#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h1i n TYR 4 N 0.00 0.00 -0.03 4.78 9.36 -1.26 -2.37 117.16 127.64 3h1i n TYR 4 Ca 0.00 0.00 -0.01 0.00 3.32 0.00 0.00 57.90 61.21 3h1i n TYR 4 Cb 0.00 0.00 -0.01 0.00 -0.63 0.00 0.00 39.34 38.70 3h1i n TYR 4 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3h1i n ALA 5 N -1.57 -0.04 -0.26 2.98 0.00 -1.26 0.10 120.51 120.46 3h1i n ALA 5 Ca 0.00 0.06 -0.01 0.00 0.00 0.00 0.00 53.44 53.48 3h1i n ALA 5 Cb 0.00 0.11 0.05 0.00 0.00 0.00 0.00 19.45 19.61 3h1i n ALA 5 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 3h1i h GLN 6 N 0.00 -0.06 -0.09 0.00 4.20 -1.98 0.65 115.11 117.83 3h1i h GLN 6 Ca 0.01 0.00 0.02 0.00 0.06 0.00 0.00 58.65 58.75 3h1i h GLN 6 Cb 0.03 0.01 -0.00 0.00 0.30 0.00 0.00 27.48 27.82 3h1i h GLN 6 CO -0.06 -0.04 0.37 1.79 -0.67 0.00 0.00 178.83 180.21 3h1i h THR 7 N -0.07 0.08 -0.04 -0.54 1.35 0.04 -1.52 112.91 112.21 3h1i h THR 7 Ca 0.31 0.00 -0.04 0.00 -0.55 0.00 0.00 66.41 66.14 3h1i h THR 7 Cb 0.57 0.65 0.00 0.00 -1.73 0.00 0.00 68.15 67.64 3h1i h THR 7 CO -0.78 0.00 -0.11 -0.07 -0.25 0.00 0.00 175.52 174.31 3h1i h LEU 8 N 0.00 0.17 -0.49 3.87 3.38 0.47 -3.21 115.31 119.50 3h1i h LEU 8 Ca 0.04 -0.59 0.00 0.00 0.09 0.00 0.00 57.88 57.42 3h1i h LEU 8 Cb 0.77 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.47 3h1i h LEU 8 CO -0.00 0.74 0.00 0.06 0.09 0.00 0.00 178.44 179.32 3h1i h GLN 9 N -0.38 0.00 0.02 1.13 3.07 -1.29 -2.98 115.11 114.68 3h1i h GLN 9 Ca -0.00 0.00 -0.20 0.00 0.09 0.00 0.00 58.65 58.53 3h1i h GLN 9 Cb 0.71 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 28.26 3h1i h GLN 9 CO 0.02 0.00 -0.93 -0.91 0.09 0.00 0.00 178.83 177.10 3h1i h ASN 10 N 0.00 0.19 -0.93 0.06 4.21 -1.55 -3.45 115.58 114.12 3h1i h ASN 10 Ca 0.00 -0.16 -0.71 0.00 1.21 0.00 0.00 56.30 56.64 3h1i h ASN 10 Cb 0.56 -0.06 -0.02 0.00 -1.12 0.00 0.00 38.32 37.68 3h1i h ASN 10 CO 0.00 1.01 1.30 -0.38 -1.29 0.00 0.00 177.43 178.07 3h1i n ILE 11 N -3.58 0.17 -1.61 2.81 5.41 -1.12 -4.76 119.36 116.67 3h1i n ILE 11 Ca -0.03 -0.16 -0.59 0.00 1.00 0.00 0.00 62.75 62.97 3h1i n ILE 11 Cb 0.85 -1.31 -0.08 0.00 -0.71 0.00 0.00 39.64 38.39 3h1i n ILE 11 CO 0.00 0.00 0.00 -0.81 0.00 0.00 0.00 176.55 175.74 3h1i n PRO 12 N 7.51 0.74 -1.39 0.38 -0.04 -1.26 -4.87 135.00 136.07 3h1i n PRO 12 Ca 0.42 0.26 -0.41 0.00 -0.04 0.00 0.00 63.50 63.73 3h1i n PRO 12 Cb 0.15 -1.95 0.01 0.00 -0.04 0.00 0.00 33.50 31.67 3h1i n PRO 12 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 3h1i n GLU 13 N 5.86 0.35 -3.18 0.54 2.13 -1.26 -4.80 120.64 120.28 3h1i n GLU 13 Ca 0.34 0.13 -0.43 0.00 0.66 0.00 0.00 57.16 57.86 3h1i n GLU 13 Cb 0.08 -1.36 -0.07 0.00 0.27 0.00 0.00 31.44 30.35 3h1i n GLU 13 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 3h1i s THR 14 N -1.64 4.93 0.42 6.31 2.01 -1.26 -4.77 115.64 121.63 3h1i s THR 14 Ca 0.63 0.04 -0.24 0.00 0.31 0.00 0.00 61.69 62.43 3h1i s THR 14 Cb -0.56 -4.12 -0.08 0.00 0.01 0.00 0.00 72.50 67.74 3h1i s THR 14 CO 0.59 -0.48 1.14 0.20 -0.69 0.00 0.00 174.62 175.38 3h1i s ASN 15 N 1.91 6.46 -0.02 3.53 0.01 -1.11 -4.85 114.94 120.87 3h1i s ASN 15 Ca 0.19 2.27 -0.00 0.00 -0.71 0.00 0.00 52.86 54.61 3h1i s ASN 15 Cb -0.15 -2.60 0.02 0.00 0.41 0.00 0.00 41.25 38.92 3h1i s ASN 15 CO 0.17 -0.71 0.03 -0.69 -1.51 0.00 0.00 177.10 174.38 3h1i s VAL 16 N -1.50 -0.03 -0.06 1.60 1.01 -1.26 -2.65 120.40 117.51 3h1i s VAL 16 Ca 0.59 0.11 -0.04 0.00 0.00 0.00 0.00 61.98 62.64 3h1i s VAL 16 Cb -0.28 -0.07 0.02 0.00 0.00 0.00 0.00 36.38 36.05 3h1i s VAL 16 CO 0.35 0.05 0.14 0.42 0.00 0.00 0.00 175.10 176.06 3h1i s THR 17 N 0.57 -0.02 -0.04 3.92 -4.23 -0.65 -5.03 115.64 110.16 3h1i s THR 17 Ca -0.05 0.06 -0.02 0.00 -1.18 0.00 0.00 61.69 60.50 3h1i s THR 17 Cb -0.07 -0.22 -0.04 0.00 1.34 0.00 0.00 72.50 73.52 3h1i s THR 17 CO -0.02 0.02 0.09 -0.89 -0.54 0.00 0.00 174.62 173.28 3h1i s THR 18 N 0.45 4.87 -0.16 3.99 2.01 -1.26 -1.49 115.64 124.05 3h1i s THR 18 Ca -0.03 -0.23 -0.23 0.00 0.31 0.00 0.00 61.69 61.51 3h1i s THR 18 Cb -0.05 -3.18 -0.02 0.00 0.01 0.00 0.00 72.50 69.27 3h1i s THR 18 CO -0.02 0.45 0.71 -0.76 -0.69 0.00 0.00 174.62 174.31 3h1i s LEU 19 N -1.45 4.19 0.03 4.42 1.43 -0.47 -4.90 118.68 121.93 3h1i s LEU 19 Ca 0.20 1.02 0.00 0.00 -1.03 0.00 0.00 54.13 54.32 3h1i s LEU 19 Cb -0.12 -3.04 0.02 0.00 0.03 0.00 0.00 46.19 43.07 3h1i s LEU 19 CO 0.10 -0.28 0.60 0.47 0.23 0.00 0.00 176.35 177.48 3h1i n ASP 20 N 4.83 0.01 0.09 2.29 10.43 -1.26 0.70 116.55 133.63 3h1i n ASP 20 Ca 0.01 0.10 0.12 0.00 2.57 0.00 0.00 54.79 57.58 3h1i n ASP 20 Cb 0.50 -0.08 0.01 0.00 1.84 0.00 0.00 41.12 43.39 3h1i n ASP 20 CO 0.00 0.00 0.00 -0.46 -1.07 0.00 0.00 177.20 175.67 3h1i n ASN 21 N -1.14 0.77 0.00 -2.24 6.94 -1.26 -4.91 115.26 113.42 3h1i n ASN 21 Ca -0.00 0.25 0.00 0.00 -0.02 0.00 0.00 54.58 54.81 3h1i n ASN 21 Cb 0.45 0.52 0.00 0.00 -2.36 0.00 0.00 39.78 38.39 3h1i n ASN 21 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 3h1i n GLY 22 N 1.22 3.72 3.54 4.83 0.00 0.22 -4.33 105.19 114.38 3h1i n GLY 22 Ca 0.00 -0.82 -0.34 0.00 0.00 0.00 0.00 46.02 44.87 3h1i n GLY 22 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3h1i n LEU 23 N 0.00 1.84 -3.94 0.99 7.94 -0.59 -3.50 117.00 119.74 3h1i n LEU 23 Ca 0.00 0.50 -0.22 0.00 -1.11 0.00 0.00 56.01 55.18 3h1i n LEU 23 Cb 0.00 -1.32 -0.16 0.00 0.53 0.00 0.00 43.42 42.46 3h1i n LEU 23 CO 0.00 -2.75 -0.43 -0.13 -1.11 0.00 0.00 177.39 172.97 3h1i s ARG 24 N -3.56 1.21 -0.10 1.96 0.52 -1.13 -1.37 118.95 116.48 3h1i s ARG 24 Ca 0.66 -0.23 0.01 0.00 -0.52 0.00 0.00 55.73 55.65 3h1i s ARG 24 Cb -0.28 -1.11 -0.02 0.00 0.52 0.00 0.00 34.95 34.05 3h1i s ARG 24 CO 0.58 -0.06 -0.14 0.08 0.02 0.00 0.00 175.30 175.79 3h1i s VAL 25 N 0.90 3.05 0.13 3.52 1.01 -0.56 -1.09 120.40 127.36 3h1i s VAL 25 Ca -0.11 -0.69 -0.15 0.00 0.00 0.00 0.00 61.98 61.03 3h1i s VAL 25 Cb -0.15 -2.25 0.03 0.00 0.00 0.00 0.00 36.38 34.02 3h1i s VAL 25 CO 0.01 0.55 0.38 0.00 0.00 0.00 0.00 175.10 176.04 3h1i s ALA 26 N -0.05 -0.82 -0.07 5.51 0.00 0.06 -1.63 121.76 124.75 3h1i s ALA 26 Ca -0.03 -0.15 -0.32 0.00 0.00 0.00 0.00 51.96 51.46 3h1i s ALA 26 Cb -0.14 0.68 0.12 0.00 0.00 0.00 0.00 23.12 23.79 3h1i s ALA 26 CO 0.04 -0.64 1.22 -1.54 0.00 0.00 0.00 175.76 174.84 3h1i s SER 27 N -2.82 -0.11 -0.17 0.00 1.04 -1.08 -2.12 113.70 108.44 3h1i s SER 27 Ca 0.04 -0.09 0.01 0.00 0.48 0.00 0.00 55.95 56.38 3h1i s SER 27 Cb 0.02 0.19 0.02 0.00 0.10 0.00 0.00 66.02 66.35 3h1i s SER 27 CO -0.11 -0.33 -0.18 -0.70 0.98 0.00 0.00 173.24 172.90 3h1i s GLU 28 N -2.51 2.76 -0.06 4.02 2.12 -0.51 -2.74 118.70 121.78 3h1i s GLU 28 Ca 0.12 -0.77 -0.22 0.00 0.36 0.00 0.00 54.97 54.45 3h1i s GLU 28 Cb 0.02 -2.45 -0.04 0.00 0.26 0.00 0.00 34.13 31.92 3h1i s GLU 28 CO -0.04 -0.23 0.65 -2.00 -0.54 0.00 0.00 175.26 173.10 3h1i s GLU 29 N 1.34 4.41 0.31 4.30 2.12 -1.26 -2.43 118.70 127.48 3h1i s GLU 29 Ca 0.04 0.80 0.05 0.00 0.36 0.00 0.00 54.97 56.23 3h1i s GLU 29 Cb -0.13 -3.43 -0.02 0.00 0.26 0.00 0.00 34.13 30.81 3h1i s GLU 29 CO -0.12 0.14 0.20 -1.13 -0.54 0.00 0.00 175.26 173.80 3h1i n SER 30 N 3.55 0.09 -1.53 -1.70 3.41 0.42 -4.83 113.62 113.03 3h1i n SER 30 Ca -0.03 -2.86 0.06 0.00 -0.26 0.00 0.00 58.87 55.78 3h1i n SER 30 Cb 0.51 1.22 0.31 0.00 -0.26 0.00 0.00 64.21 65.99 3h1i n SER 30 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3h1i n SER 31 N -1.78 4.52 -4.63 4.04 3.41 -1.26 -3.83 113.62 114.10 3h1i n SER 31 Ca 0.02 -2.63 -0.43 0.00 -0.26 0.00 0.00 58.87 55.57 3h1i n SER 31 Cb 0.52 -0.61 -0.02 0.00 -0.26 0.00 0.00 64.21 63.84 3h1i n SER 31 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 3h1i s GLN 32 N -2.22 3.90 0.65 4.33 2.00 -1.26 -4.87 119.66 122.19 3h1i s GLN 32 Ca 0.43 1.08 0.36 0.00 -2.00 0.00 0.00 55.36 55.23 3h1i s GLN 32 Cb 0.31 -3.86 1.98 0.00 0.80 0.00 0.00 33.01 32.24 3h1i s GLN 32 CO 0.15 -1.14 2.16 -1.00 -0.50 0.00 0.00 175.29 174.96 3h1i h PRO 33 N 9.08 0.00 -5.83 1.67 0.13 -1.92 0.28 132.00 135.42 3h1i h PRO 33 Ca -0.24 0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.30 3h1i h PRO 33 Cb 1.08 0.00 -0.08 0.00 0.13 0.00 0.00 31.00 32.13 3h1i h PRO 33 CO 1.05 0.00 -0.45 -0.08 -0.23 0.00 0.00 178.00 178.29 3h1i s THR 34 N -4.25 2.01 0.00 1.56 -1.32 -1.26 -0.37 115.64 112.01 3h1i s THR 34 Ca -0.04 -1.67 0.00 0.00 -1.21 0.00 0.00 61.69 58.77 3h1i s THR 34 Cb 0.12 -2.68 0.00 0.00 -1.51 0.00 0.00 72.50 68.43 3h1i s THR 34 CO 0.40 0.00 0.00 0.00 -2.21 0.00 0.00 174.62 172.81 3h1i s THR 36 N -2.72 0.00 -0.06 0.00 2.01 -0.61 -1.16 115.64 113.11 3h1i s THR 36 Ca 0.00 -0.02 -0.11 0.00 0.31 0.00 0.00 61.69 61.87 3h1i s THR 36 Cb 0.00 -0.87 0.02 0.00 0.01 0.00 0.00 72.50 71.66 3h1i s THR 36 CO 0.00 -0.01 0.26 0.68 -0.69 0.00 0.00 174.62 174.86 3h1i s VAL 37 N 0.04 0.03 0.11 3.82 -7.23 -0.18 -0.80 120.40 116.19 3h1i s VAL 37 Ca -0.02 -0.26 -0.25 0.00 -1.81 0.00 0.00 61.98 59.63 3h1i s VAL 37 Cb -0.04 -0.46 0.07 0.00 0.56 0.00 0.00 36.38 36.51 3h1i s VAL 37 CO 0.02 -0.14 0.82 -0.83 -0.31 0.00 0.00 175.10 174.65 3h1i s GLY 38 N -0.56 -0.39 -0.18 2.32 0.00 -0.06 0.06 107.32 108.51 3h1i s GLY 38 Ca -0.07 0.48 -0.09 0.00 0.00 0.00 0.00 44.72 45.04 3h1i s GLY 38 CO 0.02 0.15 0.12 0.54 0.00 0.00 0.00 173.10 173.93 3h1i s VAL 39 N -3.42 5.34 -0.85 1.40 0.11 -0.31 -0.83 120.40 121.84 3h1i s VAL 39 Ca 0.07 0.16 0.00 0.00 -2.93 0.00 0.00 61.98 59.28 3h1i s VAL 39 Cb -0.02 -3.41 0.21 0.00 -1.53 0.00 0.00 36.38 31.63 3h1i s VAL 39 CO -0.05 0.48 0.72 0.79 -3.33 0.00 0.00 175.10 173.72 3h1i n TRP 40 N 3.17 3.97 -1.79 1.54 8.01 0.22 -1.62 117.44 130.94 3h1i n TRP 40 Ca -0.17 -4.17 -0.38 0.00 -1.31 0.00 0.00 57.50 51.47 3h1i n TRP 40 Cb 0.53 -1.00 0.04 0.00 -2.01 0.00 0.00 31.31 28.87 3h1i n TRP 40 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.69 177.10 3h1i s ILE 41 N -1.44 2.09 -0.69 -0.99 1.01 -0.96 -3.43 121.20 116.79 3h1i s ILE 41 Ca 0.27 0.07 -0.02 0.00 0.00 0.00 0.00 60.65 60.97 3h1i s ILE 41 Cb -0.06 -3.03 0.35 0.00 0.01 0.00 0.00 42.46 39.73 3h1i s ILE 41 CO -0.14 -0.00 2.11 0.61 0.00 0.00 0.00 174.94 177.52 3h1i n GLY 42 N 0.74 5.43 3.51 6.18 0.00 -0.80 -2.62 105.19 117.62 3h1i n GLY 42 Ca 0.11 -2.23 -0.29 0.00 0.00 0.00 0.00 46.02 43.61 3h1i n GLY 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h1i s ALA 43 N -3.54 2.74 0.00 4.61 0.00 -1.26 -4.70 121.76 119.61 3h1i s ALA 43 Ca 0.56 -1.38 0.00 0.00 0.00 0.00 0.00 51.96 51.14 3h1i s ALA 43 Cb 0.45 -0.67 0.00 0.00 0.00 0.00 0.00 23.12 22.90 3h1i s ALA 43 CO -0.20 0.57 0.00 0.41 0.00 0.00 0.00 175.76 176.54 3h1i n GLY 44 N 0.63 2.57 0.13 0.00 0.00 -1.26 -0.59 105.19 106.68 3h1i n GLY 44 Ca -0.14 -0.45 -0.21 0.00 0.00 0.00 0.00 46.02 45.21 3h1i n GLY 44 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3h1i h SER 45 N 0.00 0.57 -0.82 1.61 4.64 -0.48 -3.30 113.55 115.78 3h1i h SER 45 Ca 0.00 -0.78 0.11 0.00 -0.47 0.00 0.00 61.79 60.66 3h1i h SER 45 Cb 0.00 -0.19 -0.08 0.00 -0.31 0.00 0.00 62.40 61.82 3h1i h SER 45 CO 0.00 1.64 0.45 -0.09 -0.87 0.00 0.00 176.83 177.96 3h1i h ARG 46 N 0.10 0.69 0.00 4.77 2.43 0.00 0.63 114.38 123.00 3h1i h ARG 46 Ca -0.29 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.84 3h1i h ARG 46 Cb 2.08 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 31.48 3h1i h ARG 46 CO 0.19 0.46 0.00 0.66 -1.51 0.00 0.00 179.97 179.77 3h1i n TYR 47 N -4.80 0.00 -2.34 2.20 4.02 -1.24 -4.70 117.16 110.29 3h1i n TYR 47 Ca 0.15 0.00 -0.28 0.00 -0.01 0.00 0.00 57.90 57.76 3h1i n TYR 47 Cb 0.33 -0.47 0.02 0.00 -0.02 0.00 0.00 39.34 39.20 3h1i n TYR 47 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 3h1i s GLU 48 N -2.93 3.26 0.00 -0.72 2.02 0.22 -5.00 118.70 115.54 3h1i s GLU 48 Ca 0.06 0.24 0.00 0.00 0.02 0.00 0.00 54.97 55.30 3h1i s GLU 48 Cb 0.08 -2.25 0.00 0.00 0.10 0.00 0.00 34.13 32.05 3h1i s GLU 48 CO 0.20 -0.53 0.00 0.27 0.02 0.00 0.00 175.26 175.22 3h1i n ASN 49 N -2.54 1.31 0.16 -0.19 2.04 -1.26 -4.96 115.26 109.83 3h1i n ASN 49 Ca 0.04 -0.20 0.04 0.00 -0.44 0.00 0.00 54.58 54.02 3h1i n ASN 49 Cb 0.56 0.00 0.20 0.00 -2.53 0.00 0.00 39.78 38.01 3h1i n ASN 49 CO 0.00 0.00 0.00 -0.08 -0.44 0.00 0.00 177.26 176.74 3h1i h GLU 50 N 0.00 0.00 0.00 -3.83 4.22 -1.98 -3.05 114.58 109.93 3h1i h GLU 50 Ca 0.00 0.00 -0.11 0.00 0.08 0.00 0.00 59.36 59.33 3h1i h GLU 50 Cb 0.00 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 3h1i h GLU 50 CO 0.00 0.45 -1.37 1.63 -2.18 0.00 0.00 179.01 177.54 3h1i n LYS 51 N -3.40 0.62 -1.75 1.92 5.02 -1.26 -4.31 118.16 115.00 3h1i n LYS 51 Ca 0.01 0.15 -0.25 0.00 -2.02 0.00 0.00 58.31 56.20 3h1i n LYS 51 Cb 0.61 -1.78 0.05 0.00 -0.02 0.00 0.00 35.03 33.89 3h1i n LYS 51 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 3h1i n ASN 52 N -2.78 5.44 -4.63 4.39 6.94 -1.23 -4.95 115.26 118.44 3h1i n ASN 52 Ca -0.07 -3.77 -0.43 0.00 -0.02 0.00 0.00 54.58 50.29 3h1i n ASN 52 Cb 0.75 -0.52 -0.02 0.00 -2.36 0.00 0.00 39.78 37.63 3h1i n ASN 52 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 3h1i s ASN 53 N -3.09 6.87 0.00 0.53 3.04 -1.15 -3.92 114.94 117.22 3h1i s ASN 53 Ca 0.54 1.02 0.00 0.00 0.04 0.00 0.00 52.86 54.46 3h1i s ASN 53 Cb 0.43 -2.54 0.00 0.00 -1.54 0.00 0.00 41.25 37.60 3h1i s ASN 53 CO 0.02 -0.94 0.00 0.61 -3.04 0.00 0.00 177.10 173.75 3h1i n GLY 54 N 4.02 1.63 0.00 1.21 0.00 -1.26 -4.25 105.19 106.54 3h1i n GLY 54 Ca 0.12 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.74 3h1i n GLY 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h1i n ALA 55 N 0.00 0.00 -0.03 4.61 0.00 -1.25 0.26 120.51 124.10 3h1i n ALA 55 Ca 0.00 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.62 3h1i n ALA 55 Cb 0.00 0.00 0.28 0.00 0.00 0.00 0.00 19.45 19.73 3h1i n ALA 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3h1i n GLY 56 N 0.00 -0.65 0.10 0.00 0.00 -1.26 0.36 105.19 103.74 3h1i n GLY 56 Ca 0.00 0.23 -0.16 0.00 0.00 0.00 0.00 46.02 46.09 3h1i n GLY 56 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3h1i n TYR 57 N -2.93 0.52 -0.09 1.61 9.36 0.74 -3.08 117.16 123.29 3h1i n TYR 57 Ca 0.15 0.23 0.26 0.00 3.32 0.00 0.00 57.90 61.85 3h1i n TYR 57 Cb 1.32 -0.85 0.72 0.00 -0.63 0.00 0.00 39.34 39.90 3h1i n TYR 57 CO 0.00 0.00 0.00 0.35 0.22 0.00 0.00 176.86 177.43 3h1i h PHE 58 N -1.00 0.00 0.16 2.98 -0.00 -0.42 0.49 116.94 119.15 3h1i h PHE 58 Ca -0.26 0.00 -0.30 0.00 -0.00 0.00 0.00 57.97 57.42 3h1i h PHE 58 Cb 1.09 0.00 0.01 0.00 -0.00 0.00 0.00 35.95 37.05 3h1i h PHE 58 CO -0.16 0.00 -1.35 0.28 -0.00 0.00 0.00 178.31 177.08 3h1i h VAL 59 N 0.00 1.39 0.00 1.41 2.07 -0.26 -2.54 116.25 118.31 3h1i h VAL 59 Ca 0.35 -2.93 -0.03 0.00 0.82 0.00 0.00 66.70 64.91 3h1i h VAL 59 Cb 1.57 2.94 -0.00 0.00 -1.52 0.00 0.00 31.29 34.28 3h1i h VAL 59 CO -0.00 0.86 -0.15 -0.08 0.02 0.00 0.00 177.57 178.22 3h1i h GLU 60 N 0.09 0.00 -0.01 1.57 4.81 -0.03 -0.71 114.58 120.30 3h1i h GLU 60 Ca -0.18 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.02 3h1i h GLU 60 Cb 2.03 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.41 3h1i h GLU 60 CO 0.22 0.15 -0.11 0.45 -0.73 0.00 0.00 179.01 178.99 3h1i h HIS 61 N 0.00 0.12 -0.40 0.92 3.86 -0.99 -3.31 115.15 115.34 3h1i h HIS 61 Ca -0.00 -0.06 0.00 0.00 -1.16 0.00 0.00 60.37 59.15 3h1i h HIS 61 Cb 0.33 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 28.79 3h1i h HIS 61 CO 0.00 0.82 0.00 1.28 0.86 0.00 0.00 177.93 180.89 3h1i n LEU 62 N -4.63 2.68 -0.25 2.43 4.77 -0.96 -4.05 117.00 116.98 3h1i n LEU 62 Ca -0.09 -1.35 0.08 0.00 -0.03 0.00 0.00 56.01 54.62 3h1i n LEU 62 Cb 0.42 -0.37 0.36 0.00 -2.33 0.00 0.00 43.42 41.49 3h1i n LEU 62 CO 0.36 0.55 0.74 0.00 -1.33 0.00 0.00 177.39 177.71 3h1i n ALA 63 N 0.65 2.54 -0.27 -1.18 0.00 -0.29 -3.52 120.51 118.45 3h1i n ALA 63 Ca 0.15 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.31 3h1i n ALA 63 Cb 0.48 -1.15 0.00 0.00 0.00 0.00 0.00 19.45 18.78 3h1i n ALA 63 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3h1i n PHE 64 N -0.25 0.00 0.06 0.00 0.99 -1.26 -4.75 117.46 112.27 3h1i n PHE 64 Ca 0.12 0.00 -0.10 0.00 -0.00 0.00 0.00 57.45 57.47 3h1i n PHE 64 Cb 0.16 0.00 0.07 0.00 -1.00 0.00 0.00 39.48 38.71 3h1i n PHE 64 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 176.76 178.39 3h1i n LYS 65 N -0.21 1.50 0.00 -1.08 4.01 -1.23 -4.74 118.16 116.42 3h1i n LYS 65 Ca 0.00 -1.20 0.00 0.00 -0.51 0.00 0.00 58.31 56.60 3h1i n LYS 65 Cb 0.07 -1.47 0.00 0.00 -0.51 0.00 0.00 35.03 33.12 3h1i n LYS 65 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3h1i n GLY 66 N -0.11 -3.26 2.60 0.72 0.00 -1.26 -3.85 105.19 100.02 3h1i n GLY 66 Ca 0.24 -2.07 -0.16 0.00 0.00 0.00 0.00 46.02 44.02 3h1i n GLY 66 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3h1i n THR 67 N -0.03 0.00 0.12 2.61 -2.24 -1.00 -2.42 114.28 111.32 3h1i n THR 67 Ca 0.00 -1.95 -0.02 0.00 -2.27 0.00 0.00 64.05 59.81 3h1i n THR 67 Cb 0.00 0.93 0.09 0.00 -2.10 0.00 0.00 70.33 69.25 3h1i n THR 67 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 3h1i h LYS 68 N 0.00 0.00 0.09 -0.78 1.57 -1.84 -3.23 116.57 112.39 3h1i h LYS 68 Ca -0.20 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.58 3h1i h LYS 68 Cb 0.97 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.28 3h1i h LYS 68 CO 0.30 0.69 -0.05 0.87 -0.57 0.00 0.00 179.45 180.70 3h1i h LYS 69 N 0.00 -0.12 -3.60 3.15 1.57 -1.95 -3.43 116.57 112.19 3h1i h LYS 69 Ca -0.01 0.01 -0.57 0.00 -1.87 0.00 0.00 60.65 58.22 3h1i h LYS 69 Cb 1.31 0.03 -0.40 0.00 0.08 0.00 0.00 32.23 33.25 3h1i h LYS 69 CO 0.09 0.39 -0.76 -0.98 -0.57 0.00 0.00 179.45 177.62 3h1i s ARG 70 N -3.62 0.76 0.31 3.15 1.70 -1.25 -5.10 118.95 114.91 3h1i s ARG 70 Ca -0.15 -0.88 -0.05 0.00 -0.47 0.00 0.00 55.73 54.19 3h1i s ARG 70 Cb 0.01 -2.05 0.08 0.00 -0.57 0.00 0.00 34.95 32.41 3h1i s ARG 70 CO 0.57 -0.86 0.17 -0.35 -1.08 0.00 0.00 175.30 173.75 3h1i n PRO 71 N 4.90 -2.02 0.00 3.89 -0.04 -1.22 -2.38 135.00 138.13 3h1i n PRO 71 Ca -0.05 -0.29 0.00 0.00 -0.04 0.00 0.00 63.50 63.12 3h1i n PRO 71 Cb 0.44 -0.41 0.00 0.00 -0.04 0.00 0.00 33.50 33.48 3h1i n PRO 71 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3h1i n ALA 73 N -1.86 -0.51 -0.34 0.00 0.00 -1.26 -1.01 120.51 115.53 3h1i n ALA 73 Ca 0.00 0.68 0.10 0.00 0.00 0.00 0.00 53.44 54.22 3h1i n ALA 73 Cb 0.00 -0.01 0.22 0.00 0.00 0.00 0.00 19.45 19.66 3h1i n ALA 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3h1i h ALA 74 N 0.19 0.93 -0.90 0.00 0.00 -1.86 1.14 119.26 118.76 3h1i h ALA 74 Ca 0.13 0.35 0.00 0.00 0.00 0.00 0.00 54.91 55.39 3h1i h ALA 74 Cb 0.33 0.64 0.00 0.00 0.00 0.00 0.00 17.79 18.76 3h1i h ALA 74 CO -0.75 -0.48 0.00 0.34 0.00 0.00 0.00 179.25 178.36 3h1i n PHE 75 N -5.53 0.00 -0.23 0.00 7.35 -0.18 -0.51 117.46 118.37 3h1i n PHE 75 Ca 0.19 0.00 -0.05 0.00 -0.76 0.00 0.00 57.45 56.84 3h1i n PHE 75 Cb 0.63 -0.35 0.01 0.00 0.35 0.00 0.00 39.48 40.12 3h1i n PHE 75 CO 0.00 0.00 0.00 0.93 -0.76 0.00 0.00 176.76 176.93 3h1i h GLU 76 N 0.00 -0.14 -0.19 -4.13 5.08 -0.97 0.16 114.58 114.39 3h1i h GLU 76 Ca 0.00 0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.40 3h1i h GLU 76 Cb 0.00 0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.23 3h1i h GLU 76 CO 0.00 -0.09 -0.41 -0.22 -1.00 0.00 0.00 179.01 177.29 3h1i h LYS 77 N -0.14 -0.36 -0.43 2.33 3.64 0.13 1.21 116.57 122.95 3h1i h LYS 77 Ca 0.24 0.02 0.12 0.00 -1.27 0.00 0.00 60.65 59.77 3h1i h LYS 77 Cb 0.56 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.44 3h1i h LYS 77 CO -0.72 -0.24 0.40 1.49 -2.27 0.00 0.00 179.45 178.11 3h1i h GLU 78 N -0.38 0.00 0.00 1.90 4.81 0.54 0.17 114.58 121.62 3h1i h GLU 78 Ca 0.04 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.26 3h1i h GLU 78 Cb 0.48 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.86 3h1i h GLU 78 CO -0.38 0.00 -0.04 0.28 -0.73 0.00 0.00 179.01 178.14 3h1i h VAL 79 N 0.00 0.66 0.30 0.32 2.07 0.28 -3.32 116.25 116.56 3h1i h VAL 79 Ca 0.20 -1.50 -0.00 0.00 0.82 0.00 0.00 66.70 66.22 3h1i h VAL 79 Cb 1.01 1.25 -0.02 0.00 -1.52 0.00 0.00 31.29 32.02 3h1i h VAL 79 CO -0.00 0.22 -0.27 -0.33 0.02 0.00 0.00 177.57 177.21 3h1i h GLU 80 N -1.00 -0.57 0.00 1.57 5.08 0.17 -2.68 114.58 117.15 3h1i h GLU 80 Ca -0.01 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 3h1i h GLU 80 Cb 0.40 0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.78 3h1i h GLU 80 CO -0.00 -0.38 0.38 0.66 -1.00 0.00 0.00 179.01 178.67 3h1i h SER 81 N -0.60 0.00 -0.01 1.42 4.64 -0.87 1.11 113.55 119.25 3h1i h SER 81 Ca -0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 3h1i h SER 81 Cb 0.54 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.63 3h1i h SER 81 CO -0.04 0.00 -0.61 1.15 -0.87 0.00 0.00 176.83 176.46 3h1i n MET 82 N -2.43 1.12 -1.65 4.77 0.00 -1.03 -5.00 117.12 112.91 3h1i n MET 82 Ca -0.01 -0.57 -0.03 0.00 0.00 0.00 0.00 57.70 57.09 3h1i n MET 82 Cb 0.41 -1.40 -0.01 0.00 0.00 0.00 0.00 33.22 32.22 3h1i n MET 82 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3h1i n GLY 83 N 1.37 0.39 3.89 3.17 0.00 0.38 -4.91 105.19 109.49 3h1i n GLY 83 Ca 0.06 -0.85 -0.34 0.00 0.00 0.00 0.00 46.02 44.89 3h1i n GLY 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3h1i s ALA 84 N -2.12 3.86 -0.36 4.61 0.00 -1.19 -4.86 121.76 121.71 3h1i s ALA 84 Ca 0.00 -0.61 -0.14 0.00 0.00 0.00 0.00 51.96 51.21 3h1i s ALA 84 Cb 0.00 -2.04 -0.01 0.00 0.00 0.00 0.00 23.12 21.07 3h1i s ALA 84 CO 0.00 0.67 0.31 -1.01 0.00 0.00 0.00 175.76 175.73 3h1i s HIS 85 N -1.33 3.22 -0.28 0.00 0.09 0.76 -4.60 115.29 113.14 3h1i s HIS 85 Ca 0.29 -0.23 -0.09 0.00 -0.00 0.00 0.00 55.06 55.03 3h1i s HIS 85 Cb -0.13 -2.60 -0.03 0.00 -0.00 0.00 0.00 32.58 29.83 3h1i s HIS 85 CO 0.17 -0.45 0.14 0.12 -0.00 0.00 0.00 174.74 174.72 3h1i s PHE 86 N 1.85 3.16 0.22 1.40 2.19 -1.26 -0.86 117.98 124.68 3h1i s PHE 86 Ca 0.08 -0.31 -0.16 0.00 0.33 0.00 0.00 56.93 56.87 3h1i s PHE 86 Cb -0.17 -2.33 0.01 0.00 -1.31 0.00 0.00 43.02 39.22 3h1i s PHE 86 CO 0.11 -0.34 0.51 1.21 1.83 0.00 0.00 175.22 178.54 3h1i s ASN 87 N 1.66 -0.18 0.00 6.13 2.47 -0.96 -5.05 114.94 119.02 3h1i s ASN 87 Ca 0.06 -0.68 0.00 0.00 0.42 0.00 0.00 52.86 52.66 3h1i s ASN 87 Cb -0.16 0.59 0.00 0.00 -1.45 0.00 0.00 41.25 40.23 3h1i s ASN 87 CO 0.07 -1.10 0.00 0.61 -3.72 0.00 0.00 177.10 172.95 3h1i n GLY 88 N -0.36 0.73 0.00 1.21 0.00 -1.26 -1.90 105.19 103.61 3h1i n GLY 88 Ca -0.06 -0.64 0.00 0.00 0.00 0.00 0.00 46.02 45.32 3h1i n GLY 88 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 173.32 174.90 3h1i n TYR 89 N 0.00 -0.67 -3.15 1.61 0.18 -0.59 -5.01 117.16 109.53 3h1i n TYR 89 Ca 0.00 0.00 0.03 0.00 1.88 0.00 0.00 57.90 59.81 3h1i n TYR 89 Cb 0.00 0.00 -0.00 0.00 -0.38 0.00 0.00 39.34 38.96 3h1i n TYR 89 CO 0.00 0.00 0.00 -0.08 -2.08 0.00 0.00 176.86 174.70 3h1i s THR 90 N -2.92 -0.91 0.00 -3.48 -1.32 -1.26 -2.46 115.64 103.30 3h1i s THR 90 Ca 0.00 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.48 3h1i s THR 90 Cb 0.00 -0.55 0.00 0.00 -1.51 0.00 0.00 72.50 70.44 3h1i s THR 90 CO 0.00 0.00 0.00 -1.54 -2.21 0.00 0.00 174.62 170.87 3h1i n SER 91 N 4.97 0.00 -0.14 8.08 3.41 0.41 -4.95 113.62 125.40 3h1i n SER 91 Ca 0.07 -0.47 -0.10 0.00 -0.26 0.00 0.00 58.87 58.11 3h1i n SER 91 Cb 0.56 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.53 3h1i n SER 91 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 3h1i h ARG 92 N 0.00 0.94 -1.55 4.33 3.08 -1.95 -3.25 114.38 115.98 3h1i h ARG 92 Ca 0.00 -0.39 -0.46 0.00 0.07 0.00 0.00 59.98 59.20 3h1i h ARG 92 Cb 0.00 -0.04 -0.34 0.00 0.08 0.00 0.00 29.97 29.68 3h1i h ARG 92 CO 0.00 1.06 -0.99 -0.85 -1.07 0.00 0.00 179.97 178.11 3h1i n GLU 93 N -4.11 0.83 0.00 0.04 0.28 -1.26 0.72 120.64 117.14 3h1i n GLU 93 Ca 0.00 -2.95 0.00 0.00 -0.16 0.00 0.00 57.16 54.05 3h1i n GLU 93 Cb 0.45 -1.39 0.00 0.00 1.43 0.00 0.00 31.44 31.93 3h1i n GLU 93 CO 0.00 0.00 0.00 0.94 -0.16 0.00 0.00 177.13 177.91 3h1i n GLN 94 N 0.97 0.00 -4.39 3.44 7.27 -0.96 -4.78 117.38 118.94 3h1i n GLN 94 Ca 0.19 0.00 -0.25 0.00 0.07 0.00 0.00 57.00 57.01 3h1i n GLN 94 Cb 0.60 0.00 -0.09 0.00 2.41 0.00 0.00 30.24 33.16 3h1i n GLN 94 CO 0.00 0.00 0.00 0.99 0.07 0.00 0.00 177.06 178.12 3h1i s THR 95 N 0.00 2.51 -0.28 1.69 2.01 0.24 -0.45 115.64 121.36 3h1i s THR 95 Ca 0.00 -2.02 -0.25 0.00 0.31 0.00 0.00 61.69 59.73 3h1i s THR 95 Cb 0.00 -2.77 0.15 0.00 0.01 0.00 0.00 72.50 69.88 3h1i s THR 95 CO 0.00 -0.19 1.17 0.00 -0.69 0.00 0.00 174.62 174.91 3h1i s ALA 96 N -2.55 -2.05 -0.13 7.40 0.00 -1.03 -2.26 121.76 121.15 3h1i s ALA 96 Ca 0.34 1.80 -0.00 0.00 0.00 0.00 0.00 51.96 54.11 3h1i s ALA 96 Cb 0.01 -1.52 0.02 0.00 0.00 0.00 0.00 23.12 21.63 3h1i s ALA 96 CO 0.19 -0.20 -0.11 -0.06 0.00 0.00 0.00 175.76 175.59 3h1i s PHE 97 N 0.09 1.78 0.10 0.00 0.40 -0.64 -1.54 117.98 118.17 3h1i s PHE 97 Ca 0.04 -0.94 0.01 0.00 -0.60 0.00 0.00 56.93 55.45 3h1i s PHE 97 Cb -0.05 -1.39 -0.04 0.00 0.51 0.00 0.00 43.02 42.05 3h1i s PHE 97 CO -0.09 -0.58 -0.05 1.52 0.70 0.00 0.00 175.22 176.73 3h1i s TYR 98 N 1.59 0.89 0.03 0.36 -0.85 -0.80 -1.16 117.35 117.42 3h1i s TYR 98 Ca 0.05 -0.95 0.04 0.00 -0.52 0.00 0.00 57.07 55.68 3h1i s TYR 98 Cb -0.13 -0.52 -0.02 0.00 0.38 0.00 0.00 41.96 41.67 3h1i s TYR 98 CO -0.09 -0.19 -0.11 0.42 -1.52 0.00 0.00 175.55 174.06 3h1i s ILE 99 N -3.67 0.84 -0.23 -3.49 1.01 0.11 -2.25 121.20 113.52 3h1i s ILE 99 Ca 0.13 -0.87 -0.08 0.00 0.00 0.00 0.00 60.65 59.83 3h1i s ILE 99 Cb 0.06 -0.79 -0.04 0.00 0.01 0.00 0.00 42.46 41.70 3h1i s ILE 99 CO -0.04 -0.07 0.10 -0.54 0.00 0.00 0.00 174.94 174.39 3h1i s LYS 100 N -1.05 3.88 0.21 2.79 1.02 -0.04 -1.01 119.74 125.55 3h1i s LYS 100 Ca -0.01 -0.37 -0.18 0.00 0.02 0.00 0.00 55.97 55.43 3h1i s LYS 100 Cb -0.07 -3.36 0.03 0.00 -0.52 0.00 0.00 37.83 33.90 3h1i s LYS 100 CO 0.01 0.03 0.55 0.00 -0.92 0.00 0.00 175.35 175.02 3h1i s ALA 101 N 1.07 -0.96 0.37 5.17 0.00 -0.31 -0.17 121.76 126.93 3h1i s ALA 101 Ca 0.05 -0.24 -0.28 0.00 0.00 0.00 0.00 51.96 51.49 3h1i s ALA 101 Cb -0.14 0.87 -0.11 0.00 0.00 0.00 0.00 23.12 23.74 3h1i s ALA 101 CO 0.04 -0.83 1.51 1.28 0.00 0.00 0.00 175.76 177.75 3h1i n LEU 102 N -0.36 4.82 0.14 0.00 4.77 -1.26 -0.06 117.00 125.04 3h1i n LEU 102 Ca -0.09 1.22 0.19 0.00 -0.03 0.00 0.00 56.01 57.30 3h1i n LEU 102 Cb 0.62 -1.63 0.69 0.00 -2.33 0.00 0.00 43.42 40.77 3h1i n LEU 102 CO 0.17 0.20 1.17 0.28 -1.33 0.00 0.00 177.39 177.87 3h1i h SER 103 N 3.10 0.00 0.22 -1.43 0.02 -0.94 -2.27 113.55 112.25 3h1i h SER 103 Ca -0.51 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.43 3h1i h SER 103 Cb 1.24 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.78 3h1i h SER 103 CO 0.65 0.00 -0.13 0.50 -1.14 0.00 0.00 176.83 176.71 3h1i h LYS 104 N 0.00 -0.32 0.00 3.45 3.64 -1.88 -2.84 116.57 118.62 3h1i h LYS 104 Ca 0.17 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.57 3h1i h LYS 104 Cb 1.24 0.07 0.00 0.00 -0.41 0.00 0.00 32.23 33.14 3h1i h LYS 104 CO -0.00 -0.21 0.19 -0.25 -2.27 0.00 0.00 179.45 176.91 3h1i n ASP 105 N -3.02 0.07 -0.06 4.20 8.00 -0.86 -4.01 116.55 120.88 3h1i n ASP 105 Ca -0.04 0.38 -0.01 0.00 0.71 0.00 0.00 54.79 55.83 3h1i n ASP 105 Cb 0.14 -0.37 -0.01 0.00 -0.02 0.00 0.00 41.12 40.86 3h1i n ASP 105 CO 0.00 0.00 0.00 0.80 -0.39 0.00 0.00 177.20 177.61 3h1i n MET 106 N -1.48 -0.05 0.15 -1.24 0.00 -1.07 0.53 117.12 113.95 3h1i n MET 106 Ca -0.00 0.20 -0.12 0.00 -0.00 0.00 0.00 57.70 57.78 3h1i n MET 106 Cb 0.19 -0.30 -0.07 0.00 0.00 0.00 0.00 33.22 33.04 3h1i n MET 106 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 175.97 174.97 3h1i h PRO 107 N 0.00 -0.40 -0.97 2.12 0.13 -1.85 -2.86 132.00 128.17 3h1i h PRO 107 Ca 0.03 0.03 0.25 0.00 -0.87 0.00 0.00 66.00 65.44 3h1i h PRO 107 Cb 0.06 0.09 -0.13 0.00 0.13 0.00 0.00 31.00 31.15 3h1i h PRO 107 CO -0.13 -0.07 0.52 -0.22 -0.23 0.00 0.00 178.00 177.88 3h1i h LYS 108 N -0.86 0.46 0.16 0.86 1.63 -0.60 0.25 116.57 118.47 3h1i h LYS 108 Ca -0.04 -0.03 -0.00 0.00 -0.85 0.00 0.00 60.65 59.73 3h1i h LYS 108 Cb 0.52 -0.10 -0.02 0.00 -0.60 0.00 0.00 32.23 32.03 3h1i h LYS 108 CO 0.07 0.30 -0.26 0.28 -3.45 0.00 0.00 179.45 176.40 3h1i h VAL 109 N 0.47 0.00 -0.77 2.00 2.07 0.16 -2.63 116.25 117.55 3h1i h VAL 109 Ca 0.64 0.00 0.19 0.00 0.82 0.00 0.00 66.70 68.34 3h1i h VAL 109 Cb 1.26 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 30.88 3h1i h VAL 109 CO -0.52 0.00 -0.08 0.52 0.02 0.00 0.00 177.57 177.52 3h1i n VAL 110 N -3.90 -0.32 0.01 2.57 0.31 0.04 0.26 118.33 117.30 3h1i n VAL 110 Ca -0.05 1.73 -0.13 0.00 -0.01 0.00 0.00 64.34 65.87 3h1i n VAL 110 Cb 0.22 -2.46 -0.09 0.00 -0.91 0.00 0.00 33.84 30.60 3h1i n VAL 110 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 3h1i h GLU 111 N 0.00 -0.51 -0.29 5.55 4.81 -1.10 -1.55 114.58 121.49 3h1i h GLU 111 Ca 0.42 0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.72 3h1i h GLU 111 Cb 0.79 0.12 -0.06 0.00 0.63 0.00 0.00 28.75 30.23 3h1i h GLU 111 CO -0.75 -0.34 -0.39 -0.07 -0.73 0.00 0.00 179.01 176.73 3h1i h LEU 112 N -0.53 -1.30 -1.00 1.64 3.38 -0.09 0.89 115.31 118.31 3h1i h LEU 112 Ca 0.02 0.17 0.16 0.00 0.09 0.00 0.00 57.88 58.32 3h1i h LEU 112 Cb 0.60 0.53 -0.16 0.00 0.09 0.00 0.00 40.66 41.72 3h1i h LEU 112 CO -0.36 -0.28 -0.37 0.18 0.09 0.00 0.00 178.44 177.71 3h1i n LEU 113 N -4.55 -0.60 -0.05 1.67 4.77 -0.97 0.11 117.00 117.37 3h1i n LEU 113 Ca -0.02 1.73 0.04 0.00 -0.03 0.00 0.00 56.01 57.73 3h1i n LEU 113 Cb 0.23 -0.42 0.39 0.00 -2.33 0.00 0.00 43.42 41.30 3h1i n LEU 113 CO 0.00 -1.57 1.18 0.00 -1.33 0.00 0.00 177.39 175.67 3h1i h ALA 114 N 1.47 1.68 0.00 -1.18 0.00 -0.05 -1.59 119.26 119.59 3h1i h ALA 114 Ca 0.37 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.24 3h1i h ALA 114 Cb 0.62 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.22 3h1i h ALA 114 CO -0.99 0.29 0.00 -3.47 0.00 0.00 0.00 179.25 175.07 3h1i n ASP 115 N -4.46 0.00 -0.13 0.00 2.03 0.30 -2.79 116.55 111.50 3h1i n ASP 115 Ca 0.05 -0.14 -0.21 0.00 0.52 0.00 0.00 54.79 55.02 3h1i n ASP 115 Cb 0.08 -0.27 -0.11 0.00 -0.72 0.00 0.00 41.12 40.10 3h1i n ASP 115 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 3h1i n VAL 116 N -1.27 1.42 -0.11 5.18 0.31 -0.63 -3.47 118.33 119.76 3h1i n VAL 116 Ca 0.13 -0.48 -0.04 0.00 -0.01 0.00 0.00 64.34 63.94 3h1i n VAL 116 Cb 0.21 -1.53 0.16 0.00 -0.91 0.00 0.00 33.84 31.77 3h1i n VAL 116 CO 0.00 0.00 0.00 -0.37 -1.32 0.00 0.00 176.83 175.14 3h1i h VAL 117 N -0.31 1.24 0.00 2.52 -1.51 -1.56 -3.32 116.25 113.31 3h1i h VAL 117 Ca -0.59 -1.01 0.00 0.00 -1.23 0.00 0.00 66.70 63.87 3h1i h VAL 117 Cb 1.76 0.89 0.00 0.00 -2.13 0.00 0.00 31.29 31.81 3h1i h VAL 117 CO -0.19 0.36 0.00 0.00 -1.23 0.00 0.00 177.57 176.51 3h1i n GLN 118 N -4.21 0.00 -2.11 5.19 6.02 -1.12 -4.73 117.38 116.42 3h1i n GLN 118 Ca 0.02 0.15 -0.41 0.00 -0.01 0.00 0.00 57.00 56.76 3h1i n GLN 118 Cb 0.30 -0.55 -0.00 0.00 1.02 0.00 0.00 30.24 31.01 3h1i n GLN 118 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 3h1i n ASN 119 N -1.84 7.34 -4.68 1.08 3.02 -1.23 -4.99 115.26 113.97 3h1i n ASN 119 Ca 0.00 -3.16 -0.42 0.00 -0.03 0.00 0.00 54.58 50.97 3h1i n ASN 119 Cb 0.00 -1.38 -0.03 0.00 -0.61 0.00 0.00 39.78 37.77 3h1i n ASN 119 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3h1i h ALA 121 N 7.51 -0.23 -5.90 0.00 0.00 -1.68 -3.44 119.26 115.51 3h1i h ALA 121 Ca -0.31 0.14 -0.42 0.00 0.00 0.00 0.00 54.91 54.32 3h1i h ALA 121 Cb 1.14 0.94 0.08 0.00 0.00 0.00 0.00 17.79 19.96 3h1i h ALA 121 CO 0.90 -0.78 -0.70 1.28 0.00 0.00 0.00 179.25 179.95 3h1i n LEU 122 N -5.41 -3.11 -4.67 0.00 4.77 -1.26 -4.85 117.00 102.47 3h1i n LEU 122 Ca 0.03 -0.59 -0.44 0.00 -0.03 0.00 0.00 56.01 54.98 3h1i n LEU 122 Cb 0.35 -2.89 -0.03 0.00 -2.33 0.00 0.00 43.42 38.52 3h1i n LEU 122 CO -0.03 0.58 1.55 1.21 -1.33 0.00 0.00 177.39 179.37 3h1i n GLU 123 N -4.86 2.68 0.00 3.23 4.07 -1.26 -4.81 120.64 119.68 3h1i n GLU 123 Ca 0.01 0.98 0.04 0.00 -0.06 0.00 0.00 57.16 58.13 3h1i n GLU 123 Cb 0.55 -2.90 0.18 0.00 -0.06 0.00 0.00 31.44 29.22 3h1i n GLU 123 CO 0.00 0.00 0.00 -1.91 -0.06 0.00 0.00 177.13 175.16 3h1i n GLU 124 N 6.93 0.10 0.08 5.31 2.13 -1.26 -0.35 120.64 133.58 3h1i n GLU 124 Ca 0.20 0.21 0.04 0.00 0.66 0.00 0.00 57.16 58.27 3h1i n GLU 124 Cb 0.37 -1.50 -0.03 0.00 0.27 0.00 0.00 31.44 30.55 3h1i n GLU 124 CO 0.00 0.00 0.00 0.77 -0.41 0.00 0.00 177.13 177.49 3h1i h SER 125 N 0.00 0.00 0.75 4.31 0.02 -2.02 -3.30 113.55 113.31 3h1i h SER 125 Ca 0.00 0.00 -0.25 0.00 -0.84 0.00 0.00 61.79 60.70 3h1i h SER 125 Cb 0.07 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.58 3h1i h SER 125 CO 0.00 0.40 -1.27 -0.61 -1.14 0.00 0.00 176.83 174.21 3h1i h GLN 126 N 0.00 0.08 0.30 3.45 5.75 -1.06 -3.38 115.11 120.25 3h1i h GLN 126 Ca -0.08 -0.14 -0.01 0.00 -0.15 0.00 0.00 58.65 58.26 3h1i h GLN 126 Cb 1.38 0.05 0.00 0.00 1.07 0.00 0.00 27.48 29.99 3h1i h GLN 126 CO 0.04 0.95 -0.14 0.82 -2.65 0.00 0.00 178.83 177.84 3h1i h ILE 127 N 0.02 0.73 0.00 2.39 2.04 -1.54 -0.85 117.51 120.30 3h1i h ILE 127 Ca -0.12 -0.50 0.00 0.00 1.00 0.00 0.00 64.86 65.24 3h1i h ILE 127 Cb 1.89 0.99 0.00 0.00 -0.74 0.00 0.00 36.82 38.96 3h1i h ILE 127 CO 0.13 0.10 0.00 -0.62 0.00 0.00 0.00 178.15 177.77 3h1i n GLU 128 N -5.15 0.07 -0.13 2.37 -0.58 -1.25 -0.36 120.64 115.61 3h1i n GLU 128 Ca -0.10 0.12 -0.28 0.00 -0.42 0.00 0.00 57.16 56.48 3h1i n GLU 128 Cb 0.25 -1.50 -0.09 0.00 -0.57 0.00 0.00 31.44 29.53 3h1i n GLU 128 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 3h1i n LYS 129 N -1.13 0.56 0.02 3.49 4.81 -1.10 -4.12 118.16 120.70 3h1i n LYS 129 Ca 0.02 0.25 0.02 0.00 -0.87 0.00 0.00 58.31 57.73 3h1i n LYS 129 Cb 0.01 -1.44 0.12 0.00 0.02 0.00 0.00 35.03 33.74 3h1i n LYS 129 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 3h1i n GLU 130 N -4.19 0.02 0.17 1.64 -0.58 -0.34 -2.05 120.64 115.31 3h1i n GLU 130 Ca -0.52 0.48 -0.08 0.00 -0.42 0.00 0.00 57.16 56.62 3h1i n GLU 130 Cb 0.87 -1.56 -0.04 0.00 -0.57 0.00 0.00 31.44 30.14 3h1i n GLU 130 CO 0.00 0.00 0.00 -0.09 -0.48 0.00 0.00 177.13 176.56 3h1i h ARG 131 N 0.00 -0.50 0.00 3.49 2.43 -0.85 -2.56 114.38 116.39 3h1i h ARG 131 Ca 0.00 0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.19 3h1i h ARG 131 Cb 0.04 0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.70 3h1i h ARG 131 CO 0.00 -0.33 -0.06 0.78 -1.51 0.00 0.00 179.97 178.85 3h1i h GLY 132 N -1.14 0.00 0.69 2.80 0.00 -1.58 -2.52 103.07 101.32 3h1i h GLY 132 Ca -0.05 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.22 3h1i h GLY 132 CO 0.09 0.00 -0.15 -2.08 0.00 0.00 0.00 176.54 174.40 3h1i h VAL 133 N 0.00 1.37 -0.08 4.60 2.07 -1.48 -2.39 116.25 120.34 3h1i h VAL 133 Ca -0.00 -1.35 -0.01 0.00 0.82 0.00 0.00 66.70 66.16 3h1i h VAL 133 Cb 0.14 2.00 -0.00 0.00 -1.52 0.00 0.00 31.29 31.91 3h1i h VAL 133 CO 0.01 0.39 0.00 0.40 0.02 0.00 0.00 177.57 178.39 3h1i h ILE 134 N -0.11 1.24 -1.20 4.57 2.04 -1.34 -0.61 117.51 122.10 3h1i h ILE 134 Ca 0.01 -0.74 0.35 0.00 1.00 0.00 0.00 64.86 65.48 3h1i h ILE 134 Cb 0.69 1.59 -0.05 0.00 -0.74 0.00 0.00 36.82 38.31 3h1i h ILE 134 CO 0.03 0.21 0.94 -0.07 0.00 0.00 0.00 178.15 179.27 3h1i h LEU 135 N -0.13 0.00 0.00 1.44 3.38 -1.47 0.35 115.31 118.88 3h1i h LEU 135 Ca 0.02 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 3h1i h LEU 135 Cb 0.32 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 3h1i h LEU 135 CO 0.00 0.00 -0.26 -0.61 0.09 0.00 0.00 178.44 177.67 3h1i h GLN 136 N 0.00 0.00 0.00 1.13 5.75 -0.87 -2.98 115.11 118.14 3h1i h GLN 136 Ca 0.57 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 59.07 3h1i h GLN 136 Cb 2.45 0.00 0.00 0.00 1.07 0.00 0.00 27.48 31.00 3h1i h GLN 136 CO -0.01 0.76 0.29 0.39 -2.65 0.00 0.00 178.83 177.62 3h1i n GLU 137 N -4.61 0.06 -0.07 1.69 1.02 0.11 0.34 120.64 119.18 3h1i n GLU 137 Ca -0.12 0.49 -0.22 0.00 -0.02 0.00 0.00 57.16 57.29 3h1i n GLU 137 Cb 0.42 -2.00 -0.12 0.00 -0.02 0.00 0.00 31.44 29.71 3h1i n GLU 137 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 3h1i n LEU 138 N -1.84 2.21 0.08 -4.62 4.77 -0.29 -1.90 117.00 115.40 3h1i n LEU 138 Ca -0.01 0.30 0.20 0.00 -0.03 0.00 0.00 56.01 56.48 3h1i n LEU 138 Cb 0.31 -1.00 0.75 0.00 -2.33 0.00 0.00 43.42 41.15 3h1i n LEU 138 CO 0.04 0.55 1.18 0.11 -1.33 0.00 0.00 177.39 177.95 3h1i h LYS 139 N -0.58 0.00 0.00 3.23 1.79 0.04 -0.48 116.57 120.58 3h1i h LYS 139 Ca -0.44 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.03 3h1i h LYS 139 Cb 1.63 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.28 3h1i h LYS 139 CO -0.13 0.00 -0.05 0.93 -1.08 0.00 0.00 179.45 179.12 3h1i h GLU 140 N 0.00 0.00 -0.26 3.15 5.08 -1.25 -3.36 114.58 117.94 3h1i h GLU 140 Ca 0.20 0.00 0.08 0.00 -1.00 0.00 0.00 59.36 58.64 3h1i h GLU 140 Cb 1.02 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.26 3h1i h GLU 140 CO -0.00 0.00 0.76 0.52 -1.00 0.00 0.00 179.01 179.29 3h1i h MET 141 N -0.36 0.00 0.00 2.33 2.86 -0.98 0.32 114.93 119.10 3h1i h MET 141 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3h1i h MET 141 Cb 0.05 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.71 3h1i h MET 141 CO 0.00 0.00 0.00 -3.47 1.06 0.00 0.00 176.91 174.50 3h1i n ASP 142 N -2.94 0.00 -0.60 1.22 2.03 -0.22 -2.47 116.55 113.57 3h1i n ASP 142 Ca 0.05 -0.69 0.05 0.00 0.52 0.00 0.00 54.79 54.73 3h1i n ASP 142 Cb 0.86 -0.06 0.14 0.00 -0.72 0.00 0.00 41.12 41.33 3h1i n ASP 142 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 3h1i n ASN 143 N -1.06 2.82 -4.31 1.67 3.02 0.11 -4.75 115.26 112.76 3h1i n ASN 143 Ca 0.19 -1.97 -0.44 0.00 -0.03 0.00 0.00 54.58 52.33 3h1i n ASN 143 Cb 0.12 -0.21 -0.01 0.00 -0.61 0.00 0.00 39.78 39.07 3h1i n ASN 143 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3h1i s ASP 144 N -0.99 7.03 0.11 6.41 -1.08 -1.03 -4.93 116.67 122.19 3h1i s ASP 144 Ca 0.21 -3.42 -0.22 0.00 -0.52 0.00 0.00 52.55 48.60 3h1i s ASP 144 Cb 0.11 -2.17 -0.05 0.00 -1.46 0.00 0.00 42.92 39.35 3h1i s ASP 144 CO 0.15 -0.33 1.13 0.23 0.52 0.00 0.00 175.17 176.87 3h1i n MET 145 N 2.93 -0.31 -0.35 4.34 2.81 -1.26 -0.28 117.12 124.99 3h1i n MET 145 Ca 0.21 1.11 -0.01 0.00 -1.81 0.00 0.00 57.70 57.20 3h1i n MET 145 Cb 0.40 -1.63 0.04 0.00 -0.71 0.00 0.00 33.22 31.32 3h1i n MET 145 CO 0.00 0.00 0.00 2.41 1.51 0.00 0.00 175.97 179.89 3h1i n THR 146 N -4.83 -0.48 0.30 2.03 -1.04 -1.26 -0.13 114.28 108.88 3h1i n THR 146 Ca 0.01 2.11 -0.12 0.00 -2.04 0.00 0.00 64.05 64.02 3h1i n THR 146 Cb 0.19 -2.79 -0.06 0.00 -1.82 0.00 0.00 70.33 65.85 3h1i n THR 146 CO 0.00 0.00 0.00 0.78 -0.64 0.00 0.00 175.07 175.21 3h1i h ASN 147 N 0.00 -0.66 -1.22 8.00 2.35 -0.99 -2.64 115.58 120.41 3h1i h ASN 147 Ca 0.31 0.02 0.42 0.00 -0.55 0.00 0.00 56.30 56.51 3h1i h ASN 147 Cb 0.54 0.17 -0.12 0.00 0.05 0.00 0.00 38.32 38.96 3h1i h ASN 147 CO -0.90 -0.40 0.79 0.52 -1.65 0.00 0.00 177.43 175.80 3h1i n VAL 148 N -4.52 -0.21 0.25 2.81 0.31 -0.55 0.16 118.33 116.58 3h1i n VAL 148 Ca -0.10 1.56 -0.10 0.00 -0.01 0.00 0.00 64.34 65.68 3h1i n VAL 148 Cb 0.31 -2.55 -0.05 0.00 -0.91 0.00 0.00 33.84 30.64 3h1i n VAL 148 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 3h1i h THR 149 N 0.00 0.00 -1.00 2.52 2.02 -0.27 -2.38 112.91 113.80 3h1i h THR 149 Ca 0.77 -0.31 0.16 0.00 0.77 0.00 0.00 66.41 67.79 3h1i h THR 149 Cb 2.51 0.00 -0.09 0.00 -1.74 0.00 0.00 68.15 68.82 3h1i h THR 149 CO -0.39 0.00 0.62 -0.26 0.37 0.00 0.00 175.52 175.86 3h1i h PHE 150 N -0.99 1.09 -0.12 3.16 -1.00 0.06 0.76 116.94 119.91 3h1i h PHE 150 Ca -0.07 0.03 -0.01 0.00 2.81 0.00 0.00 57.97 60.74 3h1i h PHE 150 Cb 0.52 -0.34 -0.01 0.00 3.61 0.00 0.00 35.95 39.74 3h1i h PHE 150 CO 0.03 0.34 0.05 -0.44 -1.61 0.00 0.00 178.31 176.68 3h1i h ASP 151 N 0.87 0.16 -0.64 2.17 3.32 -1.39 0.41 116.42 121.31 3h1i h ASP 151 Ca 0.54 -0.15 0.04 0.00 0.02 0.00 0.00 57.03 57.47 3h1i h ASP 151 Cb 0.71 -0.04 -0.05 0.00 0.22 0.00 0.00 39.33 40.17 3h1i h ASP 151 CO -0.32 0.27 0.38 1.88 -1.72 0.00 0.00 179.24 179.73 3h1i h TYR 152 N 0.04 0.71 0.05 4.55 0.99 -0.53 1.35 116.97 124.13 3h1i h TYR 152 Ca 0.04 0.02 0.02 0.00 2.00 0.00 0.00 58.73 60.81 3h1i h TYR 152 Cb 0.15 -0.23 -0.02 0.00 1.00 0.00 0.00 36.73 37.63 3h1i h TYR 152 CO -0.02 0.38 -0.14 1.25 -0.00 0.00 0.00 178.16 179.64 3h1i h LEU 153 N 0.74 -0.38 -0.10 3.88 5.85 0.84 -1.92 115.31 124.21 3h1i h LEU 153 Ca 0.27 0.05 0.03 0.00 0.84 0.00 0.00 57.88 59.07 3h1i h LEU 153 Cb 0.08 0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.24 3h1i h LEU 153 CO -0.13 -0.20 -0.06 0.45 -0.34 0.00 0.00 178.44 178.16 3h1i h HIS 154 N -0.26 -0.15 0.00 1.25 3.86 0.68 0.84 115.15 121.38 3h1i h HIS 154 Ca 0.03 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.25 3h1i h HIS 154 Cb 0.29 0.08 0.00 0.00 1.06 0.00 0.00 27.41 28.84 3h1i h HIS 154 CO -0.17 -0.10 0.21 0.00 0.86 0.00 0.00 177.93 178.73 3h1i n ALA 155 N -2.34 0.72 0.00 2.45 0.00 0.45 -0.27 120.51 121.53 3h1i n ALA 155 Ca -0.04 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.52 3h1i n ALA 155 Cb 0.12 -0.88 0.00 0.00 0.00 0.00 0.00 19.45 18.69 3h1i n ALA 155 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 3h1i n THR 156 N -1.98 0.00 -0.24 0.00 5.66 -0.77 -3.71 114.28 113.24 3h1i n THR 156 Ca -0.01 0.00 -0.07 0.00 -3.05 0.00 0.00 64.05 60.93 3h1i n THR 156 Cb 0.23 -0.88 0.04 0.00 -1.55 0.00 0.00 70.33 68.18 3h1i n THR 156 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3h1i h ALA 157 N 0.00 0.86 -0.02 1.79 0.00 0.14 -3.16 119.26 118.88 3h1i h ALA 157 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 3h1i h ALA 157 Cb 0.95 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.47 3h1i h ALA 157 CO 0.00 0.45 0.00 1.19 0.00 0.00 0.00 179.25 180.89 3h1i n PHE 158 N -4.44 0.00 0.00 0.00 3.01 0.63 -1.40 117.46 115.26 3h1i n PHE 158 Ca 0.05 -0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.51 3h1i n PHE 158 Cb 0.15 -0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.62 3h1i n PHE 158 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3h1i n GLN 159 N 0.71 0.00 0.00 -1.08 10.64 -1.19 -2.40 117.38 124.06 3h1i n GLN 159 Ca 0.07 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.24 3h1i n GLN 159 Cb 0.32 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.70 3h1i n GLN 159 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 3h1i n GLY 160 N 0.00 1.62 2.44 2.61 0.00 -1.26 -4.82 105.19 105.78 3h1i n GLY 160 Ca 0.00 -0.07 -0.15 0.00 0.00 0.00 0.00 46.02 45.80 3h1i n GLY 160 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3h1i n THR 161 N 0.00 0.00 -0.03 2.61 -2.24 -1.01 -5.04 114.28 108.57 3h1i n THR 161 Ca 0.00 -0.91 -0.13 0.00 -2.27 0.00 0.00 64.05 60.74 3h1i n THR 161 Cb 0.00 -1.21 -0.09 0.00 -2.10 0.00 0.00 70.33 66.93 3h1i n THR 161 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h1i h ALA 162 N -0.85 0.10 -1.33 6.98 0.00 -1.89 -3.21 119.26 119.08 3h1i h ALA 162 Ca -0.22 -0.29 0.42 0.00 0.00 0.00 0.00 54.91 54.81 3h1i h ALA 162 Cb 0.77 -0.02 -0.11 0.00 0.00 0.00 0.00 17.79 18.42 3h1i h ALA 162 CO 0.22 -0.07 0.88 -0.07 0.00 0.00 0.00 179.25 180.20 3h1i h LEU 163 N -0.26 0.23 -0.43 0.00 3.38 -1.90 0.12 115.31 116.45 3h1i h LEU 163 Ca 0.01 0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.09 3h1i h LEU 163 Cb 0.60 0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.44 3h1i h LEU 163 CO 0.02 -0.12 0.00 0.00 0.09 0.00 0.00 178.44 178.43 3h1i n ALA 164 N -2.56 1.60 -2.78 1.53 0.00 -1.21 -4.77 120.51 112.32 3h1i n ALA 164 Ca 0.35 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.47 3h1i n ALA 164 Cb 1.40 -1.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.78 3h1i n ALA 164 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3h1i s ARG 165 N -1.57 3.02 -0.03 0.00 0.52 0.41 -4.25 118.95 117.06 3h1i s ARG 165 Ca 0.00 -0.55 -0.30 0.00 -0.52 0.00 0.00 55.73 54.36 3h1i s ARG 165 Cb 0.00 -2.82 -0.04 0.00 0.52 0.00 0.00 34.95 32.61 3h1i s ARG 165 CO 0.00 0.62 1.20 0.95 0.02 0.00 0.00 175.30 178.09 3h1i s THR 166 N -1.26 4.21 0.61 0.02 -4.23 -1.26 -4.89 115.64 108.84 3h1i s THR 166 Ca 0.25 1.55 0.29 0.00 -1.18 0.00 0.00 61.69 62.61 3h1i s THR 166 Cb -0.12 -4.00 0.36 0.00 1.34 0.00 0.00 72.50 70.08 3h1i s THR 166 CO 0.17 0.03 1.94 0.58 -0.54 0.00 0.00 174.62 176.80 3h1i h VAL 167 N 4.90 0.28 0.00 2.29 2.07 -1.92 0.49 116.25 124.37 3h1i h VAL 167 Ca -0.36 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.16 3h1i h VAL 167 Cb 1.17 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 31.62 3h1i h VAL 167 CO 0.86 0.00 -0.50 -0.33 0.02 0.00 0.00 177.57 177.62 3h1i h GLU 168 N 0.00 0.00 -1.66 1.57 3.07 -1.90 -3.41 114.58 112.25 3h1i h GLU 168 Ca 0.13 0.00 0.18 0.00 -0.50 0.00 0.00 59.36 59.17 3h1i h GLU 168 Cb 0.90 0.00 -0.07 0.00 -0.84 0.00 0.00 28.75 28.74 3h1i h GLU 168 CO -0.00 0.00 -0.47 0.41 -1.40 0.00 0.00 179.01 177.55 3h1i n GLY 169 N 1.29 -2.40 3.24 -3.84 0.00 0.17 -4.52 105.19 99.14 3h1i n GLY 169 Ca 0.03 -1.30 -0.33 0.00 0.00 0.00 0.00 46.02 44.42 3h1i n GLY 169 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3h1i n THR 170 N -3.35 0.00 0.08 2.61 -1.04 -1.26 -4.89 114.28 106.42 3h1i n THR 170 Ca -0.02 -0.25 -0.17 0.00 -2.04 0.00 0.00 64.05 61.57 3h1i n THR 170 Cb 0.33 -0.51 -0.14 0.00 -1.82 0.00 0.00 70.33 68.19 3h1i n THR 170 CO 0.00 0.00 0.00 0.74 -0.64 0.00 0.00 175.07 175.17 3h1i h THR 171 N -1.85 1.28 -0.00 12.58 2.02 -1.96 -3.23 112.91 121.74 3h1i h THR 171 Ca -0.51 -2.89 -0.00 0.00 0.77 0.00 0.00 66.41 63.79 3h1i h THR 171 Cb 1.36 2.83 -0.00 0.00 -1.74 0.00 0.00 68.15 70.60 3h1i h THR 171 CO 0.35 0.84 -0.00 -0.33 0.37 0.00 0.00 175.52 176.75 3h1i h GLU 172 N 0.07 0.00 -0.91 6.66 4.39 -1.97 -1.55 114.58 121.27 3h1i h GLU 172 Ca -0.21 -0.00 0.10 0.00 0.34 0.00 0.00 59.36 59.60 3h1i h GLU 172 Cb 2.01 -0.00 -0.08 0.00 -0.10 0.00 0.00 28.75 30.58 3h1i h GLU 172 CO 0.18 0.43 0.55 -0.91 -1.16 0.00 0.00 179.01 178.10 3h1i h ASN 173 N -0.43 0.79 0.73 1.42 4.21 -1.87 0.98 115.58 121.42 3h1i h ASN 173 Ca 0.00 0.05 -0.08 0.00 1.21 0.00 0.00 56.30 57.47 3h1i h ASN 173 Cb 0.43 -0.11 -0.01 0.00 -1.12 0.00 0.00 38.32 37.51 3h1i h ASN 173 CO 0.00 0.44 -0.40 0.40 -1.29 0.00 0.00 177.43 176.58 3h1i h ILE 174 N 0.89 0.99 0.00 2.81 2.04 -1.57 0.81 117.51 123.49 3h1i h ILE 174 Ca 0.44 -1.53 -0.10 0.00 1.00 0.00 0.00 64.86 64.67 3h1i h ILE 174 Cb 0.41 1.90 -0.01 0.00 -0.74 0.00 0.00 36.82 38.38 3h1i h ILE 174 CO -0.25 0.39 -0.49 0.11 0.00 0.00 0.00 178.15 177.90 3h1i h LYS 175 N 0.00 0.00 0.00 2.37 1.57 0.11 -3.39 116.57 117.24 3h1i h LYS 175 Ca -0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 3h1i h LYS 175 Cb 0.87 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.18 3h1i h LYS 175 CO 0.05 0.49 -1.13 0.72 -0.57 0.00 0.00 179.45 179.01 3h1i n HIS 176 N -3.28 0.00 -1.10 -1.35 8.25 0.29 -5.06 115.22 112.96 3h1i n HIS 176 Ca 0.01 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.06 3h1i n HIS 176 Cb 0.70 -0.08 -0.05 0.00 1.12 0.00 0.00 29.99 31.68 3h1i n HIS 176 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3h1i n LEU 177 N -1.72 -0.35 -4.76 2.41 4.77 0.28 -4.92 117.00 112.70 3h1i n LEU 177 Ca -0.01 0.87 -0.29 0.00 -0.03 0.00 0.00 56.01 56.54 3h1i n LEU 177 Cb 0.20 -0.70 -0.06 0.00 -2.33 0.00 0.00 43.42 40.53 3h1i n LEU 177 CO 0.05 -1.74 -0.26 -0.89 -1.33 0.00 0.00 177.39 173.22 3h1i s THR 178 N -0.28 4.39 0.34 -5.08 2.01 -1.26 -4.99 115.64 110.77 3h1i s THR 178 Ca 0.61 -0.94 0.11 0.00 0.31 0.00 0.00 61.69 61.79 3h1i s THR 178 Cb -0.86 -3.16 0.39 0.00 0.01 0.00 0.00 72.50 68.88 3h1i s THR 178 CO 0.43 0.04 1.57 -1.14 -0.69 0.00 0.00 174.62 174.83 3h1i n ARG 179 N 0.19 -0.07 0.03 4.92 0.63 -1.26 -1.15 116.66 119.95 3h1i n ARG 179 Ca -0.09 1.44 -0.01 0.00 -0.92 0.00 0.00 57.85 58.27 3h1i n ARG 179 Cb 0.53 -2.43 -0.01 0.00 0.45 0.00 0.00 32.46 31.00 3h1i n ARG 179 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3h1i h ALA 180 N 2.00 -0.91 -1.18 5.13 0.00 -1.98 -1.59 119.26 120.72 3h1i h ALA 180 Ca 0.73 -0.02 0.43 0.00 0.00 0.00 0.00 54.91 56.05 3h1i h ALA 180 Cb 1.75 0.15 -0.14 0.00 0.00 0.00 0.00 17.79 19.54 3h1i h ALA 180 CO -0.86 -0.91 0.73 -0.25 0.00 0.00 0.00 179.25 177.97 3h1i n ASP 181 N -2.34 0.24 0.07 0.00 9.92 -0.30 0.24 116.55 124.38 3h1i n ASP 181 Ca -0.01 1.38 -0.21 0.00 -0.53 0.00 0.00 54.79 55.42 3h1i n ASP 181 Cb 0.03 -0.68 -0.13 0.00 -0.64 0.00 0.00 41.12 39.70 3h1i n ASP 181 CO 0.00 0.00 0.00 -0.07 0.13 0.00 0.00 177.20 177.26 3h1i h LEU 182 N 0.00 0.72 -0.28 0.64 3.38 -1.48 -0.99 115.31 117.30 3h1i h LEU 182 Ca 0.82 -0.85 0.06 0.00 0.09 0.00 0.00 57.88 58.00 3h1i h LEU 182 Cb 2.49 -0.23 -0.08 0.00 0.09 0.00 0.00 40.66 42.94 3h1i h LEU 182 CO -0.52 1.50 -0.35 0.00 0.09 0.00 0.00 178.44 179.16 3h1i h ALA 183 N 0.23 -0.33 -0.28 1.53 0.00 0.41 -0.74 119.26 120.08 3h1i h ALA 183 Ca -0.16 0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.85 3h1i h ALA 183 Cb 1.77 0.71 -0.04 0.00 0.00 0.00 0.00 17.79 20.23 3h1i h ALA 183 CO 0.20 -0.79 0.01 0.66 0.00 0.00 0.00 179.25 179.33 3h1i h SER 184 N -0.34 -0.08 -0.73 0.00 4.64 -0.30 -2.02 113.55 114.73 3h1i h SER 184 Ca 0.13 0.06 0.16 0.00 -0.47 0.00 0.00 61.79 61.67 3h1i h SER 184 Cb 0.56 0.10 -0.11 0.00 -0.31 0.00 0.00 62.40 62.63 3h1i h SER 184 CO -0.47 -0.01 0.14 0.22 -0.87 0.00 0.00 176.83 175.85 3h1i h TYR 185 N 0.10 0.21 0.15 4.77 3.20 -0.12 0.75 116.97 126.03 3h1i h TYR 185 Ca 0.13 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 62.04 3h1i h TYR 185 Cb 0.16 0.02 -0.00 0.00 1.54 0.00 0.00 36.73 38.45 3h1i h TYR 185 CO -0.20 -0.12 -0.08 0.82 -1.64 0.00 0.00 178.16 176.94 3h1i h ILE 186 N 0.23 0.83 0.81 1.81 2.04 -0.47 0.53 117.51 123.28 3h1i h ILE 186 Ca 0.41 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 66.23 3h1i h ILE 186 Cb 0.71 0.83 0.01 0.00 -0.74 0.00 0.00 36.82 37.62 3h1i h ILE 186 CO -0.53 0.00 -0.39 0.44 0.00 0.00 0.00 178.15 177.67 3h1i h ASP 187 N -0.22 -0.92 -0.71 1.72 3.32 -0.73 0.56 116.42 119.45 3h1i h ASP 187 Ca -0.02 0.02 0.16 0.00 0.02 0.00 0.00 57.03 57.21 3h1i h ASP 187 Cb 0.18 0.24 -0.12 0.00 0.22 0.00 0.00 39.33 39.85 3h1i h ASP 187 CO 0.02 -0.57 0.08 0.74 -1.72 0.00 0.00 179.24 177.79 3h1i h THR 188 N -1.25 0.45 0.00 0.35 2.02 0.44 -3.35 112.91 111.58 3h1i h THR 188 Ca -0.11 -0.06 -0.42 0.00 0.77 0.00 0.00 66.41 66.59 3h1i h THR 188 Cb 0.84 0.26 -0.06 0.00 -1.74 0.00 0.00 68.15 67.45 3h1i h THR 188 CO 0.18 0.03 -2.42 1.41 0.37 0.00 0.00 175.52 175.09 3h1i n HIS 189 N -5.25 0.00 -1.77 3.16 8.25 0.17 -4.81 115.22 114.97 3h1i n HIS 189 Ca 0.13 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.33 3h1i n HIS 189 Cb 0.44 -0.92 -0.08 0.00 1.12 0.00 0.00 29.99 30.55 3h1i n HIS 189 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 3h1i n PHE 190 N -4.03 2.00 -4.71 4.41 0.99 0.20 -4.89 117.46 111.43 3h1i n PHE 190 Ca -0.49 -1.07 -0.25 0.00 -0.00 0.00 0.00 57.45 55.64 3h1i n PHE 190 Cb 0.87 -2.45 -0.16 0.00 -1.00 0.00 0.00 39.48 36.73 3h1i n PHE 190 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.76 176.91 3h1i s LYS 191 N 6.98 1.57 0.10 -1.08 1.02 -1.26 -4.77 119.74 122.30 3h1i s LYS 191 Ca 0.71 -0.52 -0.09 0.00 0.02 0.00 0.00 55.97 56.10 3h1i s LYS 191 Cb 0.00 -1.38 0.08 0.00 -0.52 0.00 0.00 37.83 36.01 3h1i s LYS 191 CO 0.16 0.19 0.69 0.00 -0.92 0.00 0.00 175.35 175.48 3h1i n ALA 192 N 3.23 -0.10 0.15 5.17 0.00 -1.26 -0.63 120.51 127.07 3h1i n ALA 192 Ca -0.18 0.43 0.15 0.00 0.00 0.00 0.00 53.44 53.83 3h1i n ALA 192 Cb 0.53 -0.17 0.71 0.00 0.00 0.00 0.00 19.45 20.52 3h1i n ALA 192 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 3h1i h PRO 193 N 0.00 0.00 -0.00 0.00 0.13 -1.75 -0.43 132.00 129.95 3h1i h PRO 193 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 3h1i h PRO 193 Cb 0.25 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.38 3h1i h PRO 193 CO -0.44 0.00 -0.63 0.54 -0.23 0.00 0.00 178.00 177.24 3h1i n ARG 194 N -4.29 0.40 -3.76 0.86 1.74 0.20 -4.69 116.66 107.12 3h1i n ARG 194 Ca 0.03 -0.30 -0.29 0.00 -0.77 0.00 0.00 57.85 56.52 3h1i n ARG 194 Cb 0.34 -1.49 -0.04 0.00 -1.02 0.00 0.00 32.46 30.25 3h1i n ARG 194 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 3h1i s MET 195 N -2.80 3.52 -0.04 5.56 -1.94 -0.27 -1.90 119.30 121.43 3h1i s MET 195 Ca 0.14 -0.32 -0.02 0.00 -1.71 0.00 0.00 55.69 53.78 3h1i s MET 195 Cb 0.17 -2.90 0.03 0.00 2.01 0.00 0.00 34.83 34.15 3h1i s MET 195 CO 0.70 0.47 0.07 0.08 -0.01 0.00 0.00 175.02 176.33 3h1i s VAL 196 N -1.72 -0.11 -0.40 -6.03 1.01 -1.22 -2.85 120.40 109.07 3h1i s VAL 196 Ca 0.38 0.36 -0.19 0.00 0.00 0.00 0.00 61.98 62.54 3h1i s VAL 196 Cb -0.12 -0.15 0.01 0.00 0.00 0.00 0.00 36.38 36.12 3h1i s VAL 196 CO 0.28 0.15 0.52 -0.22 0.00 0.00 0.00 175.10 175.83 3h1i s LEU 197 N 1.89 4.55 0.11 3.92 2.96 -0.25 0.71 118.68 132.57 3h1i s LEU 197 Ca 0.01 -0.32 0.09 0.00 -0.22 0.00 0.00 54.13 53.69 3h1i s LEU 197 Cb -0.12 -2.56 -0.04 0.00 0.50 0.00 0.00 46.19 43.97 3h1i s LEU 197 CO -0.03 -0.59 -0.21 0.00 -1.32 0.00 0.00 176.35 174.19 3h1i s ALA 198 N 2.43 2.58 -0.11 5.97 0.00 -0.01 -0.76 121.76 131.86 3h1i s ALA 198 Ca 0.18 -1.37 -0.18 0.00 0.00 0.00 0.00 51.96 50.59 3h1i s ALA 198 Cb -0.16 -0.57 0.04 0.00 0.00 0.00 0.00 23.12 22.43 3h1i s ALA 198 CO 0.15 0.58 0.45 0.00 0.00 0.00 0.00 175.76 176.93 3h1i s ALA 199 N -1.10 -1.13 -0.01 0.00 0.00 -0.90 -0.88 121.76 117.75 3h1i s ALA 199 Ca 0.16 1.04 -0.03 0.00 0.00 0.00 0.00 51.96 53.13 3h1i s ALA 199 Cb -0.10 -0.44 -0.00 0.00 0.00 0.00 0.00 23.12 22.58 3h1i s ALA 199 CO 0.08 -0.25 0.07 0.00 0.00 0.00 0.00 175.76 175.66 3h1i s ALA 200 N -0.36 -0.16 0.00 0.00 0.00 0.02 -1.42 121.76 119.83 3h1i s ALA 200 Ca -0.05 -0.07 0.00 0.00 0.00 0.00 0.00 51.96 51.84 3h1i s ALA 200 Cb -0.03 -0.00 0.00 0.00 0.00 0.00 0.00 23.12 23.09 3h1i s ALA 200 CO 0.03 -0.11 0.00 0.41 0.00 0.00 0.00 175.76 176.08 3h1i n GLY 201 N 2.26 0.49 3.50 0.00 0.00 -1.02 -1.57 105.19 108.85 3h1i n GLY 201 Ca -0.18 -1.83 -0.43 0.00 0.00 0.00 0.00 46.02 43.58 3h1i n GLY 201 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3h1i s GLY 202 N 0.00 1.75 -0.14 -0.02 0.00 0.99 -0.44 107.32 109.46 3h1i s GLY 202 Ca 0.00 -2.69 -0.09 0.00 0.00 0.00 0.00 44.72 41.94 3h1i s GLY 202 CO 0.00 2.29 0.34 -0.42 0.00 0.00 0.00 173.10 175.31 3h1i s ILE 203 N 3.41 -0.02 -0.23 0.90 1.01 -1.26 -4.67 121.20 120.33 3h1i s ILE 203 Ca 0.40 0.08 -0.29 0.00 0.00 0.00 0.00 60.65 60.83 3h1i s ILE 203 Cb -0.02 -0.50 0.01 0.00 0.01 0.00 0.00 42.46 41.95 3h1i s ILE 203 CO -0.07 0.03 1.10 -0.55 0.00 0.00 0.00 174.94 175.45 3h1i s SER 204 N 0.94 7.03 0.25 3.58 0.15 -1.26 -4.54 113.70 119.84 3h1i s SER 204 Ca -0.06 1.40 -0.08 0.00 0.70 0.00 0.00 55.95 57.91 3h1i s SER 204 Cb -0.07 -2.54 0.42 0.00 -1.71 0.00 0.00 66.02 62.12 3h1i s SER 204 CO -0.07 -0.73 1.62 -0.74 1.20 0.00 0.00 173.24 174.52 3h1i h HIS 205 N 7.74 -0.19 0.00 3.44 2.76 -1.99 -1.52 115.15 125.39 3h1i h HIS 205 Ca -0.21 0.06 0.00 0.00 -2.20 0.00 0.00 60.37 58.02 3h1i h HIS 205 Cb 1.07 0.21 0.00 0.00 1.55 0.00 0.00 27.41 30.24 3h1i h HIS 205 CO 0.77 -0.29 0.00 1.17 -1.30 0.00 0.00 177.93 178.28 3h1i n LYS 206 N -5.42 0.00 -0.18 5.26 4.81 -1.26 -1.30 118.16 120.07 3h1i n LYS 206 Ca 0.13 0.04 0.16 0.00 -0.87 0.00 0.00 58.31 57.77 3h1i n LYS 206 Cb 0.46 -0.58 0.27 0.00 0.02 0.00 0.00 35.03 35.20 3h1i n LYS 206 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 3h1i n GLU 207 N -0.12 -0.02 0.14 1.64 1.02 -1.08 0.79 120.64 123.01 3h1i n GLU 207 Ca 0.00 0.51 -0.06 0.00 -0.02 0.00 0.00 57.16 57.59 3h1i n GLU 207 Cb 0.00 -0.99 -0.03 0.00 -0.02 0.00 0.00 31.44 30.41 3h1i n GLU 207 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 3h1i h LEU 208 N 0.00 -0.31 -1.54 -4.62 5.85 -0.61 -2.56 115.31 111.52 3h1i h LEU 208 Ca 0.35 0.01 0.41 0.00 0.84 0.00 0.00 57.88 59.49 3h1i h LEU 208 Cb 1.10 0.08 -0.11 0.00 0.37 0.00 0.00 40.66 42.10 3h1i h LEU 208 CO -0.20 -0.18 0.89 1.62 -0.34 0.00 0.00 178.44 180.22 3h1i h VAL 209 N -0.44 0.21 0.65 1.05 3.04 0.17 -0.75 116.25 120.18 3h1i h VAL 209 Ca -0.04 -0.04 -0.03 0.00 -1.01 0.00 0.00 66.70 65.58 3h1i h VAL 209 Cb 0.28 0.08 0.01 0.00 -2.01 0.00 0.00 31.29 29.65 3h1i h VAL 209 CO 0.06 0.02 -0.31 0.44 -1.01 0.00 0.00 177.57 176.77 3h1i h ASP 210 N 0.12 -0.73 -0.04 3.17 3.32 -1.33 0.10 116.42 121.02 3h1i h ASP 210 Ca 0.77 0.03 0.01 0.00 0.02 0.00 0.00 57.03 57.85 3h1i h ASP 210 Cb 2.50 0.19 -0.00 0.00 0.22 0.00 0.00 39.33 42.24 3h1i h ASP 210 CO -0.30 -0.45 0.26 0.00 -1.72 0.00 0.00 179.24 177.03 3h1i h ALA 211 N -1.45 1.35 0.18 3.45 0.00 -0.78 0.14 119.26 122.15 3h1i h ALA 211 Ca -0.09 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 3h1i h ALA 211 Cb 0.66 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.46 3h1i h ALA 211 CO 0.15 -0.28 -0.09 0.00 0.00 0.00 0.00 179.25 179.03 3h1i h ALA 212 N 1.51 -0.24 -0.90 0.00 0.00 -0.69 -2.68 119.26 116.27 3h1i h ALA 212 Ca 0.02 -0.22 0.16 0.00 0.00 0.00 0.00 54.91 54.87 3h1i h ALA 212 Cb 0.54 0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.36 3h1i h ALA 212 CO -0.00 -0.32 0.58 0.00 0.00 0.00 0.00 179.25 179.51 3h1i h ARG 213 N -0.86 0.61 -0.42 0.00 3.08 0.12 -1.17 114.38 115.74 3h1i h ARG 213 Ca -0.02 -0.04 -0.14 0.00 0.07 0.00 0.00 59.98 59.85 3h1i h ARG 213 Cb 0.52 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.42 3h1i h ARG 213 CO 0.04 0.41 -0.27 0.37 -1.07 0.00 0.00 179.97 179.44 3h1i h GLN 214 N 0.63 0.93 0.00 0.04 4.15 -1.05 -3.35 115.11 116.46 3h1i h GLN 214 Ca 0.46 -0.44 -0.06 0.00 0.77 0.00 0.00 58.65 59.38 3h1i h GLN 214 Cb 0.83 -0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.50 3h1i h GLN 214 CO -0.21 1.10 -1.66 0.72 -1.93 0.00 0.00 178.83 176.85 3h1i n HIS 215 N -4.13 0.00 -1.01 3.99 8.25 -1.01 -4.46 115.22 116.85 3h1i n HIS 215 Ca -0.01 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.22 3h1i n HIS 215 Cb 0.48 -0.38 0.06 0.00 1.12 0.00 0.00 29.99 31.27 3h1i n HIS 215 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 3h1i n PHE 216 N -2.09 2.12 -2.12 4.41 3.01 -0.46 -4.91 117.46 117.41 3h1i n PHE 216 Ca -0.07 -2.28 -0.40 0.00 1.01 0.00 0.00 57.45 55.70 3h1i n PHE 216 Cb 0.49 -1.11 -0.03 0.00 -0.01 0.00 0.00 39.48 38.83 3h1i n PHE 216 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 3h1i s SER 217 N -0.51 5.60 0.25 4.37 1.04 -1.26 -4.92 113.70 118.28 3h1i s SER 217 Ca 0.42 0.50 0.12 0.00 0.48 0.00 0.00 55.95 57.47 3h1i s SER 217 Cb 0.33 -2.53 -0.05 0.00 0.10 0.00 0.00 66.02 63.87 3h1i s SER 217 CO -0.00 -2.09 -0.21 -0.83 0.98 0.00 0.00 173.24 171.09 3h1i s GLY 218 N 6.79 1.82 -0.11 7.32 0.00 -1.26 -5.14 107.32 116.75 3h1i s GLY 218 Ca 0.66 -1.79 0.03 0.00 0.00 0.00 0.00 44.72 43.61 3h1i s GLY 218 CO 0.24 -1.86 -0.20 0.14 0.00 0.00 0.00 173.10 171.42 3h1i s VAL 219 N -2.20 2.43 -0.39 1.40 1.01 -1.26 -4.80 120.40 116.58 3h1i s VAL 219 Ca 0.27 -0.89 0.00 0.00 0.00 0.00 0.00 61.98 61.36 3h1i s VAL 219 Cb -0.06 -1.96 0.11 0.00 0.00 0.00 0.00 36.38 34.47 3h1i s VAL 219 CO 0.13 0.55 0.15 -0.94 0.00 0.00 0.00 175.10 174.99 3h1i s SER 220 N 0.27 5.00 0.00 3.32 1.04 -1.26 -5.00 113.70 117.07 3h1i s SER 220 Ca -0.14 -2.16 0.00 0.00 0.48 0.00 0.00 55.95 54.12 3h1i s SER 220 Cb -0.17 -1.73 0.00 0.00 0.10 0.00 0.00 66.02 64.22 3h1i s SER 220 CO 0.07 -0.45 0.00 0.49 0.98 0.00 0.00 173.24 174.33 3h1i n PHE 221 N 4.33 0.00 -0.11 5.02 3.01 -1.26 -4.97 117.46 123.48 3h1i n PHE 221 Ca 0.01 0.00 -0.14 0.00 1.01 0.00 0.00 57.45 58.34 3h1i n PHE 221 Cb 0.41 0.00 0.13 0.00 -0.01 0.00 0.00 39.48 40.01 3h1i n PHE 221 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 3h1i n THR 222 N -0.24 0.00 0.01 4.37 -2.24 -1.26 -4.93 114.28 109.99 3h1i n THR 222 Ca 0.00 0.00 -0.05 0.00 -2.27 0.00 0.00 64.05 61.73 3h1i n THR 222 Cb 0.00 -0.44 -0.11 0.00 -2.10 0.00 0.00 70.33 67.68 3h1i n THR 222 CO 0.00 0.00 0.00 0.10 -0.57 0.00 0.00 175.07 174.60 3h1i h TYR 223 N -2.71 0.00 -0.48 4.78 -0.00 -1.99 -3.39 116.97 113.18 3h1i h TYR 223 Ca -0.17 0.00 0.06 0.00 -0.00 0.00 0.00 58.73 58.61 3h1i h TYR 223 Cb 0.59 0.00 -0.09 0.00 -0.00 0.00 0.00 36.73 37.23 3h1i h TYR 223 CO 0.00 0.86 -0.55 0.87 -0.00 0.00 0.00 178.16 179.34 3h1i h LYS 224 N 0.00 -0.34 0.00 0.10 1.79 -1.95 0.18 116.57 116.35 3h1i h LYS 224 Ca -0.19 0.02 0.00 0.00 -2.18 0.00 0.00 60.65 58.30 3h1i h LYS 224 Cb 1.83 0.08 0.00 0.00 -1.58 0.00 0.00 32.23 32.55 3h1i h LYS 224 CO 0.08 -0.22 0.00 0.39 -1.08 0.00 0.00 179.45 178.61 3h1i n GLU 225 N -5.37 0.04 -0.06 3.15 1.02 -1.26 -0.70 120.64 117.46 3h1i n GLU 225 Ca -0.03 0.09 0.05 0.00 -0.02 0.00 0.00 57.16 57.25 3h1i n GLU 225 Cb 0.33 -1.50 0.07 0.00 -0.02 0.00 0.00 31.44 30.33 3h1i n GLU 225 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3h1i n ASP 226 N -1.09 2.17 -4.54 1.62 9.92 0.62 -4.80 116.55 120.45 3h1i n ASP 226 Ca 0.01 -1.63 -0.34 0.00 -0.53 0.00 0.00 54.79 52.29 3h1i n ASP 226 Cb 0.01 -0.08 -0.11 0.00 -0.64 0.00 0.00 41.12 40.30 3h1i n ASP 226 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3h1i s ALA 227 N -0.86 3.16 -0.57 2.24 0.00 0.12 -5.07 121.76 120.79 3h1i s ALA 227 Ca 0.14 -0.82 -0.23 0.00 0.00 0.00 0.00 51.96 51.05 3h1i s ALA 227 Cb 0.09 -1.74 0.05 0.00 0.00 0.00 0.00 23.12 21.52 3h1i s ALA 227 CO 0.12 0.13 0.90 0.54 0.00 0.00 0.00 175.76 177.45 3h1i s VAL 228 N 0.48 4.45 -0.09 0.00 0.11 -1.26 -5.00 120.40 119.09 3h1i s VAL 228 Ca -0.00 0.02 -0.37 0.00 -2.93 0.00 0.00 61.98 58.69 3h1i s VAL 228 Cb -0.14 -4.53 -0.15 0.00 -1.53 0.00 0.00 36.38 30.04 3h1i s VAL 228 CO 0.02 -1.14 1.67 -0.81 -3.33 0.00 0.00 175.10 171.51 3h1i n PRO 229 N 7.31 1.54 -2.70 1.54 -0.04 -1.26 -4.93 135.00 136.46 3h1i n PRO 229 Ca -0.01 0.56 -0.39 0.00 -0.04 0.00 0.00 63.50 63.63 3h1i n PRO 229 Cb 0.47 -2.29 -0.06 0.00 -0.04 0.00 0.00 33.50 31.58 3h1i n PRO 229 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3h1i s ILE 230 N 2.66 3.99 0.06 0.52 1.01 -1.26 -5.03 121.20 123.14 3h1i s ILE 230 Ca 0.91 1.87 -0.21 0.00 0.00 0.00 0.00 60.65 63.22 3h1i s ILE 230 Cb -0.90 -4.14 -0.06 0.00 0.01 0.00 0.00 42.46 37.37 3h1i s ILE 230 CO 0.54 0.34 0.64 -0.76 0.00 0.00 0.00 174.94 175.70 3h1i s LEU 231 N -1.57 4.49 -0.22 2.97 1.43 -1.26 -5.02 118.68 119.50 3h1i s LEU 231 Ca 0.45 1.31 -0.29 0.00 -1.03 0.00 0.00 54.13 54.58 3h1i s LEU 231 Cb -0.25 -3.01 -0.04 0.00 0.03 0.00 0.00 46.19 42.93 3h1i s LEU 231 CO 0.31 0.17 1.89 -2.16 0.23 0.00 0.00 176.35 176.79 3h1i s PRO 232 N -0.65 3.50 0.02 1.29 0.04 -1.26 -4.90 135.00 133.04 3h1i s PRO 232 Ca 0.32 1.82 -0.37 0.00 0.04 0.00 0.00 61.00 62.81 3h1i s PRO 232 Cb -0.20 -4.20 -0.19 0.00 0.04 0.00 0.00 34.50 29.96 3h1i s PRO 232 CO 0.20 -1.66 0.97 -2.13 0.04 0.00 0.00 177.00 174.42 3h1i n ARG 233 N 8.20 0.00 -3.42 4.56 0.63 -1.26 -4.92 116.66 120.45 3h1i n ARG 233 Ca 0.23 0.00 -0.37 0.00 -0.92 0.00 0.00 57.85 56.79 3h1i n ARG 233 Cb 0.45 -1.39 -0.07 0.00 0.45 0.00 0.00 32.46 31.91 3h1i n ARG 233 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3h1i s ARG 235 N 0.60 4.35 0.25 0.00 3.52 -1.26 -5.01 118.95 121.40 3h1i s ARG 235 Ca 0.21 1.14 -0.28 0.00 -0.13 0.00 0.00 55.73 56.67 3h1i s ARG 235 Cb -0.14 -3.56 -0.09 0.00 -1.56 0.00 0.00 34.95 29.60 3h1i s ARG 235 CO 0.07 -0.30 0.92 0.12 -0.81 0.00 0.00 175.30 175.29 3h1i s PHE 236 N 2.03 3.91 -0.32 5.12 5.36 -1.26 -4.48 117.98 128.34 3h1i s PHE 236 Ca 0.42 1.85 -0.02 0.00 -0.96 0.00 0.00 56.93 58.21 3h1i s PHE 236 Cb -0.17 -2.93 0.11 0.00 -0.34 0.00 0.00 43.02 39.69 3h1i s PHE 236 CO 0.15 0.41 0.15 0.99 -1.46 0.00 0.00 175.22 175.46 3h1i s THR 237 N -1.27 0.19 -0.12 0.12 2.01 -0.49 -5.03 115.64 111.05 3h1i s THR 237 Ca 0.42 -1.20 -0.34 0.00 0.31 0.00 0.00 61.69 60.88 3h1i s THR 237 Cb -0.24 -1.16 -0.12 0.00 0.01 0.00 0.00 72.50 71.00 3h1i s THR 237 CO 0.29 -0.80 1.91 0.61 -0.69 0.00 0.00 174.62 175.94 3h1i n GLY 238 N 4.77 1.37 0.00 4.40 0.00 -1.26 -4.53 105.19 109.94 3h1i n GLY 238 Ca 0.00 0.87 0.00 0.00 0.00 0.00 0.00 46.02 46.89 3h1i n GLY 238 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3h1i n SER 239 N 7.01 0.00 -4.20 1.61 3.41 -0.52 -4.87 113.62 116.06 3h1i n SER 239 Ca 0.24 -0.68 -0.12 0.00 -0.26 0.00 0.00 58.87 58.05 3h1i n SER 239 Cb 0.29 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.14 3h1i n SER 239 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 3h1i s GLU 240 N -1.05 1.17 -0.15 4.33 -1.05 -1.26 0.80 118.70 121.50 3h1i s GLU 240 Ca 0.00 -1.61 -0.06 0.00 -0.15 0.00 0.00 54.97 53.15 3h1i s GLU 240 Cb 0.00 0.24 0.07 0.00 -0.44 0.00 0.00 34.13 34.01 3h1i s GLU 240 CO 0.00 -0.37 0.32 -1.50 0.95 0.00 0.00 175.26 174.66 3h1i s ILE 241 N -4.13 -0.45 -0.28 1.83 2.07 -0.82 -4.94 121.20 114.48 3h1i s ILE 241 Ca 0.37 0.22 -0.00 0.00 -1.41 0.00 0.00 60.65 59.83 3h1i s ILE 241 Cb 0.07 -0.52 0.05 0.00 0.13 0.00 0.00 42.46 42.19 3h1i s ILE 241 CO 0.11 0.09 -0.04 -0.13 -1.91 0.00 0.00 174.94 173.06 3h1i s ARG 242 N 2.35 2.42 -0.45 3.50 0.52 -1.26 -1.58 118.95 124.45 3h1i s ARG 242 Ca -0.01 -1.26 -0.13 0.00 -0.52 0.00 0.00 55.73 53.81 3h1i s ARG 242 Cb -0.12 -3.08 0.08 0.00 0.52 0.00 0.00 34.95 32.35 3h1i s ARG 242 CO -0.10 -0.58 0.34 0.00 0.02 0.00 0.00 175.30 174.98 3h1i s ALA 243 N 1.22 3.45 -0.05 2.13 0.00 0.84 -5.00 121.76 124.34 3h1i s ALA 243 Ca -0.06 -2.13 -0.03 0.00 0.00 0.00 0.00 51.96 49.74 3h1i s ALA 243 Cb -0.19 -2.90 -0.04 0.00 0.00 0.00 0.00 23.12 19.99 3h1i s ALA 243 CO -0.02 -1.70 0.10 0.50 0.00 0.00 0.00 175.76 174.63 3h1i s ARG 244 N 1.55 3.21 -0.39 0.00 3.52 -1.26 -1.34 118.95 124.23 3h1i s ARG 244 Ca 0.04 -0.35 0.07 0.00 -0.13 0.00 0.00 55.73 55.35 3h1i s ARG 244 Cb -0.24 -2.97 0.18 0.00 -1.56 0.00 0.00 34.95 30.36 3h1i s ARG 244 CO 0.05 0.70 0.65 0.34 -0.81 0.00 0.00 175.30 176.23 3h1i s ASP 245 N -1.41 -1.48 0.42 -2.12 -1.08 0.32 -4.84 116.67 106.48 3h1i s ASP 245 Ca 0.20 -0.63 0.29 0.00 -0.52 0.00 0.00 52.55 51.89 3h1i s ASP 245 Cb -0.12 1.89 1.53 0.00 -1.46 0.00 0.00 42.92 44.76 3h1i s ASP 245 CO 0.10 -0.18 1.88 0.44 0.52 0.00 0.00 175.17 177.93 3h1i h ASP 246 N 7.03 0.00 -0.04 -0.34 3.32 -1.93 -2.10 116.42 122.37 3h1i h ASP 246 Ca 0.04 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.09 3h1i h ASP 246 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 3h1i h ASP 246 CO 0.09 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.61 3h1i n ALA 247 N -1.87 2.51 -2.83 3.45 0.00 -1.26 -4.69 120.51 115.83 3h1i n ALA 247 Ca -0.02 -0.09 -0.34 0.00 0.00 0.00 0.00 53.44 53.00 3h1i n ALA 247 Cb 0.07 -1.00 -0.06 0.00 0.00 0.00 0.00 19.45 18.45 3h1i n ALA 247 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 3h1i s LEU 248 N -0.81 4.09 0.17 0.00 1.43 -0.83 -5.03 118.68 117.69 3h1i s LEU 248 Ca 0.03 0.24 -0.23 0.00 -1.03 0.00 0.00 54.13 53.14 3h1i s LEU 248 Cb 0.02 -2.35 0.06 0.00 0.03 0.00 0.00 46.19 43.95 3h1i s LEU 248 CO 0.02 0.29 1.60 1.55 0.23 0.00 0.00 176.35 180.03 3h1i h PRO 249 N 4.13 -0.24 -4.69 1.29 0.13 -1.90 -3.41 132.00 127.31 3h1i h PRO 249 Ca -0.50 0.02 -0.23 0.00 -0.87 0.00 0.00 66.00 64.42 3h1i h PRO 249 Cb 1.19 0.05 -0.15 0.00 0.13 0.00 0.00 31.00 32.23 3h1i h PRO 249 CO 0.64 -0.16 -0.70 0.14 -0.23 0.00 0.00 178.00 177.69 3h1i s VAL 250 N -5.99 0.73 0.07 1.56 -7.23 -1.26 -4.63 120.40 103.65 3h1i s VAL 250 Ca -0.15 -1.95 0.02 0.00 -1.81 0.00 0.00 61.98 58.09 3h1i s VAL 250 Cb 0.13 -1.72 -0.04 0.00 0.56 0.00 0.00 36.38 35.32 3h1i s VAL 250 CO 0.68 -0.84 0.15 0.00 -0.31 0.00 0.00 175.10 174.77 3h1i s ALA 251 N -3.61 3.79 -0.05 1.32 0.00 -1.01 -4.47 121.76 117.74 3h1i s ALA 251 Ca 0.13 -0.93 0.05 0.00 0.00 0.00 0.00 51.96 51.20 3h1i s ALA 251 Cb 0.05 -1.63 -0.02 0.00 0.00 0.00 0.00 23.12 21.51 3h1i s ALA 251 CO -0.04 0.78 -0.18 -1.01 0.00 0.00 0.00 175.76 175.31 3h1i s HIS 252 N -1.46 2.60 -0.01 0.00 3.76 0.63 -2.19 115.29 118.62 3h1i s HIS 252 Ca 0.32 -0.31 0.02 0.00 -0.15 0.00 0.00 55.06 54.94 3h1i s HIS 252 Cb -0.13 -1.62 0.00 0.00 1.11 0.00 0.00 32.58 31.95 3h1i s HIS 252 CO 0.25 0.07 -0.06 0.08 -0.85 0.00 0.00 174.74 174.23 3h1i s VAL 253 N -0.56 0.51 -0.04 -0.90 1.01 -0.65 -1.70 120.40 118.07 3h1i s VAL 253 Ca 0.08 -0.23 0.01 0.00 0.00 0.00 0.00 61.98 61.83 3h1i s VAL 253 Cb -0.11 -0.46 0.02 0.00 0.00 0.00 0.00 36.38 35.83 3h1i s VAL 253 CO 0.01 0.16 -0.03 0.00 0.00 0.00 0.00 175.10 175.25 3h1i s ALA 254 N 0.11 0.51 0.02 5.51 0.00 -0.27 -1.23 121.76 126.41 3h1i s ALA 254 Ca -0.01 0.04 0.04 0.00 0.00 0.00 0.00 51.96 52.03 3h1i s ALA 254 Cb -0.06 -0.36 -0.02 0.00 0.00 0.00 0.00 23.12 22.68 3h1i s ALA 254 CO -0.00 -0.03 -0.12 -1.17 0.00 0.00 0.00 175.76 174.44 3h1i s LEU 255 N 0.92 2.12 0.15 0.00 2.96 0.59 0.46 118.68 125.88 3h1i s LEU 255 Ca -0.11 -0.37 -0.24 0.00 -0.22 0.00 0.00 54.13 53.20 3h1i s LEU 255 Cb -0.14 -0.53 0.07 0.00 0.50 0.00 0.00 46.19 46.09 3h1i s LEU 255 CO -0.01 0.04 0.64 0.00 -1.32 0.00 0.00 176.35 175.71 3h1i s ALA 256 N -0.68 -1.61 0.20 5.97 0.00 -0.37 0.28 121.76 125.56 3h1i s ALA 256 Ca 0.01 0.51 0.11 0.00 0.00 0.00 0.00 51.96 52.59 3h1i s ALA 256 Cb -0.07 0.83 -0.04 0.00 0.00 0.00 0.00 23.12 23.84 3h1i s ALA 256 CO 0.01 -0.77 -0.19 0.14 0.00 0.00 0.00 175.76 174.94 3h1i s VAL 257 N -3.68 2.61 0.36 0.00 -7.23 0.31 0.50 120.40 113.27 3h1i s VAL 257 Ca 0.02 -1.97 -0.28 0.00 -1.81 0.00 0.00 61.98 57.94 3h1i s VAL 257 Cb -0.01 -2.28 -0.12 0.00 0.56 0.00 0.00 36.38 34.53 3h1i s VAL 257 CO -0.11 -0.15 1.41 1.21 -0.31 0.00 0.00 175.10 177.15 3h1i n GLU 258 N 0.10 2.46 -3.98 4.82 2.13 -1.26 -1.46 120.64 123.45 3h1i n GLU 258 Ca -0.11 0.86 -0.22 0.00 0.66 0.00 0.00 57.16 58.35 3h1i n GLU 258 Cb 0.56 -2.54 -0.02 0.00 0.27 0.00 0.00 31.44 29.71 3h1i n GLU 258 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 3h1i s GLY 259 N -0.19 1.34 0.04 8.31 0.00 -0.69 -4.65 107.32 111.47 3h1i s GLY 259 Ca 0.54 -1.20 -0.22 0.00 0.00 0.00 0.00 44.72 43.84 3h1i s GLY 259 CO 0.63 -1.22 1.42 -0.56 0.00 0.00 0.00 173.10 173.37 3h1i h PRO 260 N 1.42 0.23 0.00 2.90 0.13 -1.90 -1.96 132.00 132.82 3h1i h PRO 260 Ca -0.51 -0.09 0.00 0.00 -0.87 0.00 0.00 66.00 64.53 3h1i h PRO 260 Cb 1.22 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.34 3h1i h PRO 260 CO 0.63 0.53 0.00 0.41 -0.23 0.00 0.00 178.00 179.34 3h1i n GLY 261 N -0.10 3.19 0.00 1.56 0.00 -0.03 -4.02 105.19 105.78 3h1i n GLY 261 Ca -0.06 -1.42 0.00 0.00 0.00 0.00 0.00 46.02 44.53 3h1i n GLY 261 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3h1i n TRP 262 N 0.81 0.00 0.00 1.61 7.02 -0.44 -1.60 117.44 124.84 3h1i n TRP 262 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 3h1i n TRP 262 Cb 0.00 -0.48 0.00 0.00 -2.42 0.00 0.00 31.31 28.41 3h1i n TRP 262 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 3h1i n ALA 263 N -3.81 0.00 -1.20 6.99 0.00 -1.26 -4.65 120.51 116.58 3h1i n ALA 263 Ca 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 53.44 52.97 3h1i n ALA 263 Cb 0.00 0.37 -0.07 0.00 0.00 0.00 0.00 19.45 19.75 3h1i n ALA 263 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 3h1i n ASP 264 N -2.73 0.29 0.00 0.00 -0.08 -0.63 -4.82 116.55 108.59 3h1i n ASP 264 Ca 0.00 0.89 0.11 0.00 -1.51 0.00 0.00 54.79 54.27 3h1i n ASP 264 Cb 0.00 -0.69 0.54 0.00 2.34 0.00 0.00 41.12 43.32 3h1i n ASP 264 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 3h1i n PRO 265 N 1.75 0.31 0.04 -0.67 -0.02 -1.26 -2.61 135.00 132.54 3h1i n PRO 265 Ca 0.18 0.08 -0.10 0.00 -2.02 0.00 0.00 63.50 61.64 3h1i n PRO 265 Cb 0.03 -1.50 0.03 0.00 -0.02 0.00 0.00 33.50 32.03 3h1i n PRO 265 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3h1i h ASP 266 N 0.00 0.53 -1.13 2.55 3.32 -1.93 -3.15 116.42 116.62 3h1i h ASP 266 Ca 0.00 -0.34 0.43 0.00 0.02 0.00 0.00 57.03 57.14 3h1i h ASP 266 Cb 0.20 -0.16 -0.16 0.00 0.22 0.00 0.00 39.33 39.43 3h1i h ASP 266 CO 0.00 1.08 0.66 0.78 -1.72 0.00 0.00 179.24 180.03 3h1i h ASN 267 N 0.31 0.29 0.00 6.45 2.35 -1.84 0.38 115.58 123.53 3h1i h ASN 267 Ca -0.03 0.22 0.00 0.00 -0.55 0.00 0.00 56.30 55.94 3h1i h ASN 267 Cb 1.28 0.23 0.00 0.00 0.05 0.00 0.00 38.32 39.88 3h1i h ASN 267 CO 0.12 -0.36 0.00 0.52 -1.65 0.00 0.00 177.43 176.06 3h1i n VAL 268 N -5.07 0.00 -0.38 2.81 0.31 -1.19 -1.36 118.33 113.45 3h1i n VAL 268 Ca 0.38 1.38 -0.07 0.00 -0.01 0.00 0.00 64.34 66.02 3h1i n VAL 268 Cb 1.36 -2.16 -0.05 0.00 -0.91 0.00 0.00 33.84 32.08 3h1i n VAL 268 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 3h1i n VAL 269 N -2.02 -0.58 -0.29 2.52 0.31 0.12 0.42 118.33 118.82 3h1i n VAL 269 Ca 0.00 2.22 0.08 0.00 -0.01 0.00 0.00 64.34 66.63 3h1i n VAL 269 Cb 0.00 -2.80 0.20 0.00 -0.91 0.00 0.00 33.84 30.33 3h1i n VAL 269 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 3h1i h LEU 270 N 0.00 -0.37 -1.32 7.52 3.38 -0.99 0.58 115.31 124.11 3h1i h LEU 270 Ca 0.21 0.22 -0.05 0.00 0.09 0.00 0.00 57.88 58.34 3h1i h LEU 270 Cb 0.44 0.38 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 3h1i h LEU 270 CO -0.89 -0.23 -0.13 0.45 0.09 0.00 0.00 178.44 177.74 3h1i h HIS 271 N 0.09 0.31 -0.12 1.13 3.86 0.12 0.18 115.15 120.73 3h1i h HIS 271 Ca 0.48 -0.04 -0.01 0.00 -1.16 0.00 0.00 60.37 59.64 3h1i h HIS 271 Cb 0.89 -0.09 -0.01 0.00 1.06 0.00 0.00 27.41 29.27 3h1i h HIS 271 CO -0.44 0.43 0.05 0.28 0.86 0.00 0.00 177.93 179.11 3h1i h VAL 272 N 0.28 1.14 0.32 2.45 2.07 0.79 -1.63 116.25 121.68 3h1i h VAL 272 Ca 0.06 -0.43 -0.01 0.00 0.82 0.00 0.00 66.70 67.14 3h1i h VAL 272 Cb 0.41 1.21 -0.02 0.00 -1.52 0.00 0.00 31.29 31.37 3h1i h VAL 272 CO 0.02 0.13 -0.37 0.00 0.02 0.00 0.00 177.57 177.37 3h1i h ALA 273 N 0.89 -1.02 0.00 1.67 0.00 -0.06 0.83 119.26 121.58 3h1i h ALA 273 Ca 0.04 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.82 3h1i h ALA 273 Cb 0.16 0.63 0.00 0.00 0.00 0.00 0.00 17.79 18.58 3h1i h ALA 273 CO -0.00 -1.05 0.53 -0.91 0.00 0.00 0.00 179.25 177.82 3h1i h ASN 274 N -0.70 0.00 0.61 0.00 -0.26 -0.47 1.27 115.58 116.03 3h1i h ASN 274 Ca -0.04 0.00 -0.28 0.00 -0.56 0.00 0.00 56.30 55.42 3h1i h ASN 274 Cb 0.62 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 37.86 3h1i h ASN 274 CO -0.07 0.00 -1.39 0.00 -1.06 0.00 0.00 177.43 174.91 3h1i h ALA 275 N 0.59 0.34 -0.23 -0.83 0.00 0.16 -2.50 119.26 116.79 3h1i h ALA 275 Ca 0.00 -1.08 -0.02 0.00 0.00 0.00 0.00 54.91 53.80 3h1i h ALA 275 Cb 1.07 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 3h1i h ALA 275 CO 0.00 1.21 0.05 0.82 0.00 0.00 0.00 179.25 181.33 3h1i h ILE 276 N 0.04 1.21 0.00 0.00 2.04 0.19 -2.71 117.51 118.29 3h1i h ILE 276 Ca -0.18 -0.69 0.00 0.00 1.00 0.00 0.00 64.86 65.00 3h1i h ILE 276 Cb 1.95 1.23 0.00 0.00 -0.74 0.00 0.00 36.82 39.26 3h1i h ILE 276 CO 0.15 0.22 -0.13 0.40 0.00 0.00 0.00 178.15 178.79 3h1i h ILE 277 N 0.19 0.00 0.00 -0.67 2.04 -1.68 -3.40 117.51 113.99 3h1i h ILE 277 Ca 0.07 -0.51 0.00 0.00 1.00 0.00 0.00 64.86 65.42 3h1i h ILE 277 Cb 0.28 1.42 0.00 0.00 -0.74 0.00 0.00 36.82 37.78 3h1i h ILE 277 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 178.15 178.76 3h1i n GLY 278 N 1.30 0.99 3.25 5.37 0.00 -0.94 -4.68 105.19 110.48 3h1i n GLY 278 Ca 0.05 -0.40 -0.13 0.00 0.00 0.00 0.00 46.02 45.54 3h1i n GLY 278 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3h1i s ARG 279 N 0.00 0.69 0.13 1.61 1.70 -1.26 -3.24 118.95 118.58 3h1i s ARG 279 Ca 0.00 -0.20 0.03 0.00 -0.47 0.00 0.00 55.73 55.08 3h1i s ARG 279 Cb 0.00 0.31 -0.04 0.00 -0.57 0.00 0.00 34.95 34.64 3h1i s ARG 279 CO 0.00 -0.19 -0.07 -0.47 -1.08 0.00 0.00 175.30 173.49 3h1i s TYR 280 N -1.42 1.10 -0.29 5.89 5.04 -0.50 -4.99 117.35 122.18 3h1i s TYR 280 Ca -0.13 -0.88 -0.16 0.00 -2.44 0.00 0.00 57.07 53.47 3h1i s TYR 280 Cb -0.05 -0.60 0.16 0.00 0.35 0.00 0.00 41.96 41.82 3h1i s TYR 280 CO 0.04 -0.07 1.03 0.34 -1.34 0.00 0.00 175.55 175.55 3h1i s ASP 281 N -3.12 -0.44 0.00 4.32 2.15 -1.26 -1.26 116.67 117.06 3h1i s ASP 281 Ca 0.16 0.68 0.00 0.00 0.43 0.00 0.00 52.55 53.82 3h1i s ASP 281 Cb 0.04 1.29 0.00 0.00 -0.30 0.00 0.00 42.92 43.96 3h1i s ASP 281 CO -0.01 -0.10 0.00 0.54 -0.17 0.00 0.00 175.17 175.43 3h1i n ARG 282 N 3.99 0.00 0.23 4.34 5.12 -0.80 -0.23 116.66 129.29 3h1i n ARG 282 Ca -0.15 0.00 0.11 0.00 -1.93 0.00 0.00 57.85 55.88 3h1i n ARG 282 Cb 0.56 0.00 0.41 0.00 -1.16 0.00 0.00 32.46 32.27 3h1i n ARG 282 CO 0.00 0.00 0.00 1.79 -1.93 0.00 0.00 177.63 177.49 3h1i h THR 283 N 0.00 0.35 -1.59 0.55 1.35 -1.98 -3.45 112.91 108.14 3h1i h THR 283 Ca 0.00 -1.08 -0.69 0.00 -0.55 0.00 0.00 66.41 64.09 3h1i h THR 283 Cb 0.00 1.83 0.06 0.00 -1.73 0.00 0.00 68.15 68.30 3h1i h THR 283 CO 0.00 0.16 0.37 0.49 -0.25 0.00 0.00 175.52 176.29 3h1i n PHE 284 N -3.24 1.35 0.37 4.73 3.01 0.67 -4.82 117.46 119.53 3h1i n PHE 284 Ca 0.01 0.71 0.12 0.00 1.01 0.00 0.00 57.45 59.30 3h1i n PHE 284 Cb 0.46 -2.29 0.23 0.00 -0.01 0.00 0.00 39.48 37.86 3h1i n PHE 284 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 3h1i h GLY 285 N 4.20 0.00 0.68 1.37 0.00 -1.90 -3.31 103.07 104.11 3h1i h GLY 285 Ca -0.48 0.00 0.07 0.00 0.00 0.00 0.00 47.33 46.92 3h1i h GLY 285 CO 0.75 0.00 0.51 -1.33 0.00 0.00 0.00 176.54 176.47 3h1i h GLY 286 N 4.21 1.28 0.00 4.60 0.00 -1.98 -3.47 103.07 107.71 3h1i h GLY 286 Ca 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 47.33 46.96 3h1i h GLY 286 CO 0.00 0.23 0.00 0.61 0.00 0.00 0.00 176.54 177.38 3h1i n GLY 287 N -1.32 1.43 0.25 4.60 0.00 -1.25 -2.63 105.19 106.27 3h1i n GLY 287 Ca 0.12 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.66 3h1i n GLY 287 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 3h1i n LYS 288 N 5.53 0.02 0.04 1.61 2.85 -1.26 -0.48 118.16 126.47 3h1i n LYS 288 Ca 0.00 0.72 0.11 0.00 -1.05 0.00 0.00 58.31 58.10 3h1i n LYS 288 Cb 0.00 -2.32 -0.01 0.00 -0.65 0.00 0.00 35.03 32.05 3h1i n LYS 288 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 3h1i n HIS 289 N -2.11 0.36 -0.93 5.58 8.25 -1.08 -4.86 115.22 120.44 3h1i n HIS 289 Ca 0.00 0.10 -0.30 0.00 -0.26 0.00 0.00 57.72 57.26 3h1i n HIS 289 Cb 0.85 -0.54 0.02 0.00 1.12 0.00 0.00 29.99 31.44 3h1i n HIS 289 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3h1i n LEU 290 N -2.13 -3.70 0.07 2.41 4.77 0.37 -4.86 117.00 113.94 3h1i n LEU 290 Ca 0.01 0.38 0.12 0.00 -0.03 0.00 0.00 56.01 56.49 3h1i n LEU 290 Cb 0.47 -0.66 0.12 0.00 -2.33 0.00 0.00 43.42 41.02 3h1i n LEU 290 CO 0.41 -4.25 0.25 0.28 -1.33 0.00 0.00 177.39 172.75 3h1i h SER 291 N -0.31 0.00 -3.51 -1.43 0.02 -1.94 -3.44 113.55 102.94 3h1i h SER 291 Ca -0.34 -0.16 -0.56 0.00 -0.84 0.00 0.00 61.79 59.88 3h1i h SER 291 Cb 1.12 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.60 3h1i h SER 291 CO 0.28 0.08 0.99 -0.55 -1.14 0.00 0.00 176.83 176.49 3h1i s SER 292 N -4.56 6.50 0.08 3.07 0.15 -1.26 -4.93 113.70 112.75 3h1i s SER 292 Ca 0.04 0.64 -0.15 0.00 0.70 0.00 0.00 55.95 57.18 3h1i s SER 292 Cb 0.12 -2.55 -0.03 0.00 -1.71 0.00 0.00 66.02 61.85 3h1i s SER 292 CO 0.74 -1.33 1.17 0.54 1.20 0.00 0.00 173.24 175.57 3h1i n ARG 293 N 7.94 -0.21 -0.26 5.44 1.74 -1.26 0.23 116.66 130.27 3h1i n ARG 293 Ca 0.14 1.16 0.15 0.00 -0.77 0.00 0.00 57.85 58.53 3h1i n ARG 293 Cb 0.48 -1.72 0.44 0.00 -1.02 0.00 0.00 32.46 30.64 3h1i n ARG 293 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 3h1i h LEU 294 N 0.00 0.54 0.01 0.55 5.85 -1.91 -0.48 115.31 119.88 3h1i h LEU 294 Ca 0.08 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.84 3h1i h LEU 294 Cb 0.20 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.17 3h1i h LEU 294 CO -0.46 0.25 -0.00 0.00 -0.34 0.00 0.00 178.44 177.88 3h1i h ALA 295 N 1.61 -0.01 -0.72 1.25 0.00 -0.50 0.87 119.26 121.77 3h1i h ALA 295 Ca 0.46 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.34 3h1i h ALA 295 Cb 0.93 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.73 3h1i h ALA 295 CO -0.21 -0.47 0.00 0.00 0.00 0.00 0.00 179.25 178.58 3h1i n ALA 296 N -2.13 -0.19 -0.26 0.00 0.00 -0.15 -0.88 120.51 116.90 3h1i n ALA 296 Ca -0.07 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.39 3h1i n ALA 296 Cb 0.07 0.23 0.11 0.00 0.00 0.00 0.00 19.45 19.85 3h1i n ALA 296 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3h1i h LEU 297 N 0.00 -0.59 -0.98 0.00 3.38 -1.54 1.01 115.31 116.59 3h1i h LEU 297 Ca 0.00 0.22 0.34 0.00 0.09 0.00 0.00 57.88 58.52 3h1i h LEU 297 Cb 0.00 0.43 -0.17 0.00 0.09 0.00 0.00 40.66 41.01 3h1i h LEU 297 CO 0.00 -0.23 0.41 0.00 0.09 0.00 0.00 178.44 178.71 3h1i h ALA 298 N 1.73 1.80 0.19 1.53 0.00 -0.09 -0.51 119.26 123.91 3h1i h ALA 298 Ca 0.37 0.25 -0.01 0.00 0.00 0.00 0.00 54.91 55.53 3h1i h ALA 298 Cb 0.60 0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.72 3h1i h ALA 298 CO -0.74 -0.71 -0.09 0.28 0.00 0.00 0.00 179.25 178.00 3h1i h VAL 299 N 0.13 0.37 -0.63 0.00 2.07 0.29 0.48 116.25 118.96 3h1i h VAL 299 Ca 0.73 -1.00 0.10 0.00 0.82 0.00 0.00 66.70 67.35 3h1i h VAL 299 Cb 1.74 0.65 -0.12 0.00 -1.52 0.00 0.00 31.29 32.04 3h1i h VAL 299 CO -0.73 0.11 -0.37 -0.08 0.02 0.00 0.00 177.57 176.51 3h1i h GLU 300 N -1.01 -0.16 -0.60 1.57 4.81 0.69 -1.16 114.58 118.71 3h1i h GLU 300 Ca -0.03 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 3h1i h GLU 300 Cb 0.37 0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.78 3h1i h GLU 300 CO 0.04 -0.11 0.00 0.72 -0.73 0.00 0.00 179.01 178.94 3h1i n HIS 301 N -5.43 1.96 -3.94 0.92 8.25 -0.39 -4.92 115.22 111.67 3h1i n HIS 301 Ca 0.04 -0.69 -0.25 0.00 -0.26 0.00 0.00 57.72 56.55 3h1i n HIS 301 Cb 0.36 -0.46 -0.02 0.00 1.12 0.00 0.00 29.99 30.99 3h1i n HIS 301 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 3h1i n LYS 302 N 0.72 -3.38 0.17 -0.41 4.01 -0.44 -4.91 118.16 113.91 3h1i n LYS 302 Ca 0.27 0.42 -0.07 0.00 -0.51 0.00 0.00 58.31 58.42 3h1i n LYS 302 Cb 1.13 -4.57 -0.03 0.00 -0.51 0.00 0.00 35.03 31.05 3h1i n LYS 302 CO 0.00 0.00 0.00 -0.07 -1.11 0.00 0.00 177.40 176.22 3h1i h LEU 303 N -1.84 -0.36 -9.17 -0.35 3.38 -0.24 -3.47 115.31 103.26 3h1i h LEU 303 Ca -0.63 0.01 -0.47 0.00 0.09 0.00 0.00 57.88 56.88 3h1i h LEU 303 Cb 1.37 0.09 -0.14 0.00 0.09 0.00 0.00 40.66 42.08 3h1i h LEU 303 CO 0.62 -0.25 -0.63 0.00 0.09 0.00 0.00 178.44 178.27 3h1i h HIS 305 N 2.20 0.00 0.00 0.00 3.86 0.05 -3.44 115.15 117.82 3h1i h HIS 305 Ca -0.40 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.81 3h1i h HIS 305 Cb 1.24 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.71 3h1i h HIS 305 CO 0.61 0.26 0.00 -1.13 0.86 0.00 0.00 177.93 178.53 3h1i n SER 306 N -3.07 0.00 -3.68 2.45 3.41 -1.14 -1.91 113.62 109.68 3h1i n SER 306 Ca 0.01 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.49 3h1i n SER 306 Cb 0.65 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.53 3h1i n SER 306 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 3h1i s PHE 307 N -2.00 -0.29 -0.08 7.33 -0.12 -0.39 0.34 117.98 122.78 3h1i s PHE 307 Ca 0.00 0.34 -0.15 0.00 -0.05 0.00 0.00 56.93 57.07 3h1i s PHE 307 Cb 0.00 0.20 0.03 0.00 -0.63 0.00 0.00 43.02 42.63 3h1i s PHE 307 CO 0.00 -0.52 0.37 1.14 -0.05 0.00 0.00 175.22 176.16 3h1i s GLN 308 N -1.98 0.59 0.31 1.99 -2.07 0.12 -1.41 119.66 117.22 3h1i s GLN 308 Ca -0.08 0.20 -0.03 0.00 -1.82 0.00 0.00 55.36 53.62 3h1i s GLN 308 Cb -0.02 0.27 -0.04 0.00 -1.09 0.00 0.00 33.01 32.13 3h1i s GLN 308 CO 0.01 -0.13 0.56 0.95 -1.32 0.00 0.00 175.29 175.36 3h1i s THR 309 N -0.56 5.05 -0.28 3.63 -4.23 -1.20 -1.49 115.64 116.55 3h1i s THR 309 Ca -0.07 -0.09 -0.20 0.00 -1.18 0.00 0.00 61.69 60.15 3h1i s THR 309 Cb -0.04 -3.78 0.12 0.00 1.34 0.00 0.00 72.50 70.14 3h1i s THR 309 CO 0.03 -0.42 0.92 0.72 -0.54 0.00 0.00 174.62 175.32 3h1i s PHE 310 N -2.19 -0.65 -0.59 3.99 -0.71 -1.21 -4.97 117.98 111.65 3h1i s PHE 310 Ca 0.43 1.42 0.06 0.00 -1.04 0.00 0.00 56.93 57.80 3h1i s PHE 310 Cb -0.10 0.40 0.26 0.00 -1.21 0.00 0.00 43.02 42.36 3h1i s PHE 310 CO 0.33 -0.32 0.74 -1.71 -1.34 0.00 0.00 175.22 172.92 3h1i n ASN 311 N 3.17 3.30 -4.64 1.98 5.15 -1.26 -2.19 115.26 120.77 3h1i n ASN 311 Ca -0.16 -3.36 -0.42 0.00 -0.60 0.00 0.00 54.58 50.03 3h1i n ASN 311 Cb 0.57 -0.65 -0.03 0.00 -0.53 0.00 0.00 39.78 39.14 3h1i n ASN 311 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 3h1i s THR 312 N -2.51 3.22 0.24 -0.44 2.01 -1.14 -4.85 115.64 112.17 3h1i s THR 312 Ca 0.40 0.25 0.05 0.00 0.31 0.00 0.00 61.69 62.71 3h1i s THR 312 Cb 0.17 -3.20 -0.03 0.00 0.01 0.00 0.00 72.50 69.45 3h1i s THR 312 CO -0.04 -0.06 0.33 -0.44 -0.69 0.00 0.00 174.62 173.72 3h1i s SER 313 N 5.11 6.18 0.17 3.53 0.01 -1.26 0.01 113.70 127.46 3h1i s SER 313 Ca 0.86 0.02 -0.07 0.00 1.31 0.00 0.00 55.95 58.06 3h1i s SER 313 Cb -0.36 -1.78 -0.02 0.00 0.21 0.00 0.00 66.02 64.07 3h1i s SER 313 CO 0.36 -0.06 0.25 -0.31 0.41 0.00 0.00 173.24 173.89 3h1i s TYR 314 N -2.00 0.52 0.18 2.43 1.51 -1.06 -4.89 117.35 114.04 3h1i s TYR 314 Ca 0.34 -0.87 -0.26 0.00 -1.01 0.00 0.00 57.07 55.26 3h1i s TYR 314 Cb -0.09 -0.14 0.04 0.00 -0.11 0.00 0.00 41.96 41.67 3h1i s TYR 314 CO 0.28 -0.70 1.55 0.66 -1.11 0.00 0.00 175.55 176.23 3h1i h SER 315 N 2.58 -1.77 0.00 2.29 4.64 -1.95 -1.16 113.55 118.18 3h1i h SER 315 Ca -0.32 0.30 -0.02 0.00 -0.47 0.00 0.00 61.79 61.28 3h1i h SER 315 Cb 1.23 0.82 -0.00 0.00 -0.31 0.00 0.00 62.40 64.13 3h1i h SER 315 CO 0.49 -0.29 -1.60 -0.90 -0.87 0.00 0.00 176.83 173.67 3h1i n ASP 316 N -5.36 2.10 0.00 4.97 5.75 -1.26 -4.29 116.55 118.46 3h1i n ASP 316 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.82 3h1i n ASP 316 Cb 0.33 1.51 0.00 0.00 -1.03 0.00 0.00 41.12 41.93 3h1i n ASP 316 CO 0.00 0.00 0.00 1.07 -0.11 0.00 0.00 177.20 178.16 3h1i n THR 317 N -1.98 0.00 0.00 2.12 5.66 -1.24 -4.55 114.28 114.29 3h1i n THR 317 Ca -0.04 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.96 3h1i n THR 317 Cb 0.38 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.16 3h1i n THR 317 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3h1i n GLY 318 N 3.13 0.02 2.56 1.09 0.00 -0.74 -0.85 105.19 110.40 3h1i n GLY 318 Ca 0.00 -0.92 -0.24 0.00 0.00 0.00 0.00 46.02 44.86 3h1i n GLY 318 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3h1i s LEU 319 N 0.00 0.62 -0.21 0.99 1.43 0.10 -1.71 118.68 119.90 3h1i s LEU 319 Ca 0.00 -2.15 -0.19 0.00 -1.03 0.00 0.00 54.13 50.76 3h1i s LEU 319 Cb 0.00 -0.00 -0.03 0.00 0.03 0.00 0.00 46.19 46.19 3h1i s LEU 319 CO 0.00 -0.26 0.55 0.12 0.23 0.00 0.00 176.35 176.99 3h1i s PHE 320 N 0.98 3.35 0.00 0.29 5.36 -0.53 -2.88 117.98 124.54 3h1i s PHE 320 Ca 0.21 0.79 0.00 0.00 -0.96 0.00 0.00 56.93 56.97 3h1i s PHE 320 Cb -0.15 -2.72 0.00 0.00 -0.34 0.00 0.00 43.02 39.82 3h1i s PHE 320 CO -0.04 -0.16 0.00 0.41 -1.46 0.00 0.00 175.22 173.96 3h1i n GLY 321 N 3.97 1.91 3.54 13.12 0.00 -0.93 0.11 105.19 126.92 3h1i n GLY 321 Ca -0.04 -0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.86 3h1i n GLY 321 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3h1i s PHE 322 N 0.61 -0.44 -0.04 1.61 -0.12 0.14 -3.34 117.98 116.39 3h1i s PHE 322 Ca 0.00 0.67 0.01 0.00 -0.05 0.00 0.00 56.93 57.55 3h1i s PHE 322 Cb 0.00 0.46 0.02 0.00 -0.63 0.00 0.00 43.02 42.87 3h1i s PHE 322 CO 0.00 -0.46 -0.03 -1.58 -0.05 0.00 0.00 175.22 173.10 3h1i s HIS 323 N -1.58 0.65 0.09 3.49 2.46 -0.56 -0.30 115.29 119.55 3h1i s HIS 323 Ca -0.03 -0.16 0.03 0.00 0.47 0.00 0.00 55.06 55.38 3h1i s HIS 323 Cb -0.00 -0.63 -0.03 0.00 -0.13 0.00 0.00 32.58 31.78 3h1i s HIS 323 CO 0.01 -0.20 -0.10 -0.59 -2.47 0.00 0.00 174.74 171.40 3h1i s PHE 324 N 1.07 0.99 -0.11 3.88 -0.12 -0.37 0.16 117.98 123.49 3h1i s PHE 324 Ca -0.09 -0.64 0.02 0.00 -0.05 0.00 0.00 56.93 56.17 3h1i s PHE 324 Cb -0.14 -0.55 0.01 0.00 -0.63 0.00 0.00 43.02 41.71 3h1i s PHE 324 CO -0.01 -0.02 -0.16 0.08 -0.05 0.00 0.00 175.22 175.06 3h1i s VAL 325 N -2.30 1.52 0.25 -2.49 1.01 0.15 -1.64 120.40 116.89 3h1i s VAL 325 Ca 0.03 -0.66 -0.11 0.00 0.00 0.00 0.00 61.98 61.24 3h1i s VAL 325 Cb -0.04 -1.38 -0.01 0.00 0.00 0.00 0.00 36.38 34.95 3h1i s VAL 325 CO -0.00 0.44 0.45 0.00 0.00 0.00 0.00 175.10 175.99 3h1i s ALA 326 N 0.96 -0.08 0.54 5.51 0.00 -0.93 0.82 121.76 128.58 3h1i s ALA 326 Ca -0.07 -0.98 -0.22 0.00 0.00 0.00 0.00 51.96 50.69 3h1i s ALA 326 Cb -0.15 1.10 -0.05 0.00 0.00 0.00 0.00 23.12 24.02 3h1i s ALA 326 CO -0.01 -0.83 1.37 -0.51 0.00 0.00 0.00 175.76 175.77 3h1i s ASP 327 N -3.04 5.29 0.48 0.00 1.01 -1.26 -2.40 116.67 116.75 3h1i s ASP 327 Ca 0.24 2.78 0.31 0.00 0.71 0.00 0.00 52.55 56.60 3h1i s ASP 327 Cb 0.00 -2.64 1.41 0.00 1.01 0.00 0.00 42.92 42.70 3h1i s ASP 327 CO 0.10 -1.56 1.75 1.55 0.21 0.00 0.00 175.17 177.21 3h1i h PRO 328 N 1.50 0.13 -0.76 8.23 0.13 -1.82 -2.40 132.00 137.02 3h1i h PRO 328 Ca -0.51 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 64.61 3h1i h PRO 328 Cb 1.30 -0.03 -0.00 0.00 0.13 0.00 0.00 31.00 32.40 3h1i h PRO 328 CO 0.57 0.09 0.00 1.28 -0.23 0.00 0.00 178.00 179.72 3h1i n LEU 329 N -4.38 3.81 0.00 1.56 4.77 -1.26 -4.11 117.00 117.38 3h1i n LEU 329 Ca 0.29 -1.93 0.00 0.00 -0.03 0.00 0.00 56.01 54.34 3h1i n LEU 329 Cb 1.22 -0.61 0.00 0.00 -2.33 0.00 0.00 43.42 41.70 3h1i n LEU 329 CO 0.33 0.47 0.00 -1.54 -1.33 0.00 0.00 177.39 175.32 3h1i n SER 330 N 0.36 0.00 -0.21 -1.43 3.41 -0.91 -4.87 113.62 109.97 3h1i n SER 330 Ca 0.16 0.00 0.02 0.00 -0.26 0.00 0.00 58.87 58.79 3h1i n SER 330 Cb 0.81 0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.82 3h1i n SER 330 CO 0.00 0.00 0.00 -0.38 -0.16 0.00 0.00 175.04 174.50 3h1i n ILE 331 N 0.00 -0.27 0.00 -1.33 5.41 -1.21 -1.66 119.36 120.31 3h1i n ILE 331 Ca 0.00 1.33 0.00 0.00 1.00 0.00 0.00 62.75 65.08 3h1i n ILE 331 Cb 0.00 -1.80 0.00 0.00 -0.71 0.00 0.00 39.64 37.13 3h1i n ILE 331 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 3h1i n ASP 332 N -4.90 0.00 -0.25 4.38 2.03 -1.26 -0.68 116.55 115.87 3h1i n ASP 332 Ca 0.08 0.68 0.03 0.00 0.52 0.00 0.00 54.79 56.10 3h1i n ASP 332 Cb 0.26 -0.18 0.08 0.00 -0.72 0.00 0.00 41.12 40.56 3h1i n ASP 332 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 3h1i n ASP 333 N -1.18 -0.30 0.03 1.67 8.00 -0.66 -0.38 116.55 123.72 3h1i n ASP 333 Ca 0.00 1.19 -0.04 0.00 0.71 0.00 0.00 54.79 56.66 3h1i n ASP 333 Cb 0.00 -0.34 -0.02 0.00 -0.02 0.00 0.00 41.12 40.74 3h1i n ASP 333 CO 0.00 0.00 0.00 -0.03 -0.39 0.00 0.00 177.20 176.78 3h1i h MET 334 N 0.00 -0.17 -0.99 -1.24 4.05 -1.15 0.09 114.93 115.51 3h1i h MET 334 Ca 0.31 0.01 0.11 0.00 -0.28 0.00 0.00 59.70 59.85 3h1i h MET 334 Cb 0.48 0.04 -0.13 0.00 -0.80 0.00 0.00 31.60 31.19 3h1i h MET 334 CO -0.71 -0.12 -0.51 -0.12 0.23 0.00 0.00 176.91 175.69 3h1i n MET 335 N -3.09 -0.36 -0.32 0.39 0.00 0.49 -0.93 117.12 113.30 3h1i n MET 335 Ca -0.02 1.50 -0.12 0.00 -0.00 0.00 0.00 57.70 59.06 3h1i n MET 335 Cb 0.09 -2.22 -0.10 0.00 0.00 0.00 0.00 33.22 31.00 3h1i n MET 335 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 175.97 176.32 3h1i h PHE 336 N 0.00 -1.81 -0.83 1.12 3.57 -0.12 0.31 116.94 119.17 3h1i h PHE 336 Ca 0.23 0.11 0.06 0.00 3.53 0.00 0.00 57.97 61.90 3h1i h PHE 336 Cb 0.48 0.90 -0.06 0.00 2.79 0.00 0.00 35.95 40.05 3h1i h PHE 336 CO -0.96 -0.40 0.51 0.00 -2.23 0.00 0.00 178.31 175.23 3h1i n ALA 338 N -2.35 -0.33 -0.48 0.00 0.00 0.73 -1.22 120.51 116.86 3h1i n ALA 338 Ca 0.12 0.00 0.42 0.00 0.00 0.00 0.00 53.44 53.98 3h1i n ALA 338 Cb 0.17 0.13 0.77 0.00 0.00 0.00 0.00 19.45 20.52 3h1i n ALA 338 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 3h1i h GLN 339 N 0.00 0.01 0.32 0.00 4.20 -0.42 0.84 115.11 120.05 3h1i h GLN 339 Ca 0.00 -0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 3h1i h GLN 339 Cb 0.00 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 3h1i h GLN 339 CO 0.00 0.01 -0.15 0.78 -0.67 0.00 0.00 178.83 178.79 3h1i h GLY 340 N 0.01 -0.44 0.05 3.46 0.00 -0.37 -1.46 103.07 104.31 3h1i h GLY 340 Ca 0.72 0.16 0.12 0.00 0.00 0.00 0.00 47.33 48.34 3h1i h GLY 340 CO -0.03 -0.16 0.02 0.83 0.00 0.00 0.00 176.54 177.20 3h1i h GLU 341 N -0.63 0.13 -0.11 4.80 4.39 0.21 1.41 114.58 124.80 3h1i h GLU 341 Ca -0.04 -0.01 0.04 0.00 0.34 0.00 0.00 59.36 59.69 3h1i h GLU 341 Cb 0.45 -0.03 -0.06 0.00 -0.10 0.00 0.00 28.75 29.01 3h1i h GLU 341 CO 0.07 0.09 -0.36 -1.49 -1.16 0.00 0.00 179.01 176.16 3h1i h TRP 342 N 0.14 -1.01 -0.26 4.33 6.55 -1.21 0.67 115.95 125.15 3h1i h TRP 342 Ca 0.30 0.04 0.06 0.00 0.95 0.00 0.00 58.89 60.24 3h1i h TRP 342 Cb 0.47 0.46 -0.07 0.00 -0.86 0.00 0.00 29.16 29.16 3h1i h TRP 342 CO -0.33 -0.43 -0.20 0.52 -1.05 0.00 0.00 178.44 176.94 3h1i h MET 343 N -0.45 -0.18 -0.96 0.49 2.86 0.57 0.29 114.93 117.56 3h1i h MET 343 Ca 0.08 0.01 0.20 0.00 -2.06 0.00 0.00 59.70 57.93 3h1i h MET 343 Cb 0.58 0.04 -0.08 0.00 0.06 0.00 0.00 31.60 32.20 3h1i h MET 343 CO -0.36 -0.12 0.61 -0.09 1.06 0.00 0.00 176.91 178.01 3h1i h ARG 344 N -0.19 0.57 -0.30 1.72 2.43 0.37 0.33 114.38 119.31 3h1i h ARG 344 Ca 0.14 -0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.28 3h1i h ARG 344 Cb 0.41 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.82 3h1i h ARG 344 CO -0.37 0.37 0.18 -0.07 -1.51 0.00 0.00 179.97 178.57 3h1i h LEU 345 N 0.58 0.35 0.00 3.80 3.38 0.39 0.19 115.31 124.01 3h1i h LEU 345 Ca 0.52 -0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.44 3h1i h LEU 345 Cb 1.04 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.70 3h1i h LEU 345 CO -0.26 0.30 0.00 0.00 0.09 0.00 0.00 178.44 178.56 3h1i n THR 347 N -1.15 0.00 -2.27 0.00 -2.24 -0.69 -4.72 114.28 103.21 3h1i n THR 347 Ca 0.14 0.00 0.02 0.00 -2.27 0.00 0.00 64.05 61.94 3h1i n THR 347 Cb 0.13 -0.37 0.01 0.00 -2.10 0.00 0.00 70.33 68.00 3h1i n THR 347 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3h1i n SER 348 N -1.43 0.50 -4.74 3.42 3.41 0.61 -5.08 113.62 110.31 3h1i n SER 348 Ca 0.00 -1.97 -0.42 0.00 -0.26 0.00 0.00 58.87 56.22 3h1i n SER 348 Cb 0.22 -0.23 -0.01 0.00 -0.26 0.00 0.00 64.21 63.94 3h1i n SER 348 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 3h1i n THR 349 N 0.27 1.88 -3.38 6.66 -1.04 -1.18 -4.98 114.28 112.50 3h1i n THR 349 Ca 0.02 -0.47 -0.21 0.00 -2.04 0.00 0.00 64.05 61.35 3h1i n THR 349 Cb 0.94 -1.79 0.01 0.00 -1.82 0.00 0.00 70.33 67.67 3h1i n THR 349 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 3h1i s THR 350 N -0.98 2.30 0.21 12.58 -4.23 -1.26 -4.86 115.64 119.40 3h1i s THR 350 Ca 0.55 -1.21 -0.05 0.00 -1.18 0.00 0.00 61.69 59.81 3h1i s THR 350 Cb -0.52 -2.51 0.03 0.00 1.34 0.00 0.00 72.50 70.83 3h1i s THR 350 CO 0.61 0.00 1.62 -0.33 -0.54 0.00 0.00 174.62 175.98 3h1i h GLU 351 N 0.62 0.77 -0.11 3.99 4.39 -1.99 -2.78 114.58 119.47 3h1i h GLU 351 Ca -0.36 -0.32 -0.09 0.00 0.34 0.00 0.00 59.36 58.92 3h1i h GLU 351 Cb 1.28 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.89 3h1i h GLU 351 CO 0.50 0.94 -0.34 0.77 -1.16 0.00 0.00 179.01 179.71 3h1i h SER 352 N 0.67 0.23 -0.05 1.42 0.02 -1.99 -0.86 113.55 112.99 3h1i h SER 352 Ca 0.09 -0.08 -0.01 0.00 -0.84 0.00 0.00 61.79 60.95 3h1i h SER 352 Cb 0.76 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 63.24 3h1i h SER 352 CO 0.06 0.56 0.00 -0.33 -1.14 0.00 0.00 176.83 175.99 3h1i h GLU 353 N 0.19 0.09 -0.23 3.45 5.08 -1.89 -3.02 114.58 118.25 3h1i h GLU 353 Ca 0.02 -0.03 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 3h1i h GLU 353 Cb 0.71 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.94 3h1i h GLU 353 CO 0.05 0.36 -0.01 -0.39 -1.00 0.00 0.00 179.01 178.02 3h1i h VAL 354 N -0.19 1.26 -0.87 3.13 -1.51 -1.37 -2.78 116.25 113.92 3h1i h VAL 354 Ca 0.01 -0.93 0.21 0.00 -1.23 0.00 0.00 66.70 64.77 3h1i h VAL 354 Cb 0.32 1.42 -0.16 0.00 -2.13 0.00 0.00 31.29 30.75 3h1i h VAL 354 CO 0.00 0.29 -0.02 0.50 -1.23 0.00 0.00 177.57 177.11 3h1i h LYS 355 N 0.17 0.05 0.00 5.19 3.64 -1.16 0.12 116.57 124.58 3h1i h LYS 355 Ca 0.06 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 3h1i h LYS 355 Cb 0.43 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.24 3h1i h LYS 355 CO 0.01 0.04 0.00 -2.13 -2.27 0.00 0.00 179.45 175.10 3h1i n ARG 356 N -5.44 0.00 -0.18 1.90 0.63 -1.15 -2.58 116.66 109.85 3h1i n ARG 356 Ca 0.17 0.49 -0.00 0.00 -0.92 0.00 0.00 57.85 57.59 3h1i n ARG 356 Cb 0.58 -1.40 0.02 0.00 0.45 0.00 0.00 32.46 32.11 3h1i n ARG 356 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3h1i n ALA 357 N -1.97 -0.05 -0.10 5.13 0.00 -0.72 0.23 120.51 123.03 3h1i n ALA 357 Ca 0.00 0.46 -0.13 0.00 0.00 0.00 0.00 53.44 53.78 3h1i n ALA 357 Cb 0.00 -0.21 -0.09 0.00 0.00 0.00 0.00 19.45 19.15 3h1i n ALA 357 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 3h1i h LYS 358 N 0.00 -0.37 -0.33 0.00 1.57 -0.99 1.10 116.57 117.54 3h1i h LYS 358 Ca 0.16 0.03 0.05 0.00 -1.87 0.00 0.00 60.65 59.02 3h1i h LYS 358 Cb 0.28 0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.66 3h1i h LYS 358 CO -0.46 -0.25 0.23 -0.91 -0.57 0.00 0.00 179.45 177.49 3h1i h ASN 359 N -0.39 0.20 0.10 0.86 2.35 0.31 0.15 115.58 119.16 3h1i h ASN 359 Ca 0.06 -0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.80 3h1i h ASN 359 Cb 0.55 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.87 3h1i h ASN 359 CO -0.51 0.13 -0.05 -0.74 -1.65 0.00 0.00 177.43 174.61 3h1i h HIS 360 N 0.23 -0.13 -0.41 1.19 2.76 0.12 -3.03 115.15 115.88 3h1i h HIS 360 Ca 0.15 -0.00 0.08 0.00 -2.20 0.00 0.00 60.37 58.39 3h1i h HIS 360 Cb 0.30 0.04 -0.07 0.00 1.55 0.00 0.00 27.41 29.23 3h1i h HIS 360 CO -0.00 0.33 -0.02 1.25 -1.30 0.00 0.00 177.93 178.19 3h1i h LEU 361 N -0.65 -0.20 -0.63 0.26 5.85 0.19 -1.54 115.31 118.58 3h1i h LEU 361 Ca -0.01 0.10 0.13 0.00 0.84 0.00 0.00 57.88 58.93 3h1i h LEU 361 Cb 0.51 0.18 -0.12 0.00 0.37 0.00 0.00 40.66 41.61 3h1i h LEU 361 CO 0.02 -0.06 -0.12 0.03 -0.34 0.00 0.00 178.44 177.97 3h1i h ARG 362 N 0.09 0.03 0.03 1.25 3.08 -0.77 0.93 114.38 119.02 3h1i h ARG 362 Ca 0.20 -0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.26 3h1i h ARG 362 Cb 0.29 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 30.31 3h1i h ARG 362 CO -0.35 0.02 -0.12 0.77 -1.07 0.00 0.00 179.97 179.22 3h1i h SER 363 N 0.03 -0.34 -0.89 7.04 0.02 -1.16 -1.02 113.55 117.22 3h1i h SER 363 Ca 0.31 0.05 0.05 0.00 -0.84 0.00 0.00 61.79 61.36 3h1i h SER 363 Cb 0.49 0.14 -0.06 0.00 0.14 0.00 0.00 62.40 63.11 3h1i h SER 363 CO -0.63 -0.17 0.57 0.00 -1.14 0.00 0.00 176.83 175.46 3h1i h ALA 364 N 0.72 1.21 -0.70 3.77 0.00 -1.10 0.68 119.26 123.85 3h1i h ALA 364 Ca 0.03 -0.02 0.15 0.00 0.00 0.00 0.00 54.91 55.07 3h1i h ALA 364 Cb 0.25 -0.28 -0.12 0.00 0.00 0.00 0.00 17.79 17.65 3h1i h ALA 364 CO -0.10 0.37 0.01 1.98 0.00 0.00 0.00 179.25 181.52 3h1i h MET 365 N 1.07 0.12 0.01 0.00 -1.53 -0.10 0.16 114.93 114.66 3h1i h MET 365 Ca 0.37 -0.01 -0.00 0.00 -3.44 0.00 0.00 59.70 56.63 3h1i h MET 365 Cb 0.09 -0.03 0.00 0.00 -0.55 0.00 0.00 31.60 31.12 3h1i h MET 365 CO -0.15 0.08 -0.00 0.28 0.14 0.00 0.00 176.91 177.26 3h1i h VAL 366 N 0.12 1.46 0.00 -5.77 2.07 0.30 -3.20 116.25 111.23 3h1i h VAL 366 Ca 0.37 -1.41 0.00 0.00 0.82 0.00 0.00 66.70 66.48 3h1i h VAL 366 Cb 0.63 2.41 0.00 0.00 -1.52 0.00 0.00 31.29 32.82 3h1i h VAL 366 CO -0.60 0.36 0.05 0.00 0.02 0.00 0.00 177.57 177.41 3h1i n ALA 367 N -2.41 0.96 0.19 1.67 0.00 0.22 0.63 120.51 121.76 3h1i n ALA 367 Ca -0.09 0.14 0.09 0.00 0.00 0.00 0.00 53.44 53.58 3h1i n ALA 367 Cb 0.30 -1.15 0.12 0.00 0.00 0.00 0.00 19.45 18.72 3h1i n ALA 367 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 3h1i h GLN 368 N 0.00 0.00 -2.38 0.00 1.08 -0.72 -3.28 115.11 109.81 3h1i h GLN 368 Ca 0.00 0.00 -0.69 0.00 -1.45 0.00 0.00 58.65 56.51 3h1i h GLN 368 Cb 0.10 0.00 -0.36 0.00 -0.05 0.00 0.00 27.48 27.17 3h1i h GLN 368 CO 0.00 0.15 0.04 1.28 -0.95 0.00 0.00 178.83 179.35 3h1i n LEU 369 N -3.12 5.34 -3.90 1.46 4.77 0.20 -4.22 117.00 117.54 3h1i n LEU 369 Ca 0.03 -5.46 -0.29 0.00 -0.03 0.00 0.00 56.01 50.25 3h1i n LEU 369 Cb 0.60 -0.87 -0.13 0.00 -2.33 0.00 0.00 43.42 40.69 3h1i n LEU 369 CO 0.36 2.08 -0.13 -0.62 -1.33 0.00 0.00 177.39 177.75 3h1i s ASP 370 N -2.40 4.40 0.00 -1.43 2.15 -1.24 -4.90 116.67 113.25 3h1i s ASP 370 Ca 0.41 -3.31 0.00 0.00 0.43 0.00 0.00 52.55 50.08 3h1i s ASP 370 Cb 0.18 -1.57 0.00 0.00 -0.30 0.00 0.00 42.92 41.23 3h1i s ASP 370 CO -0.05 -0.18 0.00 0.61 -0.17 0.00 0.00 175.17 175.38 3h1i n GLY 371 N 2.70 -0.24 0.00 2.66 0.00 -1.26 -4.67 105.19 104.38 3h1i n GLY 371 Ca 0.11 -2.24 -0.00 0.00 0.00 0.00 0.00 46.02 43.89 3h1i n GLY 371 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3h1i h THR 372 N 0.00 0.00 -0.93 2.61 1.35 -1.95 -3.27 112.91 110.73 3h1i h THR 372 Ca 0.00 -0.05 0.09 0.00 -0.55 0.00 0.00 66.41 65.90 3h1i h THR 372 Cb 0.00 0.00 -0.12 0.00 -1.73 0.00 0.00 68.15 66.30 3h1i h THR 372 CO 0.00 0.00 -0.52 0.41 -0.25 0.00 0.00 175.52 175.16 3h1i n THR 373 N -2.17 -0.61 -0.16 6.82 -1.04 -1.26 -0.91 114.28 114.95 3h1i n THR 373 Ca -0.00 2.24 -0.10 0.00 -2.04 0.00 0.00 64.05 64.15 3h1i n THR 373 Cb 0.00 -2.80 -0.05 0.00 -1.82 0.00 0.00 70.33 65.66 3h1i n THR 373 CO 0.00 0.00 0.00 -0.65 -0.64 0.00 0.00 175.07 173.78 3h1i h PRO 374 N 0.00 -0.29 -0.10 -2.82 0.11 -1.83 0.10 132.00 127.18 3h1i h PRO 374 Ca 0.18 0.02 0.04 0.00 0.11 0.00 0.00 66.00 66.35 3h1i h PRO 374 Cb 0.41 0.07 -0.06 0.00 0.11 0.00 0.00 31.00 31.53 3h1i h PRO 374 CO -0.88 -0.19 -0.45 0.28 -0.21 0.00 0.00 178.00 176.55 3h1i h VAL 375 N -0.30 0.11 -0.87 3.15 2.07 -1.07 -0.38 116.25 118.97 3h1i h VAL 375 Ca 0.14 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.85 3h1i h VAL 375 Cb 0.58 0.11 -0.11 0.00 -1.52 0.00 0.00 31.29 30.35 3h1i h VAL 375 CO -0.63 0.00 0.41 0.00 0.02 0.00 0.00 177.57 177.37 3h1i h GLU 377 N 0.51 -0.38 -0.51 0.00 4.57 0.53 0.68 114.58 119.98 3h1i h GLU 377 Ca 0.51 0.03 0.10 0.00 -1.18 0.00 0.00 59.36 58.81 3h1i h GLU 377 Cb 0.85 0.09 -0.08 0.00 -0.16 0.00 0.00 28.75 29.44 3h1i h GLU 377 CO -0.44 -0.25 0.01 1.15 -1.18 0.00 0.00 179.01 178.29 3h1i h THR 378 N -0.39 0.61 0.26 0.32 2.02 0.54 0.29 112.91 116.56 3h1i h THR 378 Ca -0.02 -0.04 -0.01 0.00 0.77 0.00 0.00 66.41 67.11 3h1i h THR 378 Cb 0.34 0.47 0.00 0.00 -1.74 0.00 0.00 68.15 67.23 3h1i h THR 378 CO 0.00 0.02 -0.13 0.40 0.37 0.00 0.00 175.52 176.19 3h1i h ILE 379 N 0.12 0.79 -0.83 3.11 2.04 -0.60 1.44 117.51 123.57 3h1i h ILE 379 Ca 0.26 -0.48 0.21 0.00 1.00 0.00 0.00 64.86 65.84 3h1i h ILE 379 Cb 0.39 1.05 -0.14 0.00 -0.74 0.00 0.00 36.82 37.38 3h1i h ILE 379 CO -0.42 0.10 0.07 1.23 0.00 0.00 0.00 178.15 179.14 3h1i h GLY 380 N -0.61 1.06 1.55 5.37 0.00 1.00 0.22 103.07 111.66 3h1i h GLY 380 Ca -0.04 0.08 -0.01 0.00 0.00 0.00 0.00 47.33 47.36 3h1i h GLY 380 CO 0.06 -0.35 -0.49 1.76 0.00 0.00 0.00 176.54 177.52 3h1i h SER 381 N 0.12 0.00 0.37 0.19 0.02 -0.17 -3.14 113.55 110.94 3h1i h SER 381 Ca 0.48 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.42 3h1i h SER 381 Cb 0.92 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.46 3h1i h SER 381 CO -0.71 0.05 -0.18 0.45 -1.14 0.00 0.00 176.83 175.30 3h1i h HIS 382 N 0.00 -0.46 -0.52 3.45 -0.00 0.53 -2.39 115.15 115.76 3h1i h HIS 382 Ca -0.01 -0.01 0.04 0.00 -0.00 0.00 0.00 60.37 60.39 3h1i h HIS 382 Cb 1.04 0.15 -0.04 0.00 -0.00 0.00 0.00 27.41 28.56 3h1i h HIS 382 CO 0.00 -0.13 0.28 -0.07 -0.00 0.00 0.00 177.93 178.01 3h1i h LEU 383 N -0.89 0.42 -1.34 2.43 3.38 -0.87 0.19 115.31 118.63 3h1i h LEU 383 Ca -0.05 0.02 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 3h1i h LEU 383 Cb 0.54 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.20 3h1i h LEU 383 CO 0.08 0.29 0.25 0.25 0.09 0.00 0.00 178.44 179.40 3h1i h LEU 384 N 0.55 0.62 0.00 1.67 5.85 -1.59 -2.84 115.31 119.57 3h1i h LEU 384 Ca 0.22 -0.05 -0.26 0.00 0.84 0.00 0.00 57.88 58.64 3h1i h LEU 384 Cb 0.10 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 40.94 3h1i h LEU 384 CO -0.14 0.53 -1.84 0.59 -0.34 0.00 0.00 178.44 177.24 3h1i n ASN 385 N -4.39 1.10 0.06 1.25 3.02 -0.90 -4.72 115.26 110.68 3h1i n ASN 385 Ca 0.04 0.19 0.13 0.00 -0.03 0.00 0.00 54.58 54.91 3h1i n ASN 385 Cb 0.12 -0.46 0.40 0.00 -0.61 0.00 0.00 39.78 39.23 3h1i n ASN 385 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 3h1i n TYR 386 N -3.70 0.52 0.00 3.10 4.01 0.64 -4.77 117.16 116.95 3h1i n TYR 386 Ca -0.30 0.15 0.00 0.00 -0.16 0.00 0.00 57.90 57.59 3h1i n TYR 386 Cb 0.71 -0.70 0.00 0.00 -0.31 0.00 0.00 39.34 39.04 3h1i n TYR 386 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3h1i n GLY 387 N 1.38 2.64 0.00 2.72 0.00 -1.00 -4.96 105.19 105.97 3h1i n GLY 387 Ca 0.05 -0.69 0.00 0.00 0.00 0.00 0.00 46.02 45.39 3h1i n GLY 387 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3h1i n ARG 388 N 0.00 3.89 -4.60 1.61 0.00 -1.26 -4.50 116.66 111.80 3h1i n ARG 388 Ca 0.00 0.00 -0.33 0.00 -0.00 0.00 0.00 57.85 57.52 3h1i n ARG 388 Cb 0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 32.46 32.31 3h1i n ARG 388 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.63 178.13 3h1i s ARG 389 N 2.40 3.26 -0.43 2.89 6.06 -1.26 -2.18 118.95 129.70 3h1i s ARG 389 Ca 0.00 -0.73 -0.16 0.00 -2.50 0.00 0.00 55.73 52.34 3h1i s ARG 389 Cb 0.00 -2.63 0.03 0.00 0.06 0.00 0.00 34.95 32.41 3h1i s ARG 389 CO 0.00 0.07 0.38 0.42 -2.50 0.00 0.00 175.30 173.67 3h1i s ILE 390 N 0.69 5.18 0.77 4.11 1.01 -1.26 -5.03 121.20 126.67 3h1i s ILE 390 Ca -0.07 -0.60 -0.11 0.00 0.00 0.00 0.00 60.65 59.88 3h1i s ILE 390 Cb -0.16 -4.01 0.05 0.00 0.01 0.00 0.00 42.46 38.36 3h1i s ILE 390 CO 0.02 -0.41 1.08 -0.94 0.00 0.00 0.00 174.94 174.69 3h1i s SER 391 N 1.89 4.58 0.23 3.58 1.04 -1.26 -4.82 113.70 118.94 3h1i s SER 391 Ca 0.08 1.72 -0.03 0.00 0.48 0.00 0.00 55.95 58.20 3h1i s SER 391 Cb -0.19 -2.46 0.23 0.00 0.10 0.00 0.00 66.02 63.70 3h1i s SER 391 CO 0.11 -1.97 1.65 -0.07 0.98 0.00 0.00 173.24 173.94 3h1i h LEU 392 N -1.08 0.74 -0.85 2.42 3.38 -1.97 -0.39 115.31 117.56 3h1i h LEU 392 Ca -0.44 -0.26 0.11 0.00 0.09 0.00 0.00 57.88 57.38 3h1i h LEU 392 Cb 1.23 -0.20 -0.08 0.00 0.09 0.00 0.00 40.66 41.70 3h1i h LEU 392 CO 0.53 0.94 0.48 -0.08 0.09 0.00 0.00 178.44 180.39 3h1i h GLU 393 N 0.64 0.74 0.15 1.13 4.81 -1.93 0.76 114.58 120.88 3h1i h GLU 393 Ca 0.09 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.27 3h1i h GLU 393 Cb 0.71 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 29.92 3h1i h GLU 393 CO 0.05 0.49 -0.07 1.49 -0.73 0.00 0.00 179.01 180.24 3h1i h GLU 394 N 0.76 -0.20 -0.66 1.92 4.81 -1.78 -2.91 114.58 116.53 3h1i h GLU 394 Ca 0.42 0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.75 3h1i h GLU 394 Cb 0.46 0.04 -0.10 0.00 0.63 0.00 0.00 28.75 29.79 3h1i h GLU 394 CO -0.28 -0.13 -0.31 0.91 -0.73 0.00 0.00 179.01 178.47 3h1i n TRP 395 N -2.78 -0.10 -0.23 0.92 5.03 -0.21 0.53 117.44 120.60 3h1i n TRP 395 Ca -0.03 0.81 0.00 0.00 3.03 0.00 0.00 57.50 61.32 3h1i n TRP 395 Cb 0.08 -0.67 0.07 0.00 -1.03 0.00 0.00 31.31 29.76 3h1i n TRP 395 CO 0.00 0.00 0.00 0.22 -0.03 0.00 0.00 177.69 177.88 3h1i h ASP 396 N 0.00 -0.69 0.29 -0.99 1.82 -0.85 -1.36 116.42 114.64 3h1i h ASP 396 Ca 0.18 0.21 0.00 0.00 -0.39 0.00 0.00 57.03 57.03 3h1i h ASP 396 Cb 0.34 0.44 -0.04 0.00 0.68 0.00 0.00 39.33 40.76 3h1i h ASP 396 CO -0.64 -0.24 -0.51 -1.28 -1.61 0.00 0.00 179.24 174.97 3h1i h SER 397 N -0.01 -1.47 -1.13 2.28 0.87 0.29 0.19 113.55 114.56 3h1i h SER 397 Ca 0.32 0.14 0.33 0.00 -1.23 0.00 0.00 61.79 61.35 3h1i h SER 397 Cb 0.51 0.52 -0.05 0.00 -0.44 0.00 0.00 62.40 62.94 3h1i h SER 397 CO -0.71 -0.60 0.99 0.03 -0.53 0.00 0.00 176.83 176.00 3h1i h ARG 398 N -0.86 0.00 0.05 2.24 3.08 -0.95 0.07 114.38 118.02 3h1i h ARG 398 Ca -0.03 0.00 -0.23 0.00 0.07 0.00 0.00 59.98 59.79 3h1i h ARG 398 Cb 0.81 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.84 3h1i h ARG 398 CO -0.18 0.00 -1.25 0.82 -1.07 0.00 0.00 179.97 178.29 3h1i h ILE 399 N 0.00 1.02 0.00 2.04 2.04 -0.27 -3.30 117.51 119.03 3h1i h ILE 399 Ca 0.54 -2.28 0.00 0.00 1.00 0.00 0.00 64.86 64.11 3h1i h ILE 399 Cb 2.50 2.54 0.00 0.00 -0.74 0.00 0.00 36.82 41.12 3h1i h ILE 399 CO -0.01 0.53 0.05 0.28 0.00 0.00 0.00 178.15 179.01 3h1i h SER 400 N -0.66 0.00 0.29 1.72 0.02 0.12 -2.35 113.55 112.69 3h1i h SER 400 Ca -0.30 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.63 3h1i h SER 400 Cb 1.49 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.04 3h1i h SER 400 CO -0.07 0.00 -0.14 0.00 -1.14 0.00 0.00 176.83 175.48 3h1i h ALA 401 N 1.88 -0.40 -1.50 3.77 0.00 -1.35 -3.46 119.26 118.21 3h1i h ALA 401 Ca 0.00 -0.16 -0.68 0.00 0.00 0.00 0.00 54.91 54.08 3h1i h ALA 401 Cb 0.09 0.15 0.08 0.00 0.00 0.00 0.00 17.79 18.11 3h1i h ALA 401 CO 0.00 -0.41 0.12 0.28 0.00 0.00 0.00 179.25 179.24 3h1i n VAL 402 N -5.04 0.88 -4.18 0.00 0.31 -0.89 -5.00 118.33 104.41 3h1i n VAL 402 Ca -0.07 -0.22 -0.15 0.00 -0.01 0.00 0.00 64.34 63.90 3h1i n VAL 402 Cb 0.23 -0.56 -0.05 0.00 -0.91 0.00 0.00 33.84 32.54 3h1i n VAL 402 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 3h1i n ASP 403 N 1.92 -0.63 0.00 4.52 5.75 -1.26 -4.98 116.55 121.87 3h1i n ASP 403 Ca 0.16 -2.67 0.00 0.00 -0.01 0.00 0.00 54.79 52.28 3h1i n ASP 403 Cb 0.21 1.40 0.00 0.00 -1.03 0.00 0.00 41.12 41.71 3h1i n ASP 403 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3h1i n ALA 404 N -1.22 0.00 -0.05 2.12 0.00 -1.26 -2.18 120.51 117.92 3h1i n ALA 404 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.35 3h1i n ALA 404 Cb 0.47 0.13 0.01 0.00 0.00 0.00 0.00 19.45 20.05 3h1i n ALA 404 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 3h1i n ARG 405 N -0.64 -0.03 0.33 0.00 3.00 -1.26 0.11 116.66 118.17 3h1i n ARG 405 Ca 0.00 0.21 -0.18 0.00 -0.00 0.00 0.00 57.85 57.89 3h1i n ARG 405 Cb 0.00 -0.32 -0.09 0.00 0.00 0.00 0.00 32.46 32.05 3h1i n ARG 405 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 177.63 179.61 3h1i h MET 406 N 0.00 -0.99 -0.59 -0.14 4.05 -1.91 -0.83 114.93 114.53 3h1i h MET 406 Ca 0.05 0.07 0.11 0.00 -0.28 0.00 0.00 59.70 59.65 3h1i h MET 406 Cb 0.09 0.22 -0.11 0.00 -0.80 0.00 0.00 31.60 31.00 3h1i h MET 406 CO -0.14 -0.66 -0.28 0.28 0.23 0.00 0.00 176.91 176.34 3h1i h VAL 407 N -1.02 0.23 -0.00 -5.77 2.07 0.13 0.26 116.25 112.15 3h1i h VAL 407 Ca -0.08 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.44 3h1i h VAL 407 Cb 0.85 0.23 -0.00 0.00 -1.52 0.00 0.00 31.29 30.85 3h1i h VAL 407 CO 0.02 0.00 -0.02 0.03 0.02 0.00 0.00 177.57 177.62 3h1i h ARG 408 N -0.12 -0.02 -0.88 1.57 3.08 -1.16 0.15 114.38 117.00 3h1i h ARG 408 Ca 0.25 0.00 0.13 0.00 0.07 0.00 0.00 59.98 60.43 3h1i h ARG 408 Cb 0.53 0.00 -0.14 0.00 0.08 0.00 0.00 29.97 30.44 3h1i h ARG 408 CO -0.66 -0.01 -0.41 -0.44 -1.07 0.00 0.00 179.97 177.38 3h1i h ASP 409 N -0.02 -1.48 -0.11 7.04 3.32 -0.41 0.29 116.42 125.04 3h1i h ASP 409 Ca 0.00 0.29 0.02 0.00 0.02 0.00 0.00 57.03 57.36 3h1i h ASP 409 Cb 0.02 0.74 -0.02 0.00 0.22 0.00 0.00 39.33 40.29 3h1i h ASP 409 CO -0.01 -0.29 -0.02 0.58 -1.72 0.00 0.00 179.24 177.78 3h1i h VAL 410 N -0.06 0.90 -0.57 -1.35 2.07 -0.17 1.08 116.25 118.15 3h1i h VAL 410 Ca 0.29 -0.00 -0.08 0.00 0.82 0.00 0.00 66.70 67.72 3h1i h VAL 410 Cb 0.56 0.88 -0.02 0.00 -1.52 0.00 0.00 31.29 31.20 3h1i h VAL 410 CO -0.89 0.00 0.03 0.00 0.02 0.00 0.00 177.57 176.73 3h1i h SER 412 N 0.87 -0.08 -0.78 0.00 0.02 -0.08 1.37 113.55 114.88 3h1i h SER 412 Ca 0.17 0.03 0.16 0.00 -0.84 0.00 0.00 61.79 61.31 3h1i h SER 412 Cb 0.50 0.07 -0.15 0.00 0.14 0.00 0.00 62.40 62.96 3h1i h SER 412 CO 0.02 -0.02 -0.20 0.50 -1.14 0.00 0.00 176.83 175.99 3h1i h LYS 413 N 0.03 -0.00 0.00 3.45 3.64 0.21 -2.57 116.57 121.32 3h1i h LYS 413 Ca 0.07 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.45 3h1i h LYS 413 Cb 0.09 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 3h1i h LYS 413 CO -0.12 -0.00 -1.54 0.66 -2.27 0.00 0.00 179.45 176.17 3h1i n TYR 414 N -5.51 0.00 -0.08 1.91 4.02 -0.53 -4.76 117.16 112.22 3h1i n TYR 414 Ca 0.11 0.00 -0.10 0.00 -0.01 0.00 0.00 57.90 57.90 3h1i n TYR 414 Cb 0.40 -0.29 -0.09 0.00 -0.02 0.00 0.00 39.34 39.34 3h1i n TYR 414 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 176.86 174.96 3h1i n ILE 415 N -1.92 0.92 -1.90 -0.72 5.41 0.46 -4.76 119.36 116.85 3h1i n ILE 415 Ca -0.01 -0.43 -0.42 0.00 1.00 0.00 0.00 62.75 62.89 3h1i n ILE 415 Cb 0.43 -0.92 -0.03 0.00 -0.71 0.00 0.00 39.64 38.41 3h1i n ILE 415 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 176.55 176.08 3h1i s TYR 416 N -2.32 2.01 -1.30 1.39 5.04 -0.98 -3.28 117.35 117.90 3h1i s TYR 416 Ca -0.16 0.10 -0.03 0.00 -2.44 0.00 0.00 57.07 54.54 3h1i s TYR 416 Cb 0.05 -4.01 0.02 0.00 0.35 0.00 0.00 41.96 38.37 3h1i s TYR 416 CO 0.44 -4.24 0.19 -3.47 -1.34 0.00 0.00 175.55 167.13 3h1i n ASP 417 N 6.58 -4.55 -4.89 4.32 4.64 -0.92 -4.97 116.55 116.76 3h1i n ASP 417 Ca 0.17 -0.03 -0.34 0.00 -1.38 0.00 0.00 54.79 53.21 3h1i n ASP 417 Cb 0.41 -3.79 -0.05 0.00 -1.04 0.00 0.00 41.12 36.65 3h1i n ASP 417 CO 0.00 0.00 0.00 -0.54 -0.82 0.00 0.00 177.20 175.84 3h1i s LYS 418 N -5.34 3.54 -0.03 -0.67 -0.14 -1.21 -5.04 119.74 110.86 3h1i s LYS 418 Ca 0.13 -0.15 -0.30 0.00 -1.36 0.00 0.00 55.97 54.29 3h1i s LYS 418 Cb -0.06 -3.07 -0.03 0.00 -1.68 0.00 0.00 37.83 32.99 3h1i s LYS 418 CO 0.16 0.64 1.12 0.00 -0.76 0.00 0.00 175.35 176.51 3h1i s PRO 420 N 1.68 2.47 -0.18 0.00 0.04 -1.26 -4.42 135.00 133.33 3h1i s PRO 420 Ca 0.54 -1.61 -0.08 0.00 0.04 0.00 0.00 61.00 59.89 3h1i s PRO 420 Cb -0.24 -2.48 -0.04 0.00 0.04 0.00 0.00 34.50 31.78 3h1i s PRO 420 CO 0.24 -0.50 0.09 0.00 0.04 0.00 0.00 177.00 176.87 3h1i s ALA 421 N -2.57 3.53 -0.04 8.56 0.00 0.18 -1.44 121.76 129.99 3h1i s ALA 421 Ca 0.51 -0.72 0.06 0.00 0.00 0.00 0.00 51.96 51.81 3h1i s ALA 421 Cb -0.05 -1.99 -0.02 0.00 0.00 0.00 0.00 23.12 21.06 3h1i s ALA 421 CO 0.31 0.22 -0.21 -1.17 0.00 0.00 0.00 175.76 174.91 3h1i s LEU 422 N 0.21 2.33 -0.20 0.00 2.96 0.24 -1.24 118.68 122.98 3h1i s LEU 422 Ca 0.06 -0.37 -0.01 0.00 -0.22 0.00 0.00 54.13 53.59 3h1i s LEU 422 Cb -0.12 -1.43 0.05 0.00 0.50 0.00 0.00 46.19 45.19 3h1i s LEU 422 CO -0.00 0.31 -0.03 0.00 -1.32 0.00 0.00 176.35 175.31 3h1i s ALA 423 N -0.52 1.54 -0.04 5.97 0.00 0.17 -1.95 121.76 126.94 3h1i s ALA 423 Ca 0.07 -1.00 0.06 0.00 0.00 0.00 0.00 51.96 51.09 3h1i s ALA 423 Cb -0.11 -1.26 -0.01 0.00 0.00 0.00 0.00 23.12 21.74 3h1i s ALA 423 CO 0.01 -1.04 -0.23 0.00 0.00 0.00 0.00 175.76 174.50 3h1i s ALA 424 N 1.60 1.93 -0.04 0.00 0.00 -0.62 -1.12 121.76 123.52 3h1i s ALA 424 Ca -0.02 -0.96 -0.04 0.00 0.00 0.00 0.00 51.96 50.94 3h1i s ALA 424 Cb -0.17 -0.56 0.01 0.00 0.00 0.00 0.00 23.12 22.41 3h1i s ALA 424 CO -0.07 0.42 0.11 0.08 0.00 0.00 0.00 175.76 176.30 3h1i s VAL 425 N -0.30 -0.01 0.00 0.00 1.01 -0.69 -0.11 120.40 120.30 3h1i s VAL 425 Ca 0.02 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.03 3h1i s VAL 425 Cb -0.11 -0.17 0.00 0.00 0.00 0.00 0.00 36.38 36.10 3h1i s VAL 425 CO 0.01 0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.73 3h1i n GLY 426 N 3.21 -0.18 2.62 4.51 0.00 -0.45 -0.27 105.19 114.63 3h1i n GLY 426 Ca -0.15 -1.93 -0.41 0.00 0.00 0.00 0.00 46.02 43.53 3h1i n GLY 426 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3h1i n PRO 427 N 0.00 3.68 -0.14 1.61 -0.04 -0.97 -0.52 135.00 138.63 3h1i n PRO 427 Ca 0.00 -2.99 0.02 0.00 -0.04 0.00 0.00 63.50 60.49 3h1i n PRO 427 Cb 0.00 -2.92 0.08 0.00 -0.04 0.00 0.00 33.50 30.62 3h1i n PRO 427 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 3h1i n ILE 428 N 3.44 0.40 -0.26 0.52 -5.35 -1.26 -4.59 119.36 112.26 3h1i n ILE 428 Ca 0.57 -0.26 0.01 0.00 -0.27 0.00 0.00 62.75 62.80 3h1i n ILE 428 Cb 0.31 -0.16 0.08 0.00 -1.74 0.00 0.00 39.64 38.13 3h1i n ILE 428 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 3h1i h GLU 429 N 0.90 -0.01 -0.63 6.28 4.81 -1.88 -2.50 114.58 121.55 3h1i h GLU 429 Ca 0.00 0.00 0.11 0.00 -0.13 0.00 0.00 59.36 59.34 3h1i h GLU 429 Cb 0.51 0.00 -0.08 0.00 0.63 0.00 0.00 28.75 29.81 3h1i h GLU 429 CO 0.05 -0.01 0.19 0.37 -0.73 0.00 0.00 179.01 178.88 3h1i h GLN 430 N -0.01 0.32 -6.20 1.92 4.15 -1.81 -3.40 115.11 110.08 3h1i h GLN 430 Ca 0.35 -0.02 -0.56 0.00 0.77 0.00 0.00 58.65 59.19 3h1i h GLN 430 Cb 0.55 -0.07 -0.04 0.00 0.21 0.00 0.00 27.48 28.13 3h1i h GLN 430 CO -0.77 0.21 0.71 -1.17 -1.93 0.00 0.00 178.83 175.88 3h1i s LEU 431 N -10.48 4.20 0.22 -2.39 2.96 -0.94 -4.74 118.68 107.51 3h1i s LEU 431 Ca -0.13 1.58 -0.07 0.00 -0.22 0.00 0.00 54.13 55.29 3h1i s LEU 431 Cb 0.18 -3.55 -0.02 0.00 0.50 0.00 0.00 46.19 43.30 3h1i s LEU 431 CO 0.75 -0.59 0.29 -0.22 -1.32 0.00 0.00 176.35 175.26 3h1i s LEU 432 N 2.62 0.78 0.13 -0.68 0.20 -1.26 -5.01 118.68 115.46 3h1i s LEU 432 Ca 0.50 -1.15 0.00 0.00 0.69 0.00 0.00 54.13 54.17 3h1i s LEU 432 Cb -0.19 1.05 0.00 0.00 -0.43 0.00 0.00 46.19 46.61 3h1i s LEU 432 CO 0.15 -0.97 0.00 -0.67 -0.29 0.00 0.00 176.35 174.57 3h1i n ASP 433 N -0.31 -6.49 -0.04 3.68 4.64 -1.26 -4.43 116.55 112.34 3h1i n ASP 433 Ca -0.00 1.36 -0.10 0.00 -1.38 0.00 0.00 54.79 54.66 3h1i n ASP 433 Cb 0.64 -4.11 -0.04 0.00 -1.04 0.00 0.00 41.12 36.57 3h1i n ASP 433 CO 0.00 0.00 0.00 0.22 -0.82 0.00 0.00 177.20 176.60 3h1i h TYR 434 N 4.09 0.24 -0.91 -0.67 3.20 -1.98 -1.29 116.97 119.64 3h1i h TYR 434 Ca 0.00 0.00 0.11 0.00 3.14 0.00 0.00 58.73 61.98 3h1i h TYR 434 Cb 0.00 -0.08 -0.13 0.00 1.54 0.00 0.00 36.73 38.06 3h1i h TYR 434 CO 0.00 0.17 -0.45 0.09 -1.64 0.00 0.00 178.16 176.33 3h1i n ASN 435 N -4.94 -0.78 -0.01 -2.11 3.02 -1.26 0.25 115.26 109.42 3h1i n ASN 435 Ca -0.04 1.61 -0.11 0.00 -0.03 0.00 0.00 54.58 56.02 3h1i n ASN 435 Cb 0.04 -0.29 -0.05 0.00 -0.61 0.00 0.00 39.78 38.88 3h1i n ASN 435 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 3h1i h ARG 436 N 0.00 0.16 -0.90 3.52 2.47 -1.73 0.11 114.38 118.00 3h1i h ARG 436 Ca 0.23 -0.01 0.06 0.00 -1.26 0.00 0.00 59.98 59.00 3h1i h ARG 436 Cb 0.46 -0.04 -0.06 0.00 -1.65 0.00 0.00 29.97 28.68 3h1i h ARG 436 CO -0.88 0.10 0.57 0.82 0.56 0.00 0.00 179.97 181.14 3h1i h ILE 437 N 0.16 1.07 0.49 2.04 2.04 0.13 -2.10 117.51 121.34 3h1i h ILE 437 Ca 0.05 -0.36 -0.01 0.00 1.00 0.00 0.00 64.86 65.54 3h1i h ILE 437 Cb -0.01 -0.07 -0.02 0.00 -0.74 0.00 0.00 36.82 35.98 3h1i h ILE 437 CO -0.02 0.19 -0.40 -0.09 0.00 0.00 0.00 178.15 177.83 3h1i h ARG 438 N 1.05 -0.85 -1.13 2.37 9.65 0.42 -0.93 114.38 124.96 3h1i h ARG 438 Ca 0.39 0.06 0.33 0.00 -1.10 0.00 0.00 59.98 59.65 3h1i h ARG 438 Cb 0.14 0.19 -0.05 0.00 -1.39 0.00 0.00 29.97 28.87 3h1i h ARG 438 CO -0.16 -0.57 0.90 0.77 2.80 0.00 0.00 179.97 183.70 3h1i h SER 439 N -0.89 0.00 0.00 -3.80 0.02 -0.21 0.67 113.55 109.34 3h1i h SER 439 Ca -0.05 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 3h1i h SER 439 Cb 0.76 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.30 3h1i h SER 439 CO -0.01 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.29 3h1i n GLY 440 N -1.73 0.37 0.84 -3.77 0.00 -0.35 -2.97 105.19 97.56 3h1i n GLY 440 Ca 0.24 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.37 3h1i n GLY 440 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 3h1i n MET 441 N -0.12 1.93 -3.79 1.61 2.00 0.23 -4.76 117.12 114.22 3h1i n MET 441 Ca 0.00 -1.74 -0.12 0.00 0.00 0.00 0.00 57.70 55.84 3h1i n MET 441 Cb 0.11 -1.41 -0.09 0.00 0.00 0.00 0.00 33.22 31.84 3h1i n MET 441 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 175.97 177.49 3h1i s TYR 442 N -1.78 -0.10 -0.03 2.03 -0.85 -1.16 -2.17 117.35 113.28 3h1i s TYR 442 Ca 0.25 0.09 -0.02 0.00 -0.52 0.00 0.00 57.07 56.86 3h1i s TYR 442 Cb 0.18 0.06 0.01 0.00 0.38 0.00 0.00 41.96 42.58 3h1i s TYR 442 CO 0.27 -0.40 0.04 1.87 -1.52 0.00 0.00 175.55 175.81 3h1i n TRP 443 N 1.10 -0.72 0.63 -3.49 -0.00 -1.26 -5.06 117.44 108.64 3h1i n TRP 443 Ca -0.21 0.41 0.05 0.00 -0.00 0.00 0.00 57.50 57.75 3h1i n TRP 443 Cb 0.57 -1.89 0.30 0.00 -0.00 0.00 0.00 31.31 30.28 3h1i n TRP 443 CO 0.00 0.00 0.00 0.44 -0.00 0.00 0.00 177.69 178.13