#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b1i s GLN 5 N 0.00 4.13 0.58 5.56 0.74 -1.26 -4.96 119.66 124.45 2b1i s GLN 5 Ca 0.00 2.61 -0.07 0.00 0.05 0.00 0.00 55.36 57.95 2b1i s GLN 5 Cb 0.00 -3.36 -0.01 0.00 1.10 0.00 0.00 33.01 30.74 2b1i s GLN 5 CO 0.00 -0.81 0.91 -0.65 -0.55 0.00 0.00 175.29 174.19 2b1i s GLN 6 N 2.03 3.21 0.11 1.67 -0.21 -1.26 -4.72 119.66 120.48 2b1i s GLN 6 Ca 0.78 0.23 0.08 0.00 0.02 0.00 0.00 55.36 56.48 2b1i s GLN 6 Cb -0.48 -2.24 -0.04 0.00 1.00 0.00 0.00 33.01 31.25 2b1i s GLN 6 CO 0.34 -0.57 -0.14 -0.51 -2.12 0.00 0.00 175.29 172.29 2b1i s LEU 7 N -4.99 2.86 -0.24 2.90 1.43 0.13 -0.79 118.68 119.98 2b1i s LEU 7 Ca 0.53 -0.48 -0.06 0.00 -1.03 0.00 0.00 54.13 53.08 2b1i s LEU 7 Cb -0.11 -1.68 -0.02 0.00 0.03 0.00 0.00 46.19 44.41 2b1i s LEU 7 CO 0.47 0.18 0.03 0.00 0.23 0.00 0.00 176.35 177.26 2b1i s ALA 8 N -1.18 3.04 -0.22 4.21 0.00 0.49 0.59 121.76 128.69 2b1i s ALA 8 Ca 0.20 -1.16 -0.12 0.00 0.00 0.00 0.00 51.96 50.88 2b1i s ALA 8 Cb -0.11 -1.95 -0.05 0.00 0.00 0.00 0.00 23.12 21.01 2b1i s ALA 8 CO 0.12 -0.49 0.21 -1.17 0.00 0.00 0.00 175.76 174.44 2b1i s LEU 9 N 1.56 4.15 -0.19 0.00 2.96 0.45 -0.61 118.68 127.01 2b1i s LEU 9 Ca 0.06 0.24 -0.00 0.00 -0.22 0.00 0.00 54.13 54.21 2b1i s LEU 9 Cb -0.15 -2.21 0.01 0.00 0.50 0.00 0.00 46.19 44.35 2b1i s LEU 9 CO 0.01 0.05 -0.16 -0.76 -1.32 0.00 0.00 176.35 174.17 2b1i s LEU 10 N 0.97 2.31 -0.35 -0.68 1.43 0.18 -0.07 118.68 122.48 2b1i s LEU 10 Ca 0.11 -0.60 0.02 0.00 -1.03 0.00 0.00 54.13 52.62 2b1i s LEU 10 Cb -0.13 -1.54 0.15 0.00 0.03 0.00 0.00 46.19 44.70 2b1i s LEU 10 CO 0.04 -0.01 0.33 -0.55 0.23 0.00 0.00 176.35 176.39 2b1i s SER 11 N 1.33 1.60 -0.03 2.29 0.15 0.19 -2.37 113.70 116.85 2b1i s SER 11 Ca 0.05 -1.48 0.03 0.00 0.70 0.00 0.00 55.95 55.25 2b1i s SER 11 Cb -0.13 0.39 0.00 0.00 -1.71 0.00 0.00 66.02 64.56 2b1i s SER 11 CO -0.11 -0.30 -0.12 0.68 1.20 0.00 0.00 173.24 174.59 2b1i s VAL 12 N 1.60 1.02 0.09 4.45 -7.23 -1.26 -2.68 120.40 116.39 2b1i s VAL 12 Ca 0.15 -0.49 -0.14 0.00 -1.81 0.00 0.00 61.98 59.69 2b1i s VAL 12 Cb -0.16 -0.90 -0.15 0.00 0.56 0.00 0.00 36.38 35.74 2b1i s VAL 12 CO -0.10 0.31 1.31 0.28 -0.31 0.00 0.00 175.10 176.58 2b1i h SER 13 N 6.36 0.84 -3.50 4.85 0.02 -1.74 -3.42 113.55 116.96 2b1i h SER 13 Ca -0.33 -0.60 -0.71 0.00 -0.84 0.00 0.00 61.79 59.31 2b1i h SER 13 Cb 1.17 -0.25 -0.20 0.00 0.14 0.00 0.00 62.40 63.27 2b1i h SER 13 CO 0.48 1.30 -0.30 -0.70 -1.14 0.00 0.00 176.83 176.47 2b1i s GLU 14 N -3.84 3.03 0.00 3.45 2.56 -1.26 -4.91 118.70 117.73 2b1i s GLU 14 Ca -0.11 -0.90 0.26 0.00 0.00 0.00 0.00 54.97 54.21 2b1i s GLU 14 Cb 0.08 -3.98 0.69 0.00 2.00 0.00 0.00 34.13 32.91 2b1i s GLU 14 CO 0.87 -0.83 1.52 1.63 -0.56 0.00 0.00 175.26 177.90 2b1i n LYS 15 N 5.40 0.78 -1.65 4.30 4.01 -1.26 -4.85 118.16 124.89 2b1i n LYS 15 Ca -0.09 -0.48 -0.55 0.00 -0.51 0.00 0.00 58.31 56.69 2b1i n LYS 15 Cb 0.47 -1.49 -0.07 0.00 -0.51 0.00 0.00 35.03 33.43 2b1i n LYS 15 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2b1i n ALA 16 N -0.69 -0.58 -0.16 7.82 0.00 -1.26 -1.24 120.51 124.39 2b1i n ALA 16 Ca 0.11 0.45 0.00 0.00 0.00 0.00 0.00 53.44 54.01 2b1i n ALA 16 Cb 0.35 -2.15 0.00 0.00 0.00 0.00 0.00 19.45 17.65 2b1i n ALA 16 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2b1i n GLY 17 N 3.35 1.94 0.28 0.00 0.00 -1.26 -4.78 105.19 104.71 2b1i n GLY 17 Ca 0.22 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.16 2b1i n GLY 17 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2b1i h LEU 18 N 0.00 0.91 -0.06 0.99 5.85 -1.50 -2.56 115.31 118.93 2b1i h LEU 18 Ca 0.00 -0.24 0.04 0.00 0.84 0.00 0.00 57.88 58.52 2b1i h LEU 18 Cb 0.00 -0.24 -0.06 0.00 0.37 0.00 0.00 40.66 40.73 2b1i h LEU 18 CO 0.00 0.91 -0.33 0.58 -0.34 0.00 0.00 178.44 179.27 2b1i h VAL 19 N 0.86 0.29 -0.00 1.05 2.07 -1.90 0.45 116.25 119.06 2b1i h VAL 19 Ca 0.18 0.00 -0.14 0.00 0.82 0.00 0.00 66.70 67.57 2b1i h VAL 19 Cb 0.37 0.29 -0.02 0.00 -1.52 0.00 0.00 31.29 30.41 2b1i h VAL 19 CO 0.00 0.00 -0.64 1.05 0.02 0.00 0.00 177.57 178.00 2b1i h GLU 20 N -0.44 0.02 0.05 1.57 4.11 -1.94 -0.87 114.58 117.08 2b1i h GLU 20 Ca 0.08 -0.01 -0.00 0.00 0.07 0.00 0.00 59.36 59.49 2b1i h GLU 20 Cb 0.56 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.81 2b1i h GLU 20 CO -0.31 0.65 -0.03 0.35 0.07 0.00 0.00 179.01 179.75 2b1i h PHE 21 N 0.01 -0.07 -0.55 2.06 3.57 -1.04 -2.63 116.94 118.29 2b1i h PHE 21 Ca -0.01 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.47 2b1i h PHE 21 Cb 1.14 0.02 -0.03 0.00 2.79 0.00 0.00 35.95 39.88 2b1i h PHE 21 CO 0.00 0.07 0.25 0.00 -2.23 0.00 0.00 178.31 176.41 2b1i h ALA 22 N 0.74 1.40 -0.71 2.41 0.00 0.26 -0.75 119.26 122.62 2b1i h ALA 22 Ca -0.01 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.80 2b1i h ALA 22 Cb 0.17 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 2b1i h ALA 22 CO 0.01 0.46 0.45 0.00 0.00 0.00 0.00 179.25 180.18 2b1i h ARG 23 N 0.78 0.87 -0.44 0.00 3.08 -1.12 0.99 114.38 118.54 2b1i h ARG 23 Ca 0.19 -0.05 -0.09 0.00 0.07 0.00 0.00 59.98 60.10 2b1i h ARG 23 Cb 0.11 -0.20 -0.01 0.00 0.08 0.00 0.00 29.97 29.95 2b1i h ARG 23 CO -0.02 0.57 -0.06 0.77 -1.07 0.00 0.00 179.97 180.16 2b1i h SER 24 N 0.89 0.81 -0.61 7.04 0.02 -0.86 0.27 113.55 121.11 2b1i h SER 24 Ca 0.28 -0.34 -0.02 0.00 -0.84 0.00 0.00 61.79 60.87 2b1i h SER 24 Cb -0.02 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.27 2b1i h SER 24 CO -0.09 0.96 0.30 -0.07 -1.14 0.00 0.00 176.83 176.79 2b1i h LEU 25 N 0.65 0.79 -0.86 5.07 3.38 -1.00 -1.31 115.31 122.03 2b1i h LEU 25 Ca 0.12 -0.12 -0.09 0.00 0.09 0.00 0.00 57.88 57.87 2b1i h LEU 25 Cb 0.58 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.11 2b1i h LEU 25 CO 0.03 0.69 -0.12 -1.13 0.09 0.00 0.00 178.44 178.00 2b1i h ASN 26 N 0.83 0.70 0.34 -0.43 -0.00 -0.57 -2.89 115.58 113.56 2b1i h ASN 26 Ca 0.21 -0.21 -0.09 0.00 -0.00 0.00 0.00 56.30 56.21 2b1i h ASN 26 Cb 0.11 -0.19 -0.01 0.00 -0.00 0.00 0.00 38.32 38.23 2b1i h ASN 26 CO -0.03 0.85 -0.40 0.00 -0.00 0.00 0.00 177.43 177.85 2b1i h ALA 27 N 1.22 1.27 -2.08 1.57 0.00 -0.01 -3.34 119.26 117.89 2b1i h ALA 27 Ca 0.11 -0.38 -0.42 0.00 0.00 0.00 0.00 54.91 54.23 2b1i h ALA 27 Cb 0.58 -0.07 0.22 0.00 0.00 0.00 0.00 17.79 18.51 2b1i h ALA 27 CO 0.04 0.53 -0.05 -0.51 0.00 0.00 0.00 179.25 179.25 2b1i s LEU 28 N -8.18 0.03 0.00 0.00 1.02 -0.53 -4.85 118.68 106.17 2b1i s LEU 28 Ca -0.03 1.28 -0.02 0.00 0.02 0.00 0.00 54.13 55.38 2b1i s LEU 28 Cb 0.14 -2.99 -0.09 0.00 0.02 0.00 0.00 46.19 43.27 2b1i s LEU 28 CO 0.74 -4.72 2.39 0.61 0.02 0.00 0.00 176.35 175.39 2b1i n GLY 29 N 1.12 2.51 3.40 -3.19 0.00 -1.26 -4.88 105.19 102.89 2b1i n GLY 29 Ca 0.06 -0.40 -0.34 0.00 0.00 0.00 0.00 46.02 45.34 2b1i n GLY 29 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2b1i s LEU 30 N 0.00 2.93 0.01 0.99 1.43 -1.18 -4.18 118.68 118.68 2b1i s LEU 30 Ca 0.22 -0.28 -0.30 0.00 -1.03 0.00 0.00 54.13 52.74 2b1i s LEU 30 Cb 0.11 -1.70 -0.04 0.00 0.03 0.00 0.00 46.19 44.58 2b1i s LEU 30 CO 0.00 0.12 1.17 -0.83 0.23 0.00 0.00 176.35 177.04 2b1i s GLY 31 N 0.64 2.36 -0.11 -3.19 0.00 0.03 -4.04 107.32 103.00 2b1i s GLY 31 Ca -0.05 0.73 -0.23 0.00 0.00 0.00 0.00 44.72 45.17 2b1i s GLY 31 CO 0.03 2.06 0.72 1.08 0.00 0.00 0.00 173.10 176.98 2b1i s LEU 32 N 1.48 4.26 0.04 0.66 1.43 -1.26 -0.38 118.68 124.91 2b1i s LEU 32 Ca 0.57 1.13 0.06 0.00 -1.03 0.00 0.00 54.13 54.86 2b1i s LEU 32 Cb -0.27 -3.09 -0.02 0.00 0.03 0.00 0.00 46.19 42.85 2b1i s LEU 32 CO 0.26 -0.20 -0.18 0.27 0.23 0.00 0.00 176.35 176.74 2b1i s ILE 33 N 1.23 1.42 0.07 -0.59 -4.36 0.22 -0.92 121.20 118.28 2b1i s ILE 33 Ca 0.36 -1.08 -0.16 0.00 -0.26 0.00 0.00 60.65 59.51 2b1i s ILE 33 Cb -0.17 -1.25 0.03 0.00 1.25 0.00 0.00 42.46 42.32 2b1i s ILE 33 CO 0.16 0.14 0.37 0.00 0.24 0.00 0.00 174.94 175.85 2b1i s ALA 34 N -0.79 -0.87 1.09 2.27 0.00 -0.38 0.50 121.76 123.58 2b1i s ALA 34 Ca 0.05 0.08 -0.16 0.00 0.00 0.00 0.00 51.96 51.93 2b1i s ALA 34 Cb -0.08 0.46 0.23 0.00 0.00 0.00 0.00 23.12 23.73 2b1i s ALA 34 CO 0.01 -0.51 1.13 -1.54 0.00 0.00 0.00 175.76 174.85 2b1i s SER 35 N -2.32 1.91 0.06 0.00 1.04 -1.00 -0.49 113.70 112.91 2b1i s SER 35 Ca -0.02 0.78 -0.24 0.00 0.48 0.00 0.00 55.95 56.95 2b1i s SER 35 Cb 0.00 -1.17 -0.16 0.00 0.10 0.00 0.00 66.02 64.79 2b1i s SER 35 CO -0.06 -3.53 1.61 1.23 0.98 0.00 0.00 173.24 173.47 2b1i h GLY 36 N -2.17 -0.05 0.94 7.32 0.00 -1.94 0.11 103.07 107.28 2b1i h GLY 36 Ca -0.48 0.02 -0.02 0.00 0.00 0.00 0.00 47.33 46.84 2b1i h GLY 36 CO 0.45 -0.02 0.15 -1.33 0.00 0.00 0.00 176.54 175.79 2b1i h GLY 37 N -0.17 0.64 0.91 4.60 0.00 -1.95 -1.44 103.07 105.65 2b1i h GLY 37 Ca -0.01 -0.36 -0.02 0.00 0.00 0.00 0.00 47.33 46.95 2b1i h GLY 37 CO 0.01 0.33 0.10 -0.84 0.00 0.00 0.00 176.54 176.15 2b1i h THR 38 N 0.50 1.19 -0.42 4.70 2.02 -1.78 -0.30 112.91 118.82 2b1i h THR 38 Ca 0.13 -0.60 0.04 0.00 0.77 0.00 0.00 66.41 66.75 2b1i h THR 38 Cb 0.20 1.04 -0.04 0.00 -1.74 0.00 0.00 68.15 67.61 2b1i h THR 38 CO -0.01 0.20 0.19 0.00 0.37 0.00 0.00 175.52 176.28 2b1i h ALA 39 N 0.94 0.52 -0.21 6.16 0.00 -0.66 0.33 119.26 126.34 2b1i h ALA 39 Ca 0.10 0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.06 2b1i h ALA 39 Cb 0.21 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 2b1i h ALA 39 CO -0.01 -0.17 0.05 1.15 0.00 0.00 0.00 179.25 180.27 2b1i h THR 40 N 0.39 0.91 -0.67 0.00 2.02 -0.83 -0.10 112.91 114.64 2b1i h THR 40 Ca 0.19 -0.04 0.06 0.00 0.77 0.00 0.00 66.41 67.38 2b1i h THR 40 Cb 0.12 0.77 -0.05 0.00 -1.74 0.00 0.00 68.15 67.24 2b1i h THR 40 CO -0.15 0.02 0.38 0.00 0.37 0.00 0.00 175.52 176.14 2b1i h ALA 41 N 1.15 0.90 -0.42 6.16 0.00 -0.41 -0.12 119.26 126.51 2b1i h ALA 41 Ca 0.09 0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.89 2b1i h ALA 41 Cb 0.09 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 2b1i h ALA 41 CO -0.12 0.06 -0.24 -0.07 0.00 0.00 0.00 179.25 178.88 2b1i h LEU 42 N 0.70 0.89 -0.81 0.00 3.38 -0.45 -3.01 115.31 116.01 2b1i h LEU 42 Ca 0.30 -0.34 -0.12 0.00 0.09 0.00 0.00 57.88 57.81 2b1i h LEU 42 Cb 0.18 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.66 2b1i h LEU 42 CO -0.18 1.09 -0.59 0.03 0.09 0.00 0.00 178.44 178.88 2b1i h ARG 43 N 0.75 0.00 0.00 1.13 3.08 -0.38 -1.92 114.38 117.04 2b1i h ARG 43 Ca 0.10 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.15 2b1i h ARG 43 Cb 0.79 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.84 2b1i h ARG 43 CO 0.07 0.59 -0.00 -0.44 -1.07 0.00 0.00 179.97 179.11 2b1i h ASP 44 N 0.00 0.00 -0.52 7.04 3.45 -0.90 -1.31 116.42 124.17 2b1i h ASP 44 Ca -0.01 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.45 2b1i h ASP 44 Cb 1.05 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.82 2b1i h ASP 44 CO 0.08 0.00 0.00 0.00 -1.57 0.00 0.00 179.24 177.75 2b1i n ALA 45 N -2.13 3.07 -2.04 3.45 0.00 -0.77 -4.96 120.51 117.13 2b1i n ALA 45 Ca -0.03 -1.74 -0.09 0.00 0.00 0.00 0.00 53.44 51.59 2b1i n ALA 45 Cb 0.09 -0.89 -0.01 0.00 0.00 0.00 0.00 19.45 18.64 2b1i n ALA 45 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2b1i n GLY 46 N 0.64 0.15 3.18 0.00 0.00 -0.49 -5.02 105.19 103.65 2b1i n GLY 46 Ca 0.23 -0.53 -0.34 0.00 0.00 0.00 0.00 46.02 45.39 2b1i n GLY 46 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2b1i s LEU 47 N -2.50 2.77 0.20 0.99 0.20 -0.91 -5.02 118.68 114.41 2b1i s LEU 47 Ca 0.00 -0.75 -0.32 0.00 0.69 0.00 0.00 54.13 53.76 2b1i s LEU 47 Cb 0.00 -1.60 -0.11 0.00 -0.43 0.00 0.00 46.19 44.05 2b1i s LEU 47 CO 0.00 -0.07 1.67 -2.84 -0.29 0.00 0.00 176.35 174.83 2b1i s PRO 48 N 1.32 4.15 -0.06 0.98 0.02 -1.26 -3.63 135.00 136.53 2b1i s PRO 48 Ca 0.02 2.54 -0.11 0.00 0.02 0.00 0.00 61.00 63.48 2b1i s PRO 48 Cb -0.15 -3.09 0.02 0.00 0.02 0.00 0.00 34.50 31.30 2b1i s PRO 48 CO -0.07 -0.71 0.26 0.54 -0.33 0.00 0.00 177.00 176.69 2b1i s VAL 49 N 1.08 0.03 -0.12 3.83 0.11 -1.26 -4.74 120.40 119.32 2b1i s VAL 49 Ca 0.73 -0.27 -0.19 0.00 -2.93 0.00 0.00 61.98 59.31 2b1i s VAL 49 Cb -0.48 -0.46 -0.04 0.00 -1.53 0.00 0.00 36.38 33.87 2b1i s VAL 49 CO 0.33 -0.15 0.51 -0.60 -3.33 0.00 0.00 175.10 171.86 2b1i s ARG 50 N -0.59 4.33 0.47 1.54 3.52 -0.09 -4.97 118.95 123.17 2b1i s ARG 50 Ca -0.07 0.50 -0.23 0.00 -0.13 0.00 0.00 55.73 55.80 2b1i s ARG 50 Cb -0.04 -3.45 -0.07 0.00 -1.56 0.00 0.00 34.95 29.83 2b1i s ARG 50 CO 0.02 0.10 1.24 -0.51 -0.81 0.00 0.00 175.30 175.34 2b1i s ASP 51 N 0.72 5.96 0.22 -2.12 1.01 -1.26 -1.25 116.67 119.95 2b1i s ASP 51 Ca 0.27 2.49 -0.07 0.00 0.71 0.00 0.00 52.55 55.95 2b1i s ASP 51 Cb -0.15 -2.62 0.17 0.00 1.01 0.00 0.00 42.92 41.33 2b1i s ASP 51 CO 0.11 -1.07 1.77 -0.37 0.21 0.00 0.00 175.17 175.82 2b1i h VAL 52 N 1.87 1.26 -0.86 -1.27 -1.51 -1.11 -0.44 116.25 114.19 2b1i h VAL 52 Ca -0.50 -0.86 0.20 0.00 -1.23 0.00 0.00 66.70 64.32 2b1i h VAL 52 Cb 1.26 0.37 -0.16 0.00 -2.13 0.00 0.00 31.29 30.64 2b1i h VAL 52 CO 0.60 0.34 -0.04 -1.28 -1.23 0.00 0.00 177.57 175.96 2b1i h SER 53 N 1.12 -0.50 -0.43 4.19 0.87 -1.83 0.55 113.55 117.52 2b1i h SER 53 Ca 0.25 0.24 -0.12 0.00 -1.23 0.00 0.00 61.79 60.93 2b1i h SER 53 Cb 0.25 0.44 -0.01 0.00 -0.44 0.00 0.00 62.40 62.64 2b1i h SER 53 CO -0.02 -0.26 -0.20 -0.78 -0.53 0.00 0.00 176.83 175.05 2b1i h ASP 54 N 0.05 0.95 -0.04 6.23 1.82 -1.40 0.32 116.42 124.35 2b1i h ASP 54 Ca 0.47 -0.35 -0.12 0.00 -0.39 0.00 0.00 57.03 56.65 2b1i h ASP 54 Cb 0.86 -0.26 -0.01 0.00 0.68 0.00 0.00 39.33 40.60 2b1i h ASP 54 CO -0.80 1.12 -0.35 0.25 -1.61 0.00 0.00 179.24 177.85 2b1i h LEU 55 N 0.81 0.54 -0.29 2.28 5.85 0.32 -3.18 115.31 121.65 2b1i h LEU 55 Ca 0.11 -0.22 0.00 0.00 0.84 0.00 0.00 57.88 58.61 2b1i h LEU 55 Cb 0.76 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.64 2b1i h LEU 55 CO 0.06 0.85 -0.61 0.35 -0.34 0.00 0.00 178.44 178.75 2b1i n THR 56 N -4.06 0.00 -0.90 1.05 -2.24 0.17 -4.93 114.28 103.37 2b1i n THR 56 Ca -0.01 -0.08 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 2b1i n THR 56 Cb 0.47 0.72 0.00 0.00 -2.10 0.00 0.00 70.33 69.42 2b1i n THR 56 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2b1i n GLY 57 N 1.45 0.00 3.37 3.38 0.00 0.11 -4.93 105.19 108.58 2b1i n GLY 57 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 2b1i n GLY 57 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2b1i s PHE 58 N -0.91 2.68 0.61 1.61 5.36 -1.01 -5.00 117.98 121.33 2b1i s PHE 58 Ca 0.00 -0.52 -0.08 0.00 -0.96 0.00 0.00 56.93 55.37 2b1i s PHE 58 Cb 0.00 -1.71 -0.00 0.00 -0.34 0.00 0.00 43.02 40.97 2b1i s PHE 58 CO 0.00 -0.09 0.95 -1.25 -1.46 0.00 0.00 175.22 173.37 2b1i s PRO 59 N -0.12 3.08 0.10 10.12 0.04 -1.26 -4.12 135.00 142.83 2b1i s PRO 59 Ca -0.02 0.24 -0.31 0.00 0.04 0.00 0.00 61.00 60.95 2b1i s PRO 59 Cb -0.14 -2.20 -0.07 0.00 0.04 0.00 0.00 34.50 32.13 2b1i s PRO 59 CO 0.04 -0.70 1.35 -1.21 0.04 0.00 0.00 177.00 176.51 2b1i s GLU 60 N -5.08 4.34 0.18 4.56 2.02 -1.26 -4.91 118.70 118.56 2b1i s GLU 60 Ca 0.54 2.00 0.04 0.00 0.02 0.00 0.00 54.97 57.57 2b1i s GLU 60 Cb -0.11 -3.29 -0.05 0.00 0.10 0.00 0.00 34.13 30.79 2b1i s GLU 60 CO 0.48 -0.40 -0.05 0.00 0.02 0.00 0.00 175.26 175.30 2b1i s MET 61 N 1.16 1.17 -0.69 1.61 0.23 -0.47 -4.78 119.30 117.53 2b1i s MET 61 Ca 0.63 -1.55 -0.04 0.00 -1.03 0.00 0.00 55.69 53.70 2b1i s MET 61 Cb -0.35 -0.57 0.00 0.00 -1.53 0.00 0.00 34.83 32.39 2b1i s MET 61 CO 0.30 -0.02 0.60 1.28 -2.03 0.00 0.00 175.02 175.15 2b1i n LEU 62 N -0.29 -2.74 -2.46 0.18 4.77 -1.26 -1.71 117.00 113.49 2b1i n LEU 62 Ca -0.08 -0.28 -0.13 0.00 -0.03 0.00 0.00 56.01 55.49 2b1i n LEU 62 Cb 0.62 -1.80 0.05 0.00 -2.33 0.00 0.00 43.42 39.96 2b1i n LEU 62 CO 0.34 0.33 0.12 0.61 -1.33 0.00 0.00 177.39 177.46 2b1i n GLY 63 N -1.26 -0.01 2.52 -0.72 0.00 -1.26 -2.46 105.19 102.00 2b1i n GLY 63 Ca -0.00 -0.10 -0.07 0.00 0.00 0.00 0.00 46.02 45.84 2b1i n GLY 63 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b1i n GLY 64 N -1.31 0.86 0.23 -0.02 0.00 -1.19 -4.90 105.19 98.84 2b1i n GLY 64 Ca -0.06 -0.20 0.15 0.00 0.00 0.00 0.00 46.02 45.91 2b1i n GLY 64 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2b1i h ARG 65 N 0.16 0.00 -3.73 1.61 3.08 -1.07 -3.39 114.38 111.03 2b1i h ARG 65 Ca -0.15 0.00 -0.55 0.00 0.07 0.00 0.00 59.98 59.34 2b1i h ARG 65 Cb 0.79 0.00 -0.40 0.00 0.08 0.00 0.00 29.97 30.45 2b1i h ARG 65 CO 0.22 0.00 -0.77 0.08 -1.07 0.00 0.00 179.97 178.44 2b1i s VAL 66 N -3.48 0.84 0.00 2.04 1.01 -0.70 -4.81 120.40 115.30 2b1i s VAL 66 Ca 0.03 -0.92 0.00 0.00 0.00 0.00 0.00 61.98 61.10 2b1i s VAL 66 Cb 0.09 -1.36 0.00 0.00 0.00 0.00 0.00 36.38 35.10 2b1i s VAL 66 CO 0.53 -0.30 0.00 0.29 0.00 0.00 0.00 175.10 175.62 2b1i n LYS 67 N 4.91 0.00 0.00 2.72 5.02 -1.26 -1.37 118.16 128.18 2b1i n LYS 67 Ca -0.08 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.21 2b1i n LYS 67 Cb 0.45 -0.81 0.00 0.00 -0.02 0.00 0.00 35.03 34.66 2b1i n LYS 67 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 2b1i n THR 68 N -2.53 0.16 -1.99 -0.18 -2.24 -1.26 -4.68 114.28 101.56 2b1i n THR 68 Ca 0.00 -0.33 -0.42 0.00 -2.27 0.00 0.00 64.05 61.03 2b1i n THR 68 Cb 0.44 1.26 -0.00 0.00 -2.10 0.00 0.00 70.33 69.93 2b1i n THR 68 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2b1i n LEU 69 N -0.08 6.24 -3.94 3.22 4.77 -1.26 -4.64 117.00 121.31 2b1i n LEU 69 Ca 0.00 -4.06 -0.10 0.00 -0.03 0.00 0.00 56.01 51.82 2b1i n LEU 69 Cb 0.21 -1.68 -0.11 0.00 -2.33 0.00 0.00 43.42 39.50 2b1i n LEU 69 CO 0.00 0.79 -0.33 -1.00 -1.33 0.00 0.00 177.39 175.52 2b1i s HIS 70 N 3.56 0.17 0.39 -1.77 3.76 -1.26 -5.05 115.29 115.08 2b1i s HIS 70 Ca 0.49 -0.35 0.07 0.00 -0.15 0.00 0.00 55.06 55.12 2b1i s HIS 70 Cb 0.11 -0.13 0.78 0.00 1.11 0.00 0.00 32.58 34.45 2b1i s HIS 70 CO -0.03 -0.17 1.98 -1.00 -0.85 0.00 0.00 174.74 174.67 2b1i h PRO 71 N 4.91 0.47 -0.41 8.40 0.13 -1.97 0.36 132.00 143.89 2b1i h PRO 71 Ca -0.30 -0.06 0.03 0.00 -0.87 0.00 0.00 66.00 64.80 2b1i h PRO 71 Cb 1.21 -0.09 -0.03 0.00 0.13 0.00 0.00 31.00 32.21 2b1i h PRO 71 CO 0.43 0.41 0.20 0.00 -0.23 0.00 0.00 178.00 178.81 2b1i h ALA 72 N 1.66 0.50 0.39 -0.56 0.00 -1.96 1.45 119.26 120.75 2b1i h ALA 72 Ca 0.12 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 2b1i h ALA 72 Cb 0.13 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.87 2b1i h ALA 72 CO -0.01 -0.16 -0.19 0.28 0.00 0.00 0.00 179.25 179.18 2b1i h VAL 73 N 0.41 0.27 -0.77 0.00 2.07 -1.78 -2.26 116.25 114.20 2b1i h VAL 73 Ca 0.17 -0.66 -0.05 0.00 0.82 0.00 0.00 66.70 66.98 2b1i h VAL 73 Cb 0.08 0.43 -0.03 0.00 -1.52 0.00 0.00 31.29 30.24 2b1i h VAL 73 CO -0.12 0.06 0.27 0.45 0.02 0.00 0.00 177.57 178.25 2b1i h HIS 74 N -1.05 1.21 -0.56 1.57 3.86 -0.80 -1.01 115.15 118.37 2b1i h HIS 74 Ca -0.05 -0.11 -0.07 0.00 -1.16 0.00 0.00 60.37 58.98 2b1i h HIS 74 Cb 0.50 -0.36 -0.02 0.00 1.06 0.00 0.00 27.41 28.60 2b1i h HIS 74 CO 0.02 0.94 0.08 0.00 0.86 0.00 0.00 177.93 179.83 2b1i h ALA 75 N 1.14 1.09 -0.18 2.45 0.00 0.19 0.32 119.26 124.28 2b1i h ALA 75 Ca 0.25 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 2b1i h ALA 75 Cb 0.27 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2b1i h ALA 75 CO -0.01 0.59 -0.02 0.78 0.00 0.00 0.00 179.25 180.59 2b1i h GLY 76 N 1.00 0.29 0.86 0.00 0.00 -0.60 -0.00 103.07 104.61 2b1i h GLY 76 Ca 0.17 -0.15 -0.34 0.00 0.00 0.00 0.00 47.33 47.01 2b1i h GLY 76 CO 0.01 0.14 -1.71 -2.22 0.00 0.00 0.00 176.54 172.75 2b1i h ILE 77 N 0.26 0.94 0.00 2.60 2.04 -0.94 0.24 117.51 122.65 2b1i h ILE 77 Ca 0.06 -2.49 0.00 0.00 1.00 0.00 0.00 64.86 63.43 2b1i h ILE 77 Cb 0.22 2.76 0.00 0.00 -0.74 0.00 0.00 36.82 39.05 2b1i h ILE 77 CO 0.01 0.84 -0.59 -0.07 0.00 0.00 0.00 178.15 178.33 2b1i h LEU 78 N 0.05 0.00-10.01 1.44 3.38 -0.08 -3.45 115.31 106.65 2b1i h LEU 78 Ca -0.34 -0.08 -0.53 0.00 0.09 0.00 0.00 57.88 57.02 2b1i h LEU 78 Cb 2.06 0.00 0.10 0.00 0.09 0.00 0.00 40.66 42.90 2b1i h LEU 78 CO 0.16 0.04 0.56 0.00 0.09 0.00 0.00 178.44 179.30 2b1i s ALA 79 N -3.24 2.97 0.18 1.53 0.00 -0.04 -4.97 121.76 118.19 2b1i s ALA 79 Ca 0.04 1.17 0.11 0.00 0.00 0.00 0.00 51.96 53.28 2b1i s ALA 79 Cb 0.10 -3.48 -0.04 0.00 0.00 0.00 0.00 23.12 19.70 2b1i s ALA 79 CO 0.73 -0.99 -0.23 -0.98 0.00 0.00 0.00 175.76 174.29 2b1i s ARG 80 N -2.69 1.43 -0.84 0.00 1.70 -1.26 -4.98 118.95 112.31 2b1i s ARG 80 Ca 0.65 -1.46 -0.22 0.00 -0.47 0.00 0.00 55.73 54.23 2b1i s ARG 80 Cb -0.36 -1.71 -0.15 0.00 -0.57 0.00 0.00 34.95 32.16 2b1i s ARG 80 CO 0.43 0.37 1.92 -1.71 -1.08 0.00 0.00 175.30 175.23 2b1i n ASN 81 N 0.39 2.61 -3.80 -2.89 5.15 -1.26 -4.25 115.26 111.21 2b1i n ASN 81 Ca -0.14 -2.68 -0.19 0.00 -0.60 0.00 0.00 54.58 50.98 2b1i n ASN 81 Cb 0.56 -1.24 -0.17 0.00 -0.53 0.00 0.00 39.78 38.40 2b1i n ASN 81 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2b1i s ILE 82 N 6.51 0.21 0.21 -1.44 1.01 -1.26 -5.03 121.20 121.40 2b1i s ILE 82 Ca 0.60 0.12 -0.02 0.00 0.00 0.00 0.00 60.65 61.35 2b1i s ILE 82 Cb 0.11 -0.33 0.31 0.00 0.01 0.00 0.00 42.46 42.56 2b1i s ILE 82 CO 0.13 0.18 1.11 -2.65 0.00 0.00 0.00 174.94 173.71 2b1i n PRO 83 N 4.48 -0.06 -0.08 2.79 -0.02 -1.26 0.05 135.00 140.90 2b1i n PRO 83 Ca -0.20 1.08 -0.13 0.00 -2.02 0.00 0.00 63.50 62.24 2b1i n PRO 83 Cb 0.50 -1.67 -0.05 0.00 -0.02 0.00 0.00 33.50 32.26 2b1i n PRO 83 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 2b1i h GLU 84 N 0.00 0.57 -0.63 -0.52 3.07 -1.97 -1.14 114.58 113.96 2b1i h GLU 84 Ca 0.38 -0.29 -0.07 0.00 -0.50 0.00 0.00 59.36 58.89 2b1i h GLU 84 Cb 0.70 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.59 2b1i h GLU 84 CO -0.70 0.88 0.13 -0.44 -1.40 0.00 0.00 179.01 177.48 2b1i h ASP 85 N 0.28 0.97 -0.15 1.42 5.19 -1.25 -2.32 116.42 120.56 2b1i h ASP 85 Ca 0.04 -0.24 -0.00 0.00 -0.62 0.00 0.00 57.03 56.21 2b1i h ASP 85 Cb 0.75 -0.26 -0.01 0.00 0.18 0.00 0.00 39.33 40.00 2b1i h ASP 85 CO 0.05 0.96 0.09 0.78 -3.12 0.00 0.00 179.24 178.00 2b1i h ASN 86 N 0.93 0.20 -0.23 6.45 2.35 -0.23 -1.01 115.58 124.04 2b1i h ASN 86 Ca 0.19 -0.01 -0.18 0.00 -0.55 0.00 0.00 56.30 55.76 2b1i h ASN 86 Cb 0.38 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.71 2b1i h ASN 86 CO 0.01 0.17 -0.56 0.00 -1.65 0.00 0.00 177.43 175.40 2b1i h ALA 87 N 1.87 0.38 -0.48 -0.83 0.00 -0.94 -1.55 119.26 117.70 2b1i h ALA 87 Ca 0.06 -0.52 -0.03 0.00 0.00 0.00 0.00 54.91 54.42 2b1i h ALA 87 Cb 0.01 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2b1i h ALA 87 CO -0.01 0.60 0.18 -0.44 0.00 0.00 0.00 179.25 179.58 2b1i h ASP 88 N 0.53 0.67 -0.35 0.00 3.32 -1.03 -0.84 116.42 118.70 2b1i h ASP 88 Ca -0.00 -0.18 -0.03 0.00 0.02 0.00 0.00 57.03 56.84 2b1i h ASP 88 Cb 1.17 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.54 2b1i h ASP 88 CO 0.12 0.66 0.10 0.24 -1.72 0.00 0.00 179.24 178.64 2b1i h MET 89 N 0.63 0.56 -0.23 3.56 2.86 -1.22 -1.88 114.93 119.21 2b1i h MET 89 Ca 0.16 -0.13 0.04 0.00 -2.06 0.00 0.00 59.70 57.71 2b1i h MET 89 Cb 0.21 -0.08 -0.04 0.00 0.06 0.00 0.00 31.60 31.76 2b1i h MET 89 CO -0.01 0.60 -0.02 -0.91 1.06 0.00 0.00 176.91 177.63 2b1i h ASN 90 N 0.42 -0.12 -0.86 1.22 -0.26 -1.25 -0.57 115.58 114.16 2b1i h ASN 90 Ca 0.11 0.06 0.10 0.00 -0.56 0.00 0.00 56.30 56.01 2b1i h ASN 90 Cb 0.28 0.10 -0.06 0.00 -1.06 0.00 0.00 38.32 37.58 2b1i h ASN 90 CO -0.00 -0.03 0.56 0.50 -1.06 0.00 0.00 177.43 177.39 2b1i h LYS 91 N 0.05 0.80 -0.00 0.81 3.64 -0.85 -2.37 116.57 118.64 2b1i h LYS 91 Ca 0.11 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.44 2b1i h LYS 91 Cb 0.15 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 31.79 2b1i h LYS 91 CO -0.20 0.53 -0.61 1.04 -2.27 0.00 0.00 179.45 177.94 2b1i n GLN 92 N -4.52 0.19 -2.45 1.90 1.13 -0.73 -4.95 117.38 107.95 2b1i n GLN 92 Ca 0.15 -0.13 -0.13 0.00 -1.94 0.00 0.00 57.00 54.95 2b1i n GLN 92 Cb 0.32 -1.50 0.01 0.00 0.11 0.00 0.00 30.24 29.18 2b1i n GLN 92 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 2b1i n ASP 93 N -1.29 -4.06 -4.78 1.08 -0.08 -0.57 -5.03 116.55 101.82 2b1i n ASP 93 Ca 0.06 -0.09 -0.38 0.00 -1.51 0.00 0.00 54.79 52.88 2b1i n ASP 93 Cb 0.34 -3.12 -0.06 0.00 2.34 0.00 0.00 41.12 40.62 2b1i n ASP 93 CO 0.00 0.00 0.00 -0.36 0.12 0.00 0.00 177.20 176.96 2b1i s PHE 94 N -2.75 3.59 0.38 -0.67 0.08 -0.33 -5.03 117.98 113.25 2b1i s PHE 94 Ca 0.08 0.85 -0.00 0.00 0.12 0.00 0.00 56.93 57.98 2b1i s PHE 94 Cb -0.04 -2.37 -0.03 0.00 -0.57 0.00 0.00 43.02 40.01 2b1i s PHE 94 CO 0.10 0.40 0.60 -1.54 -0.10 0.00 0.00 175.22 174.68 2b1i s SER 95 N -0.17 6.24 0.16 1.36 1.04 -1.26 -4.50 113.70 116.56 2b1i s SER 95 Ca 0.22 0.51 -0.31 0.00 0.48 0.00 0.00 55.95 56.85 2b1i s SER 95 Cb -0.15 -2.01 -0.09 0.00 0.10 0.00 0.00 66.02 63.87 2b1i s SER 95 CO 0.10 -0.38 1.40 -0.76 0.98 0.00 0.00 173.24 174.57 2b1i s LEU 96 N -4.41 4.38 -0.27 2.42 1.43 -1.26 -4.36 118.68 116.60 2b1i s LEU 96 Ca 0.42 2.42 -0.22 0.00 -1.03 0.00 0.00 54.13 55.72 2b1i s LEU 96 Cb -0.10 -3.60 -0.01 0.00 0.03 0.00 0.00 46.19 42.52 2b1i s LEU 96 CO 0.38 -0.65 0.73 -0.69 0.23 0.00 0.00 176.35 176.35 2b1i s VAL 97 N 0.74 4.88 -0.02 -1.59 1.01 0.85 0.21 120.40 126.48 2b1i s VAL 97 Ca 0.63 1.23 0.11 0.00 0.00 0.00 0.00 61.98 63.95 2b1i s VAL 97 Cb -0.38 -4.06 -0.23 0.00 0.00 0.00 0.00 36.38 31.71 2b1i s VAL 97 CO 0.34 -0.11 0.74 -0.09 0.00 0.00 0.00 175.10 175.98 2b1i h ARG 98 N 7.94 0.02 -4.02 2.72 2.43 -0.13 -3.41 114.38 119.93 2b1i h ARG 98 Ca -0.25 -0.03 -0.40 0.00 -0.81 0.00 0.00 59.98 58.49 2b1i h ARG 98 Cb 1.11 0.01 -0.34 0.00 -0.42 0.00 0.00 29.97 30.33 2b1i h ARG 98 CO 0.84 0.61 -0.77 0.08 -1.51 0.00 0.00 179.97 179.21 2b1i s VAL 99 N -2.61 0.52 -0.21 0.20 1.01 -1.07 -0.88 120.40 117.35 2b1i s VAL 99 Ca -0.05 -0.12 0.01 0.00 0.00 0.00 0.00 61.98 61.82 2b1i s VAL 99 Cb 0.08 -0.54 0.03 0.00 0.00 0.00 0.00 36.38 35.95 2b1i s VAL 99 CO 0.82 0.22 -0.14 -0.69 0.00 0.00 0.00 175.10 175.31 2b1i s VAL 100 N 0.87 2.33 -0.34 2.92 1.01 0.89 -0.41 120.40 127.68 2b1i s VAL 100 Ca -0.12 -1.07 -0.05 0.00 0.00 0.00 0.00 61.98 60.75 2b1i s VAL 100 Cb -0.14 -2.11 0.05 0.00 0.00 0.00 0.00 36.38 34.18 2b1i s VAL 100 CO 0.00 0.35 0.09 -0.69 0.00 0.00 0.00 175.10 174.85 2b1i s VAL 101 N 1.27 3.49 -0.01 2.92 1.01 0.90 0.14 120.40 130.12 2b1i s VAL 101 Ca 0.01 -1.33 -0.06 0.00 0.00 0.00 0.00 61.98 60.60 2b1i s VAL 101 Cb -0.15 -3.04 0.00 0.00 0.00 0.00 0.00 36.38 33.20 2b1i s VAL 101 CO -0.09 -0.22 0.13 0.00 0.00 0.00 0.00 175.10 174.91 2b1i s ASN 103 N -1.08 0.05 0.29 0.00 2.20 -1.09 -3.73 114.94 111.58 2b1i s ASN 103 Ca -0.12 -0.45 0.06 0.00 -0.94 0.00 0.00 52.86 51.41 2b1i s ASN 103 Cb -0.06 0.31 -0.02 0.00 -2.00 0.00 0.00 41.25 39.48 2b1i s ASN 103 CO 0.01 -0.62 0.42 -0.76 -2.94 0.00 0.00 177.10 173.22 2b1i s LEU 104 N -2.33 4.13 0.21 3.54 1.43 -1.26 -2.65 118.68 121.75 2b1i s LEU 104 Ca -0.02 -0.05 -0.32 0.00 -1.03 0.00 0.00 54.13 52.71 2b1i s LEU 104 Cb 0.01 -2.82 -0.13 0.00 0.03 0.00 0.00 46.19 43.28 2b1i s LEU 104 CO -0.06 -0.27 1.51 -1.22 0.23 0.00 0.00 176.35 176.54 2b1i n TYR 105 N -1.54 2.31 -0.74 0.29 4.01 -1.26 -4.54 117.16 115.67 2b1i n TYR 105 Ca -0.04 0.33 -0.26 0.00 -0.16 0.00 0.00 57.90 57.76 2b1i n TYR 105 Cb 0.58 -2.52 -0.03 0.00 -0.31 0.00 0.00 39.34 37.06 2b1i n TYR 105 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 2b1i n PRO 106 N 2.72 1.52 0.11 -0.72 -0.04 -1.26 -4.67 135.00 132.65 2b1i n PRO 106 Ca 0.14 -1.41 -0.13 0.00 -0.04 0.00 0.00 63.50 62.06 2b1i n PRO 106 Cb 0.31 -2.53 -0.06 0.00 -0.04 0.00 0.00 33.50 31.19 2b1i n PRO 106 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 2b1i h PHE 107 N 7.20 -0.73 -0.41 0.54 3.57 -1.87 -1.78 116.94 123.47 2b1i h PHE 107 Ca 0.39 0.02 0.08 0.00 3.53 0.00 0.00 57.97 61.99 2b1i h PHE 107 Cb 0.31 0.31 -0.07 0.00 2.79 0.00 0.00 35.95 39.29 2b1i h PHE 107 CO 1.71 -0.37 -0.07 0.28 -2.23 0.00 0.00 178.31 177.63 2b1i h VAL 108 N -0.48 0.62 -0.61 1.41 2.07 -1.92 -0.25 116.25 117.10 2b1i h VAL 108 Ca 0.03 -0.01 0.04 0.00 0.82 0.00 0.00 66.70 67.58 2b1i h VAL 108 Cb 0.51 0.59 -0.05 0.00 -1.52 0.00 0.00 31.29 30.82 2b1i h VAL 108 CO -0.16 0.01 0.35 0.11 0.02 0.00 0.00 177.57 177.89 2b1i h LYS 109 N 0.03 0.65 -0.06 1.57 1.57 -1.91 -2.24 116.57 116.18 2b1i h LYS 109 Ca 0.20 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.93 2b1i h LYS 109 Cb 0.30 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.46 2b1i h LYS 109 CO -0.39 0.43 0.02 1.15 -0.57 0.00 0.00 179.45 180.09 2b1i h THR 110 N 0.67 1.16 0.00 -0.16 2.02 -0.40 -2.86 112.91 113.34 2b1i h THR 110 Ca 0.26 -0.47 0.00 0.00 0.77 0.00 0.00 66.41 66.97 2b1i h THR 110 Cb 0.10 1.36 0.00 0.00 -1.74 0.00 0.00 68.15 67.87 2b1i h THR 110 CO -0.14 0.13 0.00 1.33 0.37 0.00 0.00 175.52 177.21 2b1i n VAL 111 N -4.94 0.59 0.18 3.16 0.24 -0.20 -2.21 118.33 115.16 2b1i n VAL 111 Ca -0.06 0.11 0.06 0.00 -2.04 0.00 0.00 64.34 62.41 2b1i n VAL 111 Cb 0.12 -0.81 0.24 0.00 -1.47 0.00 0.00 33.84 31.92 2b1i n VAL 111 CO 0.00 0.00 0.00 -1.28 -2.14 0.00 0.00 176.83 173.41 2b1i h SER 112 N 0.00 0.00 -3.72 -1.34 0.87 -1.16 -3.46 113.55 104.73 2b1i h SER 112 Ca 0.00 0.00 -0.52 0.00 -1.23 0.00 0.00 61.79 60.04 2b1i h SER 112 Cb 0.40 0.00 0.05 0.00 -0.44 0.00 0.00 62.40 62.41 2b1i h SER 112 CO 0.00 0.35 0.63 -0.44 -0.53 0.00 0.00 176.83 176.84 2b1i s SER 113 N -6.34 6.84 0.05 6.23 0.01 -0.94 -4.95 113.70 114.61 2b1i s SER 113 Ca 0.02 2.58 -0.16 0.00 1.31 0.00 0.00 55.95 59.71 2b1i s SER 113 Cb 0.09 -2.64 -0.06 0.00 0.21 0.00 0.00 66.02 63.62 2b1i s SER 113 CO 0.69 -0.50 1.26 1.55 0.41 0.00 0.00 173.24 176.65 2b1i h PRO 114 N 3.99 -0.30 -1.30 12.44 0.13 -1.89 -3.02 132.00 142.04 2b1i h PRO 114 Ca -0.48 0.02 -0.27 0.00 -0.87 0.00 0.00 66.00 64.40 2b1i h PRO 114 Cb 1.22 0.07 -0.13 0.00 0.13 0.00 0.00 31.00 32.29 2b1i h PRO 114 CO 0.69 -0.20 0.35 0.41 -0.23 0.00 0.00 178.00 179.02 2b1i n GLY 115 N -1.22 3.61 3.75 1.56 0.00 -1.26 -4.97 105.19 106.67 2b1i n GLY 115 Ca -0.03 -0.79 -0.41 0.00 0.00 0.00 0.00 46.02 44.79 2b1i n GLY 115 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b1i s VAL 116 N -1.86 3.00 0.30 1.61 0.11 -1.14 -5.04 120.40 117.37 2b1i s VAL 116 Ca 0.28 0.87 0.05 0.00 -2.93 0.00 0.00 61.98 60.25 2b1i s VAL 116 Cb 0.22 -3.56 -0.02 0.00 -1.53 0.00 0.00 36.38 31.49 2b1i s VAL 116 CO 0.02 0.16 0.44 0.42 -3.33 0.00 0.00 175.10 172.80 2b1i s THR 117 N -0.30 4.75 0.08 5.04 -4.23 -1.26 -5.00 115.64 114.72 2b1i s THR 117 Ca 0.54 -0.91 -0.26 0.00 -1.18 0.00 0.00 61.69 59.88 2b1i s THR 117 Cb -0.38 -3.68 -0.16 0.00 1.34 0.00 0.00 72.50 69.62 2b1i s THR 117 CO 0.43 -0.29 1.71 0.58 -0.54 0.00 0.00 174.62 176.50 2b1i h VAL 118 N 0.98 0.80 -0.74 2.29 2.07 -1.99 -1.88 116.25 117.78 2b1i h VAL 118 Ca -0.49 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.19 2b1i h VAL 118 Cb 1.24 0.80 -0.12 0.00 -1.52 0.00 0.00 31.29 31.69 2b1i h VAL 118 CO 0.58 0.00 0.12 1.55 0.02 0.00 0.00 177.57 179.84 2b1i h PRO 119 N -0.28 0.20 -0.67 1.57 0.13 -1.98 0.33 132.00 131.30 2b1i h PRO 119 Ca -0.03 -0.01 0.04 0.00 -0.87 0.00 0.00 66.00 65.13 2b1i h PRO 119 Cb 0.21 -0.04 -0.05 0.00 0.13 0.00 0.00 31.00 31.25 2b1i h PRO 119 CO 0.04 0.13 0.40 0.93 -0.23 0.00 0.00 178.00 179.27 2b1i h GLU 120 N 0.20 0.75 0.31 0.86 5.08 -1.90 -1.03 114.58 118.85 2b1i h GLU 120 Ca 0.41 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.71 2b1i h GLU 120 Cb 0.72 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.81 2b1i h GLU 120 CO -0.56 0.49 -0.15 0.00 -1.00 0.00 0.00 179.01 177.79 2b1i h ALA 121 N 1.31 -0.41 -0.90 3.43 0.00 -0.51 -3.15 119.26 119.03 2b1i h ALA 121 Ca 0.28 -0.17 0.20 0.00 0.00 0.00 0.00 54.91 55.22 2b1i h ALA 121 Cb 0.08 0.16 -0.12 0.00 0.00 0.00 0.00 17.79 17.91 2b1i h ALA 121 CO -0.13 -0.60 0.43 0.28 0.00 0.00 0.00 179.25 179.24 2b1i h VAL 122 N -0.68 0.56 0.00 0.00 2.07 -0.16 -0.20 116.25 117.83 2b1i h VAL 122 Ca -0.04 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.31 2b1i h VAL 122 Cb 0.48 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.27 2b1i h VAL 122 CO 0.07 0.09 0.00 1.21 0.02 0.00 0.00 177.57 178.96 2b1i n GLU 123 N -4.97 0.19 -0.43 1.57 4.07 -0.41 -0.97 120.64 119.70 2b1i n GLU 123 Ca 0.21 0.09 0.09 0.00 -0.06 0.00 0.00 57.16 57.50 2b1i n GLU 123 Cb 0.60 -1.50 0.30 0.00 -0.06 0.00 0.00 31.44 30.78 2b1i n GLU 123 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 2b1i n LYS 124 N -1.38 3.14 -2.54 5.31 4.01 -0.10 -4.85 118.16 121.76 2b1i n LYS 124 Ca 0.09 -2.64 -0.43 0.00 -0.51 0.00 0.00 58.31 54.82 2b1i n LYS 124 Cb 0.22 -1.64 -0.02 0.00 -0.51 0.00 0.00 35.03 33.08 2b1i n LYS 124 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 2b1i s ILE 125 N -1.41 4.19 -0.14 -0.18 1.01 -0.14 -3.91 121.20 120.61 2b1i s ILE 125 Ca 0.44 1.26 -0.29 0.00 0.00 0.00 0.00 60.65 62.06 2b1i s ILE 125 Cb 0.26 -4.44 -0.01 0.00 0.01 0.00 0.00 42.46 38.28 2b1i s ILE 125 CO 0.25 -0.81 1.07 -0.62 0.00 0.00 0.00 174.94 174.84 2b1i s ASP 126 N 2.64 7.14 -0.17 3.58 -1.08 -1.26 -4.92 116.67 122.60 2b1i s ASP 126 Ca 0.51 1.54 -0.16 0.00 -0.52 0.00 0.00 52.55 53.93 2b1i s ASP 126 Cb -0.10 -2.55 -0.06 0.00 -1.46 0.00 0.00 42.92 38.74 2b1i s ASP 126 CO 0.28 -0.57 -0.32 -0.38 0.52 0.00 0.00 175.17 174.71 2b1i n ILE 127 N 4.88 1.46 -0.13 4.11 2.08 -1.26 -4.45 119.36 126.04 2b1i n ILE 127 Ca 0.11 0.07 -0.13 0.00 0.56 0.00 0.00 62.75 63.35 2b1i n ILE 127 Cb 0.47 -2.19 -0.02 0.00 -0.75 0.00 0.00 39.64 37.15 2b1i n ILE 127 CO 0.00 0.00 0.00 1.23 0.56 0.00 0.00 176.55 178.34 2b1i h GLY 128 N -0.90 1.03 0.98 7.39 0.00 -1.91 -2.30 103.07 107.35 2b1i h GLY 128 Ca -0.13 -1.02 -0.04 0.00 0.00 0.00 0.00 47.33 46.15 2b1i h GLY 128 CO -0.08 0.92 0.19 -1.33 0.00 0.00 0.00 176.54 176.24 2b1i h GLY 129 N 0.77 0.87 0.37 4.60 0.00 -1.94 0.17 103.07 107.90 2b1i h GLY 129 Ca 0.07 -0.49 0.09 0.00 0.00 0.00 0.00 47.33 46.99 2b1i h GLY 129 CO 0.09 0.46 0.13 -2.08 0.00 0.00 0.00 176.54 175.14 2b1i h VAL 130 N 0.72 0.74 -0.41 4.60 2.07 -1.76 -0.19 116.25 122.02 2b1i h VAL 130 Ca 0.17 -0.09 -0.08 0.00 0.82 0.00 0.00 66.70 67.52 2b1i h VAL 130 Cb 0.24 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 2b1i h VAL 130 CO -0.01 0.05 -0.07 0.00 0.02 0.00 0.00 177.57 177.56 2b1i h ALA 131 N 1.39 1.11 0.19 1.67 0.00 -0.70 0.13 119.26 123.04 2b1i h ALA 131 Ca 0.26 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2b1i h ALA 131 Cb 0.34 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2b1i h ALA 131 CO -0.32 0.56 -0.09 -0.07 0.00 0.00 0.00 179.25 179.33 2b1i h LEU 132 N 0.65 -0.21 -0.51 0.00 3.38 -0.07 0.24 115.31 118.78 2b1i h LEU 132 Ca 0.12 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 2b1i h LEU 132 Cb 0.51 0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 2b1i h LEU 132 CO 0.03 -0.15 0.31 -0.07 0.09 0.00 0.00 178.44 178.65 2b1i h LEU 133 N -0.25 0.62 -0.36 1.67 3.38 -0.80 -0.52 115.31 119.04 2b1i h LEU 133 Ca -0.03 -0.06 -0.11 0.00 0.09 0.00 0.00 57.88 57.77 2b1i h LEU 133 Cb 0.20 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 2b1i h LEU 133 CO 0.04 0.50 -0.20 0.03 0.09 0.00 0.00 178.44 178.90 2b1i h ARG 134 N 0.69 0.78 -0.38 1.13 3.08 -0.58 0.41 114.38 119.50 2b1i h ARG 134 Ca 0.18 -0.35 -0.01 0.00 0.07 0.00 0.00 59.98 59.87 2b1i h ARG 134 Cb -0.00 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.02 2b1i h ARG 134 CO -0.03 0.97 0.18 0.00 -1.07 0.00 0.00 179.97 180.02 2b1i h ALA 135 N 0.78 0.50 -0.26 0.04 0.00 -0.43 0.14 119.26 120.03 2b1i h ALA 135 Ca 0.08 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 2b1i h ALA 135 Cb 0.76 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2b1i h ALA 135 CO 0.06 0.06 0.10 0.00 0.00 0.00 0.00 179.25 179.47 2b1i h ALA 136 N 1.03 0.34 -0.61 0.00 0.00 -0.97 -0.67 119.26 118.39 2b1i h ALA 136 Ca 0.13 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 2b1i h ALA 136 Cb 0.12 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 2b1i h ALA 136 CO -0.02 -0.07 0.12 0.00 0.00 0.00 0.00 179.25 179.28 2b1i h ALA 137 N 0.94 1.06 -0.69 0.00 0.00 -0.80 -1.51 119.26 118.26 2b1i h ALA 137 Ca 0.09 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2b1i h ALA 137 Cb 0.18 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 2b1i h ALA 137 CO -0.01 0.61 0.44 -0.22 0.00 0.00 0.00 179.25 180.07 2b1i h LYS 138 N 0.92 0.92 -1.28 0.00 3.64 -0.39 -2.81 116.57 117.56 2b1i h LYS 138 Ca 0.19 -0.07 -0.70 0.00 -1.27 0.00 0.00 60.65 58.80 2b1i h LYS 138 Cb 0.37 -0.20 -0.29 0.00 -0.41 0.00 0.00 32.23 31.70 2b1i h LYS 138 CO 0.01 0.63 0.83 -1.71 -2.27 0.00 0.00 179.45 176.94 2b1i n ASN 139 N -4.58 7.50 0.10 4.20 5.15 -0.29 -4.55 115.26 122.79 2b1i n ASN 139 Ca 0.06 -3.80 0.12 0.00 -0.60 0.00 0.00 54.58 50.36 2b1i n ASN 139 Cb 0.04 -0.97 0.45 0.00 -0.53 0.00 0.00 39.78 38.77 2b1i n ASN 139 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2b1i n HIS 140 N -0.80 0.72 -0.21 1.20 1.44 -0.82 0.39 115.22 117.14 2b1i n HIS 140 Ca 0.59 0.25 0.29 0.00 -2.01 0.00 0.00 57.72 56.84 2b1i n HIS 140 Cb 0.55 -0.90 0.71 0.00 0.12 0.00 0.00 29.99 30.48 2b1i n HIS 140 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2b1i h ALA 141 N 2.45 2.85 0.00 1.59 0.00 -1.86 -3.32 119.26 120.96 2b1i h ALA 141 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2b1i h ALA 141 Cb 0.51 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2b1i h ALA 141 CO 0.00 -1.12 -0.83 -2.13 0.00 0.00 0.00 179.25 175.17 2b1i n ARG 142 N -4.27 0.00 -2.96 0.00 0.63 -0.65 -4.97 116.66 104.44 2b1i n ARG 142 Ca 0.20 0.00 -0.40 0.00 -0.92 0.00 0.00 57.85 56.73 2b1i n ARG 142 Cb 0.99 -0.70 -0.05 0.00 0.45 0.00 0.00 32.46 33.16 2b1i n ARG 142 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 2b1i s VAL 143 N -1.90 4.82 -0.37 5.15 1.01 0.16 -4.93 120.40 124.34 2b1i s VAL 143 Ca 0.00 1.64 -0.24 0.00 0.00 0.00 0.00 61.98 63.38 2b1i s VAL 143 Cb 0.00 -4.12 0.01 0.00 0.00 0.00 0.00 36.38 32.27 2b1i s VAL 143 CO 0.00 0.31 0.82 -0.89 0.00 0.00 0.00 175.10 175.34 2b1i s THR 144 N 0.28 4.69 -0.21 3.92 2.01 -0.06 -4.18 115.64 122.10 2b1i s THR 144 Ca 0.40 0.93 -0.07 0.00 0.31 0.00 0.00 61.69 63.26 2b1i s THR 144 Cb -0.20 -4.25 -0.03 0.00 0.01 0.00 0.00 72.50 68.03 2b1i s THR 144 CO 0.22 -0.48 0.05 0.54 -0.69 0.00 0.00 174.62 174.26 2b1i s VAL 145 N 3.21 4.43 -0.21 3.82 0.11 -1.26 -0.07 120.40 130.43 2b1i s VAL 145 Ca 0.33 -0.15 0.01 0.00 -2.93 0.00 0.00 61.98 59.24 2b1i s VAL 145 Cb -0.13 -3.02 0.05 0.00 -1.53 0.00 0.00 36.38 31.75 2b1i s VAL 145 CO 0.18 0.41 -0.09 -0.69 -3.33 0.00 0.00 175.10 171.58 2b1i s VAL 146 N 0.92 1.62 -0.53 2.04 1.01 0.12 -4.62 120.40 120.96 2b1i s VAL 146 Ca 0.03 -1.07 0.05 0.00 0.00 0.00 0.00 61.98 60.99 2b1i s VAL 146 Cb -0.14 -1.75 0.09 0.00 0.00 0.00 0.00 36.38 34.59 2b1i s VAL 146 CO 0.02 0.10 0.91 0.00 0.00 0.00 0.00 175.10 176.13 2b1i s ASP 148 N -0.73 1.81 0.58 0.00 3.68 -1.26 -4.57 116.67 116.17 2b1i s ASP 148 Ca 0.09 -0.28 0.32 0.00 2.13 0.00 0.00 52.55 54.81 2b1i s ASP 148 Cb 0.05 -0.27 1.37 0.00 -1.45 0.00 0.00 42.92 42.63 2b1i s ASP 148 CO 0.07 -0.28 1.69 -0.65 0.13 0.00 0.00 175.17 176.13 2b1i h PRO 149 N 8.40 0.00 -0.30 4.34 0.11 -1.92 0.13 132.00 142.76 2b1i h PRO 149 Ca -0.15 0.00 0.05 0.00 0.11 0.00 0.00 66.00 66.02 2b1i h PRO 149 Cb 1.13 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 2b1i h PRO 149 CO 0.23 0.00 0.21 0.00 -0.21 0.00 0.00 178.00 178.23 2b1i h ALA 150 N 1.17 2.07 -0.00 -0.75 0.00 -1.95 -2.00 119.26 117.80 2b1i h ALA 150 Ca 0.43 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.33 2b1i h ALA 150 Cb 2.11 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.87 2b1i h ALA 150 CO -0.00 -0.13 -0.24 -0.25 0.00 0.00 0.00 179.25 178.62 2b1i n ASP 151 N -4.48 0.53 -0.02 0.00 8.00 0.47 -4.43 116.55 116.63 2b1i n ASP 151 Ca 0.03 -0.39 -0.09 0.00 0.71 0.00 0.00 54.79 55.05 2b1i n ASP 151 Cb 0.25 0.01 -0.04 0.00 -0.02 0.00 0.00 41.12 41.32 2b1i n ASP 151 CO 0.00 0.00 0.00 1.88 -0.39 0.00 0.00 177.20 178.69 2b1i h TYR 152 N 0.45 -0.10 -0.28 1.24 0.05 -1.45 -0.11 116.97 116.78 2b1i h TYR 152 Ca 0.00 0.01 -0.19 0.00 0.05 0.00 0.00 58.73 58.61 2b1i h TYR 152 Cb 0.45 0.07 0.00 0.00 1.01 0.00 0.00 36.73 38.26 2b1i h TYR 152 CO 0.00 -0.08 -0.56 0.66 -1.05 0.00 0.00 178.16 177.13 2b1i h SER 153 N -0.02 0.96 -0.17 3.88 4.64 -1.79 -1.11 113.55 119.94 2b1i h SER 153 Ca 0.07 -0.52 0.05 0.00 -0.47 0.00 0.00 61.79 60.92 2b1i h SER 153 Cb 0.13 -0.27 -0.07 0.00 -0.31 0.00 0.00 62.40 61.87 2b1i h SER 153 CO -0.16 1.32 -0.42 0.28 -0.87 0.00 0.00 176.83 176.98 2b1i h SER 154 N 0.65 -1.33 0.09 4.97 0.02 -1.76 0.12 113.55 116.31 2b1i h SER 154 Ca 0.01 0.18 -0.00 0.00 -0.84 0.00 0.00 61.79 61.14 2b1i h SER 154 Cb 1.17 0.55 0.00 0.00 0.14 0.00 0.00 62.40 64.26 2b1i h SER 154 CO 0.12 -0.42 -0.04 0.58 -1.14 0.00 0.00 176.83 175.94 2b1i h VAL 155 N -0.47 0.98 -0.57 2.27 2.07 -0.91 -1.41 116.25 118.21 2b1i h VAL 155 Ca 0.08 -0.21 0.10 0.00 0.82 0.00 0.00 66.70 67.49 2b1i h VAL 155 Cb 0.62 1.12 -0.08 0.00 -1.52 0.00 0.00 31.29 31.43 2b1i h VAL 155 CO -0.42 0.05 0.14 0.00 0.02 0.00 0.00 177.57 177.36 2b1i h ALA 156 N 0.70 0.67 -0.59 1.67 0.00 -1.00 -1.33 119.26 119.38 2b1i h ALA 156 Ca -0.01 0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.93 2b1i h ALA 156 Cb 0.17 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 2b1i h ALA 156 CO 0.02 -0.28 0.04 0.87 0.00 0.00 0.00 179.25 179.90 2b1i h LYS 157 N 0.28 0.99 -0.38 0.00 1.79 -0.42 -0.38 116.57 118.45 2b1i h LYS 157 Ca 0.29 -0.28 -0.09 0.00 -2.18 0.00 0.00 60.65 58.40 2b1i h LYS 157 Cb 0.40 -0.11 -0.01 0.00 -1.58 0.00 0.00 32.23 30.93 2b1i h LYS 157 CO -0.36 0.95 -0.11 1.49 -1.08 0.00 0.00 179.45 180.34 2b1i h GLU 158 N 0.92 0.74 -0.40 3.15 4.81 -0.49 -2.07 114.58 121.24 2b1i h GLU 158 Ca 0.18 -0.29 -0.14 0.00 -0.13 0.00 0.00 59.36 58.97 2b1i h GLU 158 Cb 0.48 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.81 2b1i h GLU 158 CO 0.02 0.90 -0.30 0.52 -0.73 0.00 0.00 179.01 179.42 2b1i h MET 159 N 0.54 0.91 0.00 1.92 2.86 -1.17 -1.90 114.93 118.09 2b1i h MET 159 Ca 0.09 -0.44 -0.01 0.00 -2.06 0.00 0.00 59.70 57.28 2b1i h MET 159 Cb 0.63 -0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.29 2b1i h MET 159 CO 0.04 1.10 -0.05 0.00 1.06 0.00 0.00 176.91 179.06 2b1i h ALA 160 N 0.79 1.62 0.00 6.32 0.00 -0.98 -2.60 119.26 124.41 2b1i h ALA 160 Ca 0.08 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2b1i h ALA 160 Cb 0.88 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2b1i h ALA 160 CO 0.08 0.07 -1.20 0.00 0.00 0.00 0.00 179.25 178.20 2b1i n ALA 161 N -2.39 2.88 -1.77 0.00 0.00 -0.79 -4.96 120.51 113.48 2b1i n ALA 161 Ca -0.03 -0.35 -0.39 0.00 0.00 0.00 0.00 53.44 52.68 2b1i n ALA 161 Cb 0.14 -1.00 -0.02 0.00 0.00 0.00 0.00 19.45 18.58 2b1i n ALA 161 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2b1i s SER 162 N -4.68 6.51 0.23 0.00 0.15 -0.73 -4.95 113.70 110.23 2b1i s SER 162 Ca -0.00 2.44 -0.08 0.00 0.70 0.00 0.00 55.95 59.01 2b1i s SER 162 Cb 0.12 -2.62 0.21 0.00 -1.71 0.00 0.00 66.02 62.02 2b1i s SER 162 CO 0.81 -0.69 1.89 0.11 1.20 0.00 0.00 173.24 176.56 2b1i h LYS 163 N 2.75 1.07 -0.69 5.44 1.57 -1.90 -2.77 116.57 122.04 2b1i h LYS 163 Ca -0.49 -0.06 -0.13 0.00 -1.87 0.00 0.00 60.65 58.09 2b1i h LYS 163 Cb 1.24 -0.24 -0.08 0.00 0.08 0.00 0.00 32.23 33.22 2b1i h LYS 163 CO 0.63 0.71 0.17 -0.40 -0.57 0.00 0.00 179.45 179.99 2b1i n ASP 164 N -4.52 5.24 -4.15 0.86 5.75 -1.26 -4.94 116.55 113.53 2b1i n ASP 164 Ca 0.09 -3.11 -0.30 0.00 -0.01 0.00 0.00 54.79 51.47 2b1i n ASP 164 Cb 0.04 -0.73 -0.05 0.00 -1.03 0.00 0.00 41.12 39.35 2b1i n ASP 164 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2b1i n LYS 165 N 0.17 -2.38 -4.18 0.11 5.02 -1.04 -4.95 118.16 110.90 2b1i n LYS 165 Ca 0.36 0.28 -0.11 0.00 -2.02 0.00 0.00 58.31 56.82 2b1i n LYS 165 Cb 1.33 -4.34 -0.10 0.00 -0.02 0.00 0.00 35.03 31.90 2b1i n LYS 165 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2b1i s ASP 166 N -4.13 0.96 0.82 4.39 2.15 -1.25 -4.91 116.67 114.70 2b1i s ASP 166 Ca 0.17 -1.10 -0.12 0.00 0.43 0.00 0.00 52.55 51.94 2b1i s ASP 166 Cb -0.10 0.15 0.09 0.00 -0.30 0.00 0.00 42.92 42.76 2b1i s ASP 166 CO 0.94 -0.56 1.11 0.42 -0.17 0.00 0.00 175.17 176.90 2b1i s THR 167 N -3.74 2.83 0.69 1.71 -4.23 -1.26 -4.09 115.64 107.54 2b1i s THR 167 Ca 0.18 0.27 -0.10 0.00 -1.18 0.00 0.00 61.69 60.86 2b1i s THR 167 Cb 0.06 -3.01 0.03 0.00 1.34 0.00 0.00 72.50 70.92 2b1i s THR 167 CO -0.01 -0.35 1.05 -0.94 -0.54 0.00 0.00 174.62 173.83 2b1i s SER 168 N -3.92 5.28 0.31 3.99 1.04 -1.26 -4.95 113.70 114.19 2b1i s SER 168 Ca 0.61 0.90 0.02 0.00 0.48 0.00 0.00 55.95 57.96 2b1i s SER 168 Cb -0.15 -1.69 0.51 0.00 0.10 0.00 0.00 66.02 64.80 2b1i s SER 168 CO 0.54 -1.38 1.83 0.58 0.98 0.00 0.00 173.24 175.80 2b1i h VAL 169 N -0.58 1.21 0.02 5.02 2.07 -1.93 -2.37 116.25 119.70 2b1i h VAL 169 Ca -0.45 -0.87 -0.00 0.00 0.82 0.00 0.00 66.70 66.20 2b1i h VAL 169 Cb 1.27 0.93 0.00 0.00 -1.52 0.00 0.00 31.29 31.97 2b1i h VAL 169 CO 0.63 0.30 -0.01 -0.33 0.02 0.00 0.00 177.57 178.18 2b1i h GLU 170 N 0.58 -0.03 -0.52 1.57 5.08 -1.96 -0.54 114.58 118.77 2b1i h GLU 170 Ca 0.12 0.00 0.08 0.00 -1.00 0.00 0.00 59.36 58.57 2b1i h GLU 170 Cb 0.38 0.01 -0.07 0.00 0.50 0.00 0.00 28.75 29.56 2b1i h GLU 170 CO 0.01 0.23 0.13 1.15 -1.00 0.00 0.00 179.01 179.53 2b1i h THR 171 N -0.29 0.74 -0.84 1.13 2.02 -1.93 -1.54 112.91 112.20 2b1i h THR 171 Ca -0.00 -0.09 -0.01 0.00 0.77 0.00 0.00 66.41 67.07 2b1i h THR 171 Cb 0.27 0.44 -0.04 0.00 -1.74 0.00 0.00 68.15 67.08 2b1i h THR 171 CO 0.01 0.05 0.50 0.03 0.37 0.00 0.00 175.52 176.47 2b1i h ARG 172 N 0.28 1.15 -0.10 6.66 3.08 -1.11 0.04 114.38 124.37 2b1i h ARG 172 Ca 0.26 -0.11 0.02 0.00 0.07 0.00 0.00 59.98 60.22 2b1i h ARG 172 Cb 0.34 -0.24 -0.02 0.00 0.08 0.00 0.00 29.97 30.12 2b1i h ARG 172 CO -0.31 0.81 -0.05 0.00 -1.07 0.00 0.00 179.97 179.35 2b1i h ARG 173 N 1.17 -0.05 -0.12 0.04 3.08 -0.30 0.22 114.38 118.42 2b1i h ARG 173 Ca 0.30 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 60.24 2b1i h ARG 173 Cb -0.03 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.02 2b1i h ARG 173 CO -0.05 -0.03 -0.43 1.12 -1.07 0.00 0.00 179.97 179.51 2b1i h HIS 174 N -0.05 0.33 -0.73 3.04 2.07 -0.85 -0.93 115.15 118.03 2b1i h HIS 174 Ca 0.06 -0.09 -0.06 0.00 -2.85 0.00 0.00 60.37 57.43 2b1i h HIS 174 Cb 0.13 -0.07 -0.03 0.00 2.57 0.00 0.00 27.41 30.01 2b1i h HIS 174 CO -0.17 0.66 0.23 -0.07 -3.07 0.00 0.00 177.93 175.51 2b1i h LEU 175 N 0.23 1.06 -0.46 6.12 4.07 -0.82 -1.32 115.31 124.18 2b1i h LEU 175 Ca 0.02 -0.21 -0.08 0.00 0.08 0.00 0.00 57.88 57.70 2b1i h LEU 175 Cb 0.85 -0.28 -0.02 0.00 1.08 0.00 0.00 40.66 42.30 2b1i h LEU 175 CO 0.07 0.98 -0.01 0.00 -1.08 0.00 0.00 178.44 178.40 2b1i h ALA 176 N 1.12 0.62 -0.14 1.53 0.00 -0.07 -1.65 119.26 120.67 2b1i h ALA 176 Ca 0.24 -0.28 0.03 0.00 0.00 0.00 0.00 54.91 54.90 2b1i h ALA 176 Cb 0.30 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.89 2b1i h ALA 176 CO -0.01 0.43 -0.08 1.25 0.00 0.00 0.00 179.25 180.85 2b1i h LEU 177 N 0.67 -0.25 -0.77 0.00 6.46 -1.01 -1.41 115.31 119.00 2b1i h LEU 177 Ca 0.13 0.06 0.08 0.00 -0.12 0.00 0.00 57.88 58.03 2b1i h LEU 177 Cb 0.52 0.14 -0.07 0.00 -0.73 0.00 0.00 40.66 40.52 2b1i h LEU 177 CO 0.03 -0.10 0.43 0.50 -0.62 0.00 0.00 178.44 178.67 2b1i h LYS 178 N -0.07 0.73 -0.22 1.25 3.64 -0.99 -0.01 116.57 120.89 2b1i h LYS 178 Ca 0.08 -0.04 -0.02 0.00 -1.27 0.00 0.00 60.65 59.39 2b1i h LYS 178 Cb 0.19 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 2b1i h LYS 178 CO -0.18 0.48 0.04 0.00 -2.27 0.00 0.00 179.45 177.52 2b1i h ALA 179 N 1.42 0.30 -0.18 5.00 0.00 -0.77 0.19 119.26 125.21 2b1i h ALA 179 Ca 0.36 -0.17 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 2b1i h ALA 179 Cb 0.30 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2b1i h ALA 179 CO -0.23 -0.04 -0.09 0.74 0.00 0.00 0.00 179.25 179.64 2b1i h PHE 180 N 0.18 0.29 -0.22 0.00 0.04 -0.97 -0.69 116.94 115.57 2b1i h PHE 180 Ca 0.07 -0.03 -0.05 0.00 2.80 0.00 0.00 57.97 60.76 2b1i h PHE 180 Cb 0.30 -0.08 -0.01 0.00 2.20 0.00 0.00 35.95 38.36 2b1i h PHE 180 CO 0.02 0.37 -0.08 1.15 -0.60 0.00 0.00 178.31 179.18 2b1i h THR 181 N 0.27 1.29 -0.38 -1.55 2.02 -0.48 0.44 112.91 114.52 2b1i h THR 181 Ca 0.06 -1.10 -0.00 0.00 0.77 0.00 0.00 66.41 66.13 2b1i h THR 181 Cb 0.33 1.56 -0.02 0.00 -1.74 0.00 0.00 68.15 68.28 2b1i h THR 181 CO 0.02 0.34 0.23 0.45 0.37 0.00 0.00 175.52 176.92 2b1i h HIS 182 N 0.16 0.50 -0.24 3.16 3.86 -0.28 0.87 115.15 123.17 2b1i h HIS 182 Ca 0.05 -0.00 -0.14 0.00 -1.16 0.00 0.00 60.37 59.13 2b1i h HIS 182 Cb 0.55 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 28.85 2b1i h HIS 182 CO 0.06 0.35 -0.41 1.79 0.86 0.00 0.00 177.93 180.58 2b1i h THR 183 N 0.50 1.30 -0.74 2.45 1.35 -1.04 0.15 112.91 116.88 2b1i h THR 183 Ca 0.14 -1.58 0.08 0.00 -0.55 0.00 0.00 66.41 64.49 2b1i h THR 183 Cb -0.00 1.56 -0.06 0.00 -1.73 0.00 0.00 68.15 67.91 2b1i h THR 183 CO -0.03 0.50 0.41 0.00 -0.25 0.00 0.00 175.52 176.15 2b1i h ALA 184 N 1.07 1.01 -0.12 6.62 0.00 0.36 -1.11 119.26 127.10 2b1i h ALA 184 Ca 0.04 0.03 -0.20 0.00 0.00 0.00 0.00 54.91 54.78 2b1i h ALA 184 Cb 0.92 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.60 2b1i h ALA 184 CO 0.08 0.05 -0.74 1.96 0.00 0.00 0.00 179.25 180.61 2b1i h GLN 185 N 0.71 0.59 0.33 0.00 4.20 -0.18 -1.46 115.11 119.31 2b1i h GLN 185 Ca 0.35 -0.47 -0.01 0.00 0.06 0.00 0.00 58.65 58.57 2b1i h GLN 185 Cb 0.28 0.10 -0.00 0.00 0.30 0.00 0.00 27.48 28.16 2b1i h GLN 185 CO -0.22 1.10 -0.19 -0.92 -0.67 0.00 0.00 178.83 177.93 2b1i h TYR 186 N 0.41 -0.48 -0.48 2.96 3.20 -0.50 -0.23 116.97 121.85 2b1i h TYR 186 Ca -0.04 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.77 2b1i h TYR 186 Cb 1.33 0.17 -0.02 0.00 1.54 0.00 0.00 36.73 39.75 2b1i h TYR 186 CO 0.06 -0.29 0.05 -0.44 -1.64 0.00 0.00 178.16 175.90 2b1i h ASP 187 N -0.49 0.71 -0.43 -2.11 5.19 -1.17 -1.65 116.42 116.47 2b1i h ASP 187 Ca -0.04 -0.15 0.05 0.00 -0.62 0.00 0.00 57.03 56.28 2b1i h ASP 187 Cb 0.39 -0.19 -0.05 0.00 0.18 0.00 0.00 39.33 39.67 2b1i h ASP 187 CO 0.05 0.75 0.16 0.00 -3.12 0.00 0.00 179.24 177.08 2b1i h ALA 188 N 1.34 0.51 -0.78 3.45 0.00 -1.09 0.86 119.26 123.55 2b1i h ALA 188 Ca 0.15 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 2b1i h ALA 188 Cb 0.36 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 2b1i h ALA 188 CO 0.01 -0.22 0.46 0.00 0.00 0.00 0.00 179.25 179.49 2b1i h ALA 189 N 1.27 1.00 -0.09 0.00 0.00 -0.57 -0.78 119.26 120.08 2b1i h ALA 189 Ca 0.20 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2b1i h ALA 189 Cb 0.17 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 2b1i h ALA 189 CO -0.19 0.48 0.03 0.82 0.00 0.00 0.00 179.25 180.39 2b1i h ILE 190 N 1.08 1.18 -0.68 0.00 2.04 -0.92 -1.02 117.51 119.19 2b1i h ILE 190 Ca 0.28 -0.55 0.09 0.00 1.00 0.00 0.00 64.86 65.67 2b1i h ILE 190 Cb -0.01 1.37 -0.07 0.00 -0.74 0.00 0.00 36.82 37.37 2b1i h ILE 190 CO -0.05 0.16 0.33 0.28 0.00 0.00 0.00 178.15 178.87 2b1i h SER 191 N -0.04 0.42 -0.15 1.72 0.02 -0.69 -1.24 113.55 113.59 2b1i h SER 191 Ca 0.03 0.06 -0.01 0.00 -0.84 0.00 0.00 61.79 61.03 2b1i h SER 191 Cb 0.23 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.75 2b1i h SER 191 CO -0.00 0.25 0.07 -0.78 -1.14 0.00 0.00 176.83 175.22 2b1i h ASP 192 N 0.57 0.20 -0.25 3.07 3.58 -0.87 0.45 116.42 123.17 2b1i h ASP 192 Ca 0.33 -0.14 0.05 0.00 0.42 0.00 0.00 57.03 57.68 2b1i h ASP 192 Cb 0.34 -0.05 -0.05 0.00 1.72 0.00 0.00 39.33 41.29 2b1i h ASP 192 CO -0.26 0.29 -0.04 0.22 -2.88 0.00 0.00 179.24 176.57 2b1i h TYR 193 N 0.10 -0.10 -0.08 0.28 3.20 -0.71 -1.06 116.97 118.61 2b1i h TYR 193 Ca 0.05 0.02 -0.13 0.00 3.14 0.00 0.00 58.73 61.81 2b1i h TYR 193 Cb 0.15 0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.49 2b1i h TYR 193 CO -0.02 -0.09 -0.54 0.74 -1.64 0.00 0.00 178.16 176.62 2b1i h PHE 194 N 0.02 0.27 -0.46 -3.82 0.04 -1.00 -0.04 116.94 111.95 2b1i h PHE 194 Ca 0.12 -0.09 0.01 0.00 2.80 0.00 0.00 57.97 60.81 2b1i h PHE 194 Cb 0.18 -0.05 -0.03 0.00 2.20 0.00 0.00 35.95 38.25 2b1i h PHE 194 CO -0.24 0.71 0.29 0.00 -0.60 0.00 0.00 178.31 178.47 2b1i h ARG 195 N 0.17 0.57 -0.13 1.51 3.08 0.26 0.76 114.38 120.60 2b1i h ARG 195 Ca 0.00 -0.03 -0.15 0.00 0.07 0.00 0.00 59.98 59.87 2b1i h ARG 195 Cb 1.00 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.91 2b1i h ARG 195 CO 0.08 0.38 -0.55 0.87 -1.07 0.00 0.00 179.97 179.68 2b1i h LYS 196 N 0.59 0.40 -0.02 0.04 1.57 -0.93 0.34 116.57 118.56 2b1i h LYS 196 Ca 0.18 -0.25 -0.14 0.00 -1.87 0.00 0.00 60.65 58.57 2b1i h LYS 196 Cb -0.03 0.03 0.01 0.00 0.08 0.00 0.00 32.23 32.32 2b1i h LYS 196 CO -0.06 0.85 -0.52 1.49 -0.57 0.00 0.00 179.45 180.64 2b1i h GLU 197 N 0.31 0.39 0.00 3.15 4.57 -0.89 -3.39 114.58 118.72 2b1i h GLU 197 Ca 0.00 -0.39 -0.04 0.00 -1.18 0.00 0.00 59.36 57.76 2b1i h GLU 197 Cb 1.07 0.11 -0.01 0.00 -0.16 0.00 0.00 28.75 29.75 2b1i h GLU 197 CO 0.10 1.06 -1.49 0.66 -1.18 0.00 0.00 179.01 178.16 2b1i n TYR 198 N -4.27 0.00 -0.97 0.92 4.01 0.25 -4.74 117.16 112.36 2b1i n TYR 198 Ca -0.10 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 57.73 2b1i n TYR 198 Cb 0.63 -0.27 0.19 0.00 -0.31 0.00 0.00 39.34 39.57 2b1i n TYR 198 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2b1i n SER 199 N -1.95 3.03 -4.69 7.72 2.88 0.12 -4.94 113.62 115.79 2b1i n SER 199 Ca -0.05 -2.98 -0.42 0.00 -1.33 0.00 0.00 58.87 54.09 2b1i n SER 199 Cb 0.37 -0.46 -0.03 0.00 -0.75 0.00 0.00 64.21 63.35 2b1i n SER 199 CO 0.00 0.00 0.00 -1.59 -1.23 0.00 0.00 175.04 172.22 2b1i s LYS 200 N -2.72 4.23 0.00 -1.46 -2.85 -1.15 0.17 119.74 115.96 2b1i s LYS 200 Ca 0.35 2.15 0.00 0.00 -1.00 0.00 0.00 55.97 57.47 2b1i s LYS 200 Cb 0.29 -3.62 0.00 0.00 -2.06 0.00 0.00 37.83 32.44 2b1i s LYS 200 CO 0.06 -0.67 0.00 0.41 0.10 0.00 0.00 175.35 175.24 2b1i n GLY 201 N 3.85 1.36 0.10 0.59 0.00 0.28 -4.89 105.19 106.48 2b1i n GLY 201 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 2b1i n GLY 201 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2b1i n VAL 202 N -2.00 0.00 0.28 1.61 0.31 0.13 -4.87 118.33 113.79 2b1i n VAL 202 Ca 0.00 0.08 0.07 0.00 -0.01 0.00 0.00 64.34 64.48 2b1i n VAL 202 Cb 0.00 -0.95 0.10 0.00 -0.91 0.00 0.00 33.84 32.08 2b1i n VAL 202 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2b1i n SER 203 N -1.63 2.44 -3.86 4.52 3.41 -0.48 -0.20 113.62 117.81 2b1i n SER 203 Ca 0.00 -1.71 -0.14 0.00 -0.26 0.00 0.00 58.87 56.77 2b1i n SER 203 Cb 0.00 -0.10 -0.15 0.00 -0.26 0.00 0.00 64.21 63.71 2b1i n SER 203 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 2b1i s GLN 204 N -1.06 0.11 -0.11 4.33 -0.44 -0.84 -0.38 119.66 121.27 2b1i s GLN 204 Ca 0.19 0.01 -0.01 0.00 -2.50 0.00 0.00 55.36 53.06 2b1i s GLN 204 Cb 0.12 -0.18 0.03 0.00 -1.64 0.00 0.00 33.01 31.34 2b1i s GLN 204 CO 0.17 -0.03 -0.05 -1.17 0.50 0.00 0.00 175.29 174.71 2b1i s LEU 205 N 0.29 1.12 0.37 3.68 2.96 0.37 1.00 118.68 128.46 2b1i s LEU 205 Ca -0.03 -0.32 -0.27 0.00 -0.22 0.00 0.00 54.13 53.29 2b1i s LEU 205 Cb -0.04 -0.76 -0.09 0.00 0.50 0.00 0.00 46.19 45.80 2b1i s LEU 205 CO -0.01 -0.15 1.27 -2.84 -1.32 0.00 0.00 176.35 173.30 2b1i s PRO 206 N 1.76 4.18 0.15 0.98 0.02 -1.26 0.41 135.00 141.24 2b1i s PRO 206 Ca 0.04 2.10 0.06 0.00 0.02 0.00 0.00 61.00 63.22 2b1i s PRO 206 Cb -0.13 -2.90 -0.04 0.00 0.02 0.00 0.00 34.50 31.45 2b1i s PRO 206 CO -0.08 -0.29 0.07 -0.51 -0.33 0.00 0.00 177.00 175.86 2b1i s LEU 207 N -2.12 3.58 0.29 -5.54 1.43 -0.32 -4.80 118.68 111.20 2b1i s LEU 207 Ca 0.53 -0.23 0.03 0.00 -1.03 0.00 0.00 54.13 53.43 2b1i s LEU 207 Cb -0.37 -2.22 0.61 0.00 0.03 0.00 0.00 46.19 44.23 2b1i s LEU 207 CO 0.48 0.10 1.83 0.03 0.23 0.00 0.00 176.35 179.02 2b1i h ARG 208 N 2.69 0.91 0.00 1.70 3.08 -1.63 -3.40 114.38 117.73 2b1i h ARG 208 Ca -0.47 -0.05 0.11 0.00 0.07 0.00 0.00 59.98 59.63 2b1i h ARG 208 Cb 1.19 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 31.02 2b1i h ARG 208 CO 0.61 0.60 0.34 2.48 -1.07 0.00 0.00 179.97 182.93 2b1i n TYR 209 N -4.63 -0.66 -0.11 3.04 0.18 -1.26 -4.91 117.16 108.80 2b1i n TYR 209 Ca 0.19 -0.50 0.00 0.00 1.88 0.00 0.00 57.90 59.48 2b1i n TYR 209 Cb 0.39 0.24 0.00 0.00 -0.38 0.00 0.00 39.34 39.59 2b1i n TYR 209 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2b1i n GLY 210 N -0.38 1.18 0.38 -7.48 0.00 0.39 -2.25 105.19 97.02 2b1i n GLY 210 Ca 0.00 -1.51 0.15 0.00 0.00 0.00 0.00 46.02 44.66 2b1i n GLY 210 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2b1i h MET 211 N 0.00 0.40 -4.34 1.61 1.85 -1.96 -3.35 114.93 109.14 2b1i h MET 211 Ca 0.00 -0.02 -0.16 0.00 -0.61 0.00 0.00 59.70 58.90 2b1i h MET 211 Cb 0.00 -0.09 -0.16 0.00 0.43 0.00 0.00 31.60 31.78 2b1i h MET 211 CO 0.00 0.26 -0.69 -0.80 -0.40 0.00 0.00 176.91 175.28 2b1i s ASN 212 N -5.98 0.66 0.66 1.39 0.01 -1.26 -4.86 114.94 105.56 2b1i s ASN 212 Ca -0.08 -0.92 0.38 0.00 -0.71 0.00 0.00 52.86 51.53 2b1i s ASN 212 Cb 0.21 0.15 2.05 0.00 0.41 0.00 0.00 41.25 44.07 2b1i s ASN 212 CO 0.76 -0.51 2.17 -0.65 -1.51 0.00 0.00 177.10 177.37 2b1i h PRO 213 N 3.35 0.00 -0.01 -0.60 0.11 -1.95 0.12 132.00 133.02 2b1i h PRO 213 Ca -0.34 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.77 2b1i h PRO 213 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 2b1i h PRO 213 CO 0.61 0.00 -0.07 -2.39 -0.21 0.00 0.00 178.00 175.94 2b1i n HIS 214 N -3.04 0.00 -3.44 0.65 1.44 -1.26 -4.56 115.22 105.02 2b1i n HIS 214 Ca -0.02 0.00 -0.44 0.00 -2.01 0.00 0.00 57.72 55.25 2b1i n HIS 214 Cb 0.22 -0.05 -0.06 0.00 0.12 0.00 0.00 29.99 30.22 2b1i n HIS 214 CO 0.00 0.00 0.00 -0.65 -2.81 0.00 0.00 176.34 172.88 2b1i s GLN 215 N -2.17 2.91 -0.06 -1.40 -0.21 0.42 -5.00 119.66 114.14 2b1i s GLN 215 Ca 0.35 -1.97 -0.11 0.00 0.02 0.00 0.00 55.36 53.65 2b1i s GLN 215 Cb 0.21 -4.15 0.02 0.00 1.00 0.00 0.00 33.01 30.09 2b1i s GLN 215 CO 0.40 -1.26 0.27 -1.12 -2.12 0.00 0.00 175.29 171.46 2b1i s SER 216 N 2.69 -0.22 0.80 5.90 0.01 -1.26 0.15 113.70 121.76 2b1i s SER 216 Ca 0.09 0.31 -0.06 0.00 1.31 0.00 0.00 55.95 57.60 2b1i s SER 216 Cb -0.23 0.45 0.15 0.00 0.21 0.00 0.00 66.02 66.59 2b1i s SER 216 CO -0.02 -0.25 1.10 -2.16 0.41 0.00 0.00 173.24 172.32 2b1i s PRO 217 N -0.54 1.36 0.02 12.44 0.04 -1.26 -5.05 135.00 142.01 2b1i s PRO 217 Ca -0.06 -0.89 -0.04 0.00 0.04 0.00 0.00 61.00 60.05 2b1i s PRO 217 Cb -0.04 -2.18 -0.01 0.00 0.04 0.00 0.00 34.50 32.31 2b1i s PRO 217 CO 0.02 -1.75 0.06 0.00 0.04 0.00 0.00 177.00 175.36 2b1i s ALA 218 N -3.38 -0.03 0.13 8.56 0.00 -1.26 -4.74 121.76 121.05 2b1i s ALA 218 Ca 0.69 -0.50 -0.12 0.00 0.00 0.00 0.00 51.96 52.03 2b1i s ALA 218 Cb -0.05 0.18 0.01 0.00 0.00 0.00 0.00 23.12 23.26 2b1i s ALA 218 CO 0.47 -0.24 0.32 1.14 0.00 0.00 0.00 175.76 177.45 2b1i s GLN 219 N -1.99 1.06 -0.08 0.00 -2.07 -1.26 -1.18 119.66 114.13 2b1i s GLN 219 Ca -0.10 -0.93 0.01 0.00 -1.82 0.00 0.00 55.36 52.51 2b1i s GLN 219 Cb -0.05 0.41 -0.03 0.00 -1.09 0.00 0.00 33.01 32.25 2b1i s GLN 219 CO -0.02 -0.39 -0.10 -1.17 -1.32 0.00 0.00 175.29 172.29 2b1i s LEU 220 N -2.88 2.97 0.18 2.60 2.96 0.16 -4.88 118.68 119.80 2b1i s LEU 220 Ca 0.08 -0.14 -0.13 0.00 -0.22 0.00 0.00 54.13 53.72 2b1i s LEU 220 Cb 0.03 -1.65 0.01 0.00 0.50 0.00 0.00 46.19 45.08 2b1i s LEU 220 CO -0.07 0.30 0.40 -0.72 -1.32 0.00 0.00 176.35 174.94 2b1i s TYR 221 N -0.44 0.17 0.08 5.38 -0.85 -1.26 0.14 117.35 120.58 2b1i s TYR 221 Ca 0.06 -0.53 0.04 0.00 -0.52 0.00 0.00 57.07 56.11 2b1i s TYR 221 Cb -0.12 0.16 -0.03 0.00 0.38 0.00 0.00 41.96 42.34 2b1i s TYR 221 CO 0.02 -0.83 -0.10 -0.08 -1.52 0.00 0.00 175.55 173.04 2b1i s THR 222 N -3.93 0.88 -1.30 -3.49 -1.32 0.49 -4.98 115.64 102.00 2b1i s THR 222 Ca 0.14 -1.52 0.28 0.00 -1.21 0.00 0.00 61.69 59.38 2b1i s THR 222 Cb 0.01 -1.22 0.32 0.00 -1.51 0.00 0.00 72.50 70.11 2b1i s THR 222 CO -0.00 -0.50 1.83 0.35 -2.21 0.00 0.00 174.62 174.09 2b1i n THR 223 N 0.77 0.00 -1.91 5.08 -2.24 -1.26 -4.82 114.28 109.89 2b1i n THR 223 Ca -0.18 -0.02 -0.30 0.00 -2.27 0.00 0.00 64.05 61.29 2b1i n THR 223 Cb 0.57 -0.22 0.05 0.00 -2.10 0.00 0.00 70.33 68.63 2b1i n THR 223 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 2b1i s ARG 224 N -2.74 2.73 0.53 -0.78 0.52 -1.26 -4.96 118.95 112.99 2b1i s ARG 224 Ca 0.21 0.39 0.21 0.00 -0.52 0.00 0.00 55.73 56.01 2b1i s ARG 224 Cb 0.19 -2.02 1.36 0.00 0.52 0.00 0.00 34.95 35.00 2b1i s ARG 224 CO 0.53 -1.10 2.10 -1.35 0.02 0.00 0.00 175.30 175.50 2b1i h PRO 225 N -0.69 0.00 -3.15 3.54 0.11 -1.97 -3.43 132.00 126.41 2b1i h PRO 225 Ca -0.45 0.00 -0.19 0.00 0.11 0.00 0.00 66.00 65.47 2b1i h PRO 225 Cb 1.26 0.00 -0.28 0.00 0.11 0.00 0.00 31.00 32.10 2b1i h PRO 225 CO 0.64 0.00 -0.49 0.21 -0.21 0.00 0.00 178.00 178.15 2b1i s LYS 226 N -5.01 0.22 0.27 1.05 2.20 -1.26 -3.96 119.74 113.25 2b1i s LYS 226 Ca -0.05 0.38 -0.30 0.00 -0.36 0.00 0.00 55.97 55.65 2b1i s LYS 226 Cb 0.18 0.01 -0.10 0.00 -1.51 0.00 0.00 37.83 36.41 2b1i s LYS 226 CO 0.68 -0.09 1.40 -0.51 -0.36 0.00 0.00 175.35 176.47 2b1i s LEU 227 N 0.60 4.40 0.00 5.43 1.43 0.71 -4.90 118.68 126.35 2b1i s LEU 227 Ca -0.04 2.66 0.27 0.00 -1.03 0.00 0.00 54.13 55.99 2b1i s LEU 227 Cb -0.05 -3.63 1.22 0.00 0.03 0.00 0.00 46.19 43.76 2b1i s LEU 227 CO -0.03 -0.65 1.90 -0.81 0.23 0.00 0.00 176.35 176.98 2b1i n PRO 228 N 1.96 0.08 -3.88 1.29 -0.04 -1.26 -4.64 135.00 128.51 2b1i n PRO 228 Ca 0.05 0.03 -0.36 0.00 -0.04 0.00 0.00 63.50 63.18 2b1i n PRO 228 Cb 0.41 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.24 2b1i n PRO 228 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2b1i s LEU 229 N -2.91 3.20 0.14 1.53 2.96 -1.26 -0.29 118.68 122.06 2b1i s LEU 229 Ca 0.16 -0.27 0.09 0.00 -0.22 0.00 0.00 54.13 53.89 2b1i s LEU 229 Cb 0.18 -1.84 -0.04 0.00 0.50 0.00 0.00 46.19 44.99 2b1i s LEU 229 CO 0.48 -0.01 -0.15 0.42 -1.32 0.00 0.00 176.35 175.77 2b1i s THR 230 N 1.42 2.94 -0.31 3.68 -4.23 0.10 -4.93 115.64 114.31 2b1i s THR 230 Ca 0.05 -1.59 -0.17 0.00 -1.18 0.00 0.00 61.69 58.80 2b1i s THR 230 Cb -0.15 -2.39 -0.02 0.00 1.34 0.00 0.00 72.50 71.28 2b1i s THR 230 CO 0.01 0.01 0.47 -0.69 -0.54 0.00 0.00 174.62 173.88 2b1i s VAL 231 N -1.38 5.08 -0.10 2.29 1.01 -1.26 -0.10 120.40 125.94 2b1i s VAL 231 Ca 0.21 0.50 0.22 0.00 0.00 0.00 0.00 61.98 62.91 2b1i s VAL 231 Cb -0.10 -3.86 -0.23 0.00 0.00 0.00 0.00 36.38 32.20 2b1i s VAL 231 CO 0.12 -0.05 0.67 0.52 0.00 0.00 0.00 175.10 176.36 2b1i n VAL 232 N 5.27 0.21 -3.60 2.92 0.31 0.20 -4.96 118.33 118.69 2b1i n VAL 232 Ca -0.06 -0.52 -0.12 0.00 -0.01 0.00 0.00 64.34 63.63 2b1i n VAL 232 Cb 0.50 -0.12 -0.06 0.00 -0.91 0.00 0.00 33.84 33.25 2b1i n VAL 232 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 2b1i s ASN 233 N -4.81 -0.52 0.39 4.52 2.47 -0.90 -4.91 114.94 111.18 2b1i s ASN 233 Ca -0.05 0.81 0.00 0.00 0.42 0.00 0.00 52.86 54.04 2b1i s ASN 233 Cb 0.12 0.75 0.00 0.00 -1.45 0.00 0.00 41.25 40.68 2b1i s ASN 233 CO 0.87 -0.32 0.00 0.61 -3.72 0.00 0.00 177.10 174.54 2b1i n GLY 234 N 1.61 -0.33 3.10 1.21 0.00 -1.22 0.41 105.19 109.97 2b1i n GLY 234 Ca -0.13 -1.06 -0.05 0.00 0.00 0.00 0.00 46.02 44.78 2b1i n GLY 234 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2b1i s SER 235 N -4.00 -0.43 0.67 1.61 0.15 -1.26 -4.86 113.70 105.57 2b1i s SER 235 Ca 0.00 0.66 -0.13 0.00 0.70 0.00 0.00 55.95 57.18 2b1i s SER 235 Cb 0.00 1.56 -0.00 0.00 -1.71 0.00 0.00 66.02 65.87 2b1i s SER 235 CO 0.00 -0.27 1.07 -2.16 1.20 0.00 0.00 173.24 173.08 2b1i s PRO 236 N 2.68 2.96 0.36 5.44 0.04 -1.26 -4.70 135.00 140.51 2b1i s PRO 236 Ca 0.11 1.10 0.03 0.00 0.04 0.00 0.00 61.00 62.28 2b1i s PRO 236 Cb -0.14 -1.99 0.03 0.00 0.04 0.00 0.00 34.50 32.43 2b1i s PRO 236 CO -0.17 -1.09 0.23 0.41 0.04 0.00 0.00 177.00 176.42 2b1i n GLY 237 N -1.45 2.99 0.38 0.56 0.00 -1.26 -1.77 105.19 104.64 2b1i n GLY 237 Ca 0.08 -2.26 -0.14 0.00 0.00 0.00 0.00 46.02 43.70 2b1i n GLY 237 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2b1i h PHE 238 N 0.69 -1.03 -0.64 1.61 3.04 -1.58 -2.61 116.94 116.42 2b1i h PHE 238 Ca -0.24 0.02 0.01 0.00 3.98 0.00 0.00 57.97 61.74 2b1i h PHE 238 Cb 0.83 0.43 -0.03 0.00 2.56 0.00 0.00 35.95 39.74 2b1i h PHE 238 CO 0.00 -0.49 0.42 0.82 -2.02 0.00 0.00 178.31 177.04 2b1i h ILE 239 N -0.65 1.15 -0.96 1.41 2.04 -1.87 -0.32 117.51 118.32 2b1i h ILE 239 Ca 0.01 -0.29 0.30 0.00 1.00 0.00 0.00 64.86 65.88 2b1i h ILE 239 Cb 0.65 0.22 -0.16 0.00 -0.74 0.00 0.00 36.82 36.79 2b1i h ILE 239 CO -0.18 0.16 0.28 0.78 0.00 0.00 0.00 178.15 179.19 2b1i h ASN 240 N 0.86 -0.02 0.60 1.72 -0.26 -1.91 0.14 115.58 116.70 2b1i h ASN 240 Ca 0.24 0.24 -0.28 0.00 -0.56 0.00 0.00 56.30 55.93 2b1i h ASN 240 Cb -0.09 0.32 -0.01 0.00 -1.06 0.00 0.00 38.32 37.49 2b1i h ASN 240 CO -0.06 -0.28 -1.35 -0.07 -1.06 0.00 0.00 177.43 174.61 2b1i h LEU 241 N 0.11 0.34 -1.11 1.61 3.38 -0.82 0.10 115.31 118.92 2b1i h LEU 241 Ca 0.66 -0.42 0.05 0.00 0.09 0.00 0.00 57.88 58.26 2b1i h LEU 241 Cb 1.47 -0.11 -0.06 0.00 0.09 0.00 0.00 40.66 42.05 2b1i h LEU 241 CO -0.76 1.34 0.61 0.00 0.09 0.00 0.00 178.44 179.71 2b1i h ASP 243 N 1.12 -0.28 -0.76 0.00 3.32 -0.70 -3.04 116.42 116.08 2b1i h ASP 243 Ca 0.38 -0.24 0.10 0.00 0.02 0.00 0.00 57.03 57.29 2b1i h ASP 243 Cb 0.08 0.07 -0.08 0.00 0.22 0.00 0.00 39.33 39.63 2b1i h ASP 243 CO -0.13 0.21 0.39 0.00 -1.72 0.00 0.00 179.24 177.99 2b1i h ALA 244 N -0.47 1.07 0.02 3.45 0.00 -0.58 0.29 119.26 123.04 2b1i h ALA 244 Ca -0.03 0.06 -0.20 0.00 0.00 0.00 0.00 54.91 54.73 2b1i h ALA 244 Cb 0.50 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 2b1i h ALA 244 CO 0.06 -0.02 -0.94 -0.07 0.00 0.00 0.00 179.25 178.27 2b1i h LEU 245 N 0.64 0.14 -0.08 0.00 3.38 -1.11 0.34 115.31 118.63 2b1i h LEU 245 Ca 0.38 -0.13 -0.24 0.00 0.09 0.00 0.00 57.88 57.98 2b1i h LEU 245 Cb 0.42 -0.05 0.02 0.00 0.09 0.00 0.00 40.66 41.14 2b1i h LEU 245 CO -0.28 1.00 -0.89 0.78 0.09 0.00 0.00 178.44 179.14 2b1i h ASN 246 N 0.05 0.92 -0.63 -0.43 2.35 -1.38 -2.99 115.58 113.47 2b1i h ASN 246 Ca -0.04 -0.68 -0.06 0.00 -0.55 0.00 0.00 56.30 54.97 2b1i h ASN 246 Cb 1.62 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 39.68 2b1i h ASN 246 CO 0.13 1.47 0.17 0.00 -1.65 0.00 0.00 177.43 177.55 2b1i h ALA 247 N 0.47 1.06 -0.28 -0.83 0.00 -0.21 -1.59 119.26 117.89 2b1i h ALA 247 Ca -0.09 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.56 2b1i h ALA 247 Cb 1.53 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 19.06 2b1i h ALA 247 CO 0.18 0.62 0.06 2.35 0.00 0.00 0.00 179.25 182.46 2b1i h TRP 248 N 0.98 0.48 -0.39 0.00 2.91 -0.42 -1.85 115.95 117.66 2b1i h TRP 248 Ca 0.21 -0.06 -0.00 0.00 1.13 0.00 0.00 58.89 60.16 2b1i h TRP 248 Cb 0.33 -0.13 -0.02 0.00 -0.51 0.00 0.00 29.16 28.83 2b1i h TRP 248 CO 0.02 0.54 0.23 1.96 -1.03 0.00 0.00 178.44 180.16 2b1i h GLN 249 N 0.28 0.53 -0.01 2.65 4.20 -1.31 0.90 115.11 122.35 2b1i h GLN 249 Ca 0.09 -0.05 0.02 0.00 0.06 0.00 0.00 58.65 58.76 2b1i h GLN 249 Cb 0.31 -0.11 -0.05 0.00 0.30 0.00 0.00 27.48 27.93 2b1i h GLN 249 CO 0.00 0.40 -0.48 1.25 -0.67 0.00 0.00 178.83 179.34 2b1i h LEU 250 N 0.51 -1.48 -1.15 1.46 6.46 -1.15 0.11 115.31 120.07 2b1i h LEU 250 Ca 0.14 0.17 -0.07 0.00 -0.12 0.00 0.00 57.88 57.99 2b1i h LEU 250 Cb 0.01 0.56 -0.01 0.00 -0.73 0.00 0.00 40.66 40.49 2b1i h LEU 250 CO -0.03 -0.47 -0.20 -0.37 -0.62 0.00 0.00 178.44 176.76 2b1i h VAL 251 N -0.60 1.23 -0.39 1.05 -1.51 -1.13 -0.79 116.25 114.12 2b1i h VAL 251 Ca 0.01 -1.07 -0.02 0.00 -1.23 0.00 0.00 66.70 64.39 2b1i h VAL 251 Cb 0.64 1.31 -0.02 0.00 -2.13 0.00 0.00 31.29 31.09 2b1i h VAL 251 CO -0.32 0.34 0.16 0.50 -1.23 0.00 0.00 177.57 177.02 2b1i h LYS 252 N 0.32 0.58 -0.35 5.19 3.64 -0.58 -1.94 116.57 123.42 2b1i h LYS 252 Ca 0.06 -0.10 -0.15 0.00 -1.27 0.00 0.00 60.65 59.19 2b1i h LYS 252 Cb 0.54 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.25 2b1i h LYS 252 CO 0.04 0.54 -0.37 0.93 -2.27 0.00 0.00 179.45 178.32 2b1i h GLU 253 N 0.49 0.83 -0.07 1.90 5.08 0.06 0.36 114.58 123.22 2b1i h GLU 253 Ca 0.13 -0.42 0.02 0.00 -1.00 0.00 0.00 59.36 58.10 2b1i h GLU 253 Cb 0.17 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.40 2b1i h GLU 253 CO -0.01 1.06 -0.08 -0.07 -1.00 0.00 0.00 179.01 178.90 2b1i h LEU 254 N 0.68 -0.24 -0.74 1.33 3.38 -1.19 0.26 115.31 118.79 2b1i h LEU 254 Ca 0.06 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 2b1i h LEU 254 Cb 0.93 0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.77 2b1i h LEU 254 CO 0.09 -0.11 0.35 0.50 0.09 0.00 0.00 178.44 179.36 2b1i h LYS 255 N -0.10 1.06 -0.23 1.13 1.63 -1.12 0.17 116.57 119.11 2b1i h LYS 255 Ca 0.06 -0.16 -0.01 0.00 -0.85 0.00 0.00 60.65 59.69 2b1i h LYS 255 Cb 0.19 -0.19 -0.01 0.00 -0.60 0.00 0.00 32.23 31.61 2b1i h LYS 255 CO -0.14 0.83 0.11 1.96 -3.45 0.00 0.00 179.45 178.76 2b1i h GLN 256 N 1.04 0.34 -0.42 1.90 4.20 -0.73 0.38 115.11 121.82 2b1i h GLN 256 Ca 0.25 -0.05 -0.04 0.00 0.06 0.00 0.00 58.65 58.87 2b1i h GLN 256 Cb 0.12 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 27.82 2b1i h GLN 256 CO -0.03 0.36 0.09 0.00 -0.67 0.00 0.00 178.83 178.57 2b1i h ALA 257 N 0.96 0.55 0.00 3.87 0.00 -0.17 -3.38 119.26 121.10 2b1i h ALA 257 Ca 0.08 -0.20 -0.07 0.00 0.00 0.00 0.00 54.91 54.71 2b1i h ALA 257 Cb 0.13 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2b1i h ALA 257 CO -0.01 0.25 -1.48 1.28 0.00 0.00 0.00 179.25 179.29 2b1i n LEU 258 N -4.53 0.00 -0.76 0.00 4.77 0.57 -4.81 117.00 112.24 2b1i n LEU 258 Ca -0.00 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.90 2b1i n LEU 258 Cb 0.22 0.10 -0.02 0.00 -2.33 0.00 0.00 43.42 41.39 2b1i n LEU 258 CO 0.39 0.10 -0.09 0.61 -1.33 0.00 0.00 177.39 177.07 2b1i n GLY 259 N 2.25 0.57 3.22 -0.72 0.00 0.13 -5.01 105.19 105.64 2b1i n GLY 259 Ca -0.07 -0.61 -0.30 0.00 0.00 0.00 0.00 46.02 45.03 2b1i n GLY 259 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b1i s ILE 260 N -2.35 1.87 0.21 -0.61 1.01 -1.26 -5.07 121.20 115.00 2b1i s ILE 260 Ca 0.00 -0.95 -0.31 0.00 0.00 0.00 0.00 60.65 59.39 2b1i s ILE 260 Cb 0.00 -1.60 -0.15 0.00 0.01 0.00 0.00 42.46 40.72 2b1i s ILE 260 CO 0.00 0.52 1.09 -2.65 0.00 0.00 0.00 174.94 173.90 2b1i n PRO 261 N 3.16 1.17 -4.25 2.79 -0.02 -1.26 -4.29 135.00 132.30 2b1i n PRO 261 Ca -0.18 0.41 -0.18 0.00 -2.02 0.00 0.00 63.50 61.53 2b1i n PRO 261 Cb 0.52 -1.85 -0.11 0.00 -0.02 0.00 0.00 33.50 32.04 2b1i n PRO 261 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2b1i s ALA 262 N -0.49 1.54 0.12 3.55 0.00 -1.26 0.50 121.76 125.71 2b1i s ALA 262 Ca 0.68 -1.31 -0.04 0.00 0.00 0.00 0.00 51.96 51.29 2b1i s ALA 262 Cb -0.81 -0.08 -0.03 0.00 0.00 0.00 0.00 23.12 22.20 2b1i s ALA 262 CO 0.55 0.11 0.12 0.00 0.00 0.00 0.00 175.76 176.54 2b1i s ALA 263 N -2.15 0.43 0.01 0.00 0.00 0.51 0.10 121.76 120.65 2b1i s ALA 263 Ca 0.10 -1.16 -0.15 0.00 0.00 0.00 0.00 51.96 50.74 2b1i s ALA 263 Cb -0.05 0.73 0.02 0.00 0.00 0.00 0.00 23.12 23.82 2b1i s ALA 263 CO 0.03 -0.52 0.33 0.00 0.00 0.00 0.00 175.76 175.60 2b1i s ALA 264 N -3.98 -0.79 -0.22 0.00 0.00 -0.28 -0.98 121.76 115.50 2b1i s ALA 264 Ca 0.17 0.24 0.01 0.00 0.00 0.00 0.00 51.96 52.38 2b1i s ALA 264 Cb 0.06 0.18 0.05 0.00 0.00 0.00 0.00 23.12 23.41 2b1i s ALA 264 CO -0.02 -0.33 -0.10 0.45 0.00 0.00 0.00 175.76 175.75 2b1i s SER 265 N -1.64 3.75 0.06 0.00 0.15 -0.09 -1.13 113.70 114.80 2b1i s SER 265 Ca -0.10 -1.07 0.02 0.00 0.70 0.00 0.00 55.95 55.51 2b1i s SER 265 Cb -0.03 -1.33 -0.04 0.00 -1.71 0.00 0.00 66.02 62.91 2b1i s SER 265 CO 0.01 -0.16 0.06 -0.36 1.20 0.00 0.00 173.24 173.99 2b1i s PHE 266 N 1.31 3.17 -0.20 3.44 0.40 0.40 0.19 117.98 126.69 2b1i s PHE 266 Ca -0.04 0.09 -0.11 0.00 -0.60 0.00 0.00 56.93 56.27 2b1i s PHE 266 Cb -0.18 -1.64 0.06 0.00 0.51 0.00 0.00 43.02 41.78 2b1i s PHE 266 CO -0.07 0.52 0.48 0.21 0.70 0.00 0.00 175.22 177.05 2b1i s LYS 267 N -2.19 0.48 -1.59 0.44 2.47 -0.22 0.14 119.74 119.27 2b1i s LYS 267 Ca 0.27 0.88 -0.12 0.00 -1.56 0.00 0.00 55.97 55.44 2b1i s LYS 267 Cb -0.12 0.04 0.10 0.00 -1.46 0.00 0.00 37.83 36.38 2b1i s LYS 267 CO 0.19 -0.15 0.67 0.72 0.16 0.00 0.00 175.35 176.94 2b1i n HIS 268 N 4.16 -1.76 -2.37 4.03 8.25 -1.26 -2.37 115.22 123.91 2b1i n HIS 268 Ca -0.22 0.79 -0.18 0.00 -0.26 0.00 0.00 57.72 57.85 2b1i n HIS 268 Cb 0.56 -3.32 -0.01 0.00 1.12 0.00 0.00 29.99 28.35 2b1i n HIS 268 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 2b1i n VAL 269 N -4.43 -0.90 -4.06 1.59 0.31 -1.26 -4.92 118.33 104.68 2b1i n VAL 269 Ca -0.07 0.00 -0.09 0.00 -0.01 0.00 0.00 64.34 64.18 2b1i n VAL 269 Cb 0.56 -2.64 -0.11 0.00 -0.91 0.00 0.00 33.84 30.75 2b1i n VAL 269 CO 0.00 0.00 0.00 -0.44 -1.32 0.00 0.00 176.83 175.07 2b1i s SER 270 N -2.23 0.50 0.17 4.52 0.01 -1.00 -4.11 113.70 111.56 2b1i s SER 270 Ca 0.02 -0.77 -0.30 0.00 1.31 0.00 0.00 55.95 56.20 2b1i s SER 270 Cb -0.01 0.14 -0.08 0.00 0.21 0.00 0.00 66.02 66.28 2b1i s SER 270 CO 0.02 -0.44 1.28 -2.16 0.41 0.00 0.00 173.24 172.35 2b1i s PRO 271 N -2.78 4.41 0.15 12.44 0.04 -1.26 -1.06 135.00 146.94 2b1i s PRO 271 Ca -0.03 1.99 0.03 0.00 0.04 0.00 0.00 61.00 63.03 2b1i s PRO 271 Cb -0.01 -3.22 -0.07 0.00 0.04 0.00 0.00 34.50 31.24 2b1i s PRO 271 CO -0.05 -0.23 1.34 0.00 0.04 0.00 0.00 177.00 178.09 2b1i h ALA 272 N 5.62 0.45 -2.90 8.56 0.00 0.17 -3.46 119.26 127.70 2b1i h ALA 272 Ca -0.44 -0.77 0.09 0.00 0.00 0.00 0.00 54.91 53.78 2b1i h ALA 272 Cb 1.21 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.87 2b1i h ALA 272 CO 0.78 0.98 0.27 0.20 0.00 0.00 0.00 179.25 181.48 2b1i s GLY 273 N -4.56 -0.10 -0.29 0.00 0.00 -1.06 -4.31 107.32 97.00 2b1i s GLY 273 Ca -0.02 -0.25 -0.19 0.00 0.00 0.00 0.00 44.72 44.25 2b1i s GLY 273 CO 0.83 -0.07 1.04 0.00 0.00 0.00 0.00 173.10 174.89 2b1i s ALA 274 N -3.79 -2.22 0.04 3.20 0.00 -1.26 -0.91 121.76 116.83 2b1i s ALA 274 Ca 0.11 2.07 -0.19 0.00 0.00 0.00 0.00 51.96 53.95 2b1i s ALA 274 Cb -0.05 -1.66 0.04 0.00 0.00 0.00 0.00 23.12 21.45 2b1i s ALA 274 CO 0.06 -0.30 0.43 0.00 0.00 0.00 0.00 175.76 175.96 2b1i s ALA 275 N 0.94 -1.07 0.25 0.00 0.00 -0.16 -0.42 121.76 121.30 2b1i s ALA 275 Ca -0.05 0.37 0.00 0.00 0.00 0.00 0.00 51.96 52.28 2b1i s ALA 275 Cb -0.04 0.35 -0.04 0.00 0.00 0.00 0.00 23.12 23.39 2b1i s ALA 275 CO -0.12 -0.46 0.43 0.14 0.00 0.00 0.00 175.76 175.75 2b1i s VAL 276 N -2.46 5.18 -1.52 0.00 -7.23 -0.05 -0.37 120.40 113.95 2b1i s VAL 276 Ca -0.05 -0.45 -0.11 0.00 -1.81 0.00 0.00 61.98 59.56 2b1i s VAL 276 Cb -0.01 -3.78 -0.01 0.00 0.56 0.00 0.00 36.38 33.14 2b1i s VAL 276 CO -0.02 -0.30 2.59 0.61 -0.31 0.00 0.00 175.10 177.67 2b1i n GLY 277 N -1.05 4.44 3.72 2.32 0.00 0.18 -4.41 105.19 110.39 2b1i n GLY 277 Ca -0.05 -1.63 -0.42 0.00 0.00 0.00 0.00 46.02 43.92 2b1i n GLY 277 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b1i s ILE 278 N 2.05 2.99 0.45 -0.61 -1.09 -1.26 -4.61 121.20 119.12 2b1i s ILE 278 Ca 0.59 0.73 -0.25 0.00 -2.23 0.00 0.00 60.65 59.49 2b1i s ILE 278 Cb 0.16 -3.47 -0.09 0.00 -1.58 0.00 0.00 42.46 37.49 2b1i s ILE 278 CO -0.07 0.07 1.32 -2.65 -1.23 0.00 0.00 174.94 172.39 2b1i n PRO 279 N 3.60 1.98 -2.80 2.79 -0.02 -1.26 -4.74 135.00 134.54 2b1i n PRO 279 Ca 0.11 0.71 -0.41 0.00 -2.02 0.00 0.00 63.50 61.89 2b1i n PRO 279 Cb 0.41 -2.48 -0.04 0.00 -0.02 0.00 0.00 33.50 31.37 2b1i n PRO 279 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2b1i s LEU 280 N -2.20 4.43 1.03 2.45 1.02 -1.26 -5.06 118.68 119.09 2b1i s LEU 280 Ca 0.63 1.63 -0.12 0.00 0.02 0.00 0.00 54.13 56.29 2b1i s LEU 280 Cb -0.48 -3.46 0.21 0.00 0.02 0.00 0.00 46.19 42.48 2b1i s LEU 280 CO 0.57 -0.11 1.08 -0.94 0.02 0.00 0.00 176.35 176.96 2b1i s SER 281 N 0.37 2.09 0.28 2.29 1.04 -1.26 -4.78 113.70 113.73 2b1i s SER 281 Ca 0.46 1.72 -0.02 0.00 0.48 0.00 0.00 55.95 58.59 2b1i s SER 281 Cb -0.22 -2.36 0.41 0.00 0.10 0.00 0.00 66.02 63.96 2b1i s SER 281 CO 0.27 -3.54 1.88 -0.08 0.98 0.00 0.00 173.24 172.75 2b1i h GLU 282 N -2.17 0.96 -0.46 4.02 4.81 -1.99 0.46 114.58 120.22 2b1i h GLU 282 Ca -0.53 -0.13 -0.08 0.00 -0.13 0.00 0.00 59.36 58.49 2b1i h GLU 282 Cb 1.30 -0.18 -0.02 0.00 0.63 0.00 0.00 28.75 30.49 2b1i h GLU 282 CO 0.48 0.75 -0.02 0.93 -0.73 0.00 0.00 179.01 180.42 2b1i h GLU 283 N 0.96 0.83 -0.53 1.92 4.39 -2.00 -2.26 114.58 117.90 2b1i h GLU 283 Ca 0.23 -0.28 -0.11 0.00 0.34 0.00 0.00 59.36 59.55 2b1i h GLU 283 Cb 0.11 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 28.67 2b1i h GLU 283 CO -0.03 0.89 -0.09 1.49 -1.16 0.00 0.00 179.01 180.12 2b1i h GLU 284 N 0.68 0.97 -0.63 2.33 4.57 -1.81 -1.15 114.58 119.54 2b1i h GLU 284 Ca 0.13 -0.34 0.03 0.00 -1.18 0.00 0.00 59.36 58.00 2b1i h GLU 284 Cb 0.54 -0.07 -0.03 0.00 -0.16 0.00 0.00 28.75 29.02 2b1i h GLU 284 CO 0.03 1.01 0.42 0.00 -1.18 0.00 0.00 179.01 179.28 2b1i h ALA 285 N 1.02 1.64 0.12 2.92 0.00 -0.73 0.15 119.26 124.39 2b1i h ALA 285 Ca 0.14 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2b1i h ALA 285 Cb 0.63 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2b1i h ALA 285 CO 0.04 0.30 -0.06 1.96 0.00 0.00 0.00 179.25 181.49 2b1i h GLN 286 N 0.76 -0.16 -0.84 0.00 4.20 -1.03 0.42 115.11 118.47 2b1i h GLN 286 Ca 0.25 0.01 0.19 0.00 0.06 0.00 0.00 58.65 59.16 2b1i h GLN 286 Cb 0.05 0.04 -0.12 0.00 0.30 0.00 0.00 27.48 27.74 2b1i h GLN 286 CO -0.07 0.27 0.31 0.28 -0.67 0.00 0.00 178.83 178.95 2b1i h VAL 287 N -0.66 0.50 -0.01 -0.54 2.07 -0.86 0.23 116.25 116.98 2b1i h VAL 287 Ca -0.02 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.38 2b1i h VAL 287 Cb 0.50 0.10 0.00 0.00 -1.52 0.00 0.00 31.29 30.38 2b1i h VAL 287 CO 0.03 0.07 -0.05 0.00 0.02 0.00 0.00 177.57 177.63 2b1i n MET 289 N -0.64 -3.26 -1.63 0.00 0.00 0.79 -4.81 117.12 107.57 2b1i n MET 289 Ca 0.18 0.59 0.00 0.00 0.00 0.00 0.00 57.70 58.47 2b1i n MET 289 Cb 0.25 -4.78 0.07 0.00 0.00 0.00 0.00 33.22 28.77 2b1i n MET 289 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 175.97 177.30 2b1i n VAL 290 N -4.07 1.11 -0.07 2.03 0.24 0.13 -4.88 118.33 112.83 2b1i n VAL 290 Ca -0.07 -2.34 -0.13 0.00 -2.04 0.00 0.00 64.34 59.75 2b1i n VAL 290 Cb 0.58 0.50 -0.06 0.00 -1.47 0.00 0.00 33.84 33.40 2b1i n VAL 290 CO 0.00 0.00 0.00 -0.74 -2.14 0.00 0.00 176.83 173.95 2b1i h HIS 291 N 1.48 0.63 -0.54 6.34 6.17 -1.79 -0.65 115.15 126.80 2b1i h HIS 291 Ca -0.08 -0.19 0.12 0.00 0.71 0.00 0.00 60.37 60.93 2b1i h HIS 291 Cb 1.50 -0.13 -0.03 0.00 2.52 0.00 0.00 27.41 31.27 2b1i h HIS 291 CO 0.47 0.86 0.37 0.38 0.71 0.00 0.00 177.93 180.72 2b1i h ASP 292 N 0.21 0.18 -0.03 3.26 2.03 -1.90 -0.56 116.42 119.62 2b1i h ASP 292 Ca 0.04 0.01 0.00 0.00 -0.73 0.00 0.00 57.03 56.34 2b1i h ASP 292 Cb 0.75 -0.03 0.00 0.00 -0.83 0.00 0.00 39.33 39.22 2b1i h ASP 292 CO 0.05 0.11 0.00 0.18 -1.03 0.00 0.00 179.24 178.55 2b1i n LEU 293 N -4.44 2.50 -0.33 0.15 4.77 -1.07 -4.68 117.00 113.89 2b1i n LEU 293 Ca 0.09 -0.84 0.13 0.00 -0.03 0.00 0.00 56.01 55.36 2b1i n LEU 293 Cb 0.47 -0.00 0.31 0.00 -2.33 0.00 0.00 43.42 41.86 2b1i n LEU 293 CO 0.35 0.42 1.15 -0.74 -1.33 0.00 0.00 177.39 177.24 2b1i h HIS 294 N 3.91 0.94 0.00 -1.77 2.76 0.51 -0.55 115.15 120.95 2b1i h HIS 294 Ca 0.00 0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.21 2b1i h HIS 294 Cb 0.83 -0.27 0.00 0.00 1.55 0.00 0.00 27.41 29.52 2b1i h HIS 294 CO 0.00 0.15 0.00 0.87 -1.30 0.00 0.00 177.93 177.66 2b1i h LYS 295 N 0.65 0.00 0.00 5.26 1.79 -1.83 -2.96 116.57 119.48 2b1i h LYS 295 Ca 0.56 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 59.03 2b1i h LYS 295 Cb 0.93 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.58 2b1i h LYS 295 CO -0.42 0.00 -0.75 0.25 -1.08 0.00 0.00 179.45 177.45 2b1i n THR 296 N -2.40 0.13 -1.97 -0.16 -2.24 -0.23 -4.97 114.28 102.43 2b1i n THR 296 Ca 0.04 -0.14 -0.41 0.00 -2.27 0.00 0.00 64.05 61.27 2b1i n THR 296 Cb 0.37 0.23 -0.02 0.00 -2.10 0.00 0.00 70.33 68.80 2b1i n THR 296 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2b1i s LEU 297 N -3.56 4.38 0.41 3.22 1.43 -1.09 -4.77 118.68 118.71 2b1i s LEU 297 Ca 0.07 2.73 0.08 0.00 -1.03 0.00 0.00 54.13 55.98 2b1i s LEU 297 Cb 0.15 -3.63 -0.00 0.00 0.03 0.00 0.00 46.19 42.75 2b1i s LEU 297 CO 0.75 -0.74 0.50 0.42 0.23 0.00 0.00 176.35 177.52 2b1i s THR 298 N -0.06 3.01 0.29 5.49 -4.23 -1.26 -4.89 115.64 113.98 2b1i s THR 298 Ca 0.60 -1.10 0.04 0.00 -1.18 0.00 0.00 61.69 60.04 2b1i s THR 298 Cb -0.43 -3.04 0.28 0.00 1.34 0.00 0.00 72.50 70.66 2b1i s THR 298 CO 0.45 -0.02 1.71 -0.65 -0.54 0.00 0.00 174.62 175.57 2b1i h PRO 299 N 0.78 0.45 -0.19 3.99 0.11 -1.96 0.24 132.00 135.43 2b1i h PRO 299 Ca -0.41 -0.03 -0.20 0.00 0.11 0.00 0.00 66.00 65.47 2b1i h PRO 299 Cb 1.27 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2b1i h PRO 299 CO 0.49 0.30 -0.69 1.25 -0.21 0.00 0.00 178.00 179.14 2b1i h LEU 300 N 0.46 0.86 -0.34 2.35 5.85 -1.87 -0.88 115.31 121.75 2b1i h LEU 300 Ca 0.56 -0.53 -0.04 0.00 0.84 0.00 0.00 57.88 58.72 2b1i h LEU 300 Cb 1.03 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.79 2b1i h LEU 300 CO -0.50 1.31 0.07 0.00 -0.34 0.00 0.00 178.44 178.99 2b1i h ALA 301 N 0.69 0.45 -0.45 1.25 0.00 -1.76 0.39 119.26 119.82 2b1i h ALA 301 Ca -0.03 -0.19 0.07 0.00 0.00 0.00 0.00 54.91 54.77 2b1i h ALA 301 Cb 1.29 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 18.90 2b1i h ALA 301 CO 0.14 0.13 0.10 0.77 0.00 0.00 0.00 179.25 180.38 2b1i h SER 302 N 0.39 0.02 -0.90 0.00 0.02 -0.55 0.75 113.55 113.29 2b1i h SER 302 Ca 0.10 0.08 -0.02 0.00 -0.84 0.00 0.00 61.79 61.11 2b1i h SER 302 Cb 0.32 0.10 -0.04 0.00 0.14 0.00 0.00 62.40 62.92 2b1i h SER 302 CO 0.00 0.05 0.49 0.00 -1.14 0.00 0.00 176.83 176.23 2b1i h ALA 303 N 1.34 1.15 -0.13 3.77 0.00 -0.70 0.17 119.26 124.86 2b1i h ALA 303 Ca 0.22 -0.13 -0.14 0.00 0.00 0.00 0.00 54.91 54.86 2b1i h ALA 303 Cb 0.27 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.71 2b1i h ALA 303 CO -0.28 0.66 -0.47 -0.92 0.00 0.00 0.00 179.25 178.25 2b1i h TYR 304 N 1.26 0.72 -0.55 0.00 3.20 -0.42 -0.81 116.97 120.37 2b1i h TYR 304 Ca 0.32 -0.30 0.10 0.00 3.14 0.00 0.00 58.73 61.99 2b1i h TYR 304 Cb 0.03 -0.12 -0.08 0.00 1.54 0.00 0.00 36.73 38.11 2b1i h TYR 304 CO 0.01 1.07 0.10 0.00 -1.64 0.00 0.00 178.16 177.70 2b1i h ALA 305 N 0.51 0.63 -0.56 1.82 0.00 0.98 0.17 119.26 122.81 2b1i h ALA 305 Ca -0.02 0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 2b1i h ALA 305 Cb 1.10 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 2b1i h ALA 305 CO 0.10 -0.32 0.16 0.00 0.00 0.00 0.00 179.25 179.19 2b1i h ARG 306 N 0.23 0.89 -0.26 0.00 3.08 -0.70 0.13 114.38 117.74 2b1i h ARG 306 Ca 0.28 -0.20 -0.13 0.00 0.07 0.00 0.00 59.98 60.01 2b1i h ARG 306 Cb 0.41 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.34 2b1i h ARG 306 CO -0.38 0.81 -0.34 0.66 -1.07 0.00 0.00 179.97 179.65 2b1i h SER 307 N 0.80 0.76 0.63 7.04 4.64 0.33 -1.86 113.55 125.90 2b1i h SER 307 Ca 0.18 -0.50 -0.03 0.00 -0.47 0.00 0.00 61.79 60.97 2b1i h SER 307 Cb 0.31 -0.21 -0.00 0.00 -0.31 0.00 0.00 62.40 62.18 2b1i h SER 307 CO -0.00 1.11 -0.16 -0.09 -0.87 0.00 0.00 176.83 176.82 2b1i h ARG 308 N 0.43 0.00 0.00 4.77 2.43 -0.73 -3.13 114.38 118.14 2b1i h ARG 308 Ca 0.03 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.20 2b1i h ARG 308 Cb 0.92 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.47 2b1i h ARG 308 CO 0.08 0.16 0.00 0.41 -1.51 0.00 0.00 179.97 179.11 2b1i n GLY 309 N -0.29 -1.49 0.15 2.80 0.00 0.03 -3.40 105.19 103.00 2b1i n GLY 309 Ca -0.01 -0.03 -0.10 0.00 0.00 0.00 0.00 46.02 45.89 2b1i n GLY 309 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2b1i h ALA 310 N 2.60 0.39 -1.81 4.61 0.00 -1.39 -3.41 119.26 120.26 2b1i h ALA 310 Ca 0.00 -0.09 -0.23 0.00 0.00 0.00 0.00 54.91 54.58 2b1i h ALA 310 Cb 0.55 -0.12 -0.30 0.00 0.00 0.00 0.00 17.79 17.92 2b1i h ALA 310 CO 0.00 -0.05 -0.57 0.34 0.00 0.00 0.00 179.25 178.97 2b1i s ASP 311 N -5.66 0.70 0.45 0.00 -1.08 -1.24 -4.66 116.67 105.19 2b1i s ASP 311 Ca -0.13 -0.60 0.10 0.00 -0.52 0.00 0.00 52.55 51.40 2b1i s ASP 311 Cb 0.09 0.94 1.01 0.00 -1.46 0.00 0.00 42.92 43.50 2b1i s ASP 311 CO 0.72 -0.35 2.09 0.03 0.52 0.00 0.00 175.17 178.19 2b1i h ARG 312 N 8.05 0.34 -0.14 4.34 2.47 -1.78 -2.45 114.38 125.21 2b1i h ARG 312 Ca -0.08 -0.02 -0.19 0.00 -1.26 0.00 0.00 59.98 58.43 2b1i h ARG 312 Cb 1.10 -0.08 0.01 0.00 -1.65 0.00 0.00 29.97 29.36 2b1i h ARG 312 CO 0.27 0.23 -0.66 0.52 0.56 0.00 0.00 179.97 180.88 2b1i h MET 313 N 0.35 0.70 -0.03 0.04 2.86 -1.88 -3.14 114.93 113.84 2b1i h MET 313 Ca 0.10 -0.57 -0.04 0.00 -2.06 0.00 0.00 59.70 57.13 2b1i h MET 313 Cb -0.04 0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.73 2b1i h MET 313 CO -0.02 1.18 -0.16 0.77 1.06 0.00 0.00 176.91 179.74 2b1i h SER 314 N 0.40 0.04 0.11 1.22 0.02 -1.85 -2.04 113.55 111.45 2b1i h SER 314 Ca -0.04 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 2b1i h SER 314 Cb 1.30 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.83 2b1i h SER 314 CO 0.14 0.21 0.00 -1.20 -1.14 0.00 0.00 176.83 174.84 2b1i n SER 315 N -4.32 0.00 -4.63 3.07 7.64 -0.96 -4.73 113.62 109.68 2b1i n SER 315 Ca -0.02 -0.81 -0.43 0.00 1.01 0.00 0.00 58.87 58.62 2b1i n SER 315 Cb 0.24 -0.06 -0.03 0.00 -1.01 0.00 0.00 64.21 63.36 2b1i n SER 315 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 2b1i s PHE 316 N -2.11 1.70 0.00 1.43 2.19 -0.77 -1.68 117.98 118.74 2b1i s PHE 316 Ca 0.43 0.33 0.00 0.00 0.33 0.00 0.00 56.93 58.03 2b1i s PHE 316 Cb 0.21 -4.03 0.00 0.00 -1.31 0.00 0.00 43.02 37.89 2b1i s PHE 316 CO 0.38 -3.76 0.00 0.41 1.83 0.00 0.00 175.22 174.08 2b1i n GLY 317 N 4.92 0.51 3.80 13.12 0.00 0.03 -4.97 105.19 122.60 2b1i n GLY 317 Ca 0.22 -0.86 -0.31 0.00 0.00 0.00 0.00 46.02 45.07 2b1i n GLY 317 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2b1i s ASP 318 N -2.90 4.96 -0.16 1.61 -4.77 -0.67 -3.78 116.67 110.97 2b1i s ASP 318 Ca 0.00 1.64 -0.08 0.00 -3.30 0.00 0.00 52.55 50.82 2b1i s ASP 318 Cb 0.00 -2.45 -0.04 0.00 -1.09 0.00 0.00 42.92 39.34 2b1i s ASP 318 CO 0.00 -1.71 0.10 0.12 0.70 0.00 0.00 175.17 174.38 2b1i s PHE 319 N -3.01 3.40 0.06 2.11 2.19 0.12 0.42 117.98 123.26 2b1i s PHE 319 Ca 0.59 0.30 0.02 0.00 0.33 0.00 0.00 56.93 58.18 2b1i s PHE 319 Cb -0.15 -2.04 -0.04 0.00 -1.31 0.00 0.00 43.02 39.48 2b1i s PHE 319 CO 0.55 0.40 0.06 0.42 1.83 0.00 0.00 175.22 178.49 2b1i s ILE 320 N -0.15 4.48 -0.02 3.12 1.01 0.78 0.15 121.20 130.57 2b1i s ILE 320 Ca 0.09 -0.71 0.03 0.00 0.00 0.00 0.00 60.65 60.07 2b1i s ILE 320 Cb -0.12 -3.12 -0.00 0.00 0.01 0.00 0.00 42.46 39.23 2b1i s ILE 320 CO 0.01 0.19 -0.12 0.00 0.00 0.00 0.00 174.94 175.01 2b1i s ALA 321 N -1.32 1.10 -0.04 9.38 0.00 -0.29 -0.06 121.76 130.54 2b1i s ALA 321 Ca 0.27 -0.50 0.07 0.00 0.00 0.00 0.00 51.96 51.80 2b1i s ALA 321 Cb -0.12 -0.35 -0.01 0.00 0.00 0.00 0.00 23.12 22.64 2b1i s ALA 321 CO 0.19 0.22 -0.25 -0.51 0.00 0.00 0.00 175.76 175.41 2b1i s LEU 322 N -0.02 2.05 0.24 0.00 1.43 -0.01 -1.13 118.68 121.24 2b1i s LEU 322 Ca -0.00 -0.48 0.26 0.00 -1.03 0.00 0.00 54.13 52.87 2b1i s LEU 322 Cb -0.08 -1.32 0.79 0.00 0.03 0.00 0.00 46.19 45.61 2b1i s LEU 322 CO 0.01 0.27 1.76 0.77 0.23 0.00 0.00 176.35 179.38 2b1i h SER 323 N 5.85 0.00 -3.95 2.29 4.64 -0.61 -3.36 113.55 118.42 2b1i h SER 323 Ca -0.36 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 60.58 2b1i h SER 323 Cb 1.15 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.10 2b1i h SER 323 CO 0.47 0.00 -0.65 -1.81 -0.87 0.00 0.00 176.83 173.97 2b1i s ASP 324 N -4.68 1.74 0.28 4.97 1.11 -1.26 -4.67 116.67 114.16 2b1i s ASP 324 Ca 0.10 -1.26 -0.30 0.00 0.18 0.00 0.00 52.55 51.27 2b1i s ASP 324 Cb 0.11 0.03 -0.13 0.00 1.07 0.00 0.00 42.92 44.00 2b1i s ASP 324 CO 0.59 -0.56 1.35 -0.38 1.18 0.00 0.00 175.17 177.34 2b1i n ILE 325 N -0.44 1.36 -2.26 0.77 5.41 -1.26 -4.35 119.36 118.59 2b1i n ILE 325 Ca -0.04 -0.34 -0.42 0.00 1.00 0.00 0.00 62.75 62.94 2b1i n ILE 325 Cb 0.64 -1.48 -0.03 0.00 -0.71 0.00 0.00 39.64 38.07 2b1i n ILE 325 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2b1i s ASP 327 N 2.29 5.10 0.10 0.00 1.47 -1.26 -1.32 116.67 123.05 2b1i s ASP 327 Ca 0.62 -0.21 -0.23 0.00 1.18 0.00 0.00 52.55 53.91 2b1i s ASP 327 Cb -0.27 -0.55 -0.12 0.00 -0.34 0.00 0.00 42.92 41.63 2b1i s ASP 327 CO 0.22 -1.27 1.72 0.58 0.68 0.00 0.00 175.17 177.10 2b1i h VAL 328 N 0.02 0.88 -0.71 2.11 2.07 -1.94 -1.42 116.25 117.25 2b1i h VAL 328 Ca -0.39 0.00 0.16 0.00 0.82 0.00 0.00 66.70 67.28 2b1i h VAL 328 Cb 1.29 0.88 -0.11 0.00 -1.52 0.00 0.00 31.29 31.82 2b1i h VAL 328 CO 0.48 0.00 0.12 -0.65 0.02 0.00 0.00 177.57 177.53 2b1i h PRO 329 N -0.09 0.20 -0.47 1.57 0.11 -1.96 0.28 132.00 131.64 2b1i h PRO 329 Ca 0.02 -0.01 -0.10 0.00 0.11 0.00 0.00 66.00 66.01 2b1i h PRO 329 Cb 0.11 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 31.16 2b1i h PRO 329 CO -0.04 0.13 -0.13 1.15 -0.21 0.00 0.00 178.00 178.90 2b1i h THR 330 N 0.21 1.26 -0.32 -1.15 2.02 -1.86 -1.57 112.91 111.51 2b1i h THR 330 Ca 0.40 -1.23 -0.11 0.00 0.77 0.00 0.00 66.41 66.24 2b1i h THR 330 Cb 0.68 1.04 -0.01 0.00 -1.74 0.00 0.00 68.15 68.12 2b1i h THR 330 CO -0.54 0.42 -0.25 0.00 0.37 0.00 0.00 175.52 175.52 2b1i h ALA 331 N 1.08 0.97 -0.46 6.16 0.00 -0.25 -0.59 119.26 126.16 2b1i h ALA 331 Ca 0.12 -0.37 -0.10 0.00 0.00 0.00 0.00 54.91 54.57 2b1i h ALA 331 Cb 0.64 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2b1i h ALA 331 CO 0.04 0.60 -0.11 0.87 0.00 0.00 0.00 179.25 180.66 2b1i h LYS 332 N 0.55 0.88 0.47 0.00 1.79 -0.23 0.12 116.57 120.14 2b1i h LYS 332 Ca 0.08 -0.33 -0.02 0.00 -2.18 0.00 0.00 60.65 58.19 2b1i h LYS 332 Cb 0.72 -0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 31.31 2b1i h LYS 332 CO 0.06 0.98 -0.29 0.82 -1.08 0.00 0.00 179.45 179.93 2b1i h ILE 333 N 0.72 0.39 -0.54 1.86 2.04 -1.16 -3.05 117.51 117.77 2b1i h ILE 333 Ca 0.12 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.99 2b1i h ILE 333 Cb 0.65 0.39 -0.03 0.00 -0.74 0.00 0.00 36.82 37.09 2b1i h ILE 333 CO 0.04 0.00 0.36 0.40 0.00 0.00 0.00 178.15 178.95 2b1i h ILE 334 N -0.73 1.11 -0.48 -0.67 2.04 -1.00 -3.03 117.51 114.76 2b1i h ILE 334 Ca -0.05 -0.24 0.05 0.00 1.00 0.00 0.00 64.86 65.62 2b1i h ILE 334 Cb 0.60 0.36 -0.05 0.00 -0.74 0.00 0.00 36.82 36.99 2b1i h ILE 334 CO 0.05 0.13 0.21 -1.28 0.00 0.00 0.00 178.15 177.25 2b1i h SER 335 N 0.69 0.27 0.68 1.72 0.87 -0.65 -1.93 113.55 115.20 2b1i h SER 335 Ca 0.21 0.04 0.00 0.00 -1.23 0.00 0.00 61.79 60.81 2b1i h SER 335 Cb -0.01 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 61.94 2b1i h SER 335 CO -0.05 0.19 -0.04 -2.11 -0.53 0.00 0.00 176.83 174.29 2b1i n ARG 336 N -4.94 0.30 -3.96 2.24 1.85 -1.15 -4.86 116.66 106.14 2b1i n ARG 336 Ca 0.04 -0.03 -0.32 0.00 -1.00 0.00 0.00 57.85 56.54 2b1i n ARG 336 Cb 0.15 -1.50 -0.05 0.00 -1.05 0.00 0.00 32.46 30.01 2b1i n ARG 336 CO 0.00 0.00 0.00 -1.21 -0.01 0.00 0.00 177.63 176.41 2b1i s GLU 337 N -2.72 3.30 -0.44 2.89 0.41 -0.73 -4.93 118.70 116.48 2b1i s GLU 337 Ca 0.23 -0.46 -0.29 0.00 -0.41 0.00 0.00 54.97 54.04 2b1i s GLU 337 Cb 0.20 -2.98 0.02 0.00 -1.78 0.00 0.00 34.13 29.59 2b1i s GLU 337 CO 0.50 0.62 1.25 0.08 -0.49 0.00 0.00 175.26 177.22 2b1i s VAL 338 N -1.41 4.09 0.04 2.63 1.01 -1.26 -4.96 120.40 120.54 2b1i s VAL 338 Ca 0.31 1.12 -0.02 0.00 0.00 0.00 0.00 61.98 63.39 2b1i s VAL 338 Cb -0.13 -4.43 -0.03 0.00 0.00 0.00 0.00 36.38 31.80 2b1i s VAL 338 CO 0.23 -0.88 0.01 -0.55 0.00 0.00 0.00 175.10 173.91 2b1i s SER 339 N 3.03 0.33 -0.05 3.32 0.15 -1.26 -0.79 113.70 118.43 2b1i s SER 339 Ca 0.53 -0.73 0.17 0.00 0.70 0.00 0.00 55.95 56.62 2b1i s SER 339 Cb -0.10 0.18 -0.26 0.00 -1.71 0.00 0.00 66.02 64.13 2b1i s SER 339 CO 0.31 -0.50 0.33 0.47 1.20 0.00 0.00 173.24 175.06 2b1i n ASP 340 N 0.69 0.95 0.00 5.45 8.00 0.17 -4.77 116.55 127.03 2b1i n ASP 340 Ca -0.18 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.32 2b1i n ASP 340 Cb 0.59 1.66 0.00 0.00 -0.02 0.00 0.00 41.12 43.34 2b1i n ASP 340 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2b1i n GLY 341 N 1.58 -0.26 3.07 0.44 0.00 -1.09 -2.93 105.19 105.99 2b1i n GLY 341 Ca -0.07 -0.91 -0.13 0.00 0.00 0.00 0.00 46.02 44.91 2b1i n GLY 341 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b1i s VAL 342 N -2.00 -0.00 -0.04 1.61 0.11 0.21 -0.16 120.40 120.13 2b1i s VAL 342 Ca 0.00 0.02 0.07 0.00 -2.93 0.00 0.00 61.98 59.13 2b1i s VAL 342 Cb 0.00 -0.29 -0.01 0.00 -1.53 0.00 0.00 36.38 34.55 2b1i s VAL 342 CO 0.00 0.01 -0.24 0.54 -3.33 0.00 0.00 175.10 172.07 2b1i s VAL 343 N 0.21 1.97 0.14 2.04 0.11 0.92 0.31 120.40 126.11 2b1i s VAL 343 Ca -0.01 -1.04 -0.16 0.00 -2.93 0.00 0.00 61.98 57.84 2b1i s VAL 343 Cb -0.02 -1.66 0.03 0.00 -1.53 0.00 0.00 36.38 33.20 2b1i s VAL 343 CO -0.00 0.55 0.43 0.00 -3.33 0.00 0.00 175.10 172.75 2b1i s ALA 344 N -0.30 -0.91 -1.67 1.54 0.00 -0.85 -0.83 121.76 118.74 2b1i s ALA 344 Ca 0.01 -0.11 0.20 0.00 0.00 0.00 0.00 51.96 52.06 2b1i s ALA 344 Cb -0.12 0.74 1.09 0.00 0.00 0.00 0.00 23.12 24.83 2b1i s ALA 344 CO 0.02 -0.68 1.61 -0.35 0.00 0.00 0.00 175.76 176.36 2b1i n PRO 345 N -0.25 0.43 0.00 0.00 -0.04 -1.26 -0.57 135.00 133.31 2b1i n PRO 345 Ca -0.14 0.06 0.00 0.00 -0.04 0.00 0.00 63.50 63.38 2b1i n PRO 345 Cb 0.63 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.59 2b1i n PRO 345 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2b1i n GLY 346 N 0.34 0.92 3.04 0.55 0.00 -1.26 -4.66 105.19 104.10 2b1i n GLY 346 Ca 0.12 -1.07 -0.13 0.00 0.00 0.00 0.00 46.02 44.94 2b1i n GLY 346 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2b1i s TYR 347 N -2.00 -0.38 0.74 1.61 1.51 -1.26 -0.37 117.35 117.19 2b1i s TYR 347 Ca 0.00 0.90 -0.15 0.00 -1.01 0.00 0.00 57.07 56.80 2b1i s TYR 347 Cb 0.00 0.01 0.02 0.00 -0.11 0.00 0.00 41.96 41.88 2b1i s TYR 347 CO 0.00 -0.30 0.98 0.39 -1.11 0.00 0.00 175.55 175.51 2b1i n GLU 348 N 4.79 0.45 -0.03 -0.62 1.02 -0.44 -4.74 120.64 121.07 2b1i n GLU 348 Ca -0.16 0.21 -0.11 0.00 -0.02 0.00 0.00 57.16 57.09 2b1i n GLU 348 Cb 0.51 -2.24 -0.05 0.00 -0.02 0.00 0.00 31.44 29.64 2b1i n GLU 348 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 2b1i h GLU 349 N -0.37 0.21 -0.95 3.49 4.57 -1.99 0.18 114.58 119.71 2b1i h GLU 349 Ca -0.47 -0.03 -0.01 0.00 -1.18 0.00 0.00 59.36 57.68 2b1i h GLU 349 Cb 1.33 -0.04 -0.05 0.00 -0.16 0.00 0.00 28.75 29.83 2b1i h GLU 349 CO 0.46 0.23 0.57 0.93 -1.18 0.00 0.00 179.01 180.03 2b1i h GLU 350 N 0.13 1.29 -0.15 1.92 5.08 -1.96 -1.31 114.58 119.58 2b1i h GLU 350 Ca 0.05 -0.12 -0.00 0.00 -1.00 0.00 0.00 59.36 58.29 2b1i h GLU 350 Cb 0.09 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 29.06 2b1i h GLU 350 CO -0.01 0.90 0.08 0.00 -1.00 0.00 0.00 179.01 178.98 2b1i h ALA 351 N 1.32 0.19 -0.72 3.43 0.00 -1.72 -2.24 119.26 119.52 2b1i h ALA 351 Ca 0.34 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 55.25 2b1i h ALA 351 Cb -0.06 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 17.62 2b1i h ALA 351 CO -0.06 -0.27 0.42 1.25 0.00 0.00 0.00 179.25 180.59 2b1i h LEU 352 N 0.13 0.64 -0.01 0.00 6.46 -0.66 -1.99 115.31 119.87 2b1i h LEU 352 Ca 0.05 0.03 0.02 0.00 -0.12 0.00 0.00 57.88 57.86 2b1i h LEU 352 Cb 0.08 -0.10 -0.03 0.00 -0.73 0.00 0.00 40.66 39.88 2b1i h LEU 352 CO -0.01 0.41 -0.13 0.11 -0.62 0.00 0.00 178.44 178.20 2b1i h LYS 353 N 0.77 -0.21 -0.31 1.25 1.57 -0.83 0.72 116.57 119.53 2b1i h LYS 353 Ca 0.32 0.01 0.02 0.00 -1.87 0.00 0.00 60.65 59.13 2b1i h LYS 353 Cb 0.18 0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.51 2b1i h LYS 353 CO -0.18 -0.14 0.17 0.82 -0.57 0.00 0.00 179.45 179.55 2b1i h ILE 354 N -0.21 1.01 -0.63 1.86 2.04 -1.22 -2.91 117.51 117.45 2b1i h ILE 354 Ca 0.05 -0.12 -0.06 0.00 1.00 0.00 0.00 64.86 65.73 2b1i h ILE 354 Cb 0.28 0.63 -0.03 0.00 -0.74 0.00 0.00 36.82 36.97 2b1i h ILE 354 CO -0.14 0.06 0.17 -0.07 0.00 0.00 0.00 178.15 178.17 2b1i h LEU 355 N 0.35 0.94 -1.69 1.44 3.38 -0.97 -3.01 115.31 115.74 2b1i h LEU 355 Ca 0.13 -0.22 -0.04 0.00 0.09 0.00 0.00 57.88 57.83 2b1i h LEU 355 Cb 0.02 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 2b1i h LEU 355 CO -0.07 0.92 -0.18 0.28 0.09 0.00 0.00 178.44 179.47 2b1i h SER 356 N 0.91 0.00 0.39 -0.43 0.02 -0.72 -2.05 113.55 111.67 2b1i h SER 356 Ca 0.20 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 61.12 2b1i h SER 356 Cb 0.33 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.87 2b1i h SER 356 CO -0.00 0.18 -0.13 0.11 -1.14 0.00 0.00 176.83 175.85 2b1i h LYS 357 N 0.00 0.00 -7.00 3.45 1.57 -1.37 -3.18 116.57 110.04 2b1i h LYS 357 Ca -0.00 0.00 -0.52 0.00 -1.87 0.00 0.00 60.65 58.26 2b1i h LYS 357 Cb 0.35 0.00 0.09 0.00 0.08 0.00 0.00 32.23 32.75 2b1i h LYS 357 CO 0.02 0.13 0.55 0.15 -0.57 0.00 0.00 179.45 179.73 2b1i s LYS 358 N -4.18 3.66 -1.27 3.15 1.02 -0.77 -2.29 119.74 119.05 2b1i s LYS 358 Ca -0.03 1.98 -0.01 0.00 0.02 0.00 0.00 55.97 57.94 2b1i s LYS 358 Cb 0.13 -2.46 0.00 0.00 -0.52 0.00 0.00 37.83 34.98 2b1i s LYS 358 CO 0.59 -0.69 0.82 1.63 -0.92 0.00 0.00 175.35 176.78 2b1i n LYS 359 N -0.46 -5.60 -3.83 1.68 5.02 -1.26 -1.41 118.16 112.29 2b1i n LYS 359 Ca 0.07 0.71 -0.37 0.00 -2.02 0.00 0.00 58.31 56.70 2b1i n LYS 359 Cb 0.46 -5.45 0.03 0.00 -0.02 0.00 0.00 35.03 30.05 2b1i n LYS 359 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2b1i n ASN 360 N -3.08 -4.90 0.00 4.39 5.15 -1.23 -1.86 115.26 113.73 2b1i n ASN 360 Ca -0.28 -1.10 0.00 0.00 -0.60 0.00 0.00 54.58 52.59 2b1i n ASN 360 Cb 0.67 -2.61 0.00 0.00 -0.53 0.00 0.00 39.78 37.31 2b1i n ASN 360 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2b1i n GLY 361 N -1.85 0.37 1.24 8.20 0.00 -0.97 -4.83 105.19 107.34 2b1i n GLY 361 Ca -0.11 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.00 2b1i n GLY 361 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2b1i n GLY 362 N -2.00 2.80 3.70 -0.02 0.00 -0.78 -4.44 105.19 104.46 2b1i n GLY 362 Ca 0.00 -0.74 -0.42 0.00 0.00 0.00 0.00 46.02 44.86 2b1i n GLY 362 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2b1i s TYR 363 N -1.48 2.81 -0.34 1.61 5.04 -0.50 -4.39 117.35 120.10 2b1i s TYR 363 Ca 0.43 0.65 -0.29 0.00 -2.44 0.00 0.00 57.07 55.43 2b1i s TYR 363 Cb 0.26 -3.80 -0.01 0.00 0.35 0.00 0.00 41.96 38.76 2b1i s TYR 363 CO 0.24 -3.04 1.68 0.00 -1.34 0.00 0.00 175.55 173.09 2b1i s VAL 365 N 6.37 2.84 0.08 0.00 1.01 0.16 -0.62 120.40 130.25 2b1i s VAL 365 Ca 0.74 -0.68 0.10 0.00 0.00 0.00 0.00 61.98 62.15 2b1i s VAL 365 Cb -0.20 -2.26 -0.03 0.00 0.00 0.00 0.00 36.38 33.89 2b1i s VAL 365 CO 0.33 0.47 -0.27 -0.76 0.00 0.00 0.00 175.10 174.88 2b1i s LEU 366 N 1.36 2.23 -0.14 3.92 1.43 0.15 0.62 118.68 128.25 2b1i s LEU 366 Ca 0.05 -0.66 0.02 0.00 -1.03 0.00 0.00 54.13 52.51 2b1i s LEU 366 Cb -0.14 -1.26 0.01 0.00 0.03 0.00 0.00 46.19 44.84 2b1i s LEU 366 CO -0.07 0.22 -0.22 -1.58 0.23 0.00 0.00 176.35 174.94 2b1i s GLN 367 N -1.59 3.02 -0.05 1.70 0.74 0.86 -2.01 119.66 122.33 2b1i s GLN 367 Ca 0.13 -0.85 0.00 0.00 0.05 0.00 0.00 55.36 54.69 2b1i s GLN 367 Cb -0.10 -2.44 -0.03 0.00 1.10 0.00 0.00 33.01 31.54 2b1i s GLN 367 CO 0.04 -0.02 -0.02 1.41 -0.55 0.00 0.00 175.29 176.14 2b1i s MET 368 N 0.84 2.83 -0.16 1.67 -2.45 0.27 0.00 119.30 122.30 2b1i s MET 368 Ca -0.06 -0.53 -0.29 0.00 -1.25 0.00 0.00 55.69 53.55 2b1i s MET 368 Cb -0.15 -2.69 -0.02 0.00 1.25 0.00 0.00 34.83 33.22 2b1i s MET 368 CO -0.03 0.66 1.35 0.34 1.05 0.00 0.00 175.02 178.40 2b1i s ASP 369 N -1.14 6.84 0.51 1.11 3.68 0.60 -4.08 116.67 124.19 2b1i s ASP 369 Ca 0.15 1.73 0.28 0.00 2.13 0.00 0.00 52.55 56.84 2b1i s ASP 369 Cb -0.11 -2.54 1.37 0.00 -1.45 0.00 0.00 42.92 40.19 2b1i s ASP 369 CO 0.05 -0.85 2.02 1.55 0.13 0.00 0.00 175.17 178.07 2b1i h PRO 370 N 8.69 0.00 0.00 4.34 0.13 -1.91 -2.32 132.00 140.93 2b1i h PRO 370 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 2b1i h PRO 370 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2b1i h PRO 370 CO 0.98 0.13 -0.20 0.09 -0.23 0.00 0.00 178.00 178.77 2b1i n ASN 371 N -3.53 0.73 -4.74 1.44 4.13 -1.26 -4.91 115.26 107.12 2b1i n ASN 371 Ca -0.01 0.42 -0.41 0.00 1.68 0.00 0.00 54.58 56.25 2b1i n ASN 371 Cb 0.28 -0.47 -0.02 0.00 -1.54 0.00 0.00 39.78 38.02 2b1i n ASN 371 CO 0.00 0.00 0.00 -0.47 0.28 0.00 0.00 177.26 177.07 2b1i s TYR 372 N -3.11 2.94 -0.05 3.10 5.04 -0.87 -5.02 117.35 119.37 2b1i s TYR 372 Ca 0.10 0.90 0.03 0.00 -2.44 0.00 0.00 57.07 55.65 2b1i s TYR 372 Cb 0.13 -3.91 0.01 0.00 0.35 0.00 0.00 41.96 38.54 2b1i s TYR 372 CO 0.63 -3.05 -0.12 -1.21 -1.34 0.00 0.00 175.55 170.46 2b1i s GLU 373 N -0.25 1.54 0.75 4.97 0.41 -1.26 -5.05 118.70 119.82 2b1i s GLU 373 Ca 0.62 -0.41 -0.11 0.00 -0.41 0.00 0.00 54.97 54.66 2b1i s GLU 373 Cb -0.44 -1.31 0.04 0.00 -1.78 0.00 0.00 34.13 30.64 2b1i s GLU 373 CO 0.43 0.07 1.08 -1.25 -0.49 0.00 0.00 175.26 175.10 2b1i s PRO 374 N 0.51 2.45 0.76 0.39 0.04 -1.26 -5.03 135.00 132.86 2b1i s PRO 374 Ca -0.11 0.95 -0.15 0.00 0.04 0.00 0.00 61.00 61.73 2b1i s PRO 374 Cb -0.14 -1.94 0.05 0.00 0.04 0.00 0.00 34.50 32.52 2b1i s PRO 374 CO 0.03 -1.44 1.22 -0.51 0.04 0.00 0.00 177.00 176.34 2b1i s ASP 375 N -3.67 3.94 0.24 6.66 1.01 -1.26 -4.93 116.67 118.66 2b1i s ASP 375 Ca 0.60 2.42 -0.06 0.00 0.71 0.00 0.00 52.55 56.22 2b1i s ASP 375 Cb -0.15 -2.59 0.24 0.00 1.01 0.00 0.00 42.92 41.42 2b1i s ASP 375 CO 0.55 -2.44 1.83 0.44 0.21 0.00 0.00 175.17 175.77 2b1i h ASP 376 N -0.47 1.06 -2.68 0.27 3.45 -1.97 -3.45 116.42 112.64 2b1i h ASP 376 Ca -0.48 -0.13 -0.57 0.00 0.43 0.00 0.00 57.03 56.29 2b1i h ASP 376 Cb 1.30 -0.27 -0.03 0.00 -0.56 0.00 0.00 39.33 39.77 2b1i h ASP 376 CO 0.48 0.90 -0.48 0.20 -1.57 0.00 0.00 179.24 178.77 2b1i s ASN 377 N -6.34 6.28 -0.00 6.45 0.01 -1.26 0.32 114.94 120.40 2b1i s ASN 377 Ca -0.12 0.18 -0.03 0.00 -0.71 0.00 0.00 52.86 52.18 2b1i s ASN 377 Cb 0.16 -1.89 -0.00 0.00 0.41 0.00 0.00 41.25 39.93 2b1i s ASN 377 CO 0.83 0.09 0.06 -1.83 -1.51 0.00 0.00 177.10 174.73 2b1i s GLU 378 N -3.00 0.25 -0.01 -0.60 -1.05 0.11 -4.78 118.70 109.63 2b1i s GLU 378 Ca 0.34 -0.25 0.07 0.00 -0.15 0.00 0.00 54.97 54.99 2b1i s GLU 378 Cb -0.12 0.10 -0.02 0.00 -0.44 0.00 0.00 34.13 33.66 2b1i s GLU 378 CO 0.28 -0.05 -0.23 0.42 0.95 0.00 0.00 175.26 176.63 2b1i s ILE 379 N -0.79 1.84 0.04 1.83 1.01 -1.26 -0.62 121.20 123.24 2b1i s ILE 379 Ca -0.09 -1.04 0.04 0.00 0.00 0.00 0.00 60.65 59.57 2b1i s ILE 379 Cb -0.05 -1.53 -0.02 0.00 0.01 0.00 0.00 42.46 40.86 2b1i s ILE 379 CO 0.00 0.48 -0.13 0.00 0.00 0.00 0.00 174.94 175.29 2b1i s ARG 380 N -0.65 0.87 -0.22 2.79 1.70 0.39 -4.97 118.95 118.87 2b1i s ARG 380 Ca 0.09 -0.72 -0.13 0.00 -0.47 0.00 0.00 55.73 54.50 2b1i s ARG 380 Cb -0.09 -0.85 -0.04 0.00 -0.57 0.00 0.00 34.95 33.39 2b1i s ARG 380 CO -0.00 0.21 0.29 0.99 -1.08 0.00 0.00 175.30 175.70 2b1i s THR 381 N -0.84 5.27 -0.09 4.99 2.01 -1.26 -0.30 115.64 125.43 2b1i s THR 381 Ca 0.01 0.46 0.03 0.00 0.31 0.00 0.00 61.69 62.49 2b1i s THR 381 Cb -0.08 -3.62 0.01 0.00 0.01 0.00 0.00 72.50 68.82 2b1i s THR 381 CO 0.01 0.29 -0.17 -0.22 -0.69 0.00 0.00 174.62 173.84 2b1i s LEU 382 N 1.20 1.83 -1.56 4.42 2.96 0.56 -4.74 118.68 123.36 2b1i s LEU 382 Ca 0.14 -0.42 -0.03 0.00 -0.22 0.00 0.00 54.13 53.59 2b1i s LEU 382 Cb -0.14 -1.10 0.03 0.00 0.50 0.00 0.00 46.19 45.48 2b1i s LEU 382 CO 0.06 0.08 0.19 0.00 -1.32 0.00 0.00 176.35 175.36 2b1i n TYR 383 N 3.79 -1.36 -1.00 5.38 9.36 -1.26 -0.21 117.16 131.85 2b1i n TYR 383 Ca -0.21 0.66 -0.00 0.00 3.32 0.00 0.00 57.90 61.67 2b1i n TYR 383 Cb 0.52 -2.93 -0.00 0.00 -0.63 0.00 0.00 39.34 36.30 2b1i n TYR 383 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2b1i n GLY 384 N -2.25 0.08 3.66 2.98 0.00 -1.26 -4.98 105.19 103.43 2b1i n GLY 384 Ca -0.27 -0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.52 2b1i n GLY 384 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2b1i s LEU 385 N -0.02 3.18 -0.17 0.99 1.43 0.71 -5.08 118.68 119.71 2b1i s LEU 385 Ca 0.00 -0.73 -0.03 0.00 -1.03 0.00 0.00 54.13 52.34 2b1i s LEU 385 Cb 0.00 -1.67 -0.02 0.00 0.03 0.00 0.00 46.19 44.53 2b1i s LEU 385 CO 0.00 -0.11 -0.04 -1.10 0.23 0.00 0.00 176.35 175.33 2b1i s GLN 386 N -3.72 3.56 -0.20 1.70 1.11 -1.26 -0.32 119.66 120.53 2b1i s GLN 386 Ca 0.33 -0.56 -0.04 0.00 0.01 0.00 0.00 55.36 55.10 2b1i s GLN 386 Cb -0.04 -2.92 -0.02 0.00 -1.01 0.00 0.00 33.01 29.02 2b1i s GLN 386 CO 0.20 0.11 -0.04 -0.51 0.01 0.00 0.00 175.29 175.07 2b1i s LEU 387 N 0.69 3.01 -0.02 2.90 1.43 0.60 -4.96 118.68 122.33 2b1i s LEU 387 Ca -0.02 -0.31 0.08 0.00 -1.03 0.00 0.00 54.13 52.84 2b1i s LEU 387 Cb -0.15 -1.76 -0.02 0.00 0.03 0.00 0.00 46.19 44.30 2b1i s LEU 387 CO 0.02 0.03 -0.25 -0.32 0.23 0.00 0.00 176.35 176.06 2b1i s MET 388 N 1.17 2.16 0.16 1.70 -2.45 -1.26 -0.46 119.30 120.31 2b1i s MET 388 Ca 0.02 -0.92 -0.17 0.00 -1.25 0.00 0.00 55.69 53.38 2b1i s MET 388 Cb -0.14 -2.06 0.03 0.00 1.25 0.00 0.00 34.83 33.90 2b1i s MET 388 CO -0.00 0.55 0.45 1.14 1.05 0.00 0.00 175.02 178.21 2b1i s GLN 389 N -0.59 1.20 0.11 4.11 -2.07 0.21 -4.99 119.66 117.65 2b1i s GLN 389 Ca 0.09 -0.78 -0.31 0.00 -1.82 0.00 0.00 55.36 52.54 2b1i s GLN 389 Cb -0.10 0.49 -0.09 0.00 -1.09 0.00 0.00 33.01 32.22 2b1i s GLN 389 CO -0.01 -0.49 1.60 0.21 -1.32 0.00 0.00 175.29 175.29 2b1i s LYS 390 N -3.84 4.21 1.02 9.60 2.20 -1.26 -0.71 119.74 130.96 2b1i s LYS 390 Ca 0.06 2.33 -0.12 0.00 -0.36 0.00 0.00 55.97 57.89 2b1i s LYS 390 Cb 0.01 -3.38 0.20 0.00 -1.51 0.00 0.00 37.83 33.14 2b1i s LYS 390 CO -0.08 -0.66 1.08 -0.98 -0.36 0.00 0.00 175.35 174.34 2b1i s ARG 391 N 1.90 0.25 -1.08 4.03 1.70 0.15 -4.86 118.95 121.04 2b1i s ARG 391 Ca 0.72 1.00 -0.18 0.00 -0.47 0.00 0.00 55.73 56.80 2b1i s ARG 391 Cb -0.41 -1.68 0.12 0.00 -0.57 0.00 0.00 34.95 32.41 2b1i s ARG 391 CO 0.32 -2.98 1.35 1.21 -1.08 0.00 0.00 175.30 174.12 2b1i s ASN 392 N -2.86 6.79 -0.19 -2.89 2.47 -1.26 -4.75 114.94 112.23 2b1i s ASN 392 Ca 0.66 -2.33 0.14 0.00 0.42 0.00 0.00 52.86 51.75 2b1i s ASN 392 Cb -0.22 -2.45 0.73 0.00 -1.45 0.00 0.00 41.25 37.87 2b1i s ASN 392 CO 0.60 -1.03 1.62 -0.46 -3.72 0.00 0.00 177.10 174.11 2b1i n ASN 393 N 6.81 5.14 -4.67 -4.21 6.94 -1.26 -4.96 115.26 119.06 2b1i n ASN 393 Ca 0.33 -2.76 -0.45 0.00 -0.02 0.00 0.00 54.58 51.68 2b1i n ASN 393 Cb 0.47 -0.65 -0.04 0.00 -2.36 0.00 0.00 39.78 37.20 2b1i n ASN 393 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2b1i n ALA 394 N 0.67 1.31 -2.40 -2.53 0.00 -1.26 -4.90 120.51 111.40 2b1i n ALA 394 Ca 0.25 0.27 -0.42 0.00 0.00 0.00 0.00 53.44 53.54 2b1i n ALA 394 Cb 1.06 -2.57 -0.03 0.00 0.00 0.00 0.00 19.45 17.90 2b1i n ALA 394 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2b1i s VAL 395 N 3.94 4.01 -0.34 0.00 1.01 -1.26 -4.99 120.40 122.77 2b1i s VAL 395 Ca 0.90 1.42 -0.04 0.00 0.00 0.00 0.00 61.98 64.26 2b1i s VAL 395 Cb -0.57 -3.91 0.06 0.00 0.00 0.00 0.00 36.38 31.96 2b1i s VAL 395 CO 0.46 0.08 0.09 -0.63 0.00 0.00 0.00 175.10 175.09 2b1i s ILE 396 N 1.43 3.32 0.00 2.22 1.01 -1.26 -4.87 121.20 123.05 2b1i s ILE 396 Ca 0.59 -1.50 0.00 0.00 0.00 0.00 0.00 60.65 59.74 2b1i s ILE 396 Cb -0.29 -3.00 0.00 0.00 0.01 0.00 0.00 42.46 39.18 2b1i s ILE 396 CO 0.27 -0.29 0.00 -0.90 0.00 0.00 0.00 174.94 174.02 2b1i n ASP 397 N 4.67 0.00 0.21 3.58 5.68 -1.26 -4.74 116.55 124.69 2b1i n ASP 397 Ca -0.10 -0.32 0.06 0.00 -0.50 0.00 0.00 54.79 53.94 2b1i n ASP 397 Cb 0.43 0.00 0.56 0.00 -1.14 0.00 0.00 41.12 40.97 2b1i n ASP 397 CO 0.00 0.00 0.00 0.03 -1.33 0.00 0.00 177.20 175.90 2b1i h ARG 398 N 0.00 0.09 0.00 0.11 3.08 -1.96 -1.36 114.38 114.34 2b1i h ARG 398 Ca 0.00 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.04 2b1i h ARG 398 Cb 0.00 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.03 2b1i h ARG 398 CO 0.00 0.12 0.00 -1.13 -1.07 0.00 0.00 179.97 177.89 2b1i n SER 399 N -4.46 0.00 0.16 7.04 3.41 -1.26 -2.08 113.62 116.42 2b1i n SER 399 Ca -0.02 0.37 0.13 0.00 -0.26 0.00 0.00 58.87 59.09 2b1i n SER 399 Cb 0.13 -0.43 0.54 0.00 -0.26 0.00 0.00 64.21 64.19 2b1i n SER 399 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2b1i h LEU 400 N 0.00 0.00 -3.12 1.04 5.85 -1.58 -3.21 115.31 114.30 2b1i h LEU 400 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2b1i h LEU 400 Cb 0.19 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.22 2b1i h LEU 400 CO 0.00 0.00 0.00 0.49 -0.34 0.00 0.00 178.44 178.59 2b1i n PHE 401 N -2.35 0.88 0.22 1.25 3.72 -0.88 -4.47 117.46 115.84 2b1i n PHE 401 Ca 0.01 -0.70 0.11 0.00 -0.05 0.00 0.00 57.45 56.82 2b1i n PHE 401 Cb 0.20 -0.21 0.45 0.00 -0.94 0.00 0.00 39.48 38.99 2b1i n PHE 401 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 2b1i h LYS 402 N 2.29 0.00 -3.28 -1.08 1.57 -1.75 -3.34 116.57 110.98 2b1i h LYS 402 Ca 0.00 0.00 -0.80 0.00 -1.87 0.00 0.00 60.65 57.98 2b1i h LYS 402 Cb 1.20 0.00 -0.28 0.00 0.08 0.00 0.00 32.23 33.24 2b1i h LYS 402 CO 0.15 0.20 0.67 -1.71 -0.57 0.00 0.00 179.45 178.19 2b1i n ASN 403 N -3.33 5.95 -4.63 0.86 5.15 -1.26 -4.99 115.26 113.01 2b1i n ASN 403 Ca 0.00 -3.22 -0.43 0.00 -0.60 0.00 0.00 54.58 50.34 2b1i n ASN 403 Cb 0.43 -1.33 -0.02 0.00 -0.53 0.00 0.00 39.78 38.33 2b1i n ASN 403 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2b1i s ILE 404 N -1.92 4.50 -0.85 -1.44 1.01 -1.26 -0.44 121.20 120.79 2b1i s ILE 404 Ca 0.31 1.58 0.23 0.00 0.00 0.00 0.00 60.65 62.77 2b1i s ILE 404 Cb -0.02 -4.42 -0.13 0.00 0.01 0.00 0.00 42.46 37.90 2b1i s ILE 404 CO 0.01 -0.54 1.07 1.33 0.00 0.00 0.00 174.94 176.81 2b1i n VAL 405 N 5.99 0.05 -2.18 2.92 0.24 0.89 -4.89 118.33 121.35 2b1i n VAL 405 Ca 0.11 -0.09 -0.28 0.00 -2.04 0.00 0.00 64.34 62.04 2b1i n VAL 405 Cb 0.47 0.52 0.03 0.00 -1.47 0.00 0.00 33.84 33.40 2b1i n VAL 405 CO 0.00 0.00 0.00 0.42 -2.14 0.00 0.00 176.83 175.11 2b1i s THR 406 N -3.08 3.72 0.08 3.34 -4.23 -1.22 -5.01 115.64 109.25 2b1i s THR 406 Ca 0.07 0.26 -0.15 0.00 -1.18 0.00 0.00 61.69 60.69 2b1i s THR 406 Cb 0.16 -3.51 -0.17 0.00 1.34 0.00 0.00 72.50 70.32 2b1i s THR 406 CO 0.80 -0.59 1.27 0.11 -0.54 0.00 0.00 174.62 175.67 2b1i h LYS 407 N -0.35 0.70 -6.08 3.99 1.57 -1.91 -3.41 116.57 111.08 2b1i h LYS 407 Ca -0.45 -0.58 -0.58 0.00 -1.87 0.00 0.00 60.65 57.17 2b1i h LYS 407 Cb 1.25 0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.68 2b1i h LYS 407 CO 0.62 1.19 1.42 -1.71 -0.57 0.00 0.00 179.45 180.40 2b1i n ASN 408 N -4.04 3.44 -1.45 0.86 5.15 -1.26 -4.83 115.26 113.13 2b1i n ASN 408 Ca -0.08 0.39 0.10 0.00 -0.60 0.00 0.00 54.58 54.39 2b1i n ASN 408 Cb 0.70 -1.53 0.33 0.00 -0.53 0.00 0.00 39.78 38.75 2b1i n ASN 408 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 2b1i n LYS 409 N 8.40 3.48 -1.59 1.20 4.01 -1.26 -4.61 118.16 127.79 2b1i n LYS 409 Ca 0.28 -2.79 -0.41 0.00 -0.51 0.00 0.00 58.31 54.87 2b1i n LYS 409 Cb 0.43 -1.79 -0.03 0.00 -0.51 0.00 0.00 35.03 33.12 2b1i n LYS 409 CO 0.00 0.00 0.00 0.99 -1.11 0.00 0.00 177.40 177.28 2b1i s THR 410 N -1.69 3.01 -0.39 -0.18 2.01 -1.26 -4.91 115.64 112.22 2b1i s THR 410 Ca 0.48 0.00 0.03 0.00 0.31 0.00 0.00 61.69 62.52 2b1i s THR 410 Cb 0.30 -3.01 0.16 0.00 0.01 0.00 0.00 72.50 69.96 2b1i s THR 410 CO 0.25 -0.01 0.31 -0.22 -0.69 0.00 0.00 174.62 174.26 2b1i s LEU 411 N 9.52 1.06 0.71 4.42 2.96 -1.26 -4.74 118.68 131.34 2b1i s LEU 411 Ca 1.00 -2.61 -0.14 0.00 -0.22 0.00 0.00 54.13 52.16 2b1i s LEU 411 Cb -0.28 -0.28 0.03 0.00 0.50 0.00 0.00 46.19 46.15 2b1i s LEU 411 CO 0.32 -0.22 1.13 -2.16 -1.32 0.00 0.00 176.35 174.10 2b1i s PRO 412 N 0.54 2.47 0.29 0.98 0.04 -1.26 -4.72 135.00 133.35 2b1i s PRO 412 Ca 0.26 1.42 0.03 0.00 0.04 0.00 0.00 61.00 62.76 2b1i s PRO 412 Cb -0.07 -1.91 0.73 0.00 0.04 0.00 0.00 34.50 33.29 2b1i s PRO 412 CO -0.11 -1.51 1.67 1.49 0.04 0.00 0.00 177.00 178.59 2b1i h GLU 413 N -0.36 0.30 -0.38 4.56 4.57 -2.00 0.26 114.58 121.53 2b1i h GLU 413 Ca -0.46 -0.02 -0.05 0.00 -1.18 0.00 0.00 59.36 57.65 2b1i h GLU 413 Cb 1.25 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 29.76 2b1i h GLU 413 CO 0.52 0.20 0.03 0.66 -1.18 0.00 0.00 179.01 179.24 2b1i h SER 414 N 0.31 0.54 -0.01 1.04 4.64 -1.98 0.39 113.55 118.48 2b1i h SER 414 Ca 0.56 -0.10 -0.01 0.00 -0.47 0.00 0.00 61.79 61.78 2b1i h SER 414 Cb 1.10 -0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 63.05 2b1i h SER 414 CO -0.58 0.59 -0.01 0.00 -0.87 0.00 0.00 176.83 175.95 2b1i h ALA 415 N 1.48 0.02 -0.66 5.18 0.00 -0.90 0.31 119.26 124.70 2b1i h ALA 415 Ca 0.12 -0.27 0.10 0.00 0.00 0.00 0.00 54.91 54.87 2b1i h ALA 415 Cb 0.31 -0.00 -0.12 0.00 0.00 0.00 0.00 17.79 17.97 2b1i h ALA 415 CO 0.01 -0.21 -0.39 0.28 0.00 0.00 0.00 179.25 178.93 2b1i h VAL 416 N -0.48 0.10 -0.14 0.00 2.07 -0.98 1.13 116.25 117.95 2b1i h VAL 416 Ca 0.00 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.55 2b1i h VAL 416 Cb 0.53 0.10 -0.03 0.00 -1.52 0.00 0.00 31.29 30.38 2b1i h VAL 416 CO 0.00 0.00 -0.06 -0.09 0.02 0.00 0.00 177.57 177.44 2b1i h ARG 417 N -0.16 -0.04 -0.12 1.57 2.43 -0.08 -1.83 114.38 116.15 2b1i h ARG 417 Ca 0.23 0.00 -0.15 0.00 -0.81 0.00 0.00 59.98 59.25 2b1i h ARG 417 Cb 0.56 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.11 2b1i h ARG 417 CO -0.74 -0.03 -0.57 -0.44 -1.51 0.00 0.00 179.97 176.68 2b1i h ASP 418 N -0.05 0.42 -0.06 -3.80 3.32 0.52 -2.12 116.42 114.65 2b1i h ASP 418 Ca 0.08 -0.23 -0.06 0.00 0.02 0.00 0.00 57.03 56.84 2b1i h ASP 418 Cb 0.16 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.58 2b1i h ASP 418 CO -0.17 0.90 -0.12 -0.07 -1.72 0.00 0.00 179.24 178.06 2b1i h LEU 419 N 0.28 0.34 -0.14 1.55 3.38 0.16 -0.49 115.31 120.40 2b1i h LEU 419 Ca 0.00 -0.08 -0.19 0.00 0.09 0.00 0.00 57.88 57.71 2b1i h LEU 419 Cb 1.08 -0.09 0.01 0.00 0.09 0.00 0.00 40.66 41.75 2b1i h LEU 419 CO 0.10 0.50 -0.64 0.40 0.09 0.00 0.00 178.44 178.88 2b1i h ILE 420 N 0.34 1.32 -0.05 1.22 2.04 -1.03 0.17 117.51 121.51 2b1i h ILE 420 Ca 0.07 -1.89 -0.00 0.00 1.00 0.00 0.00 64.86 64.04 2b1i h ILE 420 Cb 0.42 2.05 -0.00 0.00 -0.74 0.00 0.00 36.82 38.55 2b1i h ILE 420 CO 0.02 0.59 0.03 0.58 0.00 0.00 0.00 178.15 179.37 2b1i h VAL 421 N 0.36 1.10 -0.50 1.67 2.07 -1.17 0.18 116.25 119.96 2b1i h VAL 421 Ca -0.04 -0.30 0.00 0.00 0.82 0.00 0.00 66.70 67.18 2b1i h VAL 421 Cb 1.28 1.20 -0.02 0.00 -1.52 0.00 0.00 31.29 32.23 2b1i h VAL 421 CO 0.13 0.09 0.33 0.00 0.02 0.00 0.00 177.57 178.14 2b1i h ALA 422 N 0.91 0.64 -0.31 1.67 0.00 -1.05 -0.59 119.26 120.52 2b1i h ALA 422 Ca 0.02 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 2b1i h ALA 422 Cb 0.11 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2b1i h ALA 422 CO -0.00 0.09 0.10 0.77 0.00 0.00 0.00 179.25 180.21 2b1i h SER 423 N 0.68 0.44 -0.41 0.00 0.02 -0.37 -0.55 113.55 113.36 2b1i h SER 423 Ca 0.18 -0.20 -0.04 0.00 -0.84 0.00 0.00 61.79 60.89 2b1i h SER 423 Cb -0.07 -0.12 -0.02 0.00 0.14 0.00 0.00 62.40 62.34 2b1i h SER 423 CO -0.04 0.52 0.08 0.40 -1.14 0.00 0.00 176.83 176.66 2b1i h ILE 424 N 0.34 1.24 -0.88 3.27 2.04 -0.50 0.27 117.51 123.29 2b1i h ILE 424 Ca 0.10 -0.83 0.00 0.00 1.00 0.00 0.00 64.86 65.13 2b1i h ILE 424 Cb 0.24 0.99 -0.04 0.00 -0.74 0.00 0.00 36.82 37.27 2b1i h ILE 424 CO -0.00 0.29 0.55 0.00 0.00 0.00 0.00 178.15 178.98 2b1i h ALA 425 N 0.94 1.11 -0.68 1.87 0.00 -1.00 -1.92 119.26 119.58 2b1i h ALA 425 Ca 0.13 -0.08 0.02 0.00 0.00 0.00 0.00 54.91 54.98 2b1i h ALA 425 Cb 0.34 -0.35 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 2b1i h ALA 425 CO 0.00 0.55 0.43 0.28 0.00 0.00 0.00 179.25 180.52 2b1i h VAL 426 N 1.20 1.11 -0.58 0.00 2.07 -0.76 -2.27 116.25 117.02 2b1i h VAL 426 Ca 0.32 -0.29 0.17 0.00 0.82 0.00 0.00 66.70 67.71 2b1i h VAL 426 Cb -0.09 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 29.84 2b1i h VAL 426 CO -0.06 0.16 0.46 0.50 0.02 0.00 0.00 177.57 178.64 2b1i h LYS 427 N 0.86 0.00 -0.10 1.57 3.64 -0.14 -2.54 116.57 119.87 2b1i h LYS 427 Ca 0.27 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.63 2b1i h LYS 427 Cb -0.01 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.80 2b1i h LYS 427 CO -0.09 0.00 -0.09 0.66 -2.27 0.00 0.00 179.45 177.66 2b1i n TYR 428 N -4.18 0.34 -4.75 1.91 4.01 -0.90 -4.73 117.16 108.86 2b1i n TYR 428 Ca 0.11 -1.12 -0.33 0.00 -0.16 0.00 0.00 57.90 56.40 2b1i n TYR 428 Cb 0.69 -0.24 -0.12 0.00 -0.31 0.00 0.00 39.34 39.35 2b1i n TYR 428 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 2b1i s THR 429 N -2.97 3.37 0.21 -0.72 2.01 -0.94 -4.15 115.64 112.45 2b1i s THR 429 Ca 0.37 -0.60 -0.32 0.00 0.31 0.00 0.00 61.69 61.45 2b1i s THR 429 Cb 0.32 -2.36 -0.13 0.00 0.01 0.00 0.00 72.50 70.35 2b1i s THR 429 CO 0.02 0.59 1.57 0.00 -0.69 0.00 0.00 174.62 176.11 2b1i n GLN 430 N 2.37 2.36 -1.80 4.92 1.13 -1.26 -4.35 117.38 120.74 2b1i n GLN 430 Ca -0.18 0.85 -0.31 0.00 -1.94 0.00 0.00 57.00 55.42 2b1i n GLN 430 Cb 0.53 -2.61 0.02 0.00 0.11 0.00 0.00 30.24 28.29 2b1i n GLN 430 CO 0.00 0.00 0.00 -1.12 -1.44 0.00 0.00 177.06 174.50 2b1i s SER 431 N 0.74 6.00 0.75 1.08 0.01 0.32 -0.71 113.70 121.89 2b1i s SER 431 Ca 0.73 1.48 -0.12 0.00 1.31 0.00 0.00 55.95 59.35 2b1i s SER 431 Cb -0.60 -2.48 0.04 0.00 0.21 0.00 0.00 66.02 63.19 2b1i s SER 431 CO 0.41 -1.02 1.13 0.54 0.41 0.00 0.00 173.24 174.71 2b1i s ASN 432 N -4.03 5.00 -0.07 2.44 6.03 0.50 -3.40 114.94 121.41 2b1i s ASN 432 Ca 0.56 1.03 -0.24 0.00 -1.03 0.00 0.00 52.86 53.18 2b1i s ASN 432 Cb -0.12 -1.72 0.05 0.00 -3.03 0.00 0.00 41.25 36.44 2b1i s ASN 432 CO 0.53 -1.61 0.55 -0.94 -2.03 0.00 0.00 177.10 173.60 2b1i s SER 433 N -4.38 -0.51 0.04 3.54 1.04 -1.26 -2.50 113.70 109.67 2b1i s SER 433 Ca 0.60 0.63 0.03 0.00 0.48 0.00 0.00 55.95 57.68 2b1i s SER 433 Cb -0.11 0.61 -0.02 0.00 0.10 0.00 0.00 66.02 66.59 2b1i s SER 433 CO 0.51 -0.48 -0.10 -0.69 0.98 0.00 0.00 173.24 173.47 2b1i s VAL 434 N -0.92 0.73 -0.02 5.02 1.01 -1.22 -0.99 120.40 124.01 2b1i s VAL 434 Ca -0.10 -0.94 0.01 0.00 0.00 0.00 0.00 61.98 60.95 2b1i s VAL 434 Cb -0.02 -0.72 0.01 0.00 0.00 0.00 0.00 36.38 35.65 2b1i s VAL 434 CO 0.06 -0.18 -0.02 0.00 0.00 0.00 0.00 175.10 174.96 2b1i s TYR 436 N 0.57 3.35 0.01 0.00 1.51 0.20 -0.55 117.35 122.43 2b1i s TYR 436 Ca -0.06 0.26 -0.04 0.00 -1.01 0.00 0.00 57.07 56.22 2b1i s TYR 436 Cb -0.09 -1.96 -0.01 0.00 -0.11 0.00 0.00 41.96 39.79 2b1i s TYR 436 CO -0.01 0.43 0.07 0.00 -1.11 0.00 0.00 175.55 174.93 2b1i s ALA 437 N -0.40 -0.14 -0.05 3.71 0.00 0.41 -0.30 121.76 124.99 2b1i s ALA 437 Ca 0.10 -0.31 -0.30 0.00 0.00 0.00 0.00 51.96 51.45 2b1i s ALA 437 Cb -0.12 0.12 0.08 0.00 0.00 0.00 0.00 23.12 23.20 2b1i s ALA 437 CO 0.02 -0.18 0.71 0.21 0.00 0.00 0.00 175.76 176.51 2b1i s LYS 438 N -1.38 1.02 -1.52 0.00 2.47 0.01 -0.51 119.74 119.85 2b1i s LYS 438 Ca -0.15 0.21 -0.13 0.00 -1.56 0.00 0.00 55.97 54.34 2b1i s LYS 438 Cb -0.08 0.48 0.08 0.00 -1.46 0.00 0.00 37.83 36.85 2b1i s LYS 438 CO 0.01 -0.33 0.96 -0.25 0.16 0.00 0.00 175.35 175.90 2b1i n ASP 439 N 0.81 -4.48 -1.46 1.43 8.00 -1.26 -1.46 116.55 118.13 2b1i n ASP 439 Ca -0.18 -0.79 -0.13 0.00 0.71 0.00 0.00 54.79 54.41 2b1i n ASP 439 Cb 0.58 -3.88 -0.01 0.00 -0.02 0.00 0.00 41.12 37.79 2b1i n ASP 439 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2b1i n GLY 440 N -1.69 -0.15 3.23 0.44 0.00 -1.26 -4.67 105.19 101.08 2b1i n GLY 440 Ca 0.01 -0.35 -0.13 0.00 0.00 0.00 0.00 46.02 45.55 2b1i n GLY 440 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2b1i s GLN 441 N -4.63 0.52 0.12 1.61 0.74 -0.53 -0.88 119.66 116.62 2b1i s GLN 441 Ca 0.00 0.12 -0.31 0.00 0.05 0.00 0.00 55.36 55.22 2b1i s GLN 441 Cb 0.00 0.24 -0.09 0.00 1.10 0.00 0.00 33.01 34.27 2b1i s GLN 441 CO 0.00 -0.11 1.46 0.08 -0.55 0.00 0.00 175.29 176.17 2b1i s VAL 442 N -0.59 3.09 -0.05 1.34 1.01 0.43 -0.81 120.40 124.82 2b1i s VAL 442 Ca -0.07 0.76 0.06 0.00 0.00 0.00 0.00 61.98 62.73 2b1i s VAL 442 Cb -0.04 -3.49 -0.08 0.00 0.00 0.00 0.00 36.38 32.77 2b1i s VAL 442 CO 0.02 0.05 0.15 2.30 0.00 0.00 0.00 175.10 177.62 2b1i n ILE 443 N 4.02 0.00 -3.64 2.22 -5.35 0.60 -4.45 119.36 112.75 2b1i n ILE 443 Ca 0.12 -0.17 -0.06 0.00 -0.27 0.00 0.00 62.75 62.38 2b1i n ILE 443 Cb 0.41 0.48 -0.07 0.00 -1.74 0.00 0.00 39.64 38.72 2b1i n ILE 443 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2b1i s GLY 444 N -2.47 -0.28 -0.11 3.28 0.00 -1.00 -3.40 107.32 103.34 2b1i s GLY 444 Ca -0.01 2.75 -0.10 0.00 0.00 0.00 0.00 44.72 47.36 2b1i s GLY 444 CO 0.24 2.36 0.29 -1.50 0.00 0.00 0.00 173.10 174.48 2b1i s ILE 445 N 1.21 -0.00 -0.04 0.90 2.07 -1.26 0.59 121.20 124.67 2b1i s ILE 445 Ca -0.07 0.01 0.05 0.00 -1.41 0.00 0.00 60.65 59.23 2b1i s ILE 445 Cb -0.04 -0.40 -0.02 0.00 0.13 0.00 0.00 42.46 42.12 2b1i s ILE 445 CO -0.14 0.00 -0.20 -0.83 -1.91 0.00 0.00 174.94 171.86 2b1i s GLY 446 N 0.20 1.41 0.03 1.50 0.00 -0.85 -4.56 107.32 105.06 2b1i s GLY 446 Ca -0.00 -1.04 0.02 0.00 0.00 0.00 0.00 44.72 43.70 2b1i s GLY 446 CO -0.00 -0.81 -0.07 0.00 0.00 0.00 0.00 173.10 172.22 2b1i s ALA 447 N -0.61 0.53 0.00 3.20 0.00 -1.26 -3.45 121.76 120.18 2b1i s ALA 447 Ca 0.09 -0.65 0.00 0.00 0.00 0.00 0.00 51.96 51.41 2b1i s ALA 447 Cb -0.11 0.01 0.00 0.00 0.00 0.00 0.00 23.12 23.03 2b1i s ALA 447 CO 0.00 0.01 0.00 0.41 0.00 0.00 0.00 175.76 176.18 2b1i n GLY 448 N 1.79 0.72 3.95 0.00 0.00 0.11 -4.89 105.19 106.87 2b1i n GLY 448 Ca -0.21 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.58 2b1i n GLY 448 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2b1i s GLN 449 N -0.15 2.29 -0.00 1.61 -1.52 -1.10 -4.45 119.66 116.34 2b1i s GLN 449 Ca 0.00 -0.55 0.00 0.00 -1.95 0.00 0.00 55.36 52.86 2b1i s GLN 449 Cb 0.00 -2.32 0.00 0.00 -0.22 0.00 0.00 33.01 30.47 2b1i s GLN 449 CO 0.00 -1.04 0.89 1.04 -0.25 0.00 0.00 175.29 175.93 2b1i n GLN 450 N -2.67 2.34 -3.68 2.91 6.02 -1.26 -0.37 117.38 120.66 2b1i n GLN 450 Ca 0.09 -1.29 -0.09 0.00 -0.01 0.00 0.00 57.00 55.69 2b1i n GLN 450 Cb 0.60 -0.89 -0.10 0.00 1.02 0.00 0.00 30.24 30.87 2b1i n GLN 450 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2b1i s SER 451 N -0.79 -0.58 0.09 1.08 0.15 -1.26 -5.04 113.70 107.35 2b1i s SER 451 Ca 0.00 1.04 -0.23 0.00 0.70 0.00 0.00 55.95 57.46 2b1i s SER 451 Cb 0.00 0.99 -0.14 0.00 -1.71 0.00 0.00 66.02 65.17 2b1i s SER 451 CO 0.00 -0.21 1.73 -0.09 1.20 0.00 0.00 173.24 175.87 2b1i h ARG 452 N 7.25 -0.06 -0.65 5.44 9.65 -1.96 -2.22 114.38 131.83 2b1i h ARG 452 Ca -0.33 0.00 -0.04 0.00 -1.10 0.00 0.00 59.98 58.52 2b1i h ARG 452 Cb 1.18 0.01 -0.03 0.00 -1.39 0.00 0.00 29.97 29.75 2b1i h ARG 452 CO 0.24 -0.04 0.25 0.97 2.80 0.00 0.00 179.97 184.20 2b1i h ILE 453 N -0.07 1.23 -0.05 1.20 6.09 -1.97 -0.74 117.51 123.19 2b1i h ILE 453 Ca 0.01 -0.72 -0.08 0.00 -1.37 0.00 0.00 64.86 62.70 2b1i h ILE 453 Cb 0.07 0.46 -0.01 0.00 0.47 0.00 0.00 36.82 37.81 2b1i h ILE 453 CO -0.02 0.29 -0.33 0.45 -3.07 0.00 0.00 178.15 175.47 2b1i h HIS 454 N 0.93 0.10 -0.11 2.19 3.86 -1.96 0.10 115.15 120.26 2b1i h HIS 454 Ca 0.22 -0.02 -0.06 0.00 -1.16 0.00 0.00 60.37 59.34 2b1i h HIS 454 Cb 0.19 -0.03 -0.00 0.00 1.06 0.00 0.00 27.41 28.63 2b1i h HIS 454 CO 0.01 0.42 -0.18 0.00 0.86 0.00 0.00 177.93 179.04 2b1i h THR 456 N -0.11 1.01 0.08 0.00 2.02 -0.85 0.94 112.91 116.00 2b1i h THR 456 Ca 0.01 -0.35 -0.00 0.00 0.77 0.00 0.00 66.41 66.84 2b1i h THR 456 Cb 0.75 -0.08 0.00 0.00 -1.74 0.00 0.00 68.15 67.08 2b1i h THR 456 CO 0.04 0.18 -0.04 0.03 0.37 0.00 0.00 175.52 176.11 2b1i h ARG 457 N 1.01 -0.11 -0.30 6.66 3.08 -0.98 0.16 114.38 123.90 2b1i h ARG 457 Ca 0.43 0.01 0.03 0.00 0.07 0.00 0.00 59.98 60.51 2b1i h ARG 457 Cb 0.31 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.36 2b1i h ARG 457 CO -0.18 0.32 0.13 1.25 -1.07 0.00 0.00 179.97 180.41 2b1i h LEU 458 N -0.57 0.17 -0.87 3.04 5.85 -0.60 0.75 115.31 123.07 2b1i h LEU 458 Ca -0.01 0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.67 2b1i h LEU 458 Cb 0.47 -0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 2b1i h LEU 458 CO 0.02 0.13 0.17 0.00 -0.34 0.00 0.00 178.44 178.42 2b1i h ALA 459 N 1.17 1.09 -0.83 1.25 0.00 -0.86 -2.48 119.26 118.60 2b1i h ALA 459 Ca 0.13 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 2b1i h ALA 459 Cb 0.07 -0.25 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 2b1i h ALA 459 CO -0.11 0.61 0.49 0.78 0.00 0.00 0.00 179.25 181.02 2b1i h GLY 460 N 1.05 1.21 1.57 0.00 0.00 0.07 -1.21 103.07 105.76 2b1i h GLY 460 Ca 0.21 -0.51 -0.11 0.00 0.00 0.00 0.00 47.33 46.91 2b1i h GLY 460 CO -0.00 0.50 -0.33 -0.55 0.00 0.00 0.00 176.54 176.16 2b1i h ASP 461 N 1.14 0.50 0.11 0.19 3.32 -0.63 0.16 116.42 121.21 2b1i h ASP 461 Ca 0.30 -0.20 -0.10 0.00 0.02 0.00 0.00 57.03 57.05 2b1i h ASP 461 Cb -0.03 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.37 2b1i h ASP 461 CO -0.05 0.80 -0.35 0.11 -1.72 0.00 0.00 179.24 178.03 2b1i h LYS 462 N 0.42 0.34 -0.31 3.56 1.57 -1.04 -1.12 116.57 119.98 2b1i h LYS 462 Ca 0.05 -0.14 -0.16 0.00 -1.87 0.00 0.00 60.65 58.53 2b1i h LYS 462 Cb 0.78 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.07 2b1i h LYS 462 CO 0.06 0.65 -0.43 0.00 -0.57 0.00 0.00 179.45 179.16 2b1i h ALA 463 N 1.35 0.65 0.11 3.86 0.00 -0.56 -0.92 119.26 123.75 2b1i h ALA 463 Ca 0.03 -0.46 0.02 0.00 0.00 0.00 0.00 54.91 54.50 2b1i h ALA 463 Cb 0.75 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 18.39 2b1i h ALA 463 CO 0.06 0.67 -0.37 -0.91 0.00 0.00 0.00 179.25 178.70 2b1i h ASN 464 N 0.64 -1.08 -1.01 0.00 -0.26 -0.28 -0.08 115.58 113.52 2b1i h ASN 464 Ca 0.04 0.12 0.02 0.00 -0.56 0.00 0.00 56.30 55.93 2b1i h ASN 464 Cb 0.99 0.41 -0.05 0.00 -1.06 0.00 0.00 38.32 38.61 2b1i h ASN 464 CO 0.10 -0.45 0.67 0.28 -1.06 0.00 0.00 177.43 176.96 2b1i h SER 465 N -0.60 1.14 -0.18 5.81 0.02 -1.10 0.19 113.55 118.82 2b1i h SER 465 Ca 0.03 -0.02 0.03 0.00 -0.84 0.00 0.00 61.79 60.99 2b1i h SER 465 Cb 0.63 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 62.86 2b1i h SER 465 CO -0.22 0.81 -0.00 -0.25 -1.14 0.00 0.00 176.83 176.03 2b1i h TRP 466 N 1.33 -0.01 -0.15 3.45 7.01 -0.72 -0.18 115.95 126.69 2b1i h TRP 466 Ca 0.38 0.01 -0.11 0.00 2.11 0.00 0.00 58.89 61.28 2b1i h TRP 466 Cb -0.10 0.03 -0.01 0.00 -2.10 0.00 0.00 29.16 26.98 2b1i h TRP 466 CO -0.00 -0.03 -0.40 2.35 -2.79 0.00 0.00 178.44 177.58 2b1i h TRP 467 N 0.06 0.39 -0.01 2.65 -0.00 -0.17 -2.49 115.95 116.37 2b1i h TRP 467 Ca 0.08 -0.11 -0.10 0.00 -0.00 0.00 0.00 58.89 58.77 2b1i h TRP 467 Cb 0.10 -0.09 -0.01 0.00 -0.00 0.00 0.00 29.16 29.16 2b1i h TRP 467 CO -0.17 0.69 -0.48 -0.07 -0.00 0.00 0.00 178.44 178.41 2b1i h LEU 468 N 0.28 0.03 0.00 0.65 3.38 -0.27 -1.29 115.31 118.10 2b1i h LEU 468 Ca 0.03 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2b1i h LEU 468 Cb 0.82 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.57 2b1i h LEU 468 CO 0.07 0.51 0.00 0.54 0.09 0.00 0.00 178.44 179.65 2b1i n ARG 469 N -3.97 0.03 0.04 1.13 1.74 -0.11 -0.57 116.66 114.95 2b1i n ARG 469 Ca -0.02 0.33 0.12 0.00 -0.77 0.00 0.00 57.85 57.52 2b1i n ARG 469 Cb 0.50 -1.50 0.23 0.00 -1.02 0.00 0.00 32.46 30.68 2b1i n ARG 469 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 2b1i n HIS 470 N -1.43 0.35 -1.74 -1.55 8.25 -0.49 -4.49 115.22 114.12 2b1i n HIS 470 Ca 0.02 0.10 -0.42 0.00 -0.26 0.00 0.00 57.72 57.16 2b1i n HIS 470 Cb 0.07 -0.52 -0.02 0.00 1.12 0.00 0.00 29.99 30.64 2b1i n HIS 470 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 2b1i n HIS 471 N -1.88 2.77 0.22 4.41 -0.00 0.26 -4.79 115.22 116.22 2b1i n HIS 471 Ca 0.04 0.29 0.17 0.00 -0.00 0.00 0.00 57.72 58.22 2b1i n HIS 471 Cb 0.40 -2.58 0.85 0.00 -0.00 0.00 0.00 29.99 28.67 2b1i n HIS 471 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 2b1i h PRO 472 N 4.63 0.00 0.00 1.57 0.13 -1.91 0.37 132.00 136.79 2b1i h PRO 472 Ca -0.47 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.56 2b1i h PRO 472 Cb 1.23 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.35 2b1i h PRO 472 CO 0.78 0.00 -0.51 -0.09 -0.23 0.00 0.00 178.00 177.96 2b1i h ARG 473 N 0.00 0.00 0.16 0.86 2.43 -1.94 -2.26 114.38 113.63 2b1i h ARG 473 Ca 0.08 0.00 -0.21 0.00 -0.81 0.00 0.00 59.98 59.04 2b1i h ARG 473 Cb 0.48 0.00 0.02 0.00 -0.42 0.00 0.00 29.97 30.05 2b1i h ARG 473 CO -0.00 0.51 -0.92 0.28 -1.51 0.00 0.00 179.97 178.32 2b1i h VAL 474 N 0.00 1.47 -0.44 0.20 2.07 -1.30 -3.33 116.25 114.93 2b1i h VAL 474 Ca -0.01 -2.56 -0.04 0.00 0.82 0.00 0.00 66.70 64.92 2b1i h VAL 474 Cb 0.99 3.18 -0.02 0.00 -1.52 0.00 0.00 31.29 33.91 2b1i h VAL 474 CO 0.07 0.73 0.11 -0.07 0.02 0.00 0.00 177.57 178.42 2b1i h LEU 475 N -0.30 0.60 -1.82 2.57 3.38 -1.01 -1.88 115.31 116.85 2b1i h LEU 475 Ca -0.16 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.72 2b1i h LEU 475 Cb 1.72 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 42.32 2b1i h LEU 475 CO 0.17 0.59 0.00 -1.54 0.09 0.00 0.00 178.44 177.75 2b1i n SER 476 N -4.31 2.69 -4.73 -0.43 3.41 -0.86 -4.93 113.62 104.45 2b1i n SER 476 Ca 0.03 -2.15 -0.42 0.00 -0.26 0.00 0.00 58.87 56.07 2b1i n SER 476 Cb 0.20 -0.38 -0.03 0.00 -0.26 0.00 0.00 64.21 63.75 2b1i n SER 476 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 2b1i s MET 477 N -1.60 4.13 -0.38 4.33 -1.94 -0.71 -4.98 119.30 118.16 2b1i s MET 477 Ca 0.29 2.58 -0.04 0.00 -1.71 0.00 0.00 55.69 56.81 2b1i s MET 477 Cb 0.17 -3.07 0.09 0.00 2.01 0.00 0.00 34.83 34.03 2b1i s MET 477 CO 0.16 -0.71 0.15 0.15 -0.01 0.00 0.00 175.02 174.77 2b1i s LYS 478 N 0.71 2.22 0.30 2.03 1.02 -1.26 -5.09 119.74 119.67 2b1i s LYS 478 Ca 0.71 -1.60 -0.16 0.00 0.02 0.00 0.00 55.97 54.94 2b1i s LYS 478 Cb -0.49 -3.50 -0.09 0.00 -0.52 0.00 0.00 37.83 33.24 2b1i s LYS 478 CO 0.36 -0.92 0.73 -0.06 -0.92 0.00 0.00 175.35 174.55 2b1i s PHE 479 N 1.22 3.43 0.42 3.18 0.40 -1.26 -0.12 117.98 125.25 2b1i s PHE 479 Ca 0.04 1.26 -0.22 0.00 -0.60 0.00 0.00 56.93 57.40 2b1i s PHE 479 Cb -0.22 -2.55 -0.10 0.00 0.51 0.00 0.00 43.02 40.65 2b1i s PHE 479 CO -0.02 0.14 0.97 -1.59 0.70 0.00 0.00 175.22 175.42 2b1i s LYS 480 N -2.77 4.21 -0.35 0.44 -2.85 -0.91 -4.59 119.74 112.92 2b1i s LYS 480 Ca 0.52 1.21 -0.28 0.00 -1.00 0.00 0.00 55.97 56.42 2b1i s LYS 480 Cb -0.12 -2.28 -0.02 0.00 -2.06 0.00 0.00 37.83 33.35 2b1i s LYS 480 CO 0.18 -0.06 1.86 0.00 0.10 0.00 0.00 175.35 177.43 2b1i s ALA 481 N -2.03 2.75 0.00 0.59 0.00 -1.26 -2.00 121.76 119.81 2b1i s ALA 481 Ca 0.61 0.20 0.00 0.00 0.00 0.00 0.00 51.96 52.77 2b1i s ALA 481 Cb -0.12 -4.06 0.00 0.00 0.00 0.00 0.00 23.12 18.94 2b1i s ALA 481 CO 0.17 -2.83 0.00 0.41 0.00 0.00 0.00 175.76 173.50 2b1i n GLY 482 N 5.49 -0.00 3.47 0.00 0.00 -1.26 -5.10 105.19 107.79 2b1i n GLY 482 Ca 0.24 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.83 2b1i n GLY 482 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b1i s VAL 483 N -0.97 5.21 1.10 1.61 1.01 -0.85 -5.08 120.40 122.44 2b1i s VAL 483 Ca 0.00 -0.57 -0.16 0.00 0.00 0.00 0.00 61.98 61.25 2b1i s VAL 483 Cb 0.00 -3.96 0.24 0.00 0.00 0.00 0.00 36.38 32.66 2b1i s VAL 483 CO 0.00 -0.34 1.11 -1.59 0.00 0.00 0.00 175.10 174.28 2b1i s LYS 484 N 1.80 -0.39 0.20 2.72 -2.85 -1.26 -4.77 119.74 115.19 2b1i s LYS 484 Ca 0.07 0.20 -0.11 0.00 -1.00 0.00 0.00 55.97 55.13 2b1i s LYS 484 Cb -0.18 -1.67 0.14 0.00 -2.06 0.00 0.00 37.83 34.05 2b1i s LYS 484 CO 0.11 -3.21 1.87 0.00 0.10 0.00 0.00 175.35 174.21 2b1i h ARG 485 N -2.23 0.94 -0.49 1.78 2.47 -1.98 -2.23 114.38 112.63 2b1i h ARG 485 Ca -0.50 -0.06 -0.05 0.00 -1.26 0.00 0.00 59.98 58.11 2b1i h ARG 485 Cb 1.31 -0.21 -0.02 0.00 -1.65 0.00 0.00 29.97 29.40 2b1i h ARG 485 CO 0.46 0.63 0.11 0.00 0.56 0.00 0.00 179.97 181.73 2b1i h ALA 486 N 1.26 0.65 0.07 0.04 0.00 -1.95 -0.99 119.26 118.34 2b1i h ALA 486 Ca 0.26 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 2b1i h ALA 486 Cb -0.10 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.50 2b1i h ALA 486 CO -0.06 0.35 -0.05 0.93 0.00 0.00 0.00 179.25 180.43 2b1i h GLU 487 N 0.68 -0.12 -0.45 0.00 5.08 -1.87 -0.37 114.58 117.53 2b1i h GLU 487 Ca 0.15 0.01 0.09 0.00 -1.00 0.00 0.00 59.36 58.61 2b1i h GLU 487 Cb 0.35 0.03 -0.08 0.00 0.50 0.00 0.00 28.75 29.54 2b1i h GLU 487 CO 0.00 -0.08 -0.08 0.28 -1.00 0.00 0.00 179.01 178.13 2b1i h VAL 488 N -0.12 0.57 -0.54 3.13 2.07 -1.32 0.16 116.25 120.20 2b1i h VAL 488 Ca -0.00 -0.01 0.05 0.00 0.82 0.00 0.00 66.70 67.56 2b1i h VAL 488 Cb 0.10 0.54 -0.05 0.00 -1.52 0.00 0.00 31.29 30.37 2b1i h VAL 488 CO 0.00 0.00 0.27 0.28 0.02 0.00 0.00 177.57 178.14 2b1i h SER 489 N 0.03 0.37 -0.22 0.57 0.02 -0.78 -0.41 113.55 113.12 2b1i h SER 489 Ca 0.22 0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.19 2b1i h SER 489 Cb 0.34 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.84 2b1i h SER 489 CO -0.44 0.25 0.08 -1.13 -1.14 0.00 0.00 176.83 174.45 2b1i h ASN 490 N 0.51 0.31 -0.81 3.07 -1.24 -0.52 -1.68 115.58 115.22 2b1i h ASN 490 Ca 0.25 -0.18 0.03 0.00 0.71 0.00 0.00 56.30 57.10 2b1i h ASN 490 Cb 0.18 -0.08 -0.05 0.00 0.73 0.00 0.00 38.32 39.10 2b1i h ASN 490 CO -0.18 0.40 0.52 0.00 -1.29 0.00 0.00 177.43 176.88 2b1i h ALA 491 N 0.92 1.06 -0.10 1.57 0.00 -0.20 0.32 119.26 122.82 2b1i h ALA 491 Ca 0.07 -0.04 -0.17 0.00 0.00 0.00 0.00 54.91 54.78 2b1i h ALA 491 Cb 0.19 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2b1i h ALA 491 CO -0.00 0.37 -0.65 0.82 0.00 0.00 0.00 179.25 179.79 2b1i h ILE 492 N 1.04 1.37 -0.06 0.00 2.04 -1.10 -1.52 117.51 119.27 2b1i h ILE 492 Ca 0.32 -2.01 -0.01 0.00 1.00 0.00 0.00 64.86 64.16 2b1i h ILE 492 Cb -0.03 2.00 -0.00 0.00 -0.74 0.00 0.00 36.82 38.04 2b1i h ILE 492 CO -0.10 0.61 0.01 -0.78 0.00 0.00 0.00 178.15 177.89 2b1i h ASP 493 N 0.29 0.09 -0.25 1.72 1.82 -0.59 -0.64 116.42 118.85 2b1i h ASP 493 Ca -0.01 -0.24 0.04 0.00 -0.39 0.00 0.00 57.03 56.43 2b1i h ASP 493 Cb 1.20 -0.02 -0.04 0.00 0.68 0.00 0.00 39.33 41.14 2b1i h ASP 493 CO 0.11 0.31 0.01 1.56 -1.61 0.00 0.00 179.24 179.62 2b1i h GLN 494 N -0.13 0.08 0.17 0.28 4.20 -0.40 0.19 115.11 119.50 2b1i h GLN 494 Ca 0.02 -0.01 0.02 0.00 0.06 0.00 0.00 58.65 58.74 2b1i h GLN 494 Cb 0.25 -0.02 -0.04 0.00 0.30 0.00 0.00 27.48 27.98 2b1i h GLN 494 CO 0.00 0.06 -0.40 -0.92 -0.67 0.00 0.00 178.83 176.90 2b1i h TYR 495 N 0.09 -1.10 0.00 2.96 3.20 -1.19 0.81 116.97 121.73 2b1i h TYR 495 Ca 0.12 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 61.98 2b1i h TYR 495 Cb 0.15 0.46 -0.00 0.00 1.54 0.00 0.00 36.73 38.88 2b1i h TYR 495 CO -0.20 -0.51 -0.15 -0.39 -1.64 0.00 0.00 178.16 175.28 2b1i h VAL 496 N -0.66 0.29 -0.12 1.81 -1.51 -0.87 -2.37 116.25 112.82 2b1i h VAL 496 Ca 0.01 -1.17 0.00 0.00 -1.23 0.00 0.00 66.70 64.31 2b1i h VAL 496 Cb 0.67 1.94 0.00 0.00 -2.13 0.00 0.00 31.29 31.77 2b1i h VAL 496 CO -0.20 0.15 0.00 0.35 -1.23 0.00 0.00 177.57 176.63 2b1i n THR 497 N -3.18 0.13 -3.48 7.19 -2.24 0.03 -4.75 114.28 107.98 2b1i n THR 497 Ca 0.02 -0.56 -0.18 0.00 -2.27 0.00 0.00 64.05 61.05 2b1i n THR 497 Cb 0.50 1.37 0.08 0.00 -2.10 0.00 0.00 70.33 70.18 2b1i n THR 497 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2b1i n GLY 498 N 1.38 -0.38 1.58 3.38 0.00 0.33 -4.94 105.19 106.53 2b1i n GLY 498 Ca 0.15 0.12 -0.07 0.00 0.00 0.00 0.00 46.02 46.22 2b1i n GLY 498 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2b1i n THR 499 N -4.26 1.95 -0.10 2.61 -2.24 0.25 -4.80 114.28 107.70 2b1i n THR 499 Ca -0.25 -3.33 -0.11 0.00 -2.27 0.00 0.00 64.05 58.09 2b1i n THR 499 Cb 0.66 -0.25 -0.03 0.00 -2.10 0.00 0.00 70.33 68.61 2b1i n THR 499 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 2b1i h ILE 500 N 2.79 1.25 0.00 2.28 2.04 -1.92 -3.45 117.51 120.51 2b1i h ILE 500 Ca 0.10 -0.92 0.00 0.00 1.00 0.00 0.00 64.86 65.04 2b1i h ILE 500 Cb 1.36 1.26 0.00 0.00 -0.74 0.00 0.00 36.82 38.70 2b1i h ILE 500 CO 0.34 0.30 0.00 0.61 0.00 0.00 0.00 178.15 179.40 2b1i n GLY 501 N -0.35 -1.40 0.00 5.37 0.00 -1.26 -4.05 105.19 103.50 2b1i n GLY 501 Ca -0.02 -2.12 0.00 0.00 0.00 0.00 0.00 46.02 43.87 2b1i n GLY 501 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2b1i n GLU 502 N -0.02 0.26 0.00 1.61 0.28 -1.26 -4.19 120.64 117.32 2b1i n GLU 502 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.00 2b1i n GLU 502 Cb 0.00 -0.68 0.00 0.00 1.43 0.00 0.00 31.44 32.19 2b1i n GLU 502 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2b1i n ASP 503 N -1.71 0.00 -0.40 -1.84 10.43 -1.26 -4.32 116.55 117.45 2b1i n ASP 503 Ca 0.00 0.00 0.33 0.00 2.57 0.00 0.00 54.79 57.69 2b1i n ASP 503 Cb 0.18 0.00 0.62 0.00 1.84 0.00 0.00 41.12 43.76 2b1i n ASP 503 CO 0.00 0.00 0.00 -0.33 -1.07 0.00 0.00 177.20 175.80 2b1i h GLU 504 N 0.00 0.17 -0.04 -1.24 4.39 -1.99 -2.10 114.58 113.78 2b1i h GLU 504 Ca 0.00 -0.01 -0.03 0.00 0.34 0.00 0.00 59.36 59.66 2b1i h GLU 504 Cb 0.00 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.61 2b1i h GLU 504 CO 0.00 0.11 -0.08 -0.44 -1.16 0.00 0.00 179.01 177.45 2b1i h ASP 505 N 0.18 0.13 0.17 1.42 3.32 -1.86 -1.42 116.42 118.36 2b1i h ASP 505 Ca 0.73 -0.56 -0.03 0.00 0.02 0.00 0.00 57.03 57.18 2b1i h ASP 505 Cb 2.24 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 41.74 2b1i h ASP 505 CO -0.32 0.67 -0.15 0.25 -1.72 0.00 0.00 179.24 177.97 2b1i h LEU 506 N -0.40 0.00 0.66 1.55 5.85 -1.57 -1.31 115.31 120.10 2b1i h LEU 506 Ca 0.00 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 2b1i h LEU 506 Cb 0.65 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.68 2b1i h LEU 506 CO 0.02 0.15 -0.32 0.58 -0.34 0.00 0.00 178.44 178.53 2b1i h VAL 507 N 0.00 0.00 -0.97 1.05 2.07 -1.25 -2.18 116.25 114.97 2b1i h VAL 507 Ca -0.00 -0.32 0.11 0.00 0.82 0.00 0.00 66.70 67.30 2b1i h VAL 507 Cb 0.28 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 29.97 2b1i h VAL 507 CO 0.02 0.00 0.60 0.11 0.02 0.00 0.00 177.57 178.32 2b1i h LYS 508 N -1.21 0.96 -0.53 1.57 1.57 -1.13 0.12 116.57 117.92 2b1i h LYS 508 Ca -0.09 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.62 2b1i h LYS 508 Cb 0.68 -0.22 -0.03 0.00 0.08 0.00 0.00 32.23 32.75 2b1i h LYS 508 CO 0.15 0.63 0.27 2.35 -0.57 0.00 0.00 179.45 182.28 2b1i h TRP 509 N 0.99 0.72 0.00 -1.35 7.01 -1.28 -1.45 115.95 120.58 2b1i h TRP 509 Ca 0.47 -0.01 0.00 0.00 2.11 0.00 0.00 58.89 61.45 2b1i h TRP 509 Cb 0.41 -0.23 0.00 0.00 -2.10 0.00 0.00 29.16 27.24 2b1i h TRP 509 CO -0.01 0.52 -0.17 1.04 -2.79 0.00 0.00 178.44 177.02 2b1i n GLN 510 N -4.39 0.13 -0.14 2.65 6.02 -0.42 -3.83 117.38 117.40 2b1i n GLN 510 Ca 0.05 0.08 0.02 0.00 -0.01 0.00 0.00 57.00 57.13 2b1i n GLN 510 Cb 0.11 -1.63 0.07 0.00 1.02 0.00 0.00 30.24 29.82 2b1i n GLN 510 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2b1i n ALA 511 N -1.64 2.67 -1.69 -1.58 0.00 0.29 -3.12 120.51 115.44 2b1i n ALA 511 Ca 0.06 -0.33 0.03 0.00 0.00 0.00 0.00 53.44 53.19 2b1i n ALA 511 Cb 0.38 -1.01 0.04 0.00 0.00 0.00 0.00 19.45 18.86 2b1i n ALA 511 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2b1i n MET 512 N 0.05 0.40 -5.00 0.00 0.00 -1.25 -4.99 117.12 106.35 2b1i n MET 512 Ca 0.05 -1.47 -0.32 0.00 0.00 0.00 0.00 57.70 55.96 2b1i n MET 512 Cb 0.33 -0.80 -0.15 0.00 0.00 0.00 0.00 33.22 32.59 2b1i n MET 512 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 175.97 175.91 2b1i s PHE 513 N -0.87 2.66 0.19 3.17 0.08 -1.18 -2.13 117.98 119.91 2b1i s PHE 513 Ca 0.10 -0.70 -0.08 0.00 0.12 0.00 0.00 56.93 56.37 2b1i s PHE 513 Cb 0.08 -1.74 0.11 0.00 -0.57 0.00 0.00 43.02 40.91 2b1i s PHE 513 CO 0.01 -0.22 1.64 1.49 -0.10 0.00 0.00 175.22 178.04 2b1i h GLU 514 N 6.41 0.99 -4.09 0.44 4.57 -0.77 -3.41 114.58 118.72 2b1i h GLU 514 Ca -0.28 -0.34 -0.52 0.00 -1.18 0.00 0.00 59.36 57.05 2b1i h GLU 514 Cb 1.21 -0.08 -0.37 0.00 -0.16 0.00 0.00 28.75 29.35 2b1i h GLU 514 CO 0.51 1.01 -0.79 -2.00 -1.18 0.00 0.00 179.01 176.56 2b1i s GLU 515 N -4.89 1.30 -0.05 1.92 2.12 -1.23 -5.08 118.70 112.79 2b1i s GLU 515 Ca -0.11 -0.27 -0.30 0.00 0.36 0.00 0.00 54.97 54.65 2b1i s GLU 515 Cb 0.13 -1.62 -0.03 0.00 0.26 0.00 0.00 34.13 32.87 2b1i s GLU 515 CO 0.85 -0.33 1.19 0.08 -0.54 0.00 0.00 175.26 176.51 2b1i s VAL 516 N 1.74 4.26 0.35 3.70 1.01 -1.26 -4.38 120.40 125.82 2b1i s VAL 516 Ca 0.04 1.59 -0.22 0.00 0.00 0.00 0.00 61.98 63.38 2b1i s VAL 516 Cb -0.13 -4.02 -0.10 0.00 0.00 0.00 0.00 36.38 32.12 2b1i s VAL 516 CO -0.08 0.00 0.89 -2.16 0.00 0.00 0.00 175.10 173.76 2b1i s PRO 517 N 2.16 4.35 0.28 2.72 0.04 -1.26 -5.05 135.00 138.23 2b1i s PRO 517 Ca 0.56 1.12 -0.29 0.00 0.04 0.00 0.00 61.00 62.42 2b1i s PRO 517 Cb -0.25 -2.54 -0.10 0.00 0.04 0.00 0.00 34.50 31.65 2b1i s PRO 517 CO 0.22 0.17 1.10 0.00 0.04 0.00 0.00 177.00 178.53 2b1i s ALA 518 N -1.85 3.41 0.71 8.56 0.00 -1.26 -5.03 121.76 126.30 2b1i s ALA 518 Ca 0.54 0.89 -0.16 0.00 0.00 0.00 0.00 51.96 53.24 2b1i s ALA 518 Cb -0.14 -3.33 0.03 0.00 0.00 0.00 0.00 23.12 19.69 2b1i s ALA 518 CO 0.19 -0.15 1.22 -0.65 0.00 0.00 0.00 175.76 176.37 2b1i s GLN 519 N -1.44 2.21 0.29 0.00 -0.21 -1.26 -4.99 119.66 114.26 2b1i s GLN 519 Ca 0.44 1.82 -0.27 0.00 0.02 0.00 0.00 55.36 57.37 2b1i s GLN 519 Cb -0.32 -1.84 -0.09 0.00 1.00 0.00 0.00 33.01 31.76 2b1i s GLN 519 CO 0.41 -1.79 0.93 -0.51 -2.12 0.00 0.00 175.29 172.21 2b1i s LEU 520 N -5.00 4.45 0.68 2.90 1.43 -1.26 -5.05 118.68 116.82 2b1i s LEU 520 Ca 0.76 1.85 -0.11 0.00 -1.03 0.00 0.00 54.13 55.60 2b1i s LEU 520 Cb -0.31 -3.85 -0.00 0.00 0.03 0.00 0.00 46.19 42.06 2b1i s LEU 520 CO 0.44 0.02 1.06 -0.89 0.23 0.00 0.00 176.35 177.20 2b1i s THR 521 N -1.46 4.07 0.46 5.49 2.01 -1.26 -4.82 115.64 120.13 2b1i s THR 521 Ca 0.47 0.70 0.16 0.00 0.31 0.00 0.00 61.69 63.33 2b1i s THR 521 Cb -0.21 -3.44 0.33 0.00 0.01 0.00 0.00 72.50 69.19 2b1i s THR 521 CO 0.26 -0.85 2.02 -0.33 -0.69 0.00 0.00 174.62 175.03 2b1i h GLU 522 N -0.56 0.27 -0.16 4.92 5.08 -1.99 0.18 114.58 122.32 2b1i h GLU 522 Ca -0.44 -0.02 -0.10 0.00 -1.00 0.00 0.00 59.36 57.81 2b1i h GLU 522 Cb 1.21 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.39 2b1i h GLU 522 CO 0.57 0.18 -0.33 0.00 -1.00 0.00 0.00 179.01 178.43 2b1i h ALA 523 N 1.76 1.15 0.02 3.43 0.00 -2.00 -2.39 119.26 121.22 2b1i h ALA 523 Ca 0.22 -0.37 -0.24 0.00 0.00 0.00 0.00 54.91 54.52 2b1i h ALA 523 Cb 0.49 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.19 2b1i h ALA 523 CO -0.05 0.55 -1.00 0.93 0.00 0.00 0.00 179.25 179.69 2b1i h GLU 524 N 0.27 0.46 0.22 0.00 5.08 -1.06 -2.48 114.58 117.08 2b1i h GLU 524 Ca 0.03 -0.52 -0.01 0.00 -1.00 0.00 0.00 59.36 57.86 2b1i h GLU 524 Cb 0.72 0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.13 2b1i h GLU 524 CO 0.06 1.17 -0.11 0.87 -1.00 0.00 0.00 179.01 179.99 2b1i h LYS 525 N 0.25 -0.29 -0.93 2.33 1.79 -1.15 -2.05 116.57 116.51 2b1i h LYS 525 Ca -0.10 0.02 0.02 0.00 -2.18 0.00 0.00 60.65 58.41 2b1i h LYS 525 Cb 1.65 0.07 -0.05 0.00 -1.58 0.00 0.00 32.23 32.31 2b1i h LYS 525 CO 0.18 -0.05 0.62 1.57 -1.08 0.00 0.00 179.45 180.68 2b1i h LYS 526 N -0.50 1.20 -0.26 3.15 2.10 -1.48 0.74 116.57 121.52 2b1i h LYS 526 Ca -0.03 -0.07 0.02 0.00 -2.00 0.00 0.00 60.65 58.57 2b1i h LYS 526 Cb 0.37 -0.27 -0.02 0.00 -0.90 0.00 0.00 32.23 31.41 2b1i h LYS 526 CO 0.05 0.79 0.12 0.37 -2.00 0.00 0.00 179.45 178.79 2b1i h GLN 527 N 1.24 0.25 -0.01 0.07 5.75 -1.41 0.27 115.11 121.28 2b1i h GLN 527 Ca 0.35 -0.02 -0.00 0.00 -0.15 0.00 0.00 58.65 58.84 2b1i h GLN 527 Cb -0.10 -0.06 -0.00 0.00 1.07 0.00 0.00 27.48 28.40 2b1i h GLN 527 CO -0.09 0.17 0.00 2.35 -2.65 0.00 0.00 178.83 178.61 2b1i h TRP 528 N 0.26 0.02 -0.74 3.99 2.91 -0.88 -3.02 115.95 118.49 2b1i h TRP 528 Ca 0.11 -0.00 0.11 0.00 1.13 0.00 0.00 58.89 60.23 2b1i h TRP 528 Cb 0.04 -0.01 -0.05 0.00 -0.51 0.00 0.00 29.16 28.64 2b1i h TRP 528 CO -0.10 0.18 0.49 0.82 -1.03 0.00 0.00 178.44 178.79 2b1i h ILE 529 N -0.15 0.91 0.00 2.65 2.04 -0.50 0.19 117.51 122.64 2b1i h ILE 529 Ca 0.00 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 65.66 2b1i h ILE 529 Cb 0.17 0.26 0.00 0.00 -0.74 0.00 0.00 36.82 36.51 2b1i h ILE 529 CO -0.00 0.11 0.00 0.00 0.00 0.00 0.00 178.15 178.26 2b1i n ALA 530 N -2.48 1.70 0.09 1.87 0.00 0.05 -2.38 120.51 119.36 2b1i n ALA 530 Ca 0.13 -0.03 -0.07 0.00 0.00 0.00 0.00 53.44 53.46 2b1i n ALA 530 Cb 0.37 -1.27 0.04 0.00 0.00 0.00 0.00 19.45 18.59 2b1i n ALA 530 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2b1i h LYS 531 N 0.00 0.20 -6.54 0.00 1.79 -0.59 -3.45 116.57 107.98 2b1i h LYS 531 Ca 0.00 -0.18 -0.53 0.00 -2.18 0.00 0.00 60.65 57.76 2b1i h LYS 531 Cb 0.28 0.05 0.02 0.00 -1.58 0.00 0.00 32.23 31.00 2b1i h LYS 531 CO 0.00 0.88 0.71 -1.17 -1.08 0.00 0.00 179.45 178.79 2b1i s LEU 532 N -7.58 4.37 0.14 2.94 2.96 -1.00 -5.01 118.68 115.49 2b1i s LEU 532 Ca -0.03 2.29 0.02 0.00 -0.22 0.00 0.00 54.13 56.20 2b1i s LEU 532 Cb 0.11 -3.59 -0.04 0.00 0.50 0.00 0.00 46.19 43.17 2b1i s LEU 532 CO 0.82 -0.63 -0.04 0.42 -1.32 0.00 0.00 176.35 175.59 2b1i s THR 533 N 1.08 0.78 -1.31 3.68 -4.23 -1.26 -3.94 115.64 110.45 2b1i s THR 533 Ca 0.64 -1.98 -0.09 0.00 -1.18 0.00 0.00 61.69 59.08 2b1i s THR 533 Cb -0.36 -1.92 0.01 0.00 1.34 0.00 0.00 72.50 71.57 2b1i s THR 533 CO 0.30 -0.67 1.14 0.00 -0.54 0.00 0.00 174.62 174.86 2b1i n ALA 534 N -0.16 -1.27 -2.20 3.99 0.00 -0.02 -4.94 120.51 115.91 2b1i n ALA 534 Ca -0.09 0.39 -0.32 0.00 0.00 0.00 0.00 53.44 53.42 2b1i n ALA 534 Cb 0.62 -5.33 -0.06 0.00 0.00 0.00 0.00 19.45 14.68 2b1i n ALA 534 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2b1i s VAL 535 N -3.31 4.74 0.14 0.00 1.01 0.08 -4.77 120.40 118.29 2b1i s VAL 535 Ca 0.56 0.82 0.07 0.00 0.00 0.00 0.00 61.98 63.43 2b1i s VAL 535 Cb -0.25 -3.62 -0.04 0.00 0.00 0.00 0.00 36.38 32.47 2b1i s VAL 535 CO 0.70 -0.18 -0.04 -0.44 0.00 0.00 0.00 175.10 175.15 2b1i s SER 536 N -2.35 4.67 -0.01 3.32 0.01 0.34 -0.40 113.70 119.28 2b1i s SER 536 Ca 0.53 -0.36 -0.00 0.00 1.31 0.00 0.00 55.95 57.42 2b1i s SER 536 Cb -0.10 -0.98 0.01 0.00 0.21 0.00 0.00 66.02 65.16 2b1i s SER 536 CO 0.19 0.13 0.03 -0.22 0.41 0.00 0.00 173.24 173.78 2b1i s LEU 537 N -2.60 1.56 -0.02 2.44 2.96 0.12 -0.45 118.68 122.69 2b1i s LEU 537 Ca 0.25 0.05 0.06 0.00 -0.22 0.00 0.00 54.13 54.27 2b1i s LEU 537 Cb -0.10 0.02 -0.01 0.00 0.50 0.00 0.00 46.19 46.59 2b1i s LEU 537 CO 0.17 -0.06 -0.21 -0.55 -1.32 0.00 0.00 176.35 174.38 2b1i s SER 538 N 0.47 2.46 0.04 3.68 0.15 0.29 -0.96 113.70 119.84 2b1i s SER 538 Ca -0.04 -0.39 0.08 0.00 0.70 0.00 0.00 55.95 56.30 2b1i s SER 538 Cb -0.06 -0.36 -0.03 0.00 -1.71 0.00 0.00 66.02 63.86 2b1i s SER 538 CO -0.01 0.24 -0.20 -0.55 1.20 0.00 0.00 173.24 173.91 2b1i s SER 539 N -0.39 3.63 0.11 5.45 0.15 -0.77 -0.27 113.70 121.60 2b1i s SER 539 Ca 0.06 -0.47 0.23 0.00 0.70 0.00 0.00 55.95 56.47 2b1i s SER 539 Cb -0.09 -0.52 0.92 0.00 -1.71 0.00 0.00 66.02 64.61 2b1i s SER 539 CO -0.00 0.26 1.72 -0.90 1.20 0.00 0.00 173.24 175.52 2b1i n ASP 540 N 1.62 0.33 -4.06 5.45 5.68 -0.16 -4.41 116.55 121.00 2b1i n ASP 540 Ca -0.16 0.55 -0.10 0.00 -0.50 0.00 0.00 54.79 54.58 2b1i n ASP 540 Cb 0.52 -0.64 -0.08 0.00 -1.14 0.00 0.00 41.12 39.78 2b1i n ASP 540 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2b1i s ALA 541 N -3.09 0.42 0.66 2.12 0.00 -1.26 -1.22 121.76 119.38 2b1i s ALA 541 Ca 0.09 -1.20 -0.18 0.00 0.00 0.00 0.00 51.96 50.68 2b1i s ALA 541 Cb 0.13 1.00 -0.01 0.00 0.00 0.00 0.00 23.12 24.24 2b1i s ALA 541 CO 0.44 -0.62 1.29 -0.59 0.00 0.00 0.00 175.76 176.27 2b1i s PHE 542 N -4.03 2.07 -0.39 0.00 -0.12 -1.26 -4.48 117.98 109.76 2b1i s PHE 542 Ca 0.24 1.50 -0.29 0.00 -0.05 0.00 0.00 56.93 58.33 2b1i s PHE 542 Cb 0.05 -3.68 0.02 0.00 -0.63 0.00 0.00 43.02 38.78 2b1i s PHE 542 CO 0.04 -2.90 1.08 -0.06 -0.05 0.00 0.00 175.22 173.33 2b1i s PHE 543 N -1.45 3.00 0.15 3.49 0.08 -1.26 -4.92 117.98 117.07 2b1i s PHE 543 Ca 0.82 0.93 0.19 0.00 0.12 0.00 0.00 56.93 59.00 2b1i s PHE 543 Cb -0.37 -4.00 0.69 0.00 -0.57 0.00 0.00 43.02 38.78 2b1i s PHE 543 CO 0.40 -0.99 1.74 -1.00 -0.10 0.00 0.00 175.22 175.27 2b1i h PRO 544 N 8.62 0.00 -4.10 0.24 0.13 -1.92 -3.46 132.00 131.52 2b1i h PRO 544 Ca -0.22 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.79 2b1i h PRO 544 Cb 1.06 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.03 2b1i h PRO 544 CO 1.07 0.35 -0.62 -0.06 -0.23 0.00 0.00 178.00 178.51 2b1i s PHE 545 N -3.59 0.40 -0.88 1.56 0.08 -1.26 -4.54 117.98 109.74 2b1i s PHE 545 Ca 0.00 -0.87 0.18 0.00 0.12 0.00 0.00 56.93 56.36 2b1i s PHE 545 Cb 0.11 -0.29 0.77 0.00 -0.57 0.00 0.00 43.02 43.03 2b1i s PHE 545 CO 0.68 -0.38 1.58 2.89 -0.10 0.00 0.00 175.22 179.89 2b1i n ARG 546 N 0.33 0.05 0.23 0.44 1.85 -1.26 -3.26 116.66 115.04 2b1i n ARG 546 Ca -0.16 0.26 0.17 0.00 -1.00 0.00 0.00 57.85 57.11 2b1i n ARG 546 Cb 0.60 -1.59 0.85 0.00 -1.05 0.00 0.00 32.46 31.28 2b1i n ARG 546 CO 0.00 0.00 0.00 0.38 -0.01 0.00 0.00 177.63 178.00 2b1i h ASP 547 N 0.00 0.00 -0.37 2.89 3.04 -1.98 0.90 116.42 120.90 2b1i h ASP 547 Ca 0.00 0.00 -0.14 0.00 -3.24 0.00 0.00 57.03 53.65 2b1i h ASP 547 Cb 0.32 0.00 -0.01 0.00 -1.04 0.00 0.00 39.33 38.60 2b1i h ASP 547 CO 0.00 0.00 -0.33 0.78 -2.04 0.00 0.00 179.24 177.65 2b1i h ASN 548 N 0.00 0.93 -0.29 4.15 2.35 -1.93 -0.96 115.58 119.84 2b1i h ASN 548 Ca 0.06 -0.46 -0.13 0.00 -0.55 0.00 0.00 56.30 55.22 2b1i h ASN 548 Cb 0.36 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 38.47 2b1i h ASN 548 CO -0.00 1.20 -0.33 0.58 -1.65 0.00 0.00 177.43 177.22 2b1i h VAL 549 N 0.68 1.30 -0.09 2.81 2.07 -1.12 -0.46 116.25 121.43 2b1i h VAL 549 Ca 0.06 -1.51 0.00 0.00 0.82 0.00 0.00 66.70 66.07 2b1i h VAL 549 Cb 0.92 1.61 -0.00 0.00 -1.52 0.00 0.00 31.29 32.29 2b1i h VAL 549 CO 0.08 0.49 0.06 0.44 0.02 0.00 0.00 177.57 178.66 2b1i h ASP 550 N 0.48 0.11 -0.34 0.57 3.32 -1.02 0.95 116.42 120.49 2b1i h ASP 550 Ca 0.04 -0.02 0.01 0.00 0.02 0.00 0.00 57.03 57.07 2b1i h ASP 550 Cb 0.91 -0.03 -0.02 0.00 0.22 0.00 0.00 39.33 40.42 2b1i h ASP 550 CO 0.08 0.10 0.22 -0.09 -1.72 0.00 0.00 179.24 177.83 2b1i h ARG 551 N 0.11 0.43 -0.22 3.56 9.65 -1.11 -2.43 114.38 124.37 2b1i h ARG 551 Ca 0.03 -0.03 0.03 0.00 -1.10 0.00 0.00 59.98 58.92 2b1i h ARG 551 Cb 0.01 -0.10 -0.03 0.00 -1.39 0.00 0.00 29.97 28.46 2b1i h ARG 551 CO -0.01 0.29 0.01 0.00 2.80 0.00 0.00 179.97 183.06 2b1i h ALA 552 N 1.14 0.20 -0.94 2.80 0.00 -0.86 -2.00 119.26 119.60 2b1i h ALA 552 Ca 0.13 0.05 0.20 0.00 0.00 0.00 0.00 54.91 55.29 2b1i h ALA 552 Cb -0.03 0.09 -0.08 0.00 0.00 0.00 0.00 17.79 17.77 2b1i h ALA 552 CO -0.04 -0.42 0.60 -0.22 0.00 0.00 0.00 179.25 179.18 2b1i h LYS 553 N 0.08 0.51 0.00 0.00 1.63 -0.59 -1.00 116.57 117.21 2b1i h LYS 553 Ca 0.10 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 59.87 2b1i h LYS 553 Cb 0.12 -0.12 0.00 0.00 -0.60 0.00 0.00 32.23 31.63 2b1i h LYS 553 CO -0.16 0.34 0.00 0.00 -3.45 0.00 0.00 179.45 176.18 2b1i h ARG 554 N 0.53 0.00 -0.15 1.90 3.08 -0.87 -1.87 114.38 116.99 2b1i h ARG 554 Ca 0.50 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.55 2b1i h ARG 554 Cb 1.07 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.12 2b1i h ARG 554 CO -0.23 0.00 -0.01 1.51 -1.07 0.00 0.00 179.97 180.17 2b1i n ILE 555 N -2.82 2.14 -0.30 2.04 0.13 -0.40 -4.74 119.36 115.39 2b1i n ILE 555 Ca -0.01 -2.08 0.00 0.00 -1.10 0.00 0.00 62.75 59.56 2b1i n ILE 555 Cb 0.13 -0.25 0.00 0.00 -0.84 0.00 0.00 39.64 38.68 2b1i n ILE 555 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 2b1i n GLY 556 N -0.91 0.84 3.70 4.50 0.00 -0.70 -4.72 105.19 107.90 2b1i n GLY 556 Ca 0.19 -0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.67 2b1i n GLY 556 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2b1i s VAL 557 N -2.00 3.06 -0.00 1.61 1.01 -1.06 -0.74 120.40 122.27 2b1i s VAL 557 Ca 0.00 0.66 0.00 0.00 0.00 0.00 0.00 61.98 62.64 2b1i s VAL 557 Cb 0.00 -3.42 -0.00 0.00 0.00 0.00 0.00 36.38 32.96 2b1i s VAL 557 CO 0.00 0.03 0.00 1.67 0.00 0.00 0.00 175.10 176.80 2b1i n GLN 558 N 4.68 3.42 -3.85 2.72 7.27 0.46 -4.45 117.38 127.65 2b1i n GLN 558 Ca 0.14 -0.00 -0.23 0.00 0.07 0.00 0.00 57.00 56.98 2b1i n GLN 558 Cb 0.41 -0.76 -0.17 0.00 2.41 0.00 0.00 30.24 32.13 2b1i n GLN 558 CO 0.00 0.00 0.00 -0.06 0.07 0.00 0.00 177.06 177.07 2b1i s PHE 559 N -1.51 0.75 -0.04 3.69 0.08 -1.05 -0.45 117.98 119.44 2b1i s PHE 559 Ca -0.00 -0.22 0.03 0.00 0.12 0.00 0.00 56.93 56.86 2b1i s PHE 559 Cb 0.00 -0.81 0.00 0.00 -0.57 0.00 0.00 43.02 41.64 2b1i s PHE 559 CO 0.00 -0.32 -0.12 0.42 -0.10 0.00 0.00 175.22 175.10 2b1i s ILE 560 N 1.76 1.07 -0.10 0.64 1.01 -0.25 0.15 121.20 125.47 2b1i s ILE 560 Ca 0.02 -0.51 0.03 0.00 0.00 0.00 0.00 60.65 60.19 2b1i s ILE 560 Cb -0.13 -0.94 0.01 0.00 0.01 0.00 0.00 42.46 41.41 2b1i s ILE 560 CO -0.05 0.32 -0.19 0.54 0.00 0.00 0.00 174.94 175.56 2b1i s VAL 561 N 0.19 1.76 0.08 2.92 0.11 -0.13 -0.43 120.40 124.90 2b1i s VAL 561 Ca -0.05 -0.83 -0.15 0.00 -2.93 0.00 0.00 61.98 58.03 2b1i s VAL 561 Cb -0.11 -1.55 0.03 0.00 -1.53 0.00 0.00 36.38 33.22 2b1i s VAL 561 CO 0.01 0.49 0.34 0.00 -3.33 0.00 0.00 175.10 172.62 2b1i s ALA 562 N 0.62 -0.77 0.61 1.54 0.00 -0.89 -1.86 121.76 121.01 2b1i s ALA 562 Ca -0.13 -0.03 -0.19 0.00 0.00 0.00 0.00 51.96 51.60 2b1i s ALA 562 Cb -0.16 0.47 -0.04 0.00 0.00 0.00 0.00 23.12 23.38 2b1i s ALA 562 CO 0.04 -0.51 1.13 -2.30 0.00 0.00 0.00 175.76 174.12 2b1i n PRO 563 N 0.22 1.09 -1.00 0.00 -0.02 -1.26 -1.28 135.00 132.74 2b1i n PRO 563 Ca -0.17 0.42 -0.24 0.00 -2.02 0.00 0.00 63.50 61.48 2b1i n PRO 563 Cb 0.61 -2.34 0.19 0.00 -0.02 0.00 0.00 33.50 31.95 2b1i n PRO 563 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2b1i n SER 564 N -1.13 -1.44 0.00 2.55 2.88 0.12 -4.01 113.62 112.57 2b1i n SER 564 Ca 0.14 -1.12 0.00 0.00 -1.33 0.00 0.00 58.87 56.56 2b1i n SER 564 Cb 0.47 -0.81 0.00 0.00 -0.75 0.00 0.00 64.21 63.11 2b1i n SER 564 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2b1i n GLY 565 N -3.08 1.22 3.85 0.46 0.00 -1.26 -4.56 105.19 101.82 2b1i n GLY 565 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 2b1i n GLY 565 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2b1i s SER 566 N -0.41 5.68 0.38 1.61 1.04 -1.26 -4.95 113.70 115.78 2b1i s SER 566 Ca 0.00 1.43 0.27 0.00 0.48 0.00 0.00 55.95 58.13 2b1i s SER 566 Cb 0.00 -2.36 0.86 0.00 0.10 0.00 0.00 66.02 64.62 2b1i s SER 566 CO 0.00 -1.23 1.77 0.00 0.98 0.00 0.00 173.24 174.76 2b1i h ALA 567 N -0.57 1.00 -0.92 5.32 0.00 -1.96 -3.00 119.26 119.13 2b1i h ALA 567 Ca -0.44 0.00 -0.61 0.00 0.00 0.00 0.00 54.91 53.86 2b1i h ALA 567 Cb 1.21 0.00 -0.30 0.00 0.00 0.00 0.00 17.79 18.70 2b1i h ALA 567 CO 0.60 0.00 0.52 0.00 0.00 0.00 0.00 179.25 180.37 2b1i n ALA 568 N -1.96 5.92 -0.08 0.00 0.00 -1.26 -4.56 120.51 118.57 2b1i n ALA 568 Ca 0.03 -3.43 -0.13 0.00 0.00 0.00 0.00 53.44 49.91 2b1i n ALA 568 Cb 0.39 -1.44 -0.05 0.00 0.00 0.00 0.00 19.45 18.34 2b1i n ALA 568 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2b1i h ASP 569 N 1.84 0.53 0.14 0.00 3.45 -1.84 -2.85 116.42 117.69 2b1i h ASP 569 Ca 0.55 -0.44 -0.02 0.00 0.43 0.00 0.00 57.03 57.55 2b1i h ASP 569 Cb 1.25 -0.15 -0.00 0.00 -0.56 0.00 0.00 39.33 39.87 2b1i h ASP 569 CO 1.33 0.86 -0.11 -0.33 -1.57 0.00 0.00 179.24 179.42 2b1i h GLU 570 N 0.20 0.00 -0.11 3.56 4.39 -1.87 -0.11 114.58 120.65 2b1i h GLU 570 Ca 0.04 0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.60 2b1i h GLU 570 Cb 0.69 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.34 2b1i h GLU 570 CO 0.04 0.11 -0.50 0.28 -1.16 0.00 0.00 179.01 177.78 2b1i h VAL 571 N 0.00 1.36 -0.35 3.13 2.07 -1.88 0.29 116.25 120.87 2b1i h VAL 571 Ca -0.00 -1.81 -0.12 0.00 0.82 0.00 0.00 66.70 65.58 2b1i h VAL 571 Cb 0.21 2.16 -0.01 0.00 -1.52 0.00 0.00 31.29 32.14 2b1i h VAL 571 CO 0.01 0.55 -0.28 0.58 0.02 0.00 0.00 177.57 178.45 2b1i h VAL 572 N 0.14 1.28 0.04 2.57 2.07 -1.21 0.41 116.25 121.54 2b1i h VAL 572 Ca -0.03 -1.41 -0.00 0.00 0.82 0.00 0.00 66.70 66.08 2b1i h VAL 572 Cb 1.14 1.31 0.00 0.00 -1.52 0.00 0.00 31.29 32.22 2b1i h VAL 572 CO 0.10 0.46 -0.02 0.40 0.02 0.00 0.00 177.57 178.54 2b1i h ILE 573 N 0.63 1.01 -0.75 4.57 2.04 -1.03 -0.66 117.51 123.31 2b1i h ILE 573 Ca 0.08 -0.15 0.02 0.00 1.00 0.00 0.00 64.86 65.81 2b1i h ILE 573 Cb 0.79 1.11 -0.04 0.00 -0.74 0.00 0.00 36.82 37.94 2b1i h ILE 573 CO 0.07 0.04 0.49 -0.33 0.00 0.00 0.00 178.15 178.42 2b1i h GLU 574 N -0.11 0.96 -0.80 2.37 5.08 -0.68 0.23 114.58 121.63 2b1i h GLU 574 Ca -0.00 -0.06 0.10 0.00 -1.00 0.00 0.00 59.36 58.40 2b1i h GLU 574 Cb 0.10 -0.22 -0.08 0.00 0.50 0.00 0.00 28.75 29.05 2b1i h GLU 574 CO 0.01 0.64 0.44 0.00 -1.00 0.00 0.00 179.01 179.10 2b1i h ALA 575 N 1.29 1.15 -0.16 3.43 0.00 0.03 0.09 119.26 125.08 2b1i h ALA 575 Ca 0.29 0.05 -0.21 0.00 0.00 0.00 0.00 54.91 55.03 2b1i h ALA 575 Cb -0.07 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.63 2b1i h ALA 575 CO -0.08 0.04 -0.72 0.00 0.00 0.00 0.00 179.25 178.49 2b1i h ASN 577 N 0.50 0.16 -0.25 0.00 2.35 -0.54 0.45 115.58 118.25 2b1i h ASN 577 Ca -0.03 0.03 0.02 0.00 -0.55 0.00 0.00 56.30 55.77 2b1i h ASN 577 Cb 1.33 0.01 -0.03 0.00 0.05 0.00 0.00 38.32 39.69 2b1i h ASN 577 CO 0.14 0.13 0.09 -0.08 -1.65 0.00 0.00 177.43 176.07 2b1i h GLU 578 N 0.29 0.21 -0.15 0.81 4.81 -0.83 -2.97 114.58 116.75 2b1i h GLU 578 Ca 0.15 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 2b1i h GLU 578 Cb 0.11 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.45 2b1i h GLU 578 CO -0.15 0.14 0.00 1.28 -0.73 0.00 0.00 179.01 179.55 2b1i n LEU 579 N -5.03 0.97 -1.69 1.64 4.77 -0.34 -4.90 117.00 112.43 2b1i n LEU 579 Ca -0.01 -0.45 -0.14 0.00 -0.03 0.00 0.00 56.01 55.37 2b1i n LEU 579 Cb 0.09 -0.10 -0.00 0.00 -2.33 0.00 0.00 43.42 41.08 2b1i n LEU 579 CO 0.29 0.23 -0.16 0.61 -1.33 0.00 0.00 177.39 177.03 2b1i n GLY 580 N 0.88 -0.21 3.70 -0.72 0.00 -0.65 -5.01 105.19 103.19 2b1i n GLY 580 Ca 0.10 -0.27 -0.35 0.00 0.00 0.00 0.00 46.02 45.50 2b1i n GLY 580 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b1i s ILE 581 N -2.75 5.01 -0.23 -0.61 1.01 0.06 -4.87 121.20 118.82 2b1i s ILE 581 Ca 0.03 0.04 -0.26 0.00 0.00 0.00 0.00 60.65 60.46 2b1i s ILE 581 Cb -0.01 -3.24 -0.00 0.00 0.01 0.00 0.00 42.46 39.22 2b1i s ILE 581 CO 0.04 0.49 0.89 -0.89 0.00 0.00 0.00 174.94 175.47 2b1i s THR 582 N 0.05 4.80 -0.21 2.92 2.01 0.40 -4.24 115.64 121.37 2b1i s THR 582 Ca 0.07 1.71 -0.01 0.00 0.31 0.00 0.00 61.69 63.77 2b1i s THR 582 Cb -0.12 -4.18 0.01 0.00 0.01 0.00 0.00 72.50 68.23 2b1i s THR 582 CO 0.00 -0.09 -0.11 -0.22 -0.69 0.00 0.00 174.62 173.51 2b1i s LEU 583 N 2.85 2.66 -0.21 4.42 2.96 -1.26 -1.09 118.68 129.02 2b1i s LEU 583 Ca 0.38 -0.65 -0.14 0.00 -0.22 0.00 0.00 54.13 53.50 2b1i s LEU 583 Cb -0.15 -1.61 -0.04 0.00 0.50 0.00 0.00 46.19 44.89 2b1i s LEU 583 CO 0.08 -0.04 0.33 -0.63 -1.32 0.00 0.00 176.35 174.77 2b1i s ILE 584 N 1.35 5.24 -0.13 6.68 1.09 0.43 -0.08 121.20 135.79 2b1i s ILE 584 Ca 0.04 0.57 -0.05 0.00 -1.10 0.00 0.00 60.65 60.11 2b1i s ILE 584 Cb -0.14 -3.67 -0.04 0.00 -1.06 0.00 0.00 42.46 37.55 2b1i s ILE 584 CO -0.08 0.28 0.04 -1.00 -0.10 0.00 0.00 174.94 174.09 2b1i s HIS 585 N 1.19 3.25 0.45 3.97 3.76 0.41 -2.10 115.29 126.21 2b1i s HIS 585 Ca 0.16 0.15 0.06 0.00 -0.15 0.00 0.00 55.06 55.28 2b1i s HIS 585 Cb -0.14 -1.93 -0.03 0.00 1.11 0.00 0.00 32.58 31.58 2b1i s HIS 585 CO 0.07 0.35 0.16 0.95 -0.85 0.00 0.00 174.74 175.42 2b1i s THR 586 N -0.33 1.96 -0.35 1.30 -4.23 -0.41 -4.54 115.64 109.05 2b1i s THR 586 Ca 0.08 -1.75 0.07 0.00 -1.18 0.00 0.00 61.69 58.90 2b1i s THR 586 Cb -0.12 -2.72 0.50 0.00 1.34 0.00 0.00 72.50 71.51 2b1i s THR 586 CO 0.02 0.00 1.52 0.59 -0.54 0.00 0.00 174.62 176.21 2b1i n ASN 587 N -1.29 3.61 -3.85 3.99 3.02 -1.26 -0.71 115.26 118.76 2b1i n ASN 587 Ca -0.05 -3.78 -0.30 0.00 -0.03 0.00 0.00 54.58 50.42 2b1i n ASN 587 Cb 0.65 -0.64 -0.14 0.00 -0.61 0.00 0.00 39.78 39.04 2b1i n ASN 587 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 2b1i s LEU 588 N -3.39 3.63 0.34 3.41 2.96 -1.26 -5.04 118.68 119.34 2b1i s LEU 588 Ca 0.49 -2.75 -0.27 0.00 -0.22 0.00 0.00 54.13 51.38 2b1i s LEU 588 Cb 0.43 -1.38 -0.09 0.00 0.50 0.00 0.00 46.19 45.65 2b1i s LEU 588 CO 0.01 -0.26 1.08 -0.60 -1.32 0.00 0.00 176.35 175.25 2b1i s ARG 589 N 0.11 4.38 -0.27 1.98 3.52 -1.26 -4.52 118.95 122.89 2b1i s ARG 589 Ca 0.17 1.66 0.11 0.00 -0.13 0.00 0.00 55.73 57.54 2b1i s ARG 589 Cb -0.25 -2.85 0.47 0.00 -1.56 0.00 0.00 34.95 30.76 2b1i s ARG 589 CO -0.01 0.02 1.17 1.28 -0.81 0.00 0.00 175.30 176.95 2b1i n LEU 590 N 0.53 3.89 -4.76 -0.88 4.77 -0.36 -5.05 117.00 115.14 2b1i n LEU 590 Ca 0.02 -4.22 -0.38 0.00 -0.03 0.00 0.00 56.01 51.40 2b1i n LEU 590 Cb 0.47 -0.16 0.03 0.00 -2.33 0.00 0.00 43.42 41.43 2b1i n LEU 590 CO 0.49 1.77 0.95 -0.36 -1.33 0.00 0.00 177.39 178.91 2b1i s PHE 591 N -3.53 2.44 -0.10 -1.77 0.08 -1.26 -4.49 117.98 109.35 2b1i s PHE 591 Ca 0.44 1.41 -0.05 0.00 0.12 0.00 0.00 56.93 58.85 2b1i s PHE 591 Cb 0.39 -3.70 0.05 0.00 -0.57 0.00 0.00 43.02 39.18 2b1i s PHE 591 CO 0.01 -2.56 0.22 -1.58 -0.10 0.00 0.00 175.22 171.21 2b1i s HIS 592 N -1.35 -0.30 0.00 0.36 5.65 -1.26 -4.99 115.29 113.40 2b1i s HIS 592 Ca 0.69 0.74 0.00 0.00 0.25 0.00 0.00 55.06 56.74 2b1i s HIS 592 Cb -0.38 -0.00 0.00 0.00 -1.18 0.00 0.00 32.58 31.02 2b1i s HIS 592 CO 0.45 -0.24 0.00 0.72 -0.65 0.00 0.00 174.74 175.02