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.43 3n8f n GLY 390 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3n8f n GLY 391 N -1.22 -1.49 0.13 -0.02 0.00 -0.81 -4.47 105.19 97.32 3n8f n GLY 391 Ca 0.00 -1.31 0.09 0.00 0.00 0.00 0.00 46.02 44.81 3n8f n GLY 391 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3n8f n ILE 392 N -0.02 0.00 -0.27 -0.61 -5.35 -1.26 -4.47 119.36 107.38 3n8f n ILE 392 Ca 0.00 -0.12 -0.06 0.00 -0.27 0.00 0.00 62.75 62.30 3n8f n ILE 392 Cb 0.00 1.07 0.06 0.00 -1.74 0.00 0.00 39.64 39.03 3n8f n ILE 392 CO 0.00 0.00 0.00 0.44 -1.76 0.00 0.00 176.55 175.23 3n8f h ASP 393 N 0.66 0.98 0.51 7.28 3.32 -1.97 0.30 116.42 127.50 3n8f h ASP 393 Ca 0.00 -0.13 0.00 0.00 0.02 0.00 0.00 57.03 56.92 3n8f h ASP 393 Cb 0.52 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 39.82 3n8f h ASP 393 CO 0.00 0.83 0.00 -0.81 -1.72 0.00 0.00 179.24 177.54 3n8f n PRO 394 N -4.40 0.04 -0.12 3.56 -0.04 -1.26 -2.82 135.00 129.97 3n8f n PRO 394 Ca 0.06 0.31 -0.17 0.00 -0.04 0.00 0.00 63.50 63.67 3n8f n PRO 394 Cb 0.13 -1.59 -0.13 0.00 -0.04 0.00 0.00 33.50 31.88 3n8f n PRO 394 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3n8f n LEU 395 N -1.67 2.39 0.25 1.53 4.77 -0.70 -1.39 117.00 122.18 3n8f n LEU 395 Ca 0.03 -0.09 0.08 0.00 -0.03 0.00 0.00 56.01 56.00 3n8f n LEU 395 Cb 0.17 -0.65 0.62 0.00 -2.33 0.00 0.00 43.42 41.23 3n8f n LEU 395 CO 0.14 0.85 1.03 0.58 -1.33 0.00 0.00 177.39 178.66 3n8f h VAL 396 N 0.00 1.01 -0.11 4.08 2.07 -1.06 -2.40 116.25 119.85 3n8f h VAL 396 Ca -0.56 -0.17 -0.20 0.00 0.82 0.00 0.00 66.70 66.59 3n8f h VAL 396 Cb 1.97 1.09 0.00 0.00 -1.52 0.00 0.00 31.29 32.84 3n8f h VAL 396 CO -0.06 0.05 -0.76 -0.09 0.02 0.00 0.00 177.57 176.73 3n8f h ARG 397 N 0.00 0.57 -0.30 1.57 2.43 -1.68 -2.85 114.38 114.12 3n8f h ARG 397 Ca -0.00 -0.47 -0.14 0.00 -0.81 0.00 0.00 59.98 58.56 3n8f h ARG 397 Cb 0.09 0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.73 3n8f h ARG 397 CO 0.01 1.09 -0.39 0.78 -1.51 0.00 0.00 179.97 179.95 3n8f h GLY 398 N 0.98 0.77 0.63 2.80 0.00 -1.58 -2.19 103.07 104.48 3n8f h GLY 398 Ca -0.04 -0.77 0.06 0.00 0.00 0.00 0.00 47.33 46.58 3n8f h GLY 398 CO 0.14 0.70 0.28 1.41 0.00 0.00 0.00 176.54 179.07 3n8f h LEU 399 N 0.58 0.38 -0.23 3.11 3.38 -1.34 0.13 115.31 121.32 3n8f h LEU 399 Ca 0.05 0.04 -0.22 0.00 0.09 0.00 0.00 57.88 57.85 3n8f h LEU 399 Cb 0.93 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.65 3n8f h LEU 399 CO 0.08 0.25 -0.82 -0.07 0.09 0.00 0.00 178.44 177.97 3n8f h LEU 400 N 0.53 0.71 0.00 1.67 3.38 -1.46 -3.03 115.31 117.11 3n8f h LEU 400 Ca 0.27 -0.49 -0.10 0.00 0.09 0.00 0.00 57.88 57.64 3n8f h LEU 400 Cb 0.21 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 3n8f h LEU 400 CO -0.20 1.27 -1.36 0.00 0.09 0.00 0.00 178.44 178.24 3n8f n ALA 401 N -2.57 2.19 -2.67 1.53 0.00 -0.83 -4.68 120.51 113.48 3n8f n ALA 401 Ca -0.07 -0.47 -0.33 0.00 0.00 0.00 0.00 53.44 52.58 3n8f n ALA 401 Cb 0.76 -0.96 -0.09 0.00 0.00 0.00 0.00 19.45 19.16 3n8f n ALA 401 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3n8f s LYS 402 N -3.11 2.80 0.54 0.00 -0.14 0.43 -4.86 119.74 115.41 3n8f s LYS 402 Ca -0.03 -0.57 -0.19 0.00 -1.36 0.00 0.00 55.97 53.82 3n8f s LYS 402 Cb 0.09 -2.68 -0.06 0.00 -1.68 0.00 0.00 37.83 33.51 3n8f s LYS 402 CO 0.81 0.64 1.09 -0.80 -0.76 0.00 0.00 175.35 176.33 3n8f s ASN 403 N -1.37 5.89 0.68 2.83 0.01 -1.26 -0.47 114.94 121.26 3n8f s ASN 403 Ca 0.18 2.03 -0.00 0.00 -0.71 0.00 0.00 52.86 54.35 3n8f s ASN 403 Cb -0.11 -2.56 0.11 0.00 0.41 0.00 0.00 41.25 39.09 3n8f s ASN 403 CO 0.08 -1.09 0.95 -0.94 -1.51 0.00 0.00 177.10 174.58 3n8f s SER 404 N -2.05 4.55 0.11 -1.22 1.04 -1.09 -4.51 113.70 110.55 3n8f s SER 404 Ca 0.69 -0.28 -0.30 0.00 0.48 0.00 0.00 55.95 56.54 3n8f s SER 404 Cb -0.20 -0.20 -0.06 0.00 0.10 0.00 0.00 66.02 65.65 3n8f s SER 404 CO 0.27 -1.71 1.11 -0.75 0.98 0.00 0.00 173.24 173.14 3n8f s LYS 405 N -5.06 4.54 -0.16 4.02 2.20 -0.43 0.65 119.74 125.50 3n8f s LYS 405 Ca 0.64 1.68 -0.23 0.00 -0.36 0.00 0.00 55.97 57.70 3n8f s LYS 405 Cb -0.06 -3.33 -0.02 0.00 -1.51 0.00 0.00 37.83 32.90 3n8f s LYS 405 CO 0.43 -0.04 0.72 -1.17 -0.36 0.00 0.00 175.35 174.93 3n8f s LEU 406 N 0.33 4.20 0.15 5.43 0.20 -0.21 -4.37 118.68 124.40 3n8f s LEU 406 Ca 0.53 1.04 -0.33 0.00 0.69 0.00 0.00 54.13 56.06 3n8f s LEU 406 Cb -0.28 -3.06 -0.12 0.00 -0.43 0.00 0.00 46.19 42.30 3n8f s LEU 406 CO 0.32 -0.28 1.72 0.80 -0.29 0.00 0.00 176.35 178.61 3n8f n MET 407 N 4.82 2.53 -4.30 1.98 0.00 -1.25 -4.86 117.12 116.04 3n8f n MET 407 Ca 0.01 0.92 -0.18 0.00 -0.00 0.00 0.00 57.70 58.44 3n8f n MET 407 Cb 0.50 -2.75 -0.14 0.00 0.00 0.00 0.00 33.22 30.83 3n8f n MET 407 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 175.97 177.18 3n8f s ASN 408 N 1.70 1.25 0.12 6.12 3.84 -1.15 -5.05 114.94 121.77 3n8f s ASN 408 Ca 0.79 -0.35 -0.13 0.00 0.21 0.00 0.00 52.86 53.38 3n8f s ASN 408 Cb -0.57 -0.08 -0.07 0.00 -0.55 0.00 0.00 41.25 39.97 3n8f s ASN 408 CO 0.37 0.02 1.43 1.56 -2.79 0.00 0.00 177.10 177.69 3n8f h GLN 409 N 5.26 0.81 0.00 0.43 4.20 -1.93 -2.97 115.11 120.92 3n8f h GLN 409 Ca -0.34 -0.44 0.00 0.00 0.06 0.00 0.00 58.65 57.92 3n8f h GLN 409 Cb 1.18 0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.99 3n8f h GLN 409 CO 0.46 1.08 0.00 0.09 -0.67 0.00 0.00 178.83 179.78 3n8f n ASN 410 N -4.16 0.76 -3.46 1.46 3.02 -1.26 -4.49 115.26 107.12 3n8f n ASN 410 Ca -0.03 0.61 -0.29 0.00 -0.03 0.00 0.00 54.58 54.83 3n8f n ASN 410 Cb 0.52 -0.80 -0.12 0.00 -0.61 0.00 0.00 39.78 38.77 3n8f n ASN 410 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3n8f s LYS 411 N -3.18 0.54 -0.15 3.52 1.02 -1.13 -4.76 119.74 115.60 3n8f s LYS 411 Ca 0.08 -1.31 -0.11 0.00 0.02 0.00 0.00 55.97 54.66 3n8f s LYS 411 Cb 0.11 -1.29 -0.05 0.00 -0.52 0.00 0.00 37.83 36.09 3n8f s LYS 411 CO 0.52 -1.21 -0.16 -1.33 -0.92 0.00 0.00 175.35 172.25 3n8f n MET 412 N 4.06 0.47 -4.34 1.68 2.81 -0.81 -2.94 117.12 118.05 3n8f n MET 412 Ca 0.12 0.51 -0.22 0.00 -1.81 0.00 0.00 57.70 56.29 3n8f n MET 412 Cb 0.37 -1.68 -0.16 0.00 -0.71 0.00 0.00 33.22 31.04 3n8f n MET 412 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 3n8f s VAL 413 N -2.30 0.80 0.69 2.03 1.01 -1.23 -4.40 120.40 117.00 3n8f s VAL 413 Ca -0.17 -0.28 -0.17 0.00 0.00 0.00 0.00 61.98 61.36 3n8f s VAL 413 Cb 0.03 -0.77 0.00 0.00 0.00 0.00 0.00 36.38 35.64 3n8f s VAL 413 CO 0.26 0.28 1.13 1.07 0.00 0.00 0.00 175.10 177.85 3n8f n THR 414 N 3.95 3.70 0.29 3.92 5.66 -1.26 -4.43 114.28 126.11 3n8f n THR 414 Ca -0.24 -0.42 0.18 0.00 -3.05 0.00 0.00 64.05 60.53 3n8f n THR 414 Cb 0.51 -1.28 0.82 0.00 -1.55 0.00 0.00 70.33 68.83 3n8f n THR 414 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 3n8f h SER 415 N 0.05 0.00 0.78 1.09 0.02 -1.95 0.31 113.55 113.86 3n8f h SER 415 Ca -0.49 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.39 3n8f h SER 415 Cb 1.34 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.87 3n8f h SER 415 CO 0.50 0.02 -0.35 -0.33 -1.14 0.00 0.00 176.83 175.52 3n8f h GLU 416 N 0.00 0.00 0.06 3.45 4.39 -1.92 0.17 114.58 120.73 3n8f h GLU 416 Ca -0.00 0.00 -0.37 0.00 0.34 0.00 0.00 59.36 59.33 3n8f h GLU 416 Cb 0.38 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.99 3n8f h GLU 416 CO 0.00 0.35 -2.16 1.28 -1.16 0.00 0.00 179.01 177.32 3n8f n LEU 417 N -3.57 2.41 0.08 1.33 4.77 -0.41 -3.82 117.00 117.79 3n8f n LEU 417 Ca -0.00 0.10 0.12 0.00 -0.03 0.00 0.00 56.01 56.19 3n8f n LEU 417 Cb 0.48 -0.82 0.24 0.00 -2.33 0.00 0.00 43.42 41.00 3n8f n LEU 417 CO 0.36 0.82 0.53 -0.09 -1.33 0.00 0.00 177.39 177.68 3n8f h ARG 418 N 0.04 0.00 0.00 3.23 2.43 -0.41 -2.65 114.38 117.02 3n8f h ARG 418 Ca -0.47 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.70 3n8f h ARG 418 Cb 2.00 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 31.55 3n8f h ARG 418 CO 0.02 0.00 -0.66 0.09 -1.51 0.00 0.00 179.97 177.92 3n8f n ASN 419 N -2.21 3.28 -1.29 -3.80 3.02 0.58 -4.31 115.26 110.53 3n8f n ASN 419 Ca 0.04 0.00 -0.05 0.00 -0.03 0.00 0.00 54.58 54.54 3n8f n ASN 419 Cb 0.44 0.36 0.12 0.00 -0.61 0.00 0.00 39.78 40.09 3n8f n ASN 419 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3n8f n LYS 420 N -1.44 2.13 -2.28 3.52 5.02 -1.11 -3.88 118.16 120.12 3n8f n LYS 420 Ca 0.00 -3.49 -0.42 0.00 -2.02 0.00 0.00 58.31 52.38 3n8f n LYS 420 Cb 0.30 -1.69 -0.03 0.00 -0.02 0.00 0.00 35.03 33.58 3n8f n LYS 420 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 3n8f s LEU 421 N -3.10 4.36 -0.04 -0.35 2.96 -1.00 -4.17 118.68 117.35 3n8f s LEU 421 Ca 0.41 2.17 -0.23 0.00 -0.22 0.00 0.00 54.13 56.27 3n8f s LEU 421 Cb 0.38 -3.58 -0.04 0.00 0.50 0.00 0.00 46.19 43.45 3n8f s LEU 421 CO -0.04 -0.58 0.67 0.12 -1.32 0.00 0.00 176.35 175.20 3n8f s PHE 422 N 1.19 3.62 -0.12 5.38 5.36 -1.26 -2.06 117.98 130.09 3n8f s PHE 422 Ca 0.62 1.25 0.00 0.00 -0.96 0.00 0.00 56.93 57.83 3n8f s PHE 422 Cb -0.33 -2.74 -0.02 0.00 -0.34 0.00 0.00 43.02 39.59 3n8f s PHE 422 CO 0.29 0.19 -0.13 -1.14 -1.46 0.00 0.00 175.22 172.97 3n8f s GLN 423 N 0.40 3.33 0.18 10.12 2.00 -1.26 -4.98 119.66 129.44 3n8f s GLN 423 Ca 0.35 -0.68 -0.14 0.00 -2.00 0.00 0.00 55.36 52.89 3n8f s GLN 423 Cb -0.18 -2.62 0.15 0.00 0.80 0.00 0.00 33.01 31.16 3n8f s GLN 423 CO 0.18 0.24 1.74 -1.35 -0.50 0.00 0.00 175.29 175.61 3n8f h PRO 424 N 6.61 0.31 -0.98 1.67 0.11 -1.97 -1.32 132.00 136.43 3n8f h PRO 424 Ca -0.27 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 65.85 3n8f h PRO 424 Cb 1.21 -0.07 -0.05 0.00 0.11 0.00 0.00 31.00 32.20 3n8f h PRO 424 CO 0.55 0.20 0.64 1.15 -0.21 0.00 0.00 178.00 180.34 3n8f h THR 425 N 0.32 1.20 -4.96 -1.15 2.02 -2.01 -3.44 112.91 104.88 3n8f h THR 425 Ca 0.22 -0.44 -0.23 0.00 0.77 0.00 0.00 66.41 66.73 3n8f h THR 425 Cb 0.23 -0.18 0.02 0.00 -1.74 0.00 0.00 68.15 66.49 3n8f h THR 425 CO -0.24 0.23 -0.00 1.41 0.37 0.00 0.00 175.52 177.29 3n8f n HIS 426 N -4.44 -2.83 -0.02 3.16 8.25 -0.50 -5.08 115.22 113.77 3n8f n HIS 426 Ca 0.12 -0.97 0.01 0.00 -0.26 0.00 0.00 57.72 56.62 3n8f n HIS 426 Cb 0.06 -0.30 -0.06 0.00 1.12 0.00 0.00 29.99 30.82 3n8f n HIS 426 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3n8f n LYS 427 N -1.71 1.30 -3.24 -0.41 5.02 -1.26 -4.74 118.16 113.12 3n8f n LYS 427 Ca 0.08 -0.04 -0.34 0.00 -2.02 0.00 0.00 58.31 55.99 3n8f n LYS 427 Cb 0.29 -1.18 -0.06 0.00 -0.02 0.00 0.00 35.03 34.06 3n8f n LYS 427 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 3n8f s VAL 428 N -2.38 4.75 -1.15 -0.18 -7.23 -1.26 -5.02 120.40 107.94 3n8f s VAL 428 Ca -0.03 0.88 -0.08 0.00 -1.81 0.00 0.00 61.98 60.93 3n8f s VAL 428 Cb 0.04 -3.68 0.25 0.00 0.56 0.00 0.00 36.38 33.55 3n8f s VAL 428 CO 0.30 -0.01 1.38 1.41 -0.31 0.00 0.00 175.10 177.88 3n8f n HIS 429 N 0.11 4.06 -1.65 2.82 8.25 -1.26 -4.22 115.22 123.32 3n8f n HIS 429 Ca 0.00 -3.29 -0.01 0.00 -0.26 0.00 0.00 57.72 54.17 3n8f n HIS 429 Cb 0.52 -1.70 -0.01 0.00 1.12 0.00 0.00 29.99 29.93 3n8f n HIS 429 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3n8f n GLY 430 N 2.56 0.56 3.89 -1.41 0.00 -0.88 -4.34 105.19 105.58 3n8f n GLY 430 Ca 0.29 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.02 3n8f n GLY 430 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3n8f s PHE 431 N 0.00 3.46 -0.21 1.61 0.40 -0.89 -4.73 117.98 117.63 3n8f s PHE 431 Ca 0.00 0.96 -0.04 0.00 -0.60 0.00 0.00 56.93 57.25 3n8f s PHE 431 Cb 0.00 -2.68 -0.01 0.00 0.51 0.00 0.00 43.02 40.84 3n8f s PHE 431 CO 0.00 -0.71 -0.03 0.34 0.70 0.00 0.00 175.22 175.53 3n8f s ASP 432 N -4.22 4.50 0.11 1.36 -1.08 -1.26 -2.38 116.67 113.69 3n8f s ASP 432 Ca 0.53 -0.32 -0.13 0.00 -0.52 0.00 0.00 52.55 52.11 3n8f s ASP 432 Cb -0.11 -1.77 -0.13 0.00 -1.46 0.00 0.00 42.92 39.45 3n8f s ASP 432 CO 0.49 0.01 1.34 0.25 0.52 0.00 0.00 175.17 177.78 3n8f h LEU 433 N 7.89 0.94 -0.63 -1.34 5.85 -1.69 0.85 115.31 127.17 3n8f h LEU 433 Ca -0.39 -0.59 -0.06 0.00 0.84 0.00 0.00 57.88 57.68 3n8f h LEU 433 Cb 1.17 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.90 3n8f h LEU 433 CO 0.60 1.37 0.16 0.00 -0.34 0.00 0.00 178.44 180.23 3n8f h ALA 434 N 0.59 0.83 -0.18 1.25 0.00 -1.88 -0.03 119.26 119.85 3n8f h ALA 434 Ca -0.03 -0.23 -0.21 0.00 0.00 0.00 0.00 54.91 54.45 3n8f h ALA 434 Cb 1.29 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 18.85 3n8f h ALA 434 CO 0.14 0.53 -0.70 0.00 0.00 0.00 0.00 179.25 179.22 3n8f h ALA 435 N 1.05 0.33 0.00 0.00 0.00 -1.80 -3.01 119.26 115.83 3n8f h ALA 435 Ca 0.20 -0.57 -0.03 0.00 0.00 0.00 0.00 54.91 54.50 3n8f h ALA 435 Cb 0.35 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 3n8f h ALA 435 CO 0.00 0.65 -0.16 0.97 0.00 0.00 0.00 179.25 180.71 3n8f h ILE 436 N 0.53 0.64 -0.23 0.00 2.10 -0.69 -2.42 117.51 117.44 3n8f h ILE 436 Ca -0.04 -0.70 -0.16 0.00 1.08 0.00 0.00 64.86 65.04 3n8f h ILE 436 Cb 1.33 1.45 -0.01 0.00 -1.09 0.00 0.00 36.82 38.50 3n8f h ILE 436 CO 0.15 0.16 -0.52 0.78 -1.08 0.00 0.00 178.15 177.64 3n8f h ASN 437 N 0.00 0.72 -0.01 2.19 -0.26 -0.92 -2.98 115.58 114.33 3n8f h ASN 437 Ca -0.00 -0.37 -0.19 0.00 -0.56 0.00 0.00 56.30 55.17 3n8f h ASN 437 Cb 0.43 -0.21 0.01 0.00 -1.06 0.00 0.00 38.32 37.50 3n8f h ASN 437 CO 0.02 1.11 -0.74 -0.07 -1.06 0.00 0.00 177.43 176.69 3n8f h LEU 438 N 0.51 0.67 -1.07 1.61 3.38 -1.31 -2.43 115.31 116.68 3n8f h LEU 438 Ca 0.02 -0.74 0.04 0.00 0.09 0.00 0.00 57.88 57.28 3n8f h LEU 438 Cb 1.07 -0.21 -0.06 0.00 0.09 0.00 0.00 40.66 41.56 3n8f h LEU 438 CO 0.10 1.33 0.63 1.56 0.09 0.00 0.00 178.44 182.15 3n8f h GLN 439 N 0.09 1.17 0.00 1.13 1.08 -1.65 -2.80 115.11 114.13 3n8f h GLN 439 Ca -0.09 -0.07 -0.03 0.00 -1.45 0.00 0.00 58.65 57.01 3n8f h GLN 439 Cb 1.43 -0.26 -0.00 0.00 -0.05 0.00 0.00 27.48 28.59 3n8f h GLN 439 CO 0.15 0.77 -0.17 -0.09 -0.95 0.00 0.00 178.83 178.54 3n8f h ARG 440 N 1.20 0.00 0.38 1.46 9.65 -1.33 0.21 114.38 125.95 3n8f h ARG 440 Ca 0.38 0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 59.24 3n8f h ARG 440 Cb 0.02 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.60 3n8f h ARG 440 CO -0.12 0.17 -0.18 0.00 2.80 0.00 0.00 179.97 182.63 3n8f h ARG 442 N -0.74 0.27 -0.50 0.00 3.08 -1.22 -1.20 114.38 114.07 3n8f h ARG 442 Ca -0.05 -0.02 -0.10 0.00 0.07 0.00 0.00 59.98 59.88 3n8f h ARG 442 Cb 0.51 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.48 3n8f h ARG 442 CO 0.09 0.18 -0.09 0.22 -1.07 0.00 0.00 179.97 179.29 3n8f h ASP 443 N 0.28 0.94 0.00 7.04 3.58 -0.60 -3.39 116.42 124.28 3n8f h ASP 443 Ca 0.11 -0.35 0.00 0.00 0.42 0.00 0.00 57.03 57.21 3n8f h ASP 443 Cb 0.11 -0.26 0.00 0.00 1.72 0.00 0.00 39.33 40.90 3n8f h ASP 443 CO -0.02 1.07 -0.01 0.45 -2.88 0.00 0.00 179.24 177.85 3n8f h HIS 444 N 0.80 0.00 0.00 0.28 3.86 -0.77 -3.47 115.15 115.85 3n8f h HIS 444 Ca 0.13 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.34 3n8f h HIS 444 Cb 0.65 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.12 3n8f h HIS 444 CO 0.05 0.00 0.00 0.41 0.86 0.00 0.00 177.93 179.25 3n8f n GLY 445 N 1.94 0.70 3.12 2.45 0.00 -0.79 -4.84 105.19 107.76 3n8f n GLY 445 Ca -0.00 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.04 3n8f n GLY 445 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3n8f s MET 446 N 0.26 0.54 0.33 1.61 0.00 -1.24 -1.99 119.30 118.81 3n8f s MET 446 Ca 0.00 0.57 -0.28 0.00 0.00 0.00 0.00 55.69 55.98 3n8f s MET 446 Cb 0.00 0.21 -0.12 0.00 0.00 0.00 0.00 34.83 34.92 3n8f s MET 446 CO 0.00 -0.97 1.29 -2.30 0.00 0.00 0.00 175.02 173.03 3n8f n PRO 447 N 5.41 2.10 -0.20 4.11 -0.02 -1.26 -4.85 135.00 140.29 3n8f n PRO 447 Ca 0.03 0.74 -0.13 0.00 -2.02 0.00 0.00 63.50 62.12 3n8f n PRO 447 Cb 0.53 -2.31 0.13 0.00 -0.02 0.00 0.00 33.50 31.82 3n8f n PRO 447 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3n8f n GLY 448 N 0.86 -2.89 0.36 -1.23 0.00 -1.26 -4.62 105.19 96.41 3n8f n GLY 448 Ca 0.05 -0.94 0.02 0.00 0.00 0.00 0.00 46.02 45.15 3n8f n GLY 448 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3n8f h TYR 449 N -2.61 1.04 0.08 1.61 3.20 -0.84 -3.13 116.97 116.32 3n8f h TYR 449 Ca -0.17 0.03 -0.26 0.00 3.14 0.00 0.00 58.73 61.46 3n8f h TYR 449 Cb 0.57 -0.35 0.01 0.00 1.54 0.00 0.00 36.73 38.51 3n8f h TYR 449 CO 0.00 0.59 -1.14 -0.91 -1.64 0.00 0.00 178.16 175.07 3n8f h ASN 450 N 1.07 0.60 -0.59 -2.11 2.35 -1.77 -0.63 115.58 114.50 3n8f h ASN 450 Ca 0.35 -0.55 0.11 0.00 -0.55 0.00 0.00 56.30 55.66 3n8f h ASN 450 Cb 0.06 -0.19 -0.09 0.00 0.05 0.00 0.00 38.32 38.15 3n8f h ASN 450 CO -0.11 1.38 0.11 0.28 -1.65 0.00 0.00 177.43 177.44 3n8f h SER 451 N 0.19 -0.04 1.88 5.81 0.02 -1.86 -0.27 113.55 119.28 3n8f h SER 451 Ca -0.13 0.11 -0.02 0.00 -0.84 0.00 0.00 61.79 60.91 3n8f h SER 451 Cb 1.81 0.17 -0.00 0.00 0.14 0.00 0.00 62.40 64.51 3n8f h SER 451 CO 0.20 -0.01 -0.10 -0.50 -1.14 0.00 0.00 176.83 175.28 3n8f h TRP 452 N 0.23 0.00 -0.30 3.45 4.06 -1.49 -1.67 115.95 120.24 3n8f h TRP 452 Ca 0.31 0.00 -0.11 0.00 2.06 0.00 0.00 58.89 61.15 3n8f h TRP 452 Cb 0.46 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.61 3n8f h TRP 452 CO -0.26 0.10 -0.27 0.00 -3.56 0.00 0.00 178.44 174.46 3n8f h ARG 453 N 0.00 0.60 -0.16 0.49 2.47 -0.44 -3.21 114.38 114.13 3n8f h ARG 453 Ca -0.00 -0.24 -0.19 0.00 -1.26 0.00 0.00 59.98 58.28 3n8f h ARG 453 Cb 1.07 -0.03 0.00 0.00 -1.65 0.00 0.00 29.97 29.36 3n8f h ARG 453 CO 0.01 0.81 -0.68 0.78 0.56 0.00 0.00 179.97 181.45 3n8f h GLY 454 N 1.01 0.70 0.11 0.04 0.00 -0.64 0.13 103.07 104.41 3n8f h GLY 454 Ca 0.07 -0.91 0.18 0.00 0.00 0.00 0.00 47.33 46.67 3n8f h GLY 454 CO 0.06 0.82 0.51 -2.75 0.00 0.00 0.00 176.54 175.17 3n8f h PHE 455 N 0.45 0.88 -0.01 5.60 3.57 -1.32 -0.04 116.94 126.08 3n8f h PHE 455 Ca -0.02 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.51 3n8f h PHE 455 Cb 1.27 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 39.76 3n8f h PHE 455 CO 0.06 0.16 -0.12 0.00 -2.23 0.00 0.00 178.31 176.18 3n8f n GLY 457 N 1.26 -0.06 3.63 0.00 0.00 -0.03 -5.05 105.19 104.93 3n8f n GLY 457 Ca 0.16 -0.09 -0.24 0.00 0.00 0.00 0.00 46.02 45.85 3n8f n GLY 457 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3n8f s LEU 458 N -4.90 3.07 -0.03 0.99 1.43 0.00 -5.02 118.68 114.22 3n8f s LEU 458 Ca 0.10 -0.81 -0.35 0.00 -1.03 0.00 0.00 54.13 52.05 3n8f s LEU 458 Cb -0.05 -1.54 -0.13 0.00 0.03 0.00 0.00 46.19 44.50 3n8f s LEU 458 CO 0.47 -0.10 1.74 -1.20 0.23 0.00 0.00 176.35 177.50 3n8f n SER 459 N -0.91 3.08 -4.58 2.29 7.64 -1.26 -4.33 113.62 115.55 3n8f n SER 459 Ca -0.05 1.03 -0.39 0.00 1.01 0.00 0.00 58.87 60.46 3n8f n SER 459 Cb 0.60 -1.34 -0.10 0.00 -1.01 0.00 0.00 64.21 62.36 3n8f n SER 459 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 3n8f s GLN 460 N 2.86 3.86 0.00 1.43 -0.21 -1.26 -4.93 119.66 121.40 3n8f s GLN 460 Ca 0.89 -0.23 0.00 0.00 0.02 0.00 0.00 55.36 56.04 3n8f s GLN 460 Cb -0.75 -3.70 0.00 0.00 1.00 0.00 0.00 33.01 29.55 3n8f s GLN 460 CO 0.49 -0.31 0.00 -2.30 -2.12 0.00 0.00 175.29 171.05 3n8f n PRO 461 N 5.23 2.23 0.00 2.91 -0.02 -1.26 -5.00 135.00 139.09 3n8f n PRO 461 Ca -0.11 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.37 3n8f n PRO 461 Cb 0.51 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.99 3n8f n PRO 461 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 3n8f n LYS 462 N 0.00 0.00 -4.27 -0.52 4.76 -1.26 -5.00 118.16 111.87 3n8f n LYS 462 Ca 0.00 0.00 -0.15 0.00 -2.87 0.00 0.00 58.31 55.29 3n8f n LYS 462 Cb 0.00 0.00 -0.10 0.00 -1.84 0.00 0.00 35.03 33.09 3n8f n LYS 462 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 3n8f s THR 463 N -0.13 0.96 0.40 -0.18 -4.23 -1.26 -4.67 115.64 106.52 3n8f s THR 463 Ca 0.00 -2.02 0.15 0.00 -1.18 0.00 0.00 61.69 58.64 3n8f s THR 463 Cb 0.00 -2.09 0.36 0.00 1.34 0.00 0.00 72.50 72.12 3n8f s THR 463 CO 0.00 -0.53 1.86 0.25 -0.54 0.00 0.00 174.62 175.65 3n8f h LEU 464 N 2.66 0.47 0.00 4.79 6.46 -1.99 -0.82 115.31 126.88 3n8f h LEU 464 Ca -0.37 0.04 -0.21 0.00 -0.12 0.00 0.00 57.88 57.22 3n8f h LEU 464 Cb 1.20 -0.04 -0.04 0.00 -0.73 0.00 0.00 40.66 41.05 3n8f h LEU 464 CO 0.64 0.20 -1.48 0.50 -0.62 0.00 0.00 178.44 177.68 3n8f h LYS 465 N 0.47 0.00 0.00 1.25 3.64 -1.98 -2.74 116.57 117.22 3n8f h LYS 465 Ca 0.47 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.85 3n8f h LYS 465 Cb 1.06 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.88 3n8f h LYS 465 CO -0.19 0.39 0.00 0.78 -2.27 0.00 0.00 179.45 178.16 3n8f h GLY 466 N 3.61 0.00 0.08 5.01 0.00 -1.57 -2.19 103.07 108.01 3n8f h GLY 466 Ca -0.20 0.00 -0.38 0.00 0.00 0.00 0.00 47.33 46.75 3n8f h GLY 466 CO 0.06 0.00 -2.39 -0.10 0.00 0.00 0.00 176.54 174.11 3n8f n LEU 467 N -2.55 2.04 -0.26 3.11 7.94 -0.71 -4.32 117.00 122.25 3n8f n LEU 467 Ca -0.01 -0.05 0.06 0.00 -1.11 0.00 0.00 56.01 54.90 3n8f n LEU 467 Cb 0.13 -0.49 0.20 0.00 0.53 0.00 0.00 43.42 43.79 3n8f n LEU 467 CO 0.17 0.79 1.01 1.56 -1.11 0.00 0.00 177.39 179.81 3n8f h GLN 468 N 0.01 0.42 -0.09 1.96 4.20 -1.08 0.06 115.11 120.59 3n8f h GLN 468 Ca -0.55 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.14 3n8f h GLN 468 Cb 2.01 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 29.70 3n8f h GLN 468 CO -0.04 0.28 0.00 0.00 -0.67 0.00 0.00 178.83 178.40 3n8f n ALA 469 N -2.52 2.56 -0.11 3.87 0.00 -1.03 -0.89 120.51 122.40 3n8f n ALA 469 Ca 0.15 -0.42 -0.15 0.00 0.00 0.00 0.00 53.44 53.03 3n8f n ALA 469 Cb 0.44 -1.17 -0.11 0.00 0.00 0.00 0.00 19.45 18.61 3n8f n ALA 469 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 3n8f n VAL 470 N 0.03 1.28 1.02 0.00 0.31 -0.13 -4.56 118.33 116.27 3n8f n VAL 470 Ca 0.17 -0.53 0.11 0.00 -0.01 0.00 0.00 64.34 64.08 3n8f n VAL 470 Cb 0.28 -1.18 -0.01 0.00 -0.91 0.00 0.00 33.84 32.02 3n8f n VAL 470 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 3n8f n LEU 471 N -3.08 1.56 -3.81 7.52 4.77 -0.42 -4.60 117.00 118.93 3n8f n LEU 471 Ca -0.38 -0.61 -0.25 0.00 -0.03 0.00 0.00 56.01 54.74 3n8f n LEU 471 Cb 0.95 -0.02 0.02 0.00 -2.33 0.00 0.00 43.42 42.04 3n8f n LEU 471 CO 0.25 0.31 -0.01 0.29 -1.33 0.00 0.00 177.39 176.90 3n8f n LYS 472 N -0.62 -5.01 -3.55 3.23 5.02 -0.07 -4.42 118.16 112.74 3n8f n LYS 472 Ca 0.08 0.59 -0.04 0.00 -2.02 0.00 0.00 58.31 56.92 3n8f n LYS 472 Cb 0.41 -5.25 -0.06 0.00 -0.02 0.00 0.00 35.03 30.11 3n8f n LYS 472 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 3n8f s ASN 473 N -3.94 -0.73 0.11 4.39 3.84 -1.16 -5.06 114.94 112.40 3n8f s ASN 473 Ca 0.27 1.14 -0.08 0.00 0.21 0.00 0.00 52.86 54.40 3n8f s ASN 473 Cb -0.14 1.83 -0.15 0.00 -0.55 0.00 0.00 41.25 42.24 3n8f s ASN 473 CO 0.83 -0.24 1.26 0.11 -2.79 0.00 0.00 177.10 176.26 3n8f h LYS 474 N 8.08 0.52 -0.26 0.43 1.57 -1.93 -2.72 116.57 122.26 3n8f h LYS 474 Ca -0.18 -0.57 -0.13 0.00 -1.87 0.00 0.00 60.65 57.90 3n8f h LYS 474 Cb 1.12 0.16 -0.00 0.00 0.08 0.00 0.00 32.23 33.59 3n8f h LYS 474 CO 0.15 1.20 -0.36 0.28 -0.57 0.00 0.00 179.45 180.14 3n8f h VAL 475 N 0.29 1.31 -0.26 0.50 2.07 -1.99 -2.64 116.25 115.52 3n8f h VAL 475 Ca -0.10 -1.56 -0.09 0.00 0.82 0.00 0.00 66.70 65.77 3n8f h VAL 475 Cb 1.64 1.69 -0.01 0.00 -1.52 0.00 0.00 31.29 33.09 3n8f h VAL 475 CO 0.18 0.49 -0.22 0.25 0.02 0.00 0.00 177.57 178.29 3n8f h LEU 476 N 0.42 0.49 -0.21 2.57 5.85 -1.99 -1.40 115.31 121.05 3n8f h LEU 476 Ca 0.03 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 3n8f h LEU 476 Cb 0.95 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.84 3n8f h LEU 476 CO 0.08 0.72 0.09 0.00 -0.34 0.00 0.00 178.44 178.99 3n8f h ALA 477 N 1.33 0.27 0.27 1.25 0.00 -1.46 -1.08 119.26 119.84 3n8f h ALA 477 Ca 0.07 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.89 3n8f h ALA 477 Cb 0.63 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 3n8f h ALA 477 CO 0.05 -0.16 -0.40 0.87 0.00 0.00 0.00 179.25 179.60 3n8f h LYS 478 N 0.20 -0.71 -0.97 0.00 1.57 -1.30 -2.45 116.57 112.91 3n8f h LYS 478 Ca 0.07 0.05 0.10 0.00 -1.87 0.00 0.00 60.65 59.00 3n8f h LYS 478 Cb 0.14 0.16 -0.07 0.00 0.08 0.00 0.00 32.23 32.53 3n8f h LYS 478 CO -0.01 -0.47 0.62 0.87 -0.57 0.00 0.00 179.45 179.89 3n8f h LYS 479 N -0.73 0.99 -0.13 3.15 1.57 -1.19 0.23 116.57 120.45 3n8f h LYS 479 Ca -0.01 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 3n8f h LYS 479 Cb 0.70 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 32.78 3n8f h LYS 479 CO -0.14 0.65 -0.05 -0.07 -0.57 0.00 0.00 179.45 179.27 3n8f h LEU 480 N 1.02 0.26 -2.37 2.94 3.38 -1.00 -3.19 115.31 116.34 3n8f h LEU 480 Ca 0.46 -0.40 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3n8f h LEU 480 Cb 0.38 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.06 3n8f h LEU 480 CO -0.21 0.60 0.00 0.00 0.09 0.00 0.00 178.44 178.92 3n8f n LEU 481 N -4.70 3.45 0.17 1.67 -0.00 -0.94 -2.11 117.00 114.54 3n8f n LEU 481 Ca -0.06 -1.72 0.05 0.00 -0.00 0.00 0.00 56.01 54.28 3n8f n LEU 481 Cb 0.27 -0.43 0.22 0.00 -0.00 0.00 0.00 43.42 43.48 3n8f n LEU 481 CO 0.37 0.86 0.61 0.44 -0.00 0.00 0.00 177.39 179.67 3n8f h ASP 482 N 3.75 0.00 0.00 1.45 3.32 -0.53 -2.82 116.42 121.59 3n8f h ASP 482 Ca 0.00 0.00 -0.32 0.00 0.02 0.00 0.00 57.03 56.73 3n8f h ASP 482 Cb 0.87 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.37 3n8f h ASP 482 CO 0.00 0.40 -2.12 0.18 -1.72 0.00 0.00 179.24 175.99 3n8f n LEU 483 N -3.36 2.24 0.09 1.55 4.77 -1.22 -4.72 117.00 116.35 3n8f n LEU 483 Ca 0.01 0.07 -0.17 0.00 -0.03 0.00 0.00 56.01 55.89 3n8f n LEU 483 Cb 0.59 -0.64 -0.14 0.00 -2.33 0.00 0.00 43.42 40.90 3n8f n LEU 483 CO 0.38 0.63 -0.16 1.88 -1.33 0.00 0.00 177.39 178.79 3n8f h TYR 484 N -0.36 0.52 0.00 -1.77 0.05 -1.61 -3.37 116.97 110.44 3n8f h TYR 484 Ca -0.47 -0.38 0.00 0.00 0.05 0.00 0.00 58.73 57.93 3n8f h TYR 484 Cb 1.56 -0.02 0.00 0.00 1.01 0.00 0.00 36.73 39.28 3n8f h TYR 484 CO -0.02 1.34 0.00 1.63 -1.05 0.00 0.00 178.16 180.06 3n8f n LYS 485 N -3.52 0.00 -3.75 4.88 5.02 -1.06 -4.74 118.16 114.99 3n8f n LYS 485 Ca -0.12 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.05 3n8f n LYS 485 Cb 1.04 -1.32 -0.11 0.00 -0.02 0.00 0.00 35.03 34.61 3n8f n LYS 485 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 3n8f s THR 486 N -1.60 -0.01 0.58 -0.18 -1.32 -1.26 -4.98 115.64 106.87 3n8f s THR 486 Ca 0.00 0.04 0.31 0.00 -1.21 0.00 0.00 61.69 60.83 3n8f s THR 486 Cb 0.00 -0.44 0.43 0.00 -1.51 0.00 0.00 72.50 70.98 3n8f s THR 486 CO 0.00 0.02 1.76 -0.65 -2.21 0.00 0.00 174.62 173.54 3n8f h PRO 487 N 6.18 0.00 -0.87 7.08 0.11 -1.89 -2.35 132.00 140.26 3n8f h PRO 487 Ca -0.31 0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.87 3n8f h PRO 487 Cb 1.18 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.23 3n8f h PRO 487 CO 0.33 0.00 0.54 -0.44 -0.21 0.00 0.00 178.00 178.22 3n8f h ASP 488 N 0.00 0.85 0.64 -2.05 3.32 -1.94 -3.18 116.42 114.07 3n8f h ASP 488 Ca 0.36 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.43 3n8f h ASP 488 Cb 1.80 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 41.19 3n8f h ASP 488 CO -0.00 0.54 -0.21 0.59 -1.72 0.00 0.00 179.24 178.44 3n8f n ASN 489 N -4.61 0.32 -4.68 6.45 3.02 -0.88 -3.36 115.26 111.51 3n8f n ASN 489 Ca 0.13 -0.07 -0.47 0.00 -0.03 0.00 0.00 54.58 54.13 3n8f n ASN 489 Cb 0.18 -0.11 -0.04 0.00 -0.61 0.00 0.00 39.78 39.20 3n8f n ASN 489 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 3n8f n ILE 490 N -1.34 0.37 -2.01 2.41 5.41 -1.20 -4.82 119.36 118.18 3n8f n ILE 490 Ca 0.08 -0.07 -0.40 0.00 1.00 0.00 0.00 62.75 63.37 3n8f n ILE 490 Cb 0.32 -1.76 -0.00 0.00 -0.71 0.00 0.00 39.64 37.49 3n8f n ILE 490 CO 0.00 0.00 0.00 -1.81 0.00 0.00 0.00 176.55 174.74 3n8f s ASP 491 N 2.89 6.32 0.14 4.38 1.01 -1.26 -0.57 116.67 129.59 3n8f s ASP 491 Ca 0.87 2.72 -0.25 0.00 0.71 0.00 0.00 52.55 56.60 3n8f s ASP 491 Cb -0.68 -2.64 -0.01 0.00 1.01 0.00 0.00 42.92 40.60 3n8f s ASP 491 CO 0.46 -0.85 1.61 0.40 0.21 0.00 0.00 175.17 177.00 3n8f h ILE 492 N 2.55 0.30 -0.88 0.77 2.04 -1.85 -1.28 117.51 119.16 3n8f h ILE 492 Ca -0.50 0.00 0.14 0.00 1.00 0.00 0.00 64.86 65.50 3n8f h ILE 492 Cb 1.25 0.30 -0.15 0.00 -0.74 0.00 0.00 36.82 37.47 3n8f h ILE 492 CO 0.63 0.00 -0.37 -0.25 0.00 0.00 0.00 178.15 178.16 3n8f h TRP 493 N -0.37 -1.04 -0.02 1.37 7.01 -1.92 1.01 115.95 122.00 3n8f h TRP 493 Ca 0.10 0.10 -0.13 0.00 2.11 0.00 0.00 58.89 61.07 3n8f h TRP 493 Cb 0.53 0.58 0.01 0.00 -2.10 0.00 0.00 29.16 28.19 3n8f h TRP 493 CO -0.41 -0.40 -0.49 0.97 -2.79 0.00 0.00 178.44 175.32 3n8f h ILE 494 N -0.05 1.44 -0.70 2.65 6.09 -1.91 -2.26 117.51 122.77 3n8f h ILE 494 Ca 0.32 -1.98 0.06 0.00 -1.37 0.00 0.00 64.86 61.88 3n8f h ILE 494 Cb 0.59 2.55 -0.06 0.00 0.47 0.00 0.00 36.82 40.37 3n8f h ILE 494 CO -0.90 0.57 0.40 1.23 -3.07 0.00 0.00 178.15 176.38 3n8f h GLY 495 N -0.16 1.04 0.72 8.18 0.00 0.31 0.16 103.07 113.32 3n8f h GLY 495 Ca -0.06 -0.28 -0.05 0.00 0.00 0.00 0.00 47.33 46.94 3n8f h GLY 495 CO 0.10 0.17 -0.13 -1.33 0.00 0.00 0.00 176.54 175.35 3n8f h GLY 496 N 0.73 0.35 2.00 4.60 0.00 0.86 -3.20 103.07 108.41 3n8f h GLY 496 Ca 0.31 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 47.29 3n8f h GLY 496 CO -0.18 0.32 0.00 0.70 0.00 0.00 0.00 176.54 177.38 3n8f n ASN 497 N -4.59 0.57 0.17 0.19 4.13 -0.85 -3.01 115.26 111.87 3n8f n ASN 497 Ca -0.06 0.65 0.06 0.00 1.68 0.00 0.00 54.58 56.91 3n8f n ASN 497 Cb 0.35 -0.77 0.08 0.00 -1.54 0.00 0.00 39.78 37.91 3n8f n ASN 497 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3n8f h ALA 498 N 2.28 0.81 -2.76 5.41 0.00 -0.96 -3.46 119.26 120.58 3n8f h ALA 498 Ca 0.00 -0.27 -0.52 0.00 0.00 0.00 0.00 54.91 54.12 3n8f h ALA 498 Cb 0.33 -0.05 0.10 0.00 0.00 0.00 0.00 17.79 18.17 3n8f h ALA 498 CO 0.00 0.37 0.46 -1.21 0.00 0.00 0.00 179.25 178.87 3n8f s GLU 499 N -3.06 3.15 0.82 0.00 2.02 -1.16 -4.87 118.70 115.59 3n8f s GLU 499 Ca 0.05 1.77 -0.11 0.00 0.02 0.00 0.00 54.97 56.70 3n8f s GLU 499 Cb 0.07 -1.99 0.08 0.00 0.10 0.00 0.00 34.13 32.39 3n8f s GLU 499 CO 0.72 -1.05 1.09 -1.25 0.02 0.00 0.00 175.26 174.78 3n8f s PRO 500 N -3.27 1.88 0.21 0.39 0.04 -1.26 -4.77 135.00 128.23 3n8f s PRO 500 Ca 0.75 0.91 -0.26 0.00 0.04 0.00 0.00 61.00 62.44 3n8f s PRO 500 Cb -0.28 -1.87 -0.09 0.00 0.04 0.00 0.00 34.50 32.30 3n8f s PRO 500 CO 0.31 -1.83 0.83 -1.64 0.04 0.00 0.00 177.00 174.71 3n8f s MET 501 N -4.98 4.59 0.48 4.56 -1.94 -1.26 -4.29 119.30 116.46 3n8f s MET 501 Ca 0.62 1.22 -0.23 0.00 -1.71 0.00 0.00 55.69 55.58 3n8f s MET 501 Cb -0.17 -3.15 -0.07 0.00 2.01 0.00 0.00 34.83 33.46 3n8f s MET 501 CO 0.56 0.50 1.24 0.14 -0.01 0.00 0.00 175.02 177.44 3n8f s VAL 502 N -1.27 2.75 0.03 -6.03 -7.23 -0.19 -4.91 120.40 103.55 3n8f s VAL 502 Ca 0.40 0.58 -0.36 0.00 -1.81 0.00 0.00 61.98 60.78 3n8f s VAL 502 Cb -0.22 -3.30 -0.15 0.00 0.56 0.00 0.00 36.38 33.26 3n8f s VAL 502 CO 0.26 0.01 1.51 1.21 -0.31 0.00 0.00 175.10 177.78 3n8f n GLU 503 N -0.54 1.49 -3.69 4.82 2.13 -1.26 -1.87 120.64 121.72 3n8f n GLU 503 Ca 0.08 0.54 -0.26 0.00 0.66 0.00 0.00 57.16 58.18 3n8f n GLU 503 Cb 0.46 -2.24 0.06 0.00 0.27 0.00 0.00 31.44 30.00 3n8f n GLU 503 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 3n8f n ARG 504 N 3.56 -7.07 -1.51 5.31 5.12 -1.26 -1.92 116.66 118.90 3n8f n ARG 504 Ca 0.20 0.75 0.00 0.00 -1.93 0.00 0.00 57.85 56.87 3n8f n ARG 504 Cb 0.21 -5.74 0.00 0.00 -1.16 0.00 0.00 32.46 25.77 3n8f n ARG 504 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3n8f n GLY 505 N -1.86 3.94 0.00 -0.13 0.00 -0.78 -3.82 105.19 102.54 3n8f n GLY 505 Ca -0.00 -1.52 0.00 0.00 0.00 0.00 0.00 46.02 44.50 3n8f n GLY 505 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3n8f n ARG 506 N 0.00 -0.39 -4.59 1.61 5.12 -0.26 -4.83 116.66 113.32 3n8f n ARG 506 Ca 0.00 -0.28 -0.28 0.00 -1.93 0.00 0.00 57.85 55.36 3n8f n ARG 506 Cb 0.00 -0.78 -0.09 0.00 -1.16 0.00 0.00 32.46 30.44 3n8f n ARG 506 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 3n8f s VAL 507 N -0.03 0.98 0.44 1.55 -7.23 -1.24 -4.96 120.40 109.91 3n8f s VAL 507 Ca 0.00 -2.00 0.05 0.00 -1.81 0.00 0.00 61.98 58.22 3n8f s VAL 507 Cb 0.00 -2.40 0.05 0.00 0.56 0.00 0.00 36.38 34.59 3n8f s VAL 507 CO 0.00 0.00 0.40 0.61 -0.31 0.00 0.00 175.10 175.80 3n8f n GLY 508 N -1.00 2.59 0.42 2.32 0.00 -1.26 -1.02 105.19 107.24 3n8f n GLY 508 Ca -0.10 -2.26 -0.10 0.00 0.00 0.00 0.00 46.02 43.56 3n8f n GLY 508 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3n8f h PRO 509 N 0.00 -0.23 0.37 1.61 0.11 -1.94 0.34 132.00 132.26 3n8f h PRO 509 Ca -0.26 0.02 -0.02 0.00 0.11 0.00 0.00 66.00 65.85 3n8f h PRO 509 Cb 1.00 0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.17 3n8f h PRO 509 CO 0.40 -0.15 -0.18 1.25 -0.21 0.00 0.00 178.00 179.11 3n8f h LEU 510 N -0.24 -0.42 -1.09 2.35 5.85 -1.96 -3.02 115.31 116.78 3n8f h LEU 510 Ca 0.15 -0.04 -0.06 0.00 0.84 0.00 0.00 57.88 58.77 3n8f h LEU 510 Cb 0.55 0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.67 3n8f h LEU 510 CO -0.71 -0.23 0.02 -0.07 -0.34 0.00 0.00 178.44 177.11 3n8f h LEU 511 N -0.59 0.62 -1.21 2.25 3.38 -1.74 -0.56 115.31 117.47 3n8f h LEU 511 Ca -0.05 -0.13 0.13 0.00 0.09 0.00 0.00 57.88 57.92 3n8f h LEU 511 Cb 0.44 -0.16 -0.07 0.00 0.09 0.00 0.00 40.66 40.95 3n8f h LEU 511 CO 0.08 0.68 0.58 0.00 0.09 0.00 0.00 178.44 179.88 3n8f h ALA 512 N 1.40 1.71 0.49 1.53 0.00 -0.38 -0.56 119.26 123.45 3n8f h ALA 512 Ca 0.13 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 3n8f h ALA 512 Cb 0.36 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.99 3n8f h ALA 512 CO 0.01 0.06 -0.24 0.00 0.00 0.00 0.00 179.25 179.09 3n8f h LEU 514 N -1.13 0.55 -0.01 0.00 3.38 -1.35 -1.46 115.31 115.31 3n8f h LEU 514 Ca -0.07 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 3n8f h LEU 514 Cb 0.55 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.22 3n8f h LEU 514 CO 0.11 0.35 -0.00 -0.07 0.09 0.00 0.00 178.44 178.92 3n8f h LEU 515 N 0.69 0.02 -0.42 1.67 3.38 -1.18 -3.14 115.31 116.33 3n8f h LEU 515 Ca 0.31 -0.42 0.08 0.00 0.09 0.00 0.00 57.88 57.93 3n8f h LEU 515 Cb 0.21 -0.00 -0.07 0.00 0.09 0.00 0.00 40.66 40.88 3n8f h LEU 515 CO -0.19 0.44 -0.01 1.23 0.09 0.00 0.00 178.44 180.00 3n8f h GLY 516 N -0.40 0.41 0.62 0.83 0.00 -0.57 -2.45 103.07 101.51 3n8f h GLY 516 Ca 0.00 0.06 0.01 0.00 0.00 0.00 0.00 47.33 47.40 3n8f h GLY 516 CO 0.00 -0.11 -0.23 3.21 0.00 0.00 0.00 176.54 179.41 3n8f h ARG 517 N 0.10 -0.42 -0.26 4.80 3.08 -1.33 -2.02 114.38 118.32 3n8f h ARG 517 Ca 0.21 0.03 0.05 0.00 0.07 0.00 0.00 59.98 60.34 3n8f h ARG 517 Cb 0.30 0.10 -0.05 0.00 0.08 0.00 0.00 29.97 30.40 3n8f h ARG 517 CO -0.35 -0.28 -0.06 0.37 -1.07 0.00 0.00 179.97 178.58 3n8f h GLN 518 N -0.44 0.01 -0.04 0.04 5.75 -1.47 -0.98 115.11 117.98 3n8f h GLN 518 Ca 0.02 -0.00 -0.04 0.00 -0.15 0.00 0.00 58.65 58.48 3n8f h GLN 518 Cb 0.45 -0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.99 3n8f h GLN 518 CO -0.12 0.00 -0.16 0.74 -2.65 0.00 0.00 178.83 176.65 3n8f h PHE 519 N 0.01 0.06 -0.14 3.99 0.04 -1.25 -0.17 116.94 119.48 3n8f h PHE 519 Ca 0.13 -0.01 -0.08 0.00 2.80 0.00 0.00 57.97 60.81 3n8f h PHE 519 Cb 0.19 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 38.32 3n8f h PHE 519 CO -0.26 0.22 -0.24 0.37 -0.60 0.00 0.00 178.31 177.80 3n8f h GLN 520 N 0.06 0.40 -0.75 1.51 4.15 -0.85 -2.87 115.11 116.76 3n8f h GLN 520 Ca 0.01 -0.25 0.01 0.00 0.77 0.00 0.00 58.65 59.19 3n8f h GLN 520 Cb 0.31 0.03 -0.04 0.00 0.21 0.00 0.00 27.48 28.00 3n8f h GLN 520 CO 0.02 0.84 0.49 1.96 -1.93 0.00 0.00 178.83 180.22 3n8f h GLN 521 N 0.00 0.99 0.00 1.69 4.20 -0.39 0.17 115.11 121.77 3n8f h GLN 521 Ca 0.01 -0.06 -0.03 0.00 0.06 0.00 0.00 58.65 58.63 3n8f h GLN 521 Cb 0.82 -0.22 -0.00 0.00 0.30 0.00 0.00 27.48 28.38 3n8f h GLN 521 CO 0.05 0.66 -0.13 -0.84 -0.67 0.00 0.00 178.83 177.91 3n8f h ILE 522 N 1.02 0.28 0.00 2.54 3.07 -1.12 -0.72 117.51 122.57 3n8f h ILE 522 Ca 0.27 -0.97 -0.03 0.00 1.55 0.00 0.00 64.86 65.68 3n8f h ILE 522 Cb -0.11 1.77 -0.00 0.00 -0.27 0.00 0.00 36.82 38.21 3n8f h ILE 522 CO -0.06 0.12 -0.23 -0.09 -1.05 0.00 0.00 178.15 176.85 3n8f h ARG 523 N 0.00 0.00 0.00 0.16 2.43 -1.25 -3.22 114.38 112.50 3n8f h ARG 523 Ca -0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3n8f h ARG 523 Cb 0.76 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.31 3n8f h ARG 523 CO 0.02 0.58 0.00 -0.44 -1.51 0.00 0.00 179.97 178.62 3n8f h ASP 524 N -1.00 0.00 0.00 -3.80 5.19 -0.65 -3.02 116.42 113.14 3n8f h ASP 524 Ca -0.05 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.36 3n8f h ASP 524 Cb 0.67 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.18 3n8f h ASP 524 CO -0.03 0.00 -1.14 0.61 -3.12 0.00 0.00 179.24 175.56 3n8f n GLY 525 N -0.68 -0.68 3.65 2.75 0.00 -0.28 -1.94 105.19 108.01 3n8f n GLY 525 Ca -0.01 -0.46 -0.43 0.00 0.00 0.00 0.00 46.02 45.11 3n8f n GLY 525 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3n8f s ASP 526 N -3.08 6.98 0.48 1.61 2.15 -1.14 -4.83 116.67 118.84 3n8f s ASP 526 Ca 0.02 1.18 0.31 0.00 0.43 0.00 0.00 52.55 54.49 3n8f s ASP 526 Cb 0.12 -2.52 1.20 0.00 -0.30 0.00 0.00 42.92 41.43 3n8f s ASP 526 CO 0.71 -0.71 1.90 -0.09 -0.17 0.00 0.00 175.17 176.81 3n8f h ARG 527 N 7.73 0.00 -0.37 4.34 2.43 -1.88 -3.17 114.38 123.45 3n8f h ARG 527 Ca -0.20 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.97 3n8f h ARG 527 Cb 1.07 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.62 3n8f h ARG 527 CO 0.98 0.00 0.00 1.19 -1.51 0.00 0.00 179.97 180.63 3n8f n PHE 528 N -2.91 0.66 -1.58 2.20 3.01 -1.26 -4.92 117.46 112.65 3n8f n PHE 528 Ca 0.01 -0.58 -0.45 0.00 1.01 0.00 0.00 57.45 57.44 3n8f n PHE 528 Cb 0.31 -0.10 -0.02 0.00 -0.01 0.00 0.00 39.48 39.67 3n8f n PHE 528 CO 0.00 0.00 0.00 1.87 1.01 0.00 0.00 176.76 179.64 3n8f n TRP 529 N 0.41 1.20 0.31 1.38 -0.00 -1.20 -4.84 117.44 114.69 3n8f n TRP 529 Ca 0.15 0.71 0.20 0.00 -0.00 0.00 0.00 57.50 58.56 3n8f n TRP 529 Cb 0.56 -2.24 0.97 0.00 -0.00 0.00 0.00 31.31 30.60 3n8f n TRP 529 CO 0.00 0.00 0.00 0.11 -0.00 0.00 0.00 177.69 177.80 3n8f h TRP 530 N 2.08 0.00 0.00 5.87 5.08 -1.94 -2.69 115.95 124.35 3n8f h TRP 530 Ca -0.39 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.58 3n8f h TRP 530 Cb 1.34 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.50 3n8f h TRP 530 CO 0.48 0.00 -1.37 0.39 -1.28 0.00 0.00 178.44 176.66 3n8f n GLU 531 N -3.03 0.50 -1.92 0.12 1.02 -1.26 -4.67 120.64 111.40 3n8f n GLU 531 Ca -0.01 -0.04 -0.42 0.00 -0.02 0.00 0.00 57.16 56.67 3n8f n GLU 531 Cb 0.17 -1.63 -0.03 0.00 -0.02 0.00 0.00 31.44 29.93 3n8f n GLU 531 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 3n8f s ASN 532 N -4.52 6.59 0.18 1.62 2.47 -1.02 -4.95 114.94 115.32 3n8f s ASN 532 Ca -0.02 2.57 -0.33 0.00 0.42 0.00 0.00 52.86 55.51 3n8f s ASN 532 Cb 0.13 -2.58 -0.13 0.00 -1.45 0.00 0.00 41.25 37.21 3n8f s ASN 532 CO 0.84 -0.86 1.59 -2.65 -3.72 0.00 0.00 177.10 172.30 3n8f n PRO 533 N 4.68 2.27 0.00 0.43 -0.02 -1.26 -3.56 135.00 137.54 3n8f n PRO 533 Ca 0.15 0.82 0.00 0.00 -2.02 0.00 0.00 63.50 62.45 3n8f n PRO 533 Cb 0.39 -2.59 0.00 0.00 -0.02 0.00 0.00 33.50 31.28 3n8f n PRO 533 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3n8f n GLY 534 N 3.32 2.31 0.09 -1.23 0.00 -1.26 -4.96 105.19 103.45 3n8f n GLY 534 Ca 0.16 -0.67 -0.04 0.00 0.00 0.00 0.00 46.02 45.47 3n8f n GLY 534 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3n8f h VAL 535 N 0.00 0.88 -4.02 1.61 -1.51 -1.89 -3.46 116.25 107.86 3n8f h VAL 535 Ca 0.00 -2.51 -0.39 0.00 -1.23 0.00 0.00 66.70 62.57 3n8f h VAL 535 Cb 0.00 2.36 -0.27 0.00 -2.13 0.00 0.00 31.29 31.25 3n8f h VAL 535 CO 0.00 0.50 -0.78 -0.36 -1.23 0.00 0.00 177.57 175.71 3n8f s PHE 536 N -2.78 0.86 0.53 5.19 0.08 -1.26 -5.11 117.98 115.49 3n8f s PHE 536 Ca -0.02 -0.23 -0.20 0.00 0.12 0.00 0.00 56.93 56.60 3n8f s PHE 536 Cb 0.09 -0.54 -0.06 0.00 -0.57 0.00 0.00 43.02 41.93 3n8f s PHE 536 CO 0.81 -0.01 1.12 0.99 -0.10 0.00 0.00 175.22 178.03 3n8f s THR 537 N -0.47 3.24 0.52 0.64 2.01 -1.26 -4.83 115.64 115.48 3n8f s THR 537 Ca 0.01 0.78 0.19 0.00 0.31 0.00 0.00 61.69 62.99 3n8f s THR 537 Cb -0.05 -3.32 0.32 0.00 0.01 0.00 0.00 72.50 69.46 3n8f s THR 537 CO 0.00 -0.15 2.08 -0.08 -0.69 0.00 0.00 174.62 175.78 3n8f h GLU 538 N 1.32 0.04 -0.18 4.92 4.81 -2.01 0.18 114.58 123.66 3n8f h GLU 538 Ca -0.50 -0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 58.71 3n8f h GLU 538 Cb 1.26 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.62 3n8f h GLU 538 CO 0.57 0.02 0.04 0.87 -0.73 0.00 0.00 179.01 179.79 3n8f h LYS 539 N 0.04 0.30 -1.00 1.92 1.57 -1.98 -3.31 116.57 114.10 3n8f h LYS 539 Ca 0.11 -0.07 0.14 0.00 -1.87 0.00 0.00 60.65 58.96 3n8f h LYS 539 Cb 0.41 -0.04 -0.09 0.00 0.08 0.00 0.00 32.23 32.59 3n8f h LYS 539 CO -0.01 0.44 0.63 1.96 -0.57 0.00 0.00 179.45 181.90 3n8f h GLN 540 N 0.11 0.91 -0.70 3.15 4.20 -0.98 -1.49 115.11 120.32 3n8f h GLN 540 Ca 0.06 -0.05 0.02 0.00 0.06 0.00 0.00 58.65 58.73 3n8f h GLN 540 Cb 0.28 -0.21 -0.04 0.00 0.30 0.00 0.00 27.48 27.81 3n8f h GLN 540 CO 0.00 0.60 0.45 0.00 -0.67 0.00 0.00 178.83 179.22 3n8f h ARG 541 N 0.94 0.88 -0.04 1.46 3.08 -1.62 -0.72 114.38 118.35 3n8f h ARG 541 Ca 0.52 -0.05 -0.05 0.00 0.07 0.00 0.00 59.98 60.46 3n8f h ARG 541 Cb 0.59 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 30.44 3n8f h ARG 541 CO -0.29 0.58 -0.21 -0.44 -1.07 0.00 0.00 179.97 178.54 3n8f h ASP 542 N 0.90 0.07 -0.03 7.04 5.19 -1.39 0.36 116.42 128.57 3n8f h ASP 542 Ca 0.27 -0.01 -0.23 0.00 -0.62 0.00 0.00 57.03 56.43 3n8f h ASP 542 Cb -0.05 -0.02 0.01 0.00 0.18 0.00 0.00 39.33 39.45 3n8f h ASP 542 CO -0.08 0.28 -0.87 0.28 -3.12 0.00 0.00 179.24 175.73 3n8f h SER 543 N 0.07 0.86 0.42 6.45 0.02 -1.38 -3.26 113.55 116.73 3n8f h SER 543 Ca 0.01 -0.62 -0.03 0.00 -0.84 0.00 0.00 61.79 60.32 3n8f h SER 543 Cb 0.41 -0.26 -0.00 0.00 0.14 0.00 0.00 62.40 62.69 3n8f h SER 543 CO 0.03 1.41 -0.13 -0.07 -1.14 0.00 0.00 176.83 176.93 3n8f h LEU 544 N 0.45 0.00 -0.94 5.07 3.38 0.24 -2.00 115.31 121.52 3n8f h LEU 544 Ca -0.08 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.78 3n8f h LEU 544 Cb 1.51 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.24 3n8f h LEU 544 CO 0.17 0.13 -0.53 1.56 0.09 0.00 0.00 178.44 179.86 3n8f h GLN 545 N 0.00 0.00 0.00 1.13 4.20 -1.03 -3.18 115.11 116.23 3n8f h GLN 545 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3n8f h GLN 545 Cb 0.37 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.15 3n8f h GLN 545 CO 0.02 0.53 0.00 1.63 -0.67 0.00 0.00 178.83 180.34 3n8f n LYS 546 N -3.91 0.13 -1.45 1.46 4.76 -0.75 -4.86 118.16 113.54 3n8f n LYS 546 Ca -0.01 0.31 -0.32 0.00 -2.87 0.00 0.00 58.31 55.42 3n8f n LYS 546 Cb 0.54 -1.72 0.07 0.00 -1.84 0.00 0.00 35.03 32.08 3n8f n LYS 546 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 3n8f s VAL 547 N -3.17 3.39 0.24 -0.18 -7.23 -1.20 -4.63 120.40 107.62 3n8f s VAL 547 Ca 0.07 0.51 -0.17 0.00 -1.81 0.00 0.00 61.98 60.58 3n8f s VAL 547 Cb 0.11 -3.03 0.01 0.00 0.56 0.00 0.00 36.38 34.03 3n8f s VAL 547 CO 0.40 -0.53 0.57 -0.94 -0.31 0.00 0.00 175.10 174.28 3n8f s SER 548 N -3.19 -0.20 0.16 4.85 1.04 -1.26 -5.02 113.70 110.08 3n8f s SER 548 Ca 0.62 -0.67 -0.06 0.00 0.48 0.00 0.00 55.95 56.32 3n8f s SER 548 Cb -0.18 0.63 0.01 0.00 0.10 0.00 0.00 66.02 66.59 3n8f s SER 548 CO 0.51 -1.18 1.43 0.15 0.98 0.00 0.00 173.24 175.14 3n8f h PHE 549 N 2.15 0.81 -0.98 5.02 3.57 -1.98 -2.57 116.94 122.96 3n8f h PHE 549 Ca -0.25 -0.32 0.30 0.00 3.53 0.00 0.00 57.97 61.24 3n8f h PHE 549 Cb 1.25 -0.14 -0.15 0.00 2.79 0.00 0.00 35.95 39.71 3n8f h PHE 549 CO 0.39 1.09 0.52 0.77 -2.23 0.00 0.00 178.31 178.85 3n8f h SER 550 N 0.46 0.45 0.59 0.41 0.02 -1.93 0.35 113.55 113.90 3n8f h SER 550 Ca -0.01 0.19 -0.24 0.00 -0.84 0.00 0.00 61.79 60.89 3n8f h SER 550 Cb 1.21 0.15 -0.00 0.00 0.14 0.00 0.00 62.40 63.90 3n8f h SER 550 CO 0.12 -0.12 -1.08 0.03 -1.14 0.00 0.00 176.83 174.65 3n8f h ARG 551 N 0.33 0.26 -1.07 3.45 2.47 -1.85 -3.13 114.38 114.85 3n8f h ARG 551 Ca 0.70 -0.37 0.31 0.00 -1.26 0.00 0.00 59.98 59.36 3n8f h ARG 551 Cb 1.54 0.12 -0.05 0.00 -1.65 0.00 0.00 29.97 29.94 3n8f h ARG 551 CO -0.60 1.12 0.76 1.25 0.56 0.00 0.00 179.97 183.06 3n8f h LEU 552 N 0.11 0.04 0.00 3.04 5.85 0.10 -0.36 115.31 124.09 3n8f h LEU 552 Ca -0.09 0.01 -0.25 0.00 0.84 0.00 0.00 57.88 58.38 3n8f h LEU 552 Cb 1.77 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.75 3n8f h LEU 552 CO 0.17 0.01 -1.81 2.30 -0.34 0.00 0.00 178.44 178.77 3n8f n ILE 553 N -4.25 1.29 0.20 4.05 -5.35 -0.96 -3.75 119.36 110.59 3n8f n ILE 553 Ca 0.23 -0.76 0.07 0.00 -0.27 0.00 0.00 62.75 62.02 3n8f n ILE 553 Cb 1.11 -0.71 0.35 0.00 -1.74 0.00 0.00 39.64 38.65 3n8f n ILE 553 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3n8f n ASP 555 N -3.46 0.65 -0.09 0.00 9.92 -0.83 -4.50 116.55 118.24 3n8f n ASP 555 Ca 0.00 -0.37 0.01 0.00 -0.53 0.00 0.00 54.79 53.90 3n8f n ASP 555 Cb 0.50 0.57 0.01 0.00 -0.64 0.00 0.00 41.12 41.56 3n8f n ASP 555 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 3n8f n ASN 556 N -1.68 0.61 -3.41 -2.24 3.02 -1.17 -5.04 115.26 105.33 3n8f n ASN 556 Ca 0.04 -1.52 -0.13 0.00 -0.03 0.00 0.00 54.58 52.93 3n8f n ASN 556 Cb 0.37 -0.06 -0.04 0.00 -0.61 0.00 0.00 39.78 39.44 3n8f n ASN 556 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3n8f s THR 557 N -0.42 0.00 -0.23 3.41 2.01 -0.72 -5.00 115.64 114.69 3n8f s THR 557 Ca 0.02 -1.57 0.14 0.00 0.31 0.00 0.00 61.69 60.59 3n8f s THR 557 Cb 0.02 -2.57 0.66 0.00 0.01 0.00 0.00 72.50 70.63 3n8f s THR 557 CO 0.00 0.00 1.60 1.41 -0.69 0.00 0.00 174.62 176.95 3n8f n HIS 558 N -0.52 1.60 -2.64 4.92 8.25 -1.26 -4.81 115.22 120.77 3n8f n HIS 558 Ca 0.00 -0.94 -0.42 0.00 -0.26 0.00 0.00 57.72 56.10 3n8f n HIS 558 Cb 0.62 -0.46 -0.03 0.00 1.12 0.00 0.00 29.99 31.24 3n8f n HIS 558 CO 0.00 0.00 0.00 0.96 0.64 0.00 0.00 176.34 177.94 3n8f s ILE 559 N -2.88 4.65 0.00 1.59 -4.36 -1.26 -4.93 121.20 114.02 3n8f s ILE 559 Ca 0.49 1.91 0.00 0.00 -0.26 0.00 0.00 60.65 62.78 3n8f s ILE 559 Cb 0.39 -4.22 0.00 0.00 1.25 0.00 0.00 42.46 39.88 3n8f s ILE 559 CO 0.11 0.14 0.15 0.35 0.24 0.00 0.00 174.94 175.94 3n8f n THR 560 N 3.92 0.00 -4.10 8.37 -2.24 -1.26 -4.68 114.28 114.30 3n8f n THR 560 Ca 0.07 -0.34 -0.33 0.00 -2.27 0.00 0.00 64.05 61.18 3n8f n THR 560 Cb 0.50 1.14 -0.16 0.00 -2.10 0.00 0.00 70.33 69.71 3n8f n THR 560 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3n8f s LYS 561 N -0.38 2.92 0.05 -0.78 -0.14 -1.26 -2.62 119.74 117.54 3n8f s LYS 561 Ca 0.00 -0.88 -0.01 0.00 -1.36 0.00 0.00 55.97 53.72 3n8f s LYS 561 Cb 0.00 -2.65 -0.04 0.00 -1.68 0.00 0.00 37.83 33.47 3n8f s LYS 561 CO 0.00 -0.26 -0.03 0.14 -0.76 0.00 0.00 175.35 174.44 3n8f s VAL 562 N 1.28 0.23 0.61 3.17 -7.23 0.51 -4.84 120.40 114.13 3n8f s VAL 562 Ca 0.03 -1.66 -0.13 0.00 -1.81 0.00 0.00 61.98 58.41 3n8f s VAL 562 Cb -0.14 -1.30 -0.03 0.00 0.56 0.00 0.00 36.38 35.46 3n8f s VAL 562 CO -0.11 -0.90 1.04 -2.16 -0.31 0.00 0.00 175.10 172.65 3n8f s PRO 563 N -3.47 3.40 0.31 4.82 0.04 -1.26 -0.74 135.00 138.09 3n8f s PRO 563 Ca 0.03 0.97 0.23 0.00 0.04 0.00 0.00 61.00 62.27 3n8f s PRO 563 Cb 0.05 -2.05 0.24 0.00 0.04 0.00 0.00 34.50 32.78 3n8f s PRO 563 CO -0.08 -0.73 1.38 1.25 0.04 0.00 0.00 177.00 178.86 3n8f h LEU 564 N 0.01 0.00 -7.23 -3.56 5.85 -1.95 -3.40 115.31 105.03 3n8f h LEU 564 Ca -0.45 -0.02 -0.61 0.00 0.84 0.00 0.00 57.88 57.64 3n8f h LEU 564 Cb 1.20 0.00 -0.40 0.00 0.37 0.00 0.00 40.66 41.83 3n8f h LEU 564 CO 0.59 0.01 -0.74 -1.00 -0.34 0.00 0.00 178.44 176.96 3n8f s HIS 565 N -3.26 2.22 -1.26 1.25 3.76 -1.26 -4.96 115.29 111.78 3n8f s HIS 565 Ca 0.04 -2.18 0.28 0.00 -0.15 0.00 0.00 55.06 53.05 3n8f s HIS 565 Cb 0.08 -2.03 1.32 0.00 1.11 0.00 0.00 32.58 33.06 3n8f s HIS 565 CO 0.71 -0.87 1.93 0.00 -0.85 0.00 0.00 174.74 175.67 3n8f n ALA 566 N 4.40 2.34 1.09 -1.40 0.00 -1.26 -3.41 120.51 122.26 3n8f n ALA 566 Ca 0.02 -0.12 0.12 0.00 0.00 0.00 0.00 53.44 53.46 3n8f n ALA 566 Cb 0.40 -1.45 0.13 0.00 0.00 0.00 0.00 19.45 18.53 3n8f n ALA 566 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3n8f n PHE 567 N -1.37 0.00 -4.35 0.00 3.72 -1.26 -4.68 117.46 109.51 3n8f n PHE 567 Ca 0.11 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.27 3n8f n PHE 567 Cb 0.26 -0.04 -0.12 0.00 -0.94 0.00 0.00 39.48 38.64 3n8f n PHE 567 CO 0.00 0.00 0.00 1.14 -0.05 0.00 0.00 176.76 177.85 3n8f s GLN 568 N -2.48 1.32 -0.24 -1.08 -2.07 -1.22 -3.16 119.66 110.73 3n8f s GLN 568 Ca 0.21 -1.40 -0.29 0.00 -1.82 0.00 0.00 55.36 52.06 3n8f s GLN 568 Cb 0.18 -1.51 -0.03 0.00 -1.09 0.00 0.00 33.01 30.56 3n8f s GLN 568 CO 0.55 0.32 1.74 0.00 -1.32 0.00 0.00 175.29 176.59 3n8f s ALA 569 N -1.74 3.13 0.04 2.60 0.00 -1.15 -4.44 121.76 120.19 3n8f s ALA 569 Ca 0.15 0.48 -0.03 0.00 0.00 0.00 0.00 51.96 52.57 3n8f s ALA 569 Cb -0.07 -3.92 -0.02 0.00 0.00 0.00 0.00 23.12 19.11 3n8f s ALA 569 CO 0.07 -2.19 0.03 0.54 0.00 0.00 0.00 175.76 174.21 3n8f s ASN 570 N 5.11 0.31 0.02 0.00 2.20 -1.26 -4.84 114.94 116.47 3n8f s ASN 570 Ca 0.77 -0.72 0.04 0.00 -0.94 0.00 0.00 52.86 52.01 3n8f s ASN 570 Cb -0.26 0.21 -0.03 0.00 -2.00 0.00 0.00 41.25 39.16 3n8f s ASN 570 CO 0.32 -0.53 -0.10 0.20 -2.94 0.00 0.00 177.10 174.05 3n8f s ASN 571 N -2.40 4.40 0.03 3.54 0.02 -1.26 -4.77 114.94 114.51 3n8f s ASN 571 Ca -0.01 -0.23 -0.21 0.00 -1.02 0.00 0.00 52.86 51.39 3n8f s ASN 571 Cb 0.02 -0.95 -0.06 0.00 0.02 0.00 0.00 41.25 40.28 3n8f s ASN 571 CO -0.07 0.27 0.61 -0.47 0.02 0.00 0.00 177.10 177.46 3n8f s TYR 572 N -0.99 3.74 -0.16 2.20 5.04 -1.26 -0.38 117.35 125.54 3n8f s TYR 572 Ca 0.17 1.27 0.16 0.00 -2.44 0.00 0.00 57.07 56.23 3n8f s TYR 572 Cb -0.11 -2.60 0.01 0.00 0.35 0.00 0.00 41.96 39.61 3n8f s TYR 572 CO 0.07 0.43 1.23 -1.00 -1.34 0.00 0.00 175.55 174.95 3n8f h PRO 573 N 5.20 0.00 0.21 4.97 0.13 -1.94 -3.48 132.00 137.08 3n8f h PRO 573 Ca -0.47 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3n8f h PRO 573 Cb 1.21 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.31 3n8f h PRO 573 CO 0.67 0.39 -0.35 1.25 -0.23 0.00 0.00 178.00 179.73 3n8f h HIS 574 N 0.00 -1.00 0.00 1.56 2.76 -1.90 -2.47 115.15 114.10 3n8f h HIS 574 Ca -0.05 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.13 3n8f h HIS 574 Cb 1.41 0.41 0.00 0.00 1.55 0.00 0.00 27.41 30.78 3n8f h HIS 574 CO 0.00 -0.43 0.00 -0.25 -1.30 0.00 0.00 177.93 175.95 3n8f n ASP 575 N -4.49 0.00 -4.82 3.26 8.00 0.49 -4.74 116.55 114.25 3n8f n ASP 575 Ca -0.07 0.22 -0.38 0.00 0.71 0.00 0.00 54.79 55.27 3n8f n ASP 575 Cb 0.30 -0.38 -0.06 0.00 -0.02 0.00 0.00 41.12 40.96 3n8f n ASP 575 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3n8f s PHE 576 N -2.75 3.66 0.27 1.24 0.40 -0.93 -4.27 117.98 115.60 3n8f s PHE 576 Ca 0.14 0.88 0.02 0.00 -0.60 0.00 0.00 56.93 57.37 3n8f s PHE 576 Cb 0.12 -2.27 -0.05 0.00 0.51 0.00 0.00 43.02 41.33 3n8f s PHE 576 CO 0.31 0.57 0.07 0.14 0.70 0.00 0.00 175.22 177.01 3n8f s VAL 577 N -0.76 0.79 0.46 -0.44 -7.23 0.08 -4.85 120.40 108.45 3n8f s VAL 577 Ca 0.22 -2.00 -0.22 0.00 -1.81 0.00 0.00 61.98 58.17 3n8f s VAL 577 Cb -0.15 -2.61 -0.08 0.00 0.56 0.00 0.00 36.38 34.09 3n8f s VAL 577 CO 0.11 -0.07 1.06 -0.62 -0.31 0.00 0.00 175.10 175.27 3n8f s ASP 578 N -3.35 6.43 0.57 4.85 2.15 -1.26 -0.36 116.67 125.69 3n8f s ASP 578 Ca 0.36 2.03 0.28 0.00 0.43 0.00 0.00 52.55 55.65 3n8f s ASP 578 Cb 0.08 -2.58 1.48 0.00 -0.30 0.00 0.00 42.92 41.60 3n8f s ASP 578 CO 0.13 -0.72 1.95 0.00 -0.17 0.00 0.00 175.17 176.35 3n8f h SER 580 N 0.00 0.73 0.00 0.00 4.64 -1.91 -2.07 113.55 114.93 3n8f h SER 580 Ca 0.24 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 3n8f h SER 580 Cb 1.12 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 63.08 3n8f h SER 580 CO -0.00 0.48 0.00 0.00 -0.87 0.00 0.00 176.83 176.43 3n8f n ALA 581 N -2.34 2.55 -2.75 5.18 0.00 -0.91 -4.75 120.51 117.49 3n8f n ALA 581 Ca 0.10 -0.12 -0.36 0.00 0.00 0.00 0.00 53.44 53.07 3n8f n ALA 581 Cb 0.15 -1.30 -0.10 0.00 0.00 0.00 0.00 19.45 18.20 3n8f n ALA 581 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3n8f s VAL 582 N -2.00 5.09 0.16 0.00 1.01 -0.78 -5.05 120.40 118.82 3n8f s VAL 582 Ca 0.28 0.08 -0.34 0.00 0.00 0.00 0.00 61.98 62.00 3n8f s VAL 582 Cb 0.13 -3.35 -0.14 0.00 0.00 0.00 0.00 36.38 33.01 3n8f s VAL 582 CO 0.21 0.38 1.58 0.47 0.00 0.00 0.00 175.10 177.74 3n8f n ASP 583 N 4.15 3.08 -4.94 3.32 8.00 -1.26 -5.00 116.55 123.90 3n8f n ASP 583 Ca -0.16 1.08 -0.24 0.00 0.71 0.00 0.00 54.79 56.18 3n8f n ASP 583 Cb 0.52 -1.42 0.03 0.00 -0.02 0.00 0.00 41.12 40.23 3n8f n ASP 583 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 3n8f s LYS 584 N 0.96 2.85 -0.49 -1.24 1.02 -1.26 -4.76 119.74 116.82 3n8f s LYS 584 Ca 0.79 -0.33 -0.20 0.00 0.02 0.00 0.00 55.97 56.25 3n8f s LYS 584 Cb -0.68 -2.40 0.04 0.00 -0.52 0.00 0.00 37.83 34.27 3n8f s LYS 584 CO 0.38 -0.59 0.66 -1.17 -0.92 0.00 0.00 175.35 173.71 3n8f s LEU 585 N -4.82 4.73 -0.55 3.17 2.96 -1.26 -4.71 118.68 118.21 3n8f s LEU 585 Ca 0.53 -0.68 -0.28 0.00 -0.22 0.00 0.00 54.13 53.48 3n8f s LEU 585 Cb -0.10 -2.56 0.02 0.00 0.50 0.00 0.00 46.19 44.04 3n8f s LEU 585 CO 0.41 -0.88 1.30 -0.62 -1.32 0.00 0.00 176.35 175.24 3n8f s ASP 586 N 2.47 6.32 0.00 3.68 -1.08 -1.26 -4.89 116.67 121.91 3n8f s ASP 586 Ca 0.19 0.29 0.16 0.00 -0.52 0.00 0.00 52.55 52.67 3n8f s ASP 586 Cb -0.17 -2.55 0.49 0.00 -1.46 0.00 0.00 42.92 39.24 3n8f s ASP 586 CO 0.15 -1.55 1.39 0.18 0.52 0.00 0.00 175.17 175.85 3n8f n LEU 587 N 8.90 2.11 -0.17 -1.34 4.77 -1.26 -4.50 117.00 125.51 3n8f n LEU 587 Ca 0.11 -0.99 -0.03 0.00 -0.03 0.00 0.00 56.01 55.07 3n8f n LEU 587 Cb 0.49 -0.22 0.07 0.00 -2.33 0.00 0.00 43.42 41.43 3n8f n LEU 587 CO 0.71 0.50 0.99 0.77 -1.33 0.00 0.00 177.39 179.03 3n8f h SER 588 N 2.48 0.26 0.02 -1.43 4.64 -2.01 -2.71 113.55 114.79 3n8f h SER 588 Ca 0.00 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 3n8f h SER 588 Cb 0.56 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.66 3n8f h SER 588 CO 0.00 0.17 0.00 -2.65 -0.87 0.00 0.00 176.83 173.48 3n8f n PRO 589 N -4.96 0.01 -0.14 4.77 -0.02 -1.26 -1.71 135.00 131.68 3n8f n PRO 589 Ca 0.06 0.26 0.11 0.00 -2.02 0.00 0.00 63.50 61.91 3n8f n PRO 589 Cb 0.19 -1.50 0.29 0.00 -0.02 0.00 0.00 33.50 32.46 3n8f n PRO 589 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 3n8f n TRP 590 N -1.27 0.38 -3.38 6.00 7.02 -1.02 -4.89 117.44 120.27 3n8f n TRP 590 Ca 0.00 -0.19 -0.38 0.00 -1.02 0.00 0.00 57.50 55.91 3n8f n TRP 590 Cb 0.01 0.00 -0.06 0.00 -2.42 0.00 0.00 31.31 28.84 3n8f n TRP 590 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 3n8f s ALA 591 N -1.62 3.60 -0.35 6.99 0.00 -0.70 -4.92 121.76 124.75 3n8f s ALA 591 Ca 0.34 -0.14 0.14 0.00 0.00 0.00 0.00 51.96 52.30 3n8f s ALA 591 Cb 0.19 -2.54 0.39 0.00 0.00 0.00 0.00 23.12 21.16 3n8f s ALA 591 CO 0.28 0.31 0.80 0.45 0.00 0.00 0.00 175.76 177.60 3n8f n SER 592 N 2.38 1.06 -4.73 0.00 2.88 -1.26 -5.10 113.62 108.85 3n8f n SER 592 Ca -0.11 -2.92 -0.67 0.00 -1.33 0.00 0.00 58.87 53.85 3n8f n SER 592 Cb 0.52 -0.59 -0.10 0.00 -0.75 0.00 0.00 64.21 63.29 3n8f n SER 592 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 3n8f n ARG 593 N 0.16 0.05 0.14 -1.46 0.63 -1.26 -4.84 116.66 110.08 3n8f n ARG 593 Ca 0.20 0.02 -0.13 0.00 -0.92 0.00 0.00 57.85 57.02 3n8f n ARG 593 Cb 0.71 -1.53 -0.06 0.00 0.45 0.00 0.00 32.46 32.03 3n8f n ARG 593 CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 3n8f h GLU 594 N 4.93 -0.45 -0.02 -0.14 4.81 -2.00 -3.55 114.58 118.16 3n8f h GLU 594 Ca -0.45 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 58.81 3n8f h GLU 594 Cb 1.37 0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.86 3n8f h GLU 594 CO 0.95 -0.30 0.00 0.09 -0.73 0.00 0.00 179.01 179.02