#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3a2p s VAL 4 N 0.00 4.30 -0.84 0.58 1.01 -1.26 -4.97 120.40 119.23 3a2p s VAL 4 Ca 0.00 1.67 -0.25 0.00 0.00 0.00 0.00 61.98 63.39 3a2p s VAL 4 Cb 0.00 -3.85 0.02 0.00 0.00 0.00 0.00 36.38 32.55 3a2p s VAL 4 CO 0.00 -0.03 1.52 -0.62 0.00 0.00 0.00 175.10 175.97 3a2p s ASP 5 N -1.84 6.00 0.00 3.32 2.15 -1.26 -4.83 116.67 120.21 3a2p s ASP 5 Ca 0.54 -0.70 0.11 0.00 0.43 0.00 0.00 52.55 52.94 3a2p s ASP 5 Cb -0.15 -2.56 0.66 0.00 -0.30 0.00 0.00 42.92 40.57 3a2p s ASP 5 CO 0.20 -1.93 1.14 0.18 -0.17 0.00 0.00 175.17 174.58 3a2p n LEU 6 N 10.36 0.00 -0.27 -1.34 4.77 -1.26 -2.61 117.00 126.65 3a2p n LEU 6 Ca 0.21 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.32 3a2p n LEU 6 Cb 0.50 0.00 0.38 0.00 -2.33 0.00 0.00 43.42 41.97 3a2p n LEU 6 CO 0.68 0.00 0.66 1.87 -1.33 0.00 0.00 177.39 179.27 3a2p n TRP 7 N -0.79 0.00 -2.51 -1.77 -0.00 -1.26 -4.82 117.44 106.29 3a2p n TRP 7 Ca 0.08 0.00 -0.35 0.00 -0.00 0.00 0.00 57.50 57.23 3a2p n TRP 7 Cb 0.04 -0.11 -0.03 0.00 -0.00 0.00 0.00 31.31 31.20 3a2p n TRP 7 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 177.69 177.04 3a2p s GLN 8 N -2.46 3.97 0.94 5.87 -1.52 -1.07 -5.03 119.66 120.35 3a2p s GLN 8 Ca 0.25 1.48 -0.14 0.00 -1.95 0.00 0.00 55.36 55.00 3a2p s GLN 8 Cb 0.19 -2.34 0.16 0.00 -0.22 0.00 0.00 33.01 30.81 3a2p s GLN 8 CO 0.51 -0.31 1.19 0.16 -0.25 0.00 0.00 175.29 176.58 3a2p s ASP 9 N -1.72 3.26 0.26 5.90 1.47 -1.26 -4.69 116.67 119.88 3a2p s ASP 9 Ca 0.62 0.72 -0.01 0.00 1.18 0.00 0.00 52.55 55.06 3a2p s ASP 9 Cb -0.20 -1.11 0.51 0.00 -0.34 0.00 0.00 42.92 41.77 3a2p s ASP 9 CO 0.25 -2.69 1.78 0.00 0.68 0.00 0.00 175.17 175.19 3a2p h ALA 10 N -1.60 1.29 -0.72 2.11 0.00 -1.96 0.54 119.26 118.92 3a2p h ALA 10 Ca -0.48 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.48 3a2p h ALA 10 Cb 1.30 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 19.00 3a2p h ALA 10 CO 0.53 -0.02 0.37 1.15 0.00 0.00 0.00 179.25 181.28 3a2p h THR 11 N 0.70 1.23 -0.32 0.00 2.02 -1.95 0.32 112.91 114.91 3a2p h THR 11 Ca 0.45 -0.61 -0.17 0.00 0.77 0.00 0.00 66.41 66.85 3a2p h THR 11 Cb 0.58 0.31 -0.00 0.00 -1.74 0.00 0.00 68.15 67.30 3a2p h THR 11 CO -0.33 0.26 -0.45 0.00 0.37 0.00 0.00 175.52 175.37 3a2p h ALA 12 N 1.18 0.48 -0.17 6.16 0.00 -1.62 -2.19 119.26 123.10 3a2p h ALA 12 Ca 0.25 -0.48 -0.08 0.00 0.00 0.00 0.00 54.91 54.60 3a2p h ALA 12 Cb 0.08 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3a2p h ALA 12 CO -0.04 0.63 -0.26 1.96 0.00 0.00 0.00 179.25 181.55 3a2p h GLN 13 N 0.65 0.32 -0.46 0.00 4.20 -0.71 -1.40 115.11 117.70 3a2p h GLN 13 Ca 0.03 -0.11 -0.14 0.00 0.06 0.00 0.00 58.65 58.49 3a2p h GLN 13 Cb 1.05 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.80 3a2p h GLN 13 CO 0.10 0.56 -0.25 0.00 -0.67 0.00 0.00 178.83 178.57 3a2p h ALA 14 N 1.45 0.67 -0.56 3.87 0.00 -0.83 -2.94 119.26 120.91 3a2p h ALA 14 Ca 0.04 -0.41 -0.07 0.00 0.00 0.00 0.00 54.91 54.48 3a2p h ALA 14 Cb 0.61 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 3a2p h ALA 14 CO 0.04 0.68 0.09 1.49 0.00 0.00 0.00 179.25 181.55 3a2p h GLU 15 N 0.84 0.93 -0.85 0.00 4.57 -0.97 0.03 114.58 119.14 3a2p h GLU 15 Ca 0.10 -0.25 0.08 0.00 -1.18 0.00 0.00 59.36 58.11 3a2p h GLU 15 Cb 0.83 -0.11 -0.06 0.00 -0.16 0.00 0.00 28.75 29.26 3a2p h GLU 15 CO 0.07 0.89 0.55 -0.07 -1.18 0.00 0.00 179.01 179.28 3a2p h LEU 16 N 0.83 0.80 -0.01 1.64 3.38 -1.18 1.03 115.31 121.80 3a2p h LEU 16 Ca 0.17 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.13 3a2p h LEU 16 Cb 0.41 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.00 3a2p h LEU 16 CO 0.01 0.50 -0.08 0.58 0.09 0.00 0.00 178.44 179.54 3a2p h VAL 17 N 0.90 1.56 -0.58 1.22 2.07 -1.30 -1.37 116.25 118.74 3a2p h VAL 17 Ca 0.37 -1.76 0.01 0.00 0.82 0.00 0.00 66.70 66.15 3a2p h VAL 17 Cb 0.29 2.71 -0.03 0.00 -1.52 0.00 0.00 31.29 32.74 3a2p h VAL 17 CO -0.14 0.47 0.38 -0.09 0.02 0.00 0.00 177.57 178.20 3a2p h ARG 18 N -0.63 0.73 0.00 1.57 2.43 -0.47 -0.93 114.38 117.08 3a2p h ARG 18 Ca -0.01 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 3a2p h ARG 18 Cb 0.81 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 30.19 3a2p h ARG 18 CO 0.02 0.49 -0.05 1.03 -1.51 0.00 0.00 179.97 179.95 3a2p h SER 19 N 0.76 0.00 0.00 -3.80 0.87 0.10 -3.46 113.55 108.02 3a2p h SER 19 Ca 0.22 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.78 3a2p h SER 19 Cb -0.05 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.91 3a2p h SER 19 CO -0.07 0.05 0.00 0.61 -0.53 0.00 0.00 176.83 176.89 3a2p n GLY 20 N -0.78 1.19 0.35 5.77 0.00 -0.36 -4.88 105.19 106.49 3a2p n GLY 20 Ca -0.02 0.00 0.18 0.00 0.00 0.00 0.00 46.02 46.18 3a2p n GLY 20 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3a2p h GLU 21 N 3.36 0.00 -3.86 1.61 4.81 -1.51 -3.42 114.58 115.58 3a2p h GLU 21 Ca 0.00 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.12 3a2p h GLU 21 Cb 0.00 0.00 -0.16 0.00 0.63 0.00 0.00 28.75 29.22 3a2p h GLU 21 CO 0.00 0.00 -0.48 0.96 -0.73 0.00 0.00 179.01 178.76 3a2p s ILE 22 N -4.92 0.15 0.45 2.32 -4.36 -0.87 -5.03 121.20 108.93 3a2p s ILE 22 Ca -0.05 -1.24 -0.03 0.00 -0.26 0.00 0.00 60.65 59.07 3a2p s ILE 22 Cb 0.18 -1.19 -0.02 0.00 1.25 0.00 0.00 42.46 42.68 3a2p s ILE 22 CO 0.67 -0.69 0.71 -0.55 0.24 0.00 0.00 174.94 175.33 3a2p s SER 23 N -2.56 6.13 0.18 4.36 0.15 -1.26 -4.24 113.70 116.46 3a2p s SER 23 Ca 0.01 0.65 -0.10 0.00 0.70 0.00 0.00 55.95 57.22 3a2p s SER 23 Cb 0.03 -2.00 0.08 0.00 -1.71 0.00 0.00 66.02 62.41 3a2p s SER 23 CO -0.08 -0.57 1.66 0.03 1.20 0.00 0.00 173.24 175.49 3a2p h ARG 24 N 0.37 1.06 -0.06 5.44 3.08 -1.95 -1.52 114.38 120.80 3a2p h ARG 24 Ca -0.47 -0.30 -0.12 0.00 0.07 0.00 0.00 59.98 59.15 3a2p h ARG 24 Cb 1.22 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 31.14 3a2p h ARG 24 CO 0.61 1.00 -0.51 0.00 -1.07 0.00 0.00 179.97 180.00 3a2p h THR 25 N 0.97 1.36 0.34 2.04 1.03 -1.94 -1.52 112.91 115.19 3a2p h THR 25 Ca 0.19 -1.76 -0.02 0.00 -0.01 0.00 0.00 66.41 64.81 3a2p h THR 25 Cb 0.48 1.88 0.00 0.00 -1.07 0.00 0.00 68.15 69.44 3a2p h THR 25 CO 0.02 0.51 -0.17 -0.33 -0.01 0.00 0.00 175.52 175.55 3a2p h GLU 26 N 0.12 -0.45 -0.24 0.00 5.08 -1.84 0.55 114.58 117.80 3a2p h GLU 26 Ca 0.00 0.03 0.04 0.00 -1.00 0.00 0.00 59.36 58.43 3a2p h GLU 26 Cb 0.94 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 30.26 3a2p h GLU 26 CO 0.07 -0.16 0.03 1.25 -1.00 0.00 0.00 179.01 179.20 3a2p h LEU 27 N -0.71 -0.03 0.50 1.33 5.85 -1.26 0.20 115.31 121.18 3a2p h LEU 27 Ca -0.05 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.69 3a2p h LEU 27 Cb 0.49 0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.59 3a2p h LEU 27 CO 0.08 0.02 -0.24 0.25 -0.34 0.00 0.00 178.44 178.20 3a2p h LEU 28 N 0.11 -0.57 -1.20 2.25 6.46 -1.27 -0.19 115.31 120.91 3a2p h LEU 28 Ca 0.11 0.01 0.02 0.00 -0.12 0.00 0.00 57.88 57.90 3a2p h LEU 28 Cb 0.12 0.15 -0.04 0.00 -0.73 0.00 0.00 40.66 40.16 3a2p h LEU 28 CO -0.16 -0.39 0.55 -0.33 -0.62 0.00 0.00 178.44 177.48 3a2p h GLU 29 N -0.70 1.03 -0.50 1.25 4.39 -0.75 0.24 114.58 119.56 3a2p h GLU 29 Ca -0.07 -0.06 -0.06 0.00 0.34 0.00 0.00 59.36 59.51 3a2p h GLU 29 Cb 0.53 -0.23 -0.02 0.00 -0.10 0.00 0.00 28.75 28.92 3a2p h GLU 29 CO 0.11 0.68 0.05 0.00 -1.16 0.00 0.00 179.01 178.70 3a2p h ALA 30 N 1.50 1.17 -0.16 3.43 0.00 -0.40 -0.64 119.26 124.16 3a2p h ALA 30 Ca 0.32 -0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.88 3a2p h ALA 30 Cb -0.03 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.56 3a2p h ALA 30 CO -0.09 0.55 -0.36 1.15 0.00 0.00 0.00 179.25 180.51 3a2p h THR 31 N 0.75 1.35 -0.48 0.00 2.02 0.30 -2.33 112.91 114.52 3a2p h THR 31 Ca 0.16 -1.62 0.00 0.00 0.77 0.00 0.00 66.41 65.72 3a2p h THR 31 Cb 0.38 1.99 -0.02 0.00 -1.74 0.00 0.00 68.15 68.75 3a2p h THR 31 CO 0.01 0.49 0.32 0.40 0.37 0.00 0.00 175.52 177.11 3a2p h ILE 32 N 0.15 1.12 -0.33 3.11 2.04 -0.36 -0.80 117.51 122.44 3a2p h ILE 32 Ca -0.00 -0.22 0.02 0.00 1.00 0.00 0.00 64.86 65.66 3a2p h ILE 32 Cb 0.96 0.42 -0.03 0.00 -0.74 0.00 0.00 36.82 37.44 3a2p h ILE 32 CO 0.08 0.12 0.18 0.00 0.00 0.00 0.00 178.15 178.52 3a2p h ALA 33 N 1.17 0.41 -0.75 1.87 0.00 -1.13 -0.72 119.26 120.11 3a2p h ALA 33 Ca 0.17 0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.13 3a2p h ALA 33 Cb -0.07 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.60 3a2p h ALA 33 CO -0.04 -0.19 0.47 1.25 0.00 0.00 0.00 179.25 180.74 3a2p h HIS 34 N 0.36 0.88 -0.21 0.00 -0.00 -1.04 -2.04 115.15 113.10 3a2p h HIS 34 Ca 0.14 0.02 -0.00 0.00 -0.00 0.00 0.00 60.37 60.53 3a2p h HIS 34 Cb 0.03 -0.29 -0.01 0.00 -0.00 0.00 0.00 27.41 27.15 3a2p h HIS 34 CO -0.09 0.49 0.12 0.28 -0.00 0.00 0.00 177.93 178.73 3a2p h VAL 35 N 0.91 1.11 -0.05 5.26 2.07 -0.54 -0.14 116.25 124.87 3a2p h VAL 35 Ca 0.31 -0.29 -0.01 0.00 0.82 0.00 0.00 66.70 67.54 3a2p h VAL 35 Cb 0.04 0.91 -0.00 0.00 -1.52 0.00 0.00 31.29 30.72 3a2p h VAL 35 CO -0.12 0.10 -0.00 1.56 0.02 0.00 0.00 177.57 179.13 3a2p h GLN 36 N 0.24 0.07 0.18 1.57 4.20 -0.75 0.64 115.11 121.26 3a2p h GLN 36 Ca 0.08 -0.01 -0.34 0.00 0.06 0.00 0.00 58.65 58.44 3a2p h GLN 36 Cb 0.06 -0.01 0.01 0.00 0.30 0.00 0.00 27.48 27.84 3a2p h GLN 36 CO -0.01 0.08 -1.68 0.00 -0.67 0.00 0.00 178.83 176.55 3a2p h ALA 37 N 1.93 0.14 0.09 3.87 0.00 -1.04 -3.41 119.26 120.84 3a2p h ALA 37 Ca 0.02 -1.11 -0.36 0.00 0.00 0.00 0.00 54.91 53.46 3a2p h ALA 37 Cb 0.05 0.44 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 3a2p h ALA 37 CO 0.00 0.97 -1.99 0.28 0.00 0.00 0.00 179.25 178.51 3a2p n VAL 38 N -3.66 1.71 -0.22 0.00 0.31 -0.09 -4.47 118.33 111.91 3a2p n VAL 38 Ca -0.24 -0.57 0.16 0.00 -0.01 0.00 0.00 64.34 63.68 3a2p n VAL 38 Cb 1.05 -1.73 0.47 0.00 -0.91 0.00 0.00 33.84 32.72 3a2p n VAL 38 CO 0.00 0.00 0.00 -1.13 -1.32 0.00 0.00 176.83 174.38 3a2p h ASN 39 N -0.08 0.46 -0.65 4.52 -1.24 -1.06 -1.82 115.58 115.72 3a2p h ASN 39 Ca -0.44 0.03 0.13 0.00 0.71 0.00 0.00 56.30 56.73 3a2p h ASN 39 Cb 1.93 -0.05 -0.04 0.00 0.73 0.00 0.00 38.32 40.88 3a2p h ASN 39 CO 0.02 0.22 0.44 -0.65 -1.29 0.00 0.00 177.43 176.17 3a2p h PRO 40 N 0.48 0.32 0.00 6.67 0.11 -1.78 0.34 132.00 138.14 3a2p h PRO 40 Ca 0.43 -0.02 -0.14 0.00 0.11 0.00 0.00 66.00 66.38 3a2p h PRO 40 Cb 0.94 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 31.96 3a2p h PRO 40 CO -0.16 0.21 -0.67 0.93 -0.21 0.00 0.00 178.00 178.10 3a2p h GLU 41 N 0.33 0.00 0.00 1.05 5.08 -1.61 -3.36 114.58 116.08 3a2p h GLU 41 Ca 0.31 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.67 3a2p h GLU 41 Cb 0.76 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.01 3a2p h GLU 41 CO -0.08 0.67 -0.89 0.44 -1.00 0.00 0.00 179.01 178.16 3a2p n ILE 42 N -3.52 0.00 -3.84 3.13 -5.35 -0.69 -4.73 119.36 104.36 3a2p n ILE 42 Ca -0.00 -0.25 -0.24 0.00 -0.27 0.00 0.00 62.75 61.99 3a2p n ILE 42 Cb 0.71 0.66 0.00 0.00 -1.74 0.00 0.00 39.64 39.27 3a2p n ILE 42 CO 0.00 0.00 0.00 -3.20 -1.76 0.00 0.00 176.55 171.59 3a2p n ASN 43 N -1.49 -0.90 -0.10 7.28 5.15 0.11 -0.68 115.26 124.63 3a2p n ASN 43 Ca 0.00 -0.93 -0.19 0.00 -0.60 0.00 0.00 54.58 52.86 3a2p n ASN 43 Cb 0.18 -3.47 -0.10 0.00 -0.53 0.00 0.00 39.78 35.86 3a2p n ASN 43 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3a2p h ALA 44 N 0.84 0.21 -2.15 5.20 0.00 -1.88 -3.39 119.26 118.09 3a2p h ALA 44 Ca -0.63 -1.05 -0.62 0.00 0.00 0.00 0.00 54.91 52.62 3a2p h ALA 44 Cb 1.37 0.65 -0.12 0.00 0.00 0.00 0.00 17.79 19.68 3a2p h ALA 44 CO 0.59 0.61 0.34 0.08 0.00 0.00 0.00 179.25 180.88 3a2p s VAL 45 N -2.32 4.72 -0.13 0.00 1.01 -1.26 -0.80 120.40 121.62 3a2p s VAL 45 Ca -0.26 0.69 0.19 0.00 0.00 0.00 0.00 61.98 62.60 3a2p s VAL 45 Cb 0.05 -4.24 -0.20 0.00 0.00 0.00 0.00 36.38 32.00 3a2p s VAL 45 CO 0.54 -0.52 0.61 2.30 0.00 0.00 0.00 175.10 178.03 3a2p n ILE 46 N 5.90 0.80 -3.78 2.22 -5.35 -0.34 -4.77 119.36 114.04 3a2p n ILE 46 Ca 0.02 -0.65 -0.30 0.00 -0.27 0.00 0.00 62.75 61.56 3a2p n ILE 46 Cb 0.48 -0.41 -0.14 0.00 -1.74 0.00 0.00 39.64 37.83 3a2p n ILE 46 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 3a2p s ILE 47 N -3.08 1.33 0.40 7.28 1.01 -1.04 -5.00 121.20 122.10 3a2p s ILE 47 Ca -0.05 -1.99 -0.25 0.00 0.00 0.00 0.00 60.65 58.35 3a2p s ILE 47 Cb 0.10 -1.97 -0.08 0.00 0.01 0.00 0.00 42.46 40.51 3a2p s ILE 47 CO 0.84 -0.74 1.18 -2.84 0.00 0.00 0.00 174.94 173.38 3a2p s PRO 48 N 1.03 4.05 -0.32 2.79 0.02 -1.26 -0.71 135.00 140.59 3a2p s PRO 48 Ca 0.13 1.87 0.17 0.00 0.02 0.00 0.00 61.00 63.18 3a2p s PRO 48 Cb -0.20 -2.69 0.47 0.00 0.02 0.00 0.00 34.50 32.10 3a2p s PRO 48 CO -0.13 -0.33 1.02 1.28 -0.33 0.00 0.00 177.00 178.51 3a2p n LEU 49 N 0.08 2.11 -0.34 -5.54 4.77 -0.19 -4.91 117.00 112.99 3a2p n LEU 49 Ca 0.04 -3.83 -0.01 0.00 -0.03 0.00 0.00 56.01 52.19 3a2p n LEU 49 Cb 0.46 0.27 0.15 0.00 -2.33 0.00 0.00 43.42 41.98 3a2p n LEU 49 CO 0.51 1.57 1.28 -0.26 -1.33 0.00 0.00 177.39 179.16 3a2p h PHE 50 N 2.81 1.18 -0.47 -1.77 0.04 -1.86 -0.84 116.94 116.03 3a2p h PHE 50 Ca -0.03 0.03 -0.03 0.00 2.80 0.00 0.00 57.97 60.74 3a2p h PHE 50 Cb 1.18 -0.40 -0.02 0.00 2.20 0.00 0.00 35.95 38.91 3a2p h PHE 50 CO 0.56 0.73 0.18 0.93 -0.60 0.00 0.00 178.31 180.11 3a2p h GLU 51 N 1.26 0.71 -0.42 1.51 4.39 -1.94 0.99 114.58 121.08 3a2p h GLU 51 Ca 0.35 -0.14 -0.04 0.00 0.34 0.00 0.00 59.36 59.88 3a2p h GLU 51 Cb -0.11 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 28.42 3a2p h GLU 51 CO -0.09 0.65 0.09 -0.22 -1.16 0.00 0.00 179.01 178.29 3a2p h LYS 52 N 0.62 0.67 -0.77 2.33 3.64 -1.81 -1.19 116.57 120.06 3a2p h LYS 52 Ca 0.16 -0.17 0.07 0.00 -1.27 0.00 0.00 60.65 59.44 3a2p h LYS 52 Cb 0.22 -0.09 -0.06 0.00 -0.41 0.00 0.00 32.23 31.89 3a2p h LYS 52 CO -0.01 0.69 0.44 0.00 -2.27 0.00 0.00 179.45 178.30 3a2p h ALA 53 N 0.95 1.06 -0.52 5.00 0.00 -0.83 0.15 119.26 125.07 3a2p h ALA 53 Ca 0.13 0.02 -0.10 0.00 0.00 0.00 0.00 54.91 54.96 3a2p h ALA 53 Cb 0.33 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 3a2p h ALA 53 CO 0.00 0.11 -0.09 0.00 0.00 0.00 0.00 179.25 179.27 3a2p h ARG 54 N 0.78 0.95 0.02 0.00 3.08 -0.48 -0.53 114.38 118.19 3a2p h ARG 54 Ca 0.35 -0.33 -0.00 0.00 0.07 0.00 0.00 59.98 60.08 3a2p h ARG 54 Cb 0.26 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.24 3a2p h ARG 54 CO -0.21 0.99 -0.01 0.00 -1.07 0.00 0.00 179.97 179.67 3a2p h ARG 55 N 0.85 -0.03 -0.62 0.04 3.08 -0.28 -3.10 114.38 114.33 3a2p h ARG 55 Ca 0.14 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.18 3a2p h ARG 55 Cb 0.62 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.65 3a2p h ARG 55 CO 0.04 0.34 0.32 0.93 -1.07 0.00 0.00 179.97 180.53 3a2p h GLU 56 N -0.40 0.86 -0.97 0.04 5.08 -0.72 -2.58 114.58 115.90 3a2p h GLU 56 Ca -0.00 -0.10 0.10 0.00 -1.00 0.00 0.00 59.36 58.36 3a2p h GLU 56 Cb 0.38 -0.17 -0.07 0.00 0.50 0.00 0.00 28.75 29.39 3a2p h GLU 56 CO 0.00 0.65 0.62 1.03 -1.00 0.00 0.00 179.01 180.31 3a2p h SER 57 N 0.86 0.90 -0.17 1.42 0.87 -1.03 1.32 113.55 117.73 3a2p h SER 57 Ca 0.22 0.03 -0.12 0.00 -1.23 0.00 0.00 61.79 60.69 3a2p h SER 57 Cb 0.05 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 61.85 3a2p h SER 57 CO -0.03 0.51 -0.31 -0.33 -0.53 0.00 0.00 176.83 176.14 3a2p h GLU 58 N 0.98 0.66 0.00 2.24 5.08 -1.39 -3.23 114.58 118.93 3a2p h GLU 58 Ca 0.46 -0.30 -0.10 0.00 -1.00 0.00 0.00 59.36 58.42 3a2p h GLU 58 Cb 0.41 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.63 3a2p h GLU 58 CO -0.22 0.89 -1.39 1.28 -1.00 0.00 0.00 179.01 178.58 3a2p n LEU 59 N -4.08 0.72 -4.45 1.33 4.77 -0.66 -4.99 117.00 109.65 3a2p n LEU 59 Ca -0.01 0.30 -0.46 0.00 -0.03 0.00 0.00 56.01 55.81 3a2p n LEU 59 Cb 0.47 0.04 -0.02 0.00 -2.33 0.00 0.00 43.42 41.58 3a2p n LEU 59 CO 0.45 0.03 0.13 0.00 -1.33 0.00 0.00 177.39 176.67 3a2p n ALA 60 N -2.32 -2.03 -3.47 -1.18 0.00 0.44 -5.01 120.51 106.94 3a2p n ALA 60 Ca -0.07 0.38 -0.14 0.00 0.00 0.00 0.00 53.44 53.61 3a2p n ALA 60 Cb 0.73 -1.73 -0.08 0.00 0.00 0.00 0.00 19.45 18.36 3a2p n ALA 60 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3a2p s SER 61 N -0.87 -0.59 0.00 0.00 1.04 -1.26 -4.78 113.70 107.23 3a2p s SER 61 Ca 0.62 1.11 0.00 0.00 0.48 0.00 0.00 55.95 58.16 3a2p s SER 61 Cb -0.82 1.12 0.00 0.00 0.10 0.00 0.00 66.02 66.43 3a2p s SER 61 CO 0.58 -0.22 0.00 0.61 0.98 0.00 0.00 173.24 175.18 3a2p n GLY 62 N 2.65 0.98 0.21 7.32 0.00 -1.26 -2.73 105.19 112.36 3a2p n GLY 62 Ca -0.14 -1.97 0.15 0.00 0.00 0.00 0.00 46.02 44.06 3a2p n GLY 62 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3a2p h PRO 63 N 7.00 0.00 0.00 1.61 0.13 -1.89 -2.40 132.00 136.44 3a2p h PRO 63 Ca 0.00 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 65.05 3a2p h PRO 63 Cb 0.00 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 30.95 3a2p h PRO 63 CO 0.00 0.00 -0.71 1.19 -0.23 0.00 0.00 178.00 178.25 3a2p n PHE 64 N -2.50 0.00 -1.67 1.56 3.72 -0.88 -4.84 117.46 112.85 3a2p n PHE 64 Ca -0.02 -0.84 -0.48 0.00 -0.05 0.00 0.00 57.45 56.06 3a2p n PHE 64 Cb 0.05 -0.17 -0.05 0.00 -0.94 0.00 0.00 39.48 38.37 3a2p n PHE 64 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 3a2p n ALA 65 N -0.28 0.79 0.00 4.37 0.00 -0.91 -1.61 120.51 122.87 3a2p n ALA 65 Ca 0.11 0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.94 3a2p n ALA 65 Cb 0.90 -2.36 0.00 0.00 0.00 0.00 0.00 19.45 17.99 3a2p n ALA 65 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a2p n GLY 66 N 3.71 2.61 3.68 0.00 0.00 0.17 -4.86 105.19 110.51 3a2p n GLY 66 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 3a2p n GLY 66 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3a2p s VAL 67 N -2.30 4.50 0.56 1.61 1.01 -0.63 -4.69 120.40 120.46 3a2p s VAL 67 Ca 0.00 1.80 -0.17 0.00 0.00 0.00 0.00 61.98 63.62 3a2p s VAL 67 Cb 0.00 -4.16 -0.05 0.00 0.00 0.00 0.00 36.38 32.17 3a2p s VAL 67 CO 0.00 -0.01 1.04 -2.84 0.00 0.00 0.00 175.10 173.29 3a2p s PRO 68 N 2.22 3.53 0.07 2.72 0.02 -1.26 -0.90 135.00 141.40 3a2p s PRO 68 Ca 0.52 1.18 -0.13 0.00 0.02 0.00 0.00 61.00 62.58 3a2p s PRO 68 Cb -0.21 -2.06 0.02 0.00 0.02 0.00 0.00 34.50 32.26 3a2p s PRO 68 CO 0.19 -0.64 0.30 1.52 -0.33 0.00 0.00 177.00 178.05 3a2p s TYR 69 N -2.42 -0.08 0.04 6.54 -0.85 -0.68 -4.22 117.35 115.70 3a2p s TYR 69 Ca 0.63 -0.17 0.07 0.00 -0.52 0.00 0.00 57.07 57.08 3a2p s TYR 69 Cb -0.15 0.10 -0.03 0.00 0.38 0.00 0.00 41.96 42.26 3a2p s TYR 69 CO 0.33 -0.56 -0.15 -0.51 -1.52 0.00 0.00 175.55 173.13 3a2p s LEU 70 N -2.42 2.74 -0.09 -3.49 1.43 -1.14 -1.74 118.68 113.97 3a2p s LEU 70 Ca -0.01 -0.38 0.03 0.00 -1.03 0.00 0.00 54.13 52.74 3a2p s LEU 70 Cb 0.01 -1.59 -0.01 0.00 0.03 0.00 0.00 46.19 44.62 3a2p s LEU 70 CO -0.07 0.25 -0.18 -0.22 0.23 0.00 0.00 176.35 176.36 3a2p s LEU 71 N -1.53 2.47 0.37 1.79 2.96 -0.56 -0.87 118.68 123.31 3a2p s LEU 71 Ca 0.16 -0.37 -0.26 0.00 -0.22 0.00 0.00 54.13 53.43 3a2p s LEU 71 Cb -0.11 -1.51 -0.09 0.00 0.50 0.00 0.00 46.19 44.99 3a2p s LEU 71 CO 0.07 0.23 1.18 -0.75 -1.32 0.00 0.00 176.35 175.76 3a2p s LYS 72 N -0.05 4.18 -1.41 1.98 2.20 -1.25 -0.53 119.74 124.87 3a2p s LYS 72 Ca -0.05 1.90 -0.07 0.00 -0.36 0.00 0.00 55.97 57.39 3a2p s LYS 72 Cb -0.14 -2.81 0.02 0.00 -1.51 0.00 0.00 37.83 33.39 3a2p s LYS 72 CO 0.04 -0.23 2.67 -3.47 -0.36 0.00 0.00 175.35 174.00 3a2p n ASP 73 N 0.34 8.28 -3.63 1.43 2.03 -1.05 -4.73 116.55 119.21 3a2p n ASP 73 Ca 0.03 -2.89 -0.12 0.00 0.52 0.00 0.00 54.79 52.33 3a2p n ASP 73 Cb 0.45 -1.44 -0.07 0.00 -0.72 0.00 0.00 41.12 39.34 3a2p n ASP 73 CO 0.00 0.00 0.00 -0.22 -1.92 0.00 0.00 177.20 175.06 3a2p s LEU 74 N -1.11 -0.73 0.00 -2.67 2.96 -1.26 -3.00 118.68 112.86 3a2p s LEU 74 Ca 0.61 1.37 0.00 0.00 -0.22 0.00 0.00 54.13 55.89 3a2p s LEU 74 Cb 0.19 2.36 0.00 0.00 0.50 0.00 0.00 46.19 49.24 3a2p s LEU 74 CO -0.08 -0.23 0.00 0.41 -1.32 0.00 0.00 176.35 175.13 3a2p n THR 75 N 2.90 0.00 -2.88 3.68 -1.04 -1.26 -4.82 114.28 110.86 3a2p n THR 75 Ca -0.15 0.00 -0.34 0.00 -2.04 0.00 0.00 64.05 61.52 3a2p n THR 75 Cb 0.56 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 69.00 3a2p n THR 75 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 3a2p s VAL 76 N 0.00 4.40 0.13 12.58 -7.23 -1.26 -4.99 120.40 124.03 3a2p s VAL 76 Ca 0.00 1.48 0.02 0.00 -1.81 0.00 0.00 61.98 61.67 3a2p s VAL 76 Cb 0.00 -3.73 -0.04 0.00 0.56 0.00 0.00 36.38 33.16 3a2p s VAL 76 CO 0.00 -0.13 -0.05 0.68 -0.31 0.00 0.00 175.10 175.29 3a2p s VAL 77 N -1.94 0.77 -0.06 1.32 -7.23 -1.26 -4.84 120.40 107.16 3a2p s VAL 77 Ca 0.56 -1.97 0.06 0.00 -1.81 0.00 0.00 61.98 58.82 3a2p s VAL 77 Cb -0.12 -1.83 -0.01 0.00 0.56 0.00 0.00 36.38 34.97 3a2p s VAL 77 CO 0.17 -0.75 -0.23 -0.94 -0.31 0.00 0.00 175.10 173.05 3a2p s SER 78 N -3.10 3.27 -0.02 4.85 1.04 -1.25 -1.58 113.70 116.91 3a2p s SER 78 Ca 0.16 -0.45 -0.36 0.00 0.48 0.00 0.00 55.95 55.79 3a2p s SER 78 Cb 0.05 -0.81 -0.14 0.00 0.10 0.00 0.00 66.02 65.22 3a2p s SER 78 CO -0.02 0.27 1.69 1.67 0.98 0.00 0.00 173.24 177.83 3a2p n GLN 79 N 2.81 1.83 -0.95 4.02 7.27 -0.42 -2.24 117.38 129.71 3a2p n GLN 79 Ca -0.17 0.67 0.00 0.00 0.07 0.00 0.00 57.00 57.57 3a2p n GLN 79 Cb 0.52 -2.43 0.00 0.00 2.41 0.00 0.00 30.24 30.74 3a2p n GLN 79 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3a2p n GLY 80 N 3.80 0.46 3.80 1.69 0.00 0.78 -4.92 105.19 110.79 3a2p n GLY 80 Ca 0.21 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.98 3a2p n GLY 80 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3a2p s ASP 81 N -2.23 5.49 0.31 1.61 1.01 -0.95 -4.80 116.67 117.12 3a2p s ASP 81 Ca 0.00 -0.18 -0.29 0.00 0.71 0.00 0.00 52.55 52.79 3a2p s ASP 81 Cb 0.00 -1.41 -0.12 0.00 1.01 0.00 0.00 42.92 42.39 3a2p s ASP 81 CO 0.00 0.04 1.39 -0.38 0.21 0.00 0.00 175.17 176.42 3a2p n ILE 82 N -0.58 1.54 -3.66 0.77 2.08 -1.26 -1.21 119.36 117.04 3a2p n ILE 82 Ca -0.08 -0.39 -0.28 0.00 0.56 0.00 0.00 62.75 62.56 3a2p n ILE 82 Cb 0.56 -1.63 -0.16 0.00 -0.75 0.00 0.00 39.64 37.65 3a2p n ILE 82 CO 0.00 0.00 0.00 0.21 0.56 0.00 0.00 176.55 177.32 3a2p s ASN 83 N 0.00 3.02 -0.11 4.38 3.04 -0.92 -4.81 114.94 119.54 3a2p s ASN 83 Ca 0.60 -0.96 0.09 0.00 0.04 0.00 0.00 52.86 52.63 3a2p s ASN 83 Cb -0.57 -0.49 -0.13 0.00 -1.54 0.00 0.00 41.25 38.52 3a2p s ASN 83 CO 0.57 -0.36 0.02 0.35 -3.04 0.00 0.00 177.10 174.64 3a2p n THR 84 N 5.12 0.74 -1.90 -5.21 -2.24 -1.26 -4.71 114.28 104.82 3a2p n THR 84 Ca -0.07 -0.44 -0.20 0.00 -2.27 0.00 0.00 64.05 61.07 3a2p n THR 84 Cb 0.46 -0.74 -0.05 0.00 -2.10 0.00 0.00 70.33 67.90 3a2p n THR 84 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3a2p n SER 85 N -2.44 -5.33 -2.83 3.42 7.64 -1.16 -1.22 113.62 111.70 3a2p n SER 85 Ca -0.18 0.30 -0.20 0.00 1.01 0.00 0.00 58.87 59.80 3a2p n SER 85 Cb 0.84 -4.62 0.01 0.00 -1.01 0.00 0.00 64.21 59.43 3a2p n SER 85 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 3a2p n SER 86 N -1.52 -5.06 -4.63 6.43 7.64 -1.26 -1.00 113.62 114.22 3a2p n SER 86 Ca -0.21 -0.14 -0.37 0.00 1.01 0.00 0.00 58.87 59.16 3a2p n SER 86 Cb 0.66 -4.17 -0.10 0.00 -1.01 0.00 0.00 64.21 59.58 3a2p n SER 86 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3a2p s ILE 87 N -2.97 5.31 0.14 0.44 1.01 -0.36 -4.15 121.20 120.63 3a2p s ILE 87 Ca 0.19 0.25 -0.26 0.00 0.00 0.00 0.00 60.65 60.83 3a2p s ILE 87 Cb -0.09 -3.55 -0.01 0.00 0.01 0.00 0.00 42.46 38.82 3a2p s ILE 87 CO 0.23 0.28 1.60 0.50 0.00 0.00 0.00 174.94 177.55 3a2p h LYS 88 N 7.92 -0.37 -0.39 2.79 1.63 -1.79 -0.31 116.57 126.05 3a2p h LYS 88 Ca -0.36 0.03 0.11 0.00 -0.85 0.00 0.00 60.65 59.58 3a2p h LYS 88 Cb 1.18 0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 32.88 3a2p h LYS 88 CO 0.62 -0.25 0.30 0.78 -3.45 0.00 0.00 179.45 177.45 3a2p h GLY 89 N -0.39 0.00 1.59 5.01 0.00 -1.32 -1.42 103.07 106.54 3a2p h GLY 89 Ca 0.11 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.16 3a2p h GLY 89 CO -0.42 0.00 -1.28 -0.33 0.00 0.00 0.00 176.54 174.52 3a2p h MET 90 N 0.00 0.27 -0.66 4.80 2.86 -1.40 -3.00 114.93 117.80 3a2p h MET 90 Ca 0.19 -0.45 -0.08 0.00 -2.06 0.00 0.00 59.70 57.29 3a2p h MET 90 Cb 0.79 0.17 -0.03 0.00 0.06 0.00 0.00 31.60 32.59 3a2p h MET 90 CO -0.00 1.20 0.08 -0.22 1.06 0.00 0.00 176.91 179.04 3a2p h LYS 91 N 0.07 1.10 0.00 1.72 3.64 -0.08 -2.82 116.57 120.20 3a2p h LYS 91 Ca -0.15 -0.30 -0.10 0.00 -1.27 0.00 0.00 60.65 58.83 3a2p h LYS 91 Cb 1.98 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 33.66 3a2p h LYS 91 CO 0.20 1.02 -0.46 0.93 -2.27 0.00 0.00 179.45 178.87 3a2p h GLU 92 N 1.02 0.00 0.00 1.90 5.08 -1.45 -3.00 114.58 118.13 3a2p h GLU 92 Ca 0.20 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.55 3a2p h GLU 92 Cb 0.47 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.72 3a2p h GLU 92 CO 0.02 0.46 -0.03 0.66 -1.00 0.00 0.00 179.01 179.11 3a2p h SER 93 N 0.00 0.00 -0.40 1.42 4.64 -1.35 -3.47 113.55 114.40 3a2p h SER 93 Ca -0.00 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 61.15 3a2p h SER 93 Cb 0.86 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 62.88 3a2p h SER 93 CO 0.06 0.03 -0.15 0.61 -0.87 0.00 0.00 176.83 176.51 3a2p n GLY 94 N 0.31 0.99 3.59 -0.77 0.00 -1.13 -4.95 105.19 103.22 3a2p n GLY 94 Ca 0.01 -0.43 -0.41 0.00 0.00 0.00 0.00 46.02 45.19 3a2p n GLY 94 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 3a2p n TYR 95 N -2.65 0.95 -4.27 1.61 9.36 -1.25 -4.90 117.16 116.00 3a2p n TYR 95 Ca -0.08 0.57 -0.19 0.00 3.32 0.00 0.00 57.90 61.51 3a2p n TYR 95 Cb 0.33 -2.19 -0.16 0.00 -0.63 0.00 0.00 39.34 36.69 3a2p n TYR 95 CO 0.00 0.00 0.00 1.03 0.22 0.00 0.00 176.86 178.11 3a2p s ARG 96 N -1.97 0.83 0.67 2.98 0.52 -1.26 -2.17 118.95 118.54 3a2p s ARG 96 Ca 0.64 -0.21 -0.17 0.00 -0.52 0.00 0.00 55.73 55.46 3a2p s ARG 96 Cb -0.56 -0.80 0.00 0.00 0.52 0.00 0.00 34.95 34.11 3a2p s ARG 96 CO 0.57 0.04 1.26 0.00 0.02 0.00 0.00 175.30 177.19 3a2p s ALA 97 N 0.42 2.32 -2.58 2.13 0.00 -0.35 -4.81 121.76 118.88 3a2p s ALA 97 Ca -0.06 1.12 0.22 0.00 0.00 0.00 0.00 51.96 53.23 3a2p s ALA 97 Cb -0.10 -3.53 0.14 0.00 0.00 0.00 0.00 23.12 19.63 3a2p s ALA 97 CO 0.00 -1.64 1.16 -0.40 0.00 0.00 0.00 175.76 174.89 3a2p n ASP 98 N -2.09 2.65 -3.37 0.00 5.68 -1.26 -0.16 116.55 118.01 3a2p n ASP 98 Ca 0.15 -1.83 -0.11 0.00 -0.50 0.00 0.00 54.79 52.50 3a2p n ASP 98 Cb 0.49 0.10 -0.02 0.00 -1.14 0.00 0.00 41.12 40.54 3a2p n ASP 98 CO 0.00 0.00 0.00 -1.38 -1.33 0.00 0.00 177.20 174.49 3a2p s HIS 99 N -1.93 0.53 -0.15 2.11 -3.43 -1.26 -4.71 115.29 106.45 3a2p s HIS 99 Ca 0.24 -0.94 -0.07 0.00 -0.80 0.00 0.00 55.06 53.49 3a2p s HIS 99 Cb 0.18 0.31 -0.04 0.00 -1.43 0.00 0.00 32.58 31.60 3a2p s HIS 99 CO 0.33 -1.24 0.09 -0.51 -2.00 0.00 0.00 174.74 171.40 3a2p s ASP 100 N -3.11 5.89 0.69 7.38 1.01 -1.26 -1.30 116.67 125.96 3a2p s ASP 100 Ca 0.23 0.24 -0.12 0.00 0.71 0.00 0.00 52.55 53.61 3a2p s ASP 100 Cb -0.02 -1.93 0.01 0.00 1.01 0.00 0.00 42.92 41.98 3a2p s ASP 100 CO 0.14 0.28 1.07 0.00 0.21 0.00 0.00 175.17 176.87 3a2p s ALA 101 N -0.29 2.60 0.35 5.23 0.00 -0.62 -4.76 121.76 124.28 3a2p s ALA 101 Ca 0.09 0.21 0.08 0.00 0.00 0.00 0.00 51.96 52.35 3a2p s ALA 101 Cb -0.12 -3.22 0.80 0.00 0.00 0.00 0.00 23.12 20.59 3a2p s ALA 101 CO 0.01 -1.24 1.87 1.88 0.00 0.00 0.00 175.76 178.28 3a2p h TYR 102 N -0.51 0.83 -0.17 0.00 0.99 -1.25 -1.49 116.97 115.36 3a2p h TYR 102 Ca -0.45 0.02 0.03 0.00 2.00 0.00 0.00 58.73 60.34 3a2p h TYR 102 Cb 1.22 -0.26 -0.03 0.00 1.00 0.00 0.00 36.73 38.66 3a2p h TYR 102 CO 0.60 0.31 -0.01 0.35 -0.00 0.00 0.00 178.16 179.41 3a2p h PHE 103 N 0.71 -0.03 -0.48 4.88 3.57 -1.77 -0.90 116.94 122.90 3a2p h PHE 103 Ca 0.45 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.97 3a2p h PHE 103 Cb 0.70 0.04 -0.03 0.00 2.79 0.00 0.00 35.95 39.45 3a2p h PHE 103 CO -0.00 -0.04 0.32 0.28 -2.23 0.00 0.00 178.31 176.63 3a2p h VAL 104 N 0.04 1.11 -0.31 1.41 2.07 -1.62 -1.92 116.25 117.03 3a2p h VAL 104 Ca 0.08 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.38 3a2p h VAL 104 Cb 0.11 0.41 -0.02 0.00 -1.52 0.00 0.00 31.29 30.28 3a2p h VAL 104 CO -0.15 0.12 0.20 1.56 0.02 0.00 0.00 177.57 179.32 3a2p h GLN 105 N 0.64 0.41 -0.66 1.57 4.20 -1.04 -1.95 115.11 118.27 3a2p h GLN 105 Ca 0.18 -0.02 0.02 0.00 0.06 0.00 0.00 58.65 58.89 3a2p h GLN 105 Cb -0.06 -0.09 -0.04 0.00 0.30 0.00 0.00 27.48 27.59 3a2p h GLN 105 CO -0.05 0.27 0.42 0.00 -0.67 0.00 0.00 178.83 178.81 3a2p h ARG 106 N 0.42 0.81 -0.57 1.46 2.47 -0.91 -1.01 114.38 117.05 3a2p h ARG 106 Ca 0.11 -0.05 -0.04 0.00 -1.26 0.00 0.00 59.98 58.74 3a2p h ARG 106 Cb -0.05 -0.18 -0.02 0.00 -1.65 0.00 0.00 29.97 28.07 3a2p h ARG 106 CO -0.02 0.53 0.18 0.52 0.56 0.00 0.00 179.97 181.74 3a2p h MET 107 N 0.83 0.88 -0.68 0.04 2.86 -1.13 -2.11 114.93 115.62 3a2p h MET 107 Ca 0.26 -0.19 -0.06 0.00 -2.06 0.00 0.00 59.70 57.66 3a2p h MET 107 Cb -0.01 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 31.49 3a2p h MET 107 CO -0.09 0.79 0.19 -0.09 1.06 0.00 0.00 176.91 178.77 3a2p h ARG 108 N 0.79 1.06 0.00 1.72 2.43 -1.03 -2.02 114.38 117.33 3a2p h ARG 108 Ca 0.18 -0.24 -0.04 0.00 -0.81 0.00 0.00 59.98 59.08 3a2p h ARG 108 Cb 0.27 -0.15 -0.01 0.00 -0.42 0.00 0.00 29.97 29.67 3a2p h ARG 108 CO -0.01 0.93 -0.17 0.00 -1.51 0.00 0.00 179.97 179.21 3a2p h ALA 109 N 1.08 1.37 0.00 2.80 0.00 -1.02 -2.04 119.26 121.45 3a2p h ALA 109 Ca 0.22 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3a2p h ALA 109 Cb 0.32 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3a2p h ALA 109 CO -0.00 0.22 -0.03 0.00 0.00 0.00 0.00 179.25 179.43 3a2p n ALA 110 N -2.35 2.36 0.00 0.00 0.00 -0.81 -4.62 120.51 115.10 3a2p n ALA 110 Ca -0.02 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.34 3a2p n ALA 110 Cb 0.27 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.27 3a2p n ALA 110 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a2p n GLY 111 N 1.43 1.33 3.76 0.00 0.00 -0.76 -2.07 105.19 108.87 3a2p n GLY 111 Ca 0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.73 3a2p n GLY 111 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3a2p s PHE 112 N -2.10 2.45 -0.13 1.61 0.08 -0.86 -0.65 117.98 118.37 3a2p s PHE 112 Ca 0.00 1.52 0.01 0.00 0.12 0.00 0.00 56.93 58.58 3a2p s PHE 112 Cb 0.00 -3.44 -0.00 0.00 -0.57 0.00 0.00 43.02 39.01 3a2p s PHE 112 CO 0.00 -2.08 -0.17 0.14 -0.10 0.00 0.00 175.22 173.01 3a2p s VAL 113 N -1.65 2.60 -0.37 -0.44 -7.23 -0.08 -4.32 120.40 108.91 3a2p s VAL 113 Ca 0.76 -0.81 -0.29 0.00 -1.81 0.00 0.00 61.98 59.83 3a2p s VAL 113 Cb -0.29 -2.07 -0.00 0.00 0.56 0.00 0.00 36.38 34.58 3a2p s VAL 113 CO 0.32 0.53 1.57 -0.22 -0.31 0.00 0.00 175.10 176.99 3a2p s LEU 114 N 0.55 3.56 0.07 1.32 2.96 -1.26 -1.69 118.68 124.19 3a2p s LEU 114 Ca -0.11 1.05 0.15 0.00 -0.22 0.00 0.00 54.13 55.00 3a2p s LEU 114 Cb -0.16 -3.53 -0.13 0.00 0.50 0.00 0.00 46.19 42.86 3a2p s LEU 114 CO 0.04 -1.53 0.91 0.25 -1.32 0.00 0.00 176.35 174.70 3a2p h LEU 115 N 12.75 0.00 0.00 -0.68 5.85 -1.60 -3.18 115.31 128.45 3a2p h LEU 115 Ca -0.30 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.42 3a2p h LEU 115 Cb 1.13 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.16 3a2p h LEU 115 CO 1.06 0.69 0.00 0.61 -0.34 0.00 0.00 178.44 180.46 3a2p n GLY 116 N 1.40 -1.91 3.48 3.75 0.00 -1.26 -1.02 105.19 109.63 3a2p n GLY 116 Ca -0.09 -1.19 -0.31 0.00 0.00 0.00 0.00 46.02 44.43 3a2p n GLY 116 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3a2p s LYS 117 N -1.75 2.18 0.16 1.61 1.02 0.11 -1.50 119.74 121.56 3a2p s LYS 117 Ca 0.00 -0.92 0.03 0.00 0.02 0.00 0.00 55.97 55.10 3a2p s LYS 117 Cb 0.00 -2.25 -0.04 0.00 -0.52 0.00 0.00 37.83 35.02 3a2p s LYS 117 CO 0.00 0.56 0.24 0.95 -0.92 0.00 0.00 175.35 176.18 3a2p s THR 118 N -0.92 5.06 0.66 2.17 -4.23 0.31 -1.20 115.64 117.50 3a2p s THR 118 Ca 0.15 -0.82 -0.15 0.00 -1.18 0.00 0.00 61.69 59.69 3a2p s THR 118 Cb -0.11 -3.61 0.00 0.00 1.34 0.00 0.00 72.50 70.13 3a2p s THR 118 CO 0.05 -0.10 1.13 0.21 -0.54 0.00 0.00 174.62 175.37 3a2p s ASN 119 N -3.21 4.97 0.05 3.99 2.47 0.02 -2.54 114.94 120.69 3a2p s ASN 119 Ca 0.33 2.09 -0.24 0.00 0.42 0.00 0.00 52.86 55.46 3a2p s ASN 119 Cb -0.11 -2.56 0.06 0.00 -1.45 0.00 0.00 41.25 37.19 3a2p s ASN 119 CO 0.27 -1.73 0.57 0.28 -3.72 0.00 0.00 177.10 172.77 3a2p s THR 120 N -2.21 0.02 0.96 -5.21 -1.32 -1.26 -1.90 115.64 104.72 3a2p s THR 120 Ca 0.69 -0.14 -0.12 0.00 -1.21 0.00 0.00 61.69 60.91 3a2p s THR 120 Cb -0.23 -0.99 0.17 0.00 -1.51 0.00 0.00 72.50 69.94 3a2p s THR 120 CO 0.41 -0.08 1.09 -2.16 -2.21 0.00 0.00 174.62 171.67 3a2p s PRO 121 N -2.49 0.71 -0.02 7.08 0.04 -1.26 -4.51 135.00 134.56 3a2p s PRO 121 Ca -0.05 0.73 -0.34 0.00 0.04 0.00 0.00 61.00 61.38 3a2p s PRO 121 Cb -0.01 -1.75 -0.12 0.00 0.04 0.00 0.00 34.50 32.66 3a2p s PRO 121 CO -0.02 -2.59 1.80 -1.91 0.04 0.00 0.00 177.00 174.31 3a2p n GLU 122 N -4.11 2.15 -2.29 4.56 2.13 -1.26 -1.26 120.64 120.56 3a2p n GLU 122 Ca 0.06 0.78 -0.12 0.00 0.66 0.00 0.00 57.16 58.54 3a2p n GLU 122 Cb 0.56 -2.61 -0.01 0.00 0.27 0.00 0.00 31.44 29.65 3a2p n GLU 122 CO 0.00 0.00 0.00 -1.33 -0.41 0.00 0.00 177.13 175.39 3a2p n MET 123 N 5.74 -2.09 -2.58 5.31 2.81 -0.17 -1.26 117.12 124.88 3a2p n MET 123 Ca 0.21 0.61 -0.20 0.00 -1.81 0.00 0.00 57.70 56.52 3a2p n MET 123 Cb 0.29 -5.16 0.00 0.00 -0.71 0.00 0.00 33.22 27.64 3a2p n MET 123 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3a2p n GLY 124 N -0.72 -0.50 1.48 3.03 0.00 -0.39 -4.90 105.19 103.19 3a2p n GLY 124 Ca -0.14 0.03 -0.03 0.00 0.00 0.00 0.00 46.02 45.88 3a2p n GLY 124 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3a2p n ASN 125 N -2.10 3.67 -3.81 1.61 4.05 -0.39 -4.73 115.26 113.56 3a2p n ASN 125 Ca -0.19 -2.70 -0.09 0.00 0.45 0.00 0.00 54.58 52.04 3a2p n ASN 125 Cb 0.66 -0.65 -0.07 0.00 1.23 0.00 0.00 39.78 40.95 3a2p n ASN 125 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 177.26 173.11 3a2p s GLN 126 N -2.01 0.90 -0.23 1.20 -1.52 -1.26 -4.65 119.66 112.09 3a2p s GLN 126 Ca 0.33 -0.91 0.13 0.00 -1.95 0.00 0.00 55.36 52.96 3a2p s GLN 126 Cb 0.26 0.37 0.77 0.00 -0.22 0.00 0.00 33.01 34.19 3a2p s GLN 126 CO 0.08 -0.30 1.68 1.33 -0.25 0.00 0.00 175.29 177.83 3a2p n VAL 127 N -0.10 2.62 -4.11 1.09 0.24 -1.26 -2.92 118.33 113.88 3a2p n VAL 127 Ca -0.15 -1.33 -0.08 0.00 -2.04 0.00 0.00 64.34 60.74 3a2p n VAL 127 Cb 0.63 -0.30 -0.10 0.00 -1.47 0.00 0.00 33.84 32.59 3a2p n VAL 127 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 3a2p s THR 128 N -2.67 0.36 -0.76 3.34 -1.32 -1.25 -1.16 115.64 112.18 3a2p s THR 128 Ca 0.51 -1.82 0.02 0.00 -1.21 0.00 0.00 61.69 59.19 3a2p s THR 128 Cb 0.39 -1.53 0.19 0.00 -1.51 0.00 0.00 72.50 70.04 3a2p s THR 128 CO 0.15 -0.94 0.59 -0.89 -2.21 0.00 0.00 174.62 171.31 3a2p s THR 129 N -3.74 3.54 -0.37 5.08 2.01 -0.91 -4.37 115.64 116.88 3a2p s THR 129 Ca 0.08 -3.94 0.13 0.00 0.31 0.00 0.00 61.69 58.26 3a2p s THR 129 Cb 0.07 -3.27 0.38 0.00 0.01 0.00 0.00 72.50 69.69 3a2p s THR 129 CO -0.08 -1.01 0.82 -0.62 -0.69 0.00 0.00 174.62 173.03 3a2p n GLU 130 N 2.32 1.25 -2.06 4.92 1.02 -1.26 -0.78 120.64 126.05 3a2p n GLU 130 Ca 0.18 -3.48 -0.36 0.00 -0.02 0.00 0.00 57.16 53.48 3a2p n GLU 130 Cb 0.36 -1.63 0.02 0.00 -0.02 0.00 0.00 31.44 30.17 3a2p n GLU 130 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 3a2p s PRO 131 N -2.73 3.15 0.31 3.49 0.04 -1.25 -4.70 135.00 133.31 3a2p s PRO 131 Ca 0.37 1.83 0.08 0.00 0.04 0.00 0.00 61.00 63.33 3a2p s PRO 131 Cb 0.38 -2.04 0.50 0.00 0.04 0.00 0.00 34.50 33.38 3a2p s PRO 131 CO -0.05 -1.06 1.72 0.93 0.04 0.00 0.00 177.00 178.57 3a2p h GLU 132 N 1.16 0.16 -0.40 4.56 5.08 -1.89 -0.40 114.58 122.84 3a2p h GLU 132 Ca -0.50 -0.08 -0.09 0.00 -1.00 0.00 0.00 59.36 57.69 3a2p h GLU 132 Cb 1.29 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.52 3a2p h GLU 132 CO 0.56 0.56 -0.09 0.00 -1.00 0.00 0.00 179.01 179.04 3a2p h ALA 133 N 1.43 0.56 -0.00 3.43 0.00 -1.92 -3.35 119.26 119.40 3a2p h ALA 133 Ca 0.01 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.60 3a2p h ALA 133 Cb 0.82 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.46 3a2p h ALA 133 CO 0.06 0.42 -0.10 0.91 0.00 0.00 0.00 179.25 180.54 3a2p n TRP 134 N -4.33 0.00 0.00 0.00 7.02 -1.23 -5.03 117.44 113.86 3a2p n TRP 134 Ca -0.01 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.47 3a2p n TRP 134 Cb 0.36 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.25 3a2p n TRP 134 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3a2p n GLY 135 N 0.67 -0.82 3.79 6.99 0.00 -0.16 -4.95 105.19 110.71 3a2p n GLY 135 Ca 0.02 -1.67 -0.36 0.00 0.00 0.00 0.00 46.02 44.01 3a2p n GLY 135 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a2p s ALA 136 N -1.92 3.02 -0.16 4.61 0.00 -1.26 -3.82 121.76 122.22 3a2p s ALA 136 Ca 0.00 0.66 -0.09 0.00 0.00 0.00 0.00 51.96 52.52 3a2p s ALA 136 Cb 0.00 -3.26 -0.05 0.00 0.00 0.00 0.00 23.12 19.81 3a2p s ALA 136 CO 0.00 -0.23 0.15 0.99 0.00 0.00 0.00 175.76 176.68 3a2p s THR 137 N -1.78 5.43 0.11 0.00 2.01 0.04 -4.69 115.64 116.76 3a2p s THR 137 Ca 0.61 0.24 0.05 0.00 0.31 0.00 0.00 61.69 62.90 3a2p s THR 137 Cb -0.20 -3.46 -0.04 0.00 0.01 0.00 0.00 72.50 68.81 3a2p s THR 137 CO 0.24 0.51 0.05 -0.13 -0.69 0.00 0.00 174.62 174.60 3a2p s ARG 138 N -0.19 2.71 -0.11 4.92 0.52 0.15 -4.28 118.95 122.66 3a2p s ARG 138 Ca 0.12 -0.82 -0.30 0.00 -0.52 0.00 0.00 55.73 54.21 3a2p s ARG 138 Cb -0.12 -2.60 -0.02 0.00 0.52 0.00 0.00 34.95 32.73 3a2p s ARG 138 CO 0.01 0.53 1.26 1.21 0.02 0.00 0.00 175.30 178.33 3a2p s ASN 139 N -2.55 6.97 0.61 0.23 3.84 -0.79 -4.73 114.94 118.52 3a2p s ASN 139 Ca 0.28 1.78 0.31 0.00 0.21 0.00 0.00 52.86 55.44 3a2p s ASN 139 Cb -0.11 -2.55 1.79 0.00 -0.55 0.00 0.00 41.25 39.83 3a2p s ASN 139 CO 0.21 -0.70 2.15 -0.65 -2.79 0.00 0.00 177.10 175.32 3a2p h PRO 140 N 7.94 0.00 0.00 0.43 0.11 -1.92 -0.07 132.00 138.49 3a2p h PRO 140 Ca -0.30 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.75 3a2p h PRO 140 Cb 1.13 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 3a2p h PRO 140 CO 0.93 0.00 -0.44 -1.49 -0.21 0.00 0.00 178.00 176.80 3a2p h TRP 141 N 0.00 0.00 -0.61 0.65 4.06 -1.92 -2.52 115.95 115.62 3a2p h TRP 141 Ca 0.05 0.00 0.13 0.00 2.06 0.00 0.00 58.89 61.13 3a2p h TRP 141 Cb 0.35 0.00 -0.20 0.00 -1.00 0.00 0.00 29.16 28.31 3a2p h TRP 141 CO 0.00 0.25 -0.18 1.21 -3.56 0.00 0.00 178.44 176.16 3a2p s ASN 142 N -6.18 -0.99 0.47 -3.49 3.84 -0.11 -4.50 114.94 103.98 3a2p s ASN 142 Ca 0.04 0.14 0.21 0.00 0.21 0.00 0.00 52.86 53.46 3a2p s ASN 142 Cb 0.07 1.64 1.15 0.00 -0.55 0.00 0.00 41.25 43.56 3a2p s ASN 142 CO 0.73 -0.18 1.60 -0.07 -2.79 0.00 0.00 177.10 176.38 3a2p h LEU 143 N 7.63 0.00 -0.72 3.21 3.38 -1.65 0.15 115.31 127.31 3a2p h LEU 143 Ca -0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.91 3a2p h LEU 143 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 3a2p h LEU 143 CO 0.02 0.00 -0.11 0.61 0.09 0.00 0.00 178.44 179.05 3a2p n GLY 144 N -1.25 -0.31 3.78 0.83 0.00 -1.26 -4.47 105.19 102.51 3a2p n GLY 144 Ca -0.01 -0.41 -0.25 0.00 0.00 0.00 0.00 46.02 45.34 3a2p n GLY 144 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3a2p s ARG 145 N -2.22 2.83 0.84 1.61 1.81 0.52 -1.26 118.95 123.08 3a2p s ARG 145 Ca 0.32 -0.96 -0.11 0.00 -1.72 0.00 0.00 55.73 53.26 3a2p s ARG 145 Cb 0.20 -2.58 0.10 0.00 -0.45 0.00 0.00 34.95 32.22 3a2p s ARG 145 CO 0.42 0.46 1.09 0.45 -0.68 0.00 0.00 175.30 177.04 3a2p s SER 146 N -3.29 3.94 0.00 0.23 0.15 0.02 -1.89 113.70 112.87 3a2p s SER 146 Ca 0.31 1.65 0.11 0.00 0.70 0.00 0.00 55.95 58.73 3a2p s SER 146 Cb -0.09 -2.34 0.30 0.00 -1.71 0.00 0.00 66.02 62.18 3a2p s SER 146 CO 0.23 -2.37 1.23 1.33 1.20 0.00 0.00 173.24 174.86 3a2p n VAL 147 N -3.72 0.90 -3.97 4.45 0.24 -1.26 -4.43 118.33 110.53 3a2p n VAL 147 Ca 0.08 -0.95 0.00 0.00 -2.04 0.00 0.00 64.34 61.43 3a2p n VAL 147 Cb 0.54 0.58 -0.00 0.00 -1.47 0.00 0.00 33.84 33.49 3a2p n VAL 147 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3a2p n GLY 148 N 0.58 -2.02 3.85 7.63 0.00 -1.26 -4.28 105.19 109.69 3a2p n GLY 148 Ca 0.12 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.74 3a2p n GLY 148 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3a2p s GLY 149 N -1.41 -0.13 0.23 -0.02 0.00 -0.31 -2.14 107.32 103.54 3a2p s GLY 149 Ca 0.00 0.09 0.25 0.00 0.00 0.00 0.00 44.72 45.06 3a2p s GLY 149 CO 0.00 2.98 1.61 1.48 0.00 0.00 0.00 173.10 179.17 3a2p h SER 150 N 2.00 0.00 -0.35 1.64 4.64 -1.58 -3.38 113.55 116.52 3a2p h SER 150 Ca -0.26 -0.05 -0.23 0.00 -0.47 0.00 0.00 61.79 60.78 3a2p h SER 150 Cb 1.20 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 63.20 3a2p h SER 150 CO 0.32 0.02 0.15 -1.20 -0.87 0.00 0.00 176.83 175.24 3a2p n SER 151 N -2.39 5.92 -0.07 4.97 7.64 -0.65 -4.00 113.62 125.04 3a2p n SER 151 Ca 0.05 -2.79 -0.01 0.00 1.01 0.00 0.00 58.87 57.13 3a2p n SER 151 Cb 0.46 -1.17 0.27 0.00 -1.01 0.00 0.00 64.21 62.75 3a2p n SER 151 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 3a2p h GLY 152 N 3.33 0.74 0.97 0.23 0.00 -1.72 -2.25 103.07 104.37 3a2p h GLY 152 Ca 0.20 -0.39 -0.02 0.00 0.00 0.00 0.00 47.33 47.12 3a2p h GLY 152 CO 0.46 0.37 0.21 -1.33 0.00 0.00 0.00 176.54 176.25 3a2p h GLY 153 N 0.87 0.77 1.19 4.60 0.00 -1.61 -1.22 103.07 107.66 3a2p h GLY 153 Ca 0.16 -0.40 -0.15 0.00 0.00 0.00 0.00 47.33 46.94 3a2p h GLY 153 CO -0.01 0.38 -0.33 1.76 0.00 0.00 0.00 176.54 178.35 3a2p h SER 154 N 0.64 0.95 -0.16 0.19 0.02 -1.74 -0.87 113.55 112.58 3a2p h SER 154 Ca 0.16 -0.41 -0.00 0.00 -0.84 0.00 0.00 61.79 60.71 3a2p h SER 154 Cb 0.16 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.43 3a2p h SER 154 CO -0.02 1.18 0.09 1.23 -1.14 0.00 0.00 176.83 178.18 3a2p h GLY 155 N 0.85 0.23 1.07 -3.77 0.00 -1.24 -1.94 103.07 98.27 3a2p h GLY 155 Ca 0.08 -0.10 -0.09 0.00 0.00 0.00 0.00 47.33 47.21 3a2p h GLY 155 CO 0.08 0.10 0.03 0.00 0.00 0.00 0.00 176.54 176.75 3a2p h ALA 156 N 0.99 0.81 -0.37 3.60 0.00 -1.20 -2.03 119.26 121.07 3a2p h ALA 156 Ca 0.06 -0.30 0.03 0.00 0.00 0.00 0.00 54.91 54.70 3a2p h ALA 156 Cb 0.06 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 3a2p h ALA 156 CO -0.01 0.63 0.18 0.00 0.00 0.00 0.00 179.25 180.05 3a2p h ALA 157 N 0.99 0.46 -0.39 0.00 0.00 -0.97 0.23 119.26 119.57 3a2p h ALA 157 Ca 0.17 0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.98 3a2p h ALA 157 Cb 0.52 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 3a2p h ALA 157 CO 0.03 -0.18 -0.23 0.28 0.00 0.00 0.00 179.25 179.15 3a2p h VAL 158 N 0.38 1.27 0.00 0.00 2.07 -1.29 0.21 116.25 118.88 3a2p h VAL 158 Ca 0.16 -1.35 -0.05 0.00 0.82 0.00 0.00 66.70 66.28 3a2p h VAL 158 Cb 0.06 1.21 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 3a2p h VAL 158 CO -0.11 0.45 -0.22 0.00 0.02 0.00 0.00 177.57 177.71 3a2p h ALA 159 N 1.06 1.54 -0.69 1.67 0.00 -0.80 -2.12 119.26 119.91 3a2p h ALA 159 Ca 0.09 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3a2p h ALA 159 Cb 0.75 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.50 3a2p h ALA 159 CO 0.06 0.28 0.00 0.00 0.00 0.00 0.00 179.25 179.59 3a2p n ALA 160 N -2.46 2.42 -2.45 0.00 0.00 0.02 -4.67 120.51 113.36 3a2p n ALA 160 Ca -0.02 -1.22 -0.20 0.00 0.00 0.00 0.00 53.44 52.00 3a2p n ALA 160 Cb 0.29 -0.95 -0.00 0.00 0.00 0.00 0.00 19.45 18.79 3a2p n ALA 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3a2p n ALA 161 N 1.50 -0.62 0.51 0.00 0.00 -0.80 -4.85 120.51 116.25 3a2p n ALA 161 Ca 0.23 0.17 0.12 0.00 0.00 0.00 0.00 53.44 53.97 3a2p n ALA 161 Cb 0.59 -2.30 0.45 0.00 0.00 0.00 0.00 19.45 18.19 3a2p n ALA 161 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3a2p n LEU 162 N -2.94 0.74 -3.61 0.00 4.77 0.66 -4.78 117.00 111.85 3a2p n LEU 162 Ca -0.22 0.62 -0.07 0.00 -0.03 0.00 0.00 56.01 56.31 3a2p n LEU 162 Cb 0.67 -0.45 -0.05 0.00 -2.33 0.00 0.00 43.42 41.25 3a2p n LEU 162 CO 0.29 -0.38 0.90 -0.44 -1.33 0.00 0.00 177.39 176.43 3a2p s SER 163 N -4.39 -0.27 0.36 -1.43 0.01 -1.25 -4.93 113.70 101.80 3a2p s SER 163 Ca 0.07 0.35 0.18 0.00 1.31 0.00 0.00 55.95 57.87 3a2p s SER 163 Cb 0.11 0.30 0.58 0.00 0.21 0.00 0.00 66.02 67.22 3a2p s SER 163 CO 0.49 -0.21 1.69 1.55 0.41 0.00 0.00 173.24 177.17 3a2p h PRO 164 N 2.73 0.00 -3.98 12.44 0.13 -1.87 -3.38 132.00 138.07 3a2p h PRO 164 Ca -0.18 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.83 3a2p h PRO 164 Cb 1.17 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.14 3a2p h PRO 164 CO 0.25 0.39 -0.58 0.14 -0.23 0.00 0.00 178.00 177.97 3a2p s VAL 165 N -3.49 0.16 0.11 1.56 -7.23 -1.26 -3.96 120.40 106.30 3a2p s VAL 165 Ca 0.01 -1.35 -0.18 0.00 -1.81 0.00 0.00 61.98 58.65 3a2p s VAL 165 Cb 0.10 -1.12 0.04 0.00 0.56 0.00 0.00 36.38 35.96 3a2p s VAL 165 CO 0.69 -0.75 0.44 0.00 -0.31 0.00 0.00 175.10 175.17 3a2p s ALA 166 N -3.15 -1.05 0.32 1.32 0.00 -0.85 -2.89 121.76 115.46 3a2p s ALA 166 Ca -0.00 0.12 0.01 0.00 0.00 0.00 0.00 51.96 52.09 3a2p s ALA 166 Cb 0.02 0.64 -0.03 0.00 0.00 0.00 0.00 23.12 23.75 3a2p s ALA 166 CO -0.07 -0.62 0.51 -1.58 0.00 0.00 0.00 175.76 174.00 3a2p s HIS 167 N -3.49 3.49 0.10 0.00 5.65 -0.05 -1.01 115.29 119.97 3a2p s HIS 167 Ca 0.01 0.28 -0.26 0.00 0.25 0.00 0.00 55.06 55.35 3a2p s HIS 167 Cb 0.01 -1.83 0.09 0.00 -1.18 0.00 0.00 32.58 29.66 3a2p s HIS 167 CO -0.10 0.20 1.11 0.20 -0.65 0.00 0.00 174.74 175.50 3a2p s GLY 168 N -3.97 -0.14 0.15 1.59 0.00 -1.13 -3.79 107.32 100.04 3a2p s GLY 168 Ca 0.39 0.08 0.04 0.00 0.00 0.00 0.00 44.72 45.23 3a2p s GLY 168 CO 0.34 1.70 -0.09 0.54 0.00 0.00 0.00 173.10 175.60 3a2p s ASN 169 N -3.24 1.66 -0.12 1.64 2.20 -1.26 0.06 114.94 115.88 3a2p s ASN 169 Ca 0.19 -1.03 -0.04 0.00 -0.94 0.00 0.00 52.86 51.04 3a2p s ASN 169 Cb -0.00 0.01 0.05 0.00 -2.00 0.00 0.00 41.25 39.31 3a2p s ASN 169 CO 0.01 -0.37 0.08 -0.62 -2.94 0.00 0.00 177.10 173.26 3a2p s ASP 170 N -3.16 1.85 -0.03 3.54 -1.08 0.29 -3.37 116.67 114.71 3a2p s ASP 170 Ca 0.17 -0.33 0.06 0.00 -0.52 0.00 0.00 52.55 51.94 3a2p s ASP 170 Cb 0.03 -0.21 -0.09 0.00 -1.46 0.00 0.00 42.92 41.20 3a2p s ASP 170 CO 0.00 -0.31 0.09 0.00 0.52 0.00 0.00 175.17 175.48 3a2p n ALA 171 N 5.28 2.07 -1.10 3.66 0.00 -1.26 -0.10 120.51 129.07 3a2p n ALA 171 Ca -0.05 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.11 3a2p n ALA 171 Cb 0.49 -0.07 0.00 0.00 0.00 0.00 0.00 19.45 19.87 3a2p n ALA 171 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3a2p n ALA 172 N -1.96 1.01 0.00 0.00 0.00 -1.26 -4.63 120.51 113.67 3a2p n ALA 172 Ca -0.05 -0.46 0.00 0.00 0.00 0.00 0.00 53.44 52.92 3a2p n ALA 172 Cb 0.41 -0.01 0.00 0.00 0.00 0.00 0.00 19.45 19.86 3a2p n ALA 172 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a2p n GLY 173 N 0.00 1.27 0.00 0.00 0.00 -1.26 -2.89 105.19 102.31 3a2p n GLY 173 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3a2p n GLY 173 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3a2p n SER 174 N 0.00 0.00 -0.08 1.61 7.64 -1.26 0.22 113.62 121.75 3a2p n SER 174 Ca 0.00 0.38 -0.16 0.00 1.01 0.00 0.00 58.87 60.09 3a2p n SER 174 Cb 0.00 -0.38 -0.06 0.00 -1.01 0.00 0.00 64.21 62.76 3a2p n SER 174 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 3a2p n VAL 175 N -1.37 0.89 -0.22 0.44 0.31 -1.22 -1.64 118.33 115.52 3a2p n VAL 175 Ca 0.00 -0.24 -0.03 0.00 -0.01 0.00 0.00 64.34 64.06 3a2p n VAL 175 Cb 0.05 -1.62 0.16 0.00 -0.91 0.00 0.00 33.84 31.52 3a2p n VAL 175 CO 0.00 0.00 0.00 0.03 -1.32 0.00 0.00 176.83 175.54 3a2p h ARG 176 N -0.50 1.03 0.36 5.55 3.08 -1.69 -2.03 114.38 120.18 3a2p h ARG 176 Ca -0.40 -0.15 -0.02 0.00 0.07 0.00 0.00 59.98 59.48 3a2p h ARG 176 Cb 1.39 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 31.25 3a2p h ARG 176 CO -0.22 0.80 -0.17 0.82 -1.07 0.00 0.00 179.97 180.13 3a2p h ILE 177 N 1.02 0.66 -0.09 2.04 2.04 -0.50 -0.27 117.51 122.40 3a2p h ILE 177 Ca 0.25 -0.30 -0.03 0.00 1.00 0.00 0.00 64.86 65.78 3a2p h ILE 177 Cb 0.12 0.81 -0.01 0.00 -0.74 0.00 0.00 36.82 37.00 3a2p h ILE 177 CO -0.03 0.06 -0.08 -0.65 0.00 0.00 0.00 178.15 177.45 3a2p h PRO 178 N -0.64 0.13 -0.22 2.37 0.11 -1.73 -0.16 132.00 131.86 3a2p h PRO 178 Ca -0.05 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 66.01 3a2p h PRO 178 Cb 0.46 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.54 3a2p h PRO 178 CO 0.08 0.23 0.04 0.00 -0.21 0.00 0.00 178.00 178.13 3a2p h ALA 179 N 1.79 0.30 -0.16 -0.75 0.00 -1.18 0.13 119.26 119.39 3a2p h ALA 179 Ca 0.03 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 3a2p h ALA 179 Cb 0.23 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3a2p h ALA 179 CO 0.01 -0.03 0.09 1.03 0.00 0.00 0.00 179.25 180.35 3a2p h SER 180 N 0.17 0.19 0.18 0.00 0.87 -0.38 -0.34 113.55 114.25 3a2p h SER 180 Ca 0.07 -0.08 -0.08 0.00 -1.23 0.00 0.00 61.79 60.47 3a2p h SER 180 Cb 0.32 -0.05 -0.01 0.00 -0.44 0.00 0.00 62.40 62.22 3a2p h SER 180 CO 0.00 0.21 -0.31 0.58 -0.53 0.00 0.00 176.83 176.79 3a2p h VAL 181 N 0.16 1.26 -0.36 2.23 2.07 -0.97 -3.15 116.25 117.48 3a2p h VAL 181 Ca 0.06 -1.23 0.00 0.00 0.82 0.00 0.00 66.70 66.35 3a2p h VAL 181 Cb 0.06 1.52 0.00 0.00 -1.52 0.00 0.00 31.29 31.35 3a2p h VAL 181 CO -0.01 0.37 0.00 0.00 0.02 0.00 0.00 177.57 177.95 3a2p n GLY 183 N 1.41 -0.00 3.45 0.00 0.00 -0.25 -4.70 105.19 105.11 3a2p n GLY 183 Ca 0.18 -0.13 -0.22 0.00 0.00 0.00 0.00 46.02 45.85 3a2p n GLY 183 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3a2p s VAL 184 N -3.13 0.79 -0.07 1.61 -7.23 -0.56 -4.79 120.40 107.01 3a2p s VAL 184 Ca 0.32 -2.00 -0.23 0.00 -1.81 0.00 0.00 61.98 58.26 3a2p s VAL 184 Cb -0.14 -2.56 -0.04 0.00 0.56 0.00 0.00 36.38 34.20 3a2p s VAL 184 CO 0.40 0.00 0.67 -0.69 -0.31 0.00 0.00 175.10 175.17 3a2p s VAL 185 N -3.34 5.06 -0.09 1.32 1.01 0.64 -4.09 120.40 120.90 3a2p s VAL 185 Ca 0.31 1.39 -0.01 0.00 0.00 0.00 0.00 61.98 63.67 3a2p s VAL 185 Cb 0.06 -4.01 0.03 0.00 0.00 0.00 0.00 36.38 32.45 3a2p s VAL 185 CO 0.15 0.26 -0.04 -0.83 0.00 0.00 0.00 175.10 174.64 3a2p s GLY 186 N 0.76 0.65 -0.13 4.51 0.00 -0.81 -1.84 107.32 110.46 3a2p s GLY 186 Ca 0.36 -0.34 -0.01 0.00 0.00 0.00 0.00 44.72 44.74 3a2p s GLY 186 CO 0.17 0.97 -0.11 -2.27 0.00 0.00 0.00 173.10 171.86 3a2p s LEU 187 N 1.84 2.85 -0.42 0.66 2.96 -0.01 -0.83 118.68 125.72 3a2p s LEU 187 Ca 0.05 -0.27 -0.08 0.00 -0.22 0.00 0.00 54.13 53.60 3a2p s LEU 187 Cb -0.12 -1.65 0.09 0.00 0.50 0.00 0.00 46.19 45.00 3a2p s LEU 187 CO -0.07 0.17 0.26 -0.75 -1.32 0.00 0.00 176.35 174.65 3a2p s LYS 188 N 0.32 2.51 0.94 1.98 2.20 -0.22 -1.79 119.74 125.68 3a2p s LYS 188 Ca -0.09 -1.55 -0.16 0.00 -0.36 0.00 0.00 55.97 53.82 3a2p s LYS 188 Cb -0.15 -3.77 0.23 0.00 -1.51 0.00 0.00 37.83 32.63 3a2p s LYS 188 CO 0.05 -1.00 0.85 -0.35 -0.36 0.00 0.00 175.35 174.54 3a2p n PRO 189 N 4.87 -2.61 -1.89 4.03 -0.04 -1.26 -1.04 135.00 137.06 3a2p n PRO 189 Ca -0.09 -1.35 -0.39 0.00 -0.04 0.00 0.00 63.50 61.63 3a2p n PRO 189 Cb 0.42 -1.26 0.02 0.00 -0.04 0.00 0.00 33.50 32.65 3a2p n PRO 189 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 3a2p s THR 190 N -2.55 2.29 0.19 0.52 2.01 -1.26 -4.35 115.64 112.49 3a2p s THR 190 Ca 0.55 0.23 -0.33 0.00 0.31 0.00 0.00 61.69 62.45 3a2p s THR 190 Cb -0.05 -3.13 -0.14 0.00 0.01 0.00 0.00 72.50 69.19 3a2p s THR 190 CO 0.42 0.02 1.54 -1.14 -0.69 0.00 0.00 174.62 174.76 3a2p n ARG 191 N -0.50 2.16 -0.58 4.92 0.63 -0.20 -1.66 116.66 121.42 3a2p n ARG 191 Ca 0.07 0.78 0.00 0.00 -0.92 0.00 0.00 57.85 57.78 3a2p n ARG 191 Cb 0.44 -2.52 0.00 0.00 0.45 0.00 0.00 32.46 30.83 3a2p n ARG 191 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3a2p n GLY 192 N 3.02 0.76 0.10 5.14 0.00 -1.26 -3.89 105.19 109.06 3a2p n GLY 192 Ca 0.15 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.00 3a2p n GLY 192 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3a2p h ARG 193 N 3.20 0.22 -5.16 1.61 9.65 -1.63 -3.14 114.38 119.13 3a2p h ARG 193 Ca 0.00 -0.28 -0.65 0.00 -1.10 0.00 0.00 59.98 57.95 3a2p h ARG 193 Cb 0.00 0.09 -0.26 0.00 -1.39 0.00 0.00 29.97 28.41 3a2p h ARG 193 CO 0.00 1.04 -0.73 0.42 2.80 0.00 0.00 179.97 183.50 3a2p s ILE 194 N -2.84 3.33 0.19 1.20 1.01 -1.26 -1.69 121.20 121.15 3a2p s ILE 194 Ca -0.15 -0.53 -0.30 0.00 0.00 0.00 0.00 60.65 59.66 3a2p s ILE 194 Cb 0.01 -2.46 -0.08 0.00 0.01 0.00 0.00 42.46 39.93 3a2p s ILE 194 CO 0.77 0.47 1.19 -0.55 0.00 0.00 0.00 174.94 176.82 3a2p s SER 195 N 0.89 7.10 0.00 3.58 0.15 -1.26 -4.59 113.70 119.57 3a2p s SER 195 Ca -0.02 2.24 0.23 0.00 0.70 0.00 0.00 55.95 59.10 3a2p s SER 195 Cb -0.15 -2.61 0.27 0.00 -1.71 0.00 0.00 66.02 61.83 3a2p s SER 195 CO 0.01 -0.35 1.29 -0.81 1.20 0.00 0.00 173.24 174.57 3a2p n PRO 196 N 2.38 2.30 -0.48 5.44 -0.04 -1.26 -4.37 135.00 138.98 3a2p n PRO 196 Ca 0.04 -2.03 -0.08 0.00 -0.04 0.00 0.00 63.50 61.39 3a2p n PRO 196 Cb 0.45 -1.46 0.06 0.00 -0.04 0.00 0.00 33.50 32.50 3a2p n PRO 196 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3a2p n GLY 197 N 1.36 -1.36 0.29 0.55 0.00 -1.26 -4.33 105.19 100.44 3a2p n GLY 197 Ca 0.16 -1.66 0.18 0.00 0.00 0.00 0.00 46.02 44.70 3a2p n GLY 197 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3a2p h PRO 198 N 0.00 0.00 -7.14 1.61 0.13 -1.91 0.25 132.00 124.93 3a2p h PRO 198 Ca -0.11 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.48 3a2p h PRO 198 Cb 0.31 0.00 0.18 0.00 0.13 0.00 0.00 31.00 31.62 3a2p h PRO 198 CO 0.08 0.02 0.29 1.28 -0.23 0.00 0.00 178.00 179.44 3a2p n LEU 199 N -3.14 4.32 -4.03 1.56 4.77 -1.26 -4.99 117.00 114.22 3a2p n LEU 199 Ca -0.00 0.62 -0.31 0.00 -0.03 0.00 0.00 56.01 56.28 3a2p n LEU 199 Cb 0.25 -1.49 -0.15 0.00 -2.33 0.00 0.00 43.42 39.70 3a2p n LEU 199 CO 0.26 -1.73 -0.37 -0.69 -1.33 0.00 0.00 177.39 173.53 3a2p s VAL 200 N -2.01 2.25 0.34 4.08 1.01 -1.26 -4.91 120.40 119.89 3a2p s VAL 200 Ca 0.74 -2.14 0.07 0.00 0.00 0.00 0.00 61.98 60.64 3a2p s VAL 200 Cb -0.31 -2.57 -0.07 0.00 0.00 0.00 0.00 36.38 33.44 3a2p s VAL 200 CO 0.50 -0.43 -0.03 0.42 0.00 0.00 0.00 175.10 175.56 3a2p s THR 201 N 0.96 1.81 -1.56 3.92 -4.23 -1.26 -4.81 115.64 110.47 3a2p s THR 201 Ca 0.05 -2.09 -0.02 0.00 -1.18 0.00 0.00 61.69 58.45 3a2p s THR 201 Cb -0.19 -2.72 0.01 0.00 1.34 0.00 0.00 72.50 70.93 3a2p s THR 201 CO -0.07 -0.13 0.24 0.47 -0.54 0.00 0.00 174.62 174.58 3a2p n ASP 202 N -0.77 -5.50 -3.11 3.99 8.00 -1.26 -0.93 116.55 116.97 3a2p n ASP 202 Ca -0.05 -0.10 -0.08 0.00 0.71 0.00 0.00 54.79 55.28 3a2p n ASP 202 Cb 0.65 -4.54 0.01 0.00 -0.02 0.00 0.00 41.12 37.22 3a2p n ASP 202 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 3a2p n SER 203 N -2.17 -7.37 -3.69 -2.24 7.64 -1.26 0.33 113.62 104.85 3a2p n SER 203 Ca -0.17 0.01 -0.24 0.00 1.01 0.00 0.00 58.87 59.47 3a2p n SER 203 Cb 0.64 -4.69 0.05 0.00 -1.01 0.00 0.00 64.21 59.20 3a2p n SER 203 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 3a2p n ASP 204 N -1.32 -4.05 -3.71 6.43 2.03 -1.22 -1.97 116.55 112.74 3a2p n ASP 204 Ca -0.01 -0.69 -0.24 0.00 0.52 0.00 0.00 54.79 54.38 3a2p n ASP 204 Cb 0.52 -4.49 0.03 0.00 -0.72 0.00 0.00 41.12 36.46 3a2p n ASP 204 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 3a2p n ASN 205 N -2.99 -2.48 -3.68 1.67 4.13 -0.11 -1.40 115.26 110.40 3a2p n ASN 205 Ca -0.10 -0.90 -0.21 0.00 1.68 0.00 0.00 54.58 55.05 3a2p n ASN 205 Cb 0.59 -3.78 0.04 0.00 -1.54 0.00 0.00 39.78 35.08 3a2p n ASN 205 CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06 3a2p n VAL 206 N -4.19 -4.61 -2.75 2.41 0.31 0.15 -1.15 118.33 108.51 3a2p n VAL 206 Ca -0.23 -0.51 -0.20 0.00 -0.01 0.00 0.00 64.34 63.39 3a2p n VAL 206 Cb 0.65 -3.88 0.01 0.00 -0.91 0.00 0.00 33.84 29.71 3a2p n VAL 206 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3a2p n ALA 207 N -4.25 -0.83 0.00 3.52 0.00 -0.83 -1.49 120.51 116.62 3a2p n ALA 207 Ca -0.30 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.32 3a2p n ALA 207 Cb 0.68 -2.70 0.00 0.00 0.00 0.00 0.00 19.45 17.43 3a2p n ALA 207 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a2p n GLY 208 N -1.16 1.02 0.17 0.00 0.00 -0.49 -4.93 105.19 99.80 3a2p n GLY 208 Ca -0.15 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.90 3a2p n GLY 208 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a2p h ALA 209 N 0.00 1.05 -2.29 4.61 0.00 -0.91 -3.42 119.26 118.29 3a2p h ALA 209 Ca 0.00 -0.40 -0.59 0.00 0.00 0.00 0.00 54.91 53.91 3a2p h ALA 209 Cb 0.00 -0.07 -0.09 0.00 0.00 0.00 0.00 17.79 17.63 3a2p h ALA 209 CO 0.00 0.55 0.47 0.00 0.00 0.00 0.00 179.25 180.27 3a2p s ALA 210 N -3.70 3.64 0.03 0.00 0.00 -0.30 -4.22 121.76 117.22 3a2p s ALA 210 Ca -0.01 -0.13 0.08 0.00 0.00 0.00 0.00 51.96 51.90 3a2p s ALA 210 Cb 0.12 -3.28 -0.03 0.00 0.00 0.00 0.00 23.12 19.93 3a2p s ALA 210 CO 0.71 -0.91 -0.23 -1.01 0.00 0.00 0.00 175.76 174.32 3a2p s HIS 211 N 2.81 2.43 0.32 0.00 0.09 0.86 -4.89 115.29 116.91 3a2p s HIS 211 Ca 0.35 -0.35 -0.24 0.00 -0.00 0.00 0.00 55.06 54.83 3a2p s HIS 211 Cb -0.15 -1.44 -0.10 0.00 -0.00 0.00 0.00 32.58 30.89 3a2p s HIS 211 CO 0.07 0.16 0.89 -1.21 -0.00 0.00 0.00 174.74 174.65 3a2p s GLU 212 N -1.22 4.44 0.20 1.40 0.41 -1.26 0.11 118.70 122.77 3a2p s GLU 212 Ca 0.13 1.18 0.04 0.00 -0.41 0.00 0.00 54.97 55.90 3a2p s GLU 212 Cb -0.10 -2.71 -0.02 0.00 -1.78 0.00 0.00 34.13 29.53 3a2p s GLU 212 CO 0.03 0.25 0.16 0.41 -0.49 0.00 0.00 175.26 175.62 3a2p n GLY 213 N 0.37 3.40 3.06 -1.39 0.00 0.11 -4.41 105.19 106.33 3a2p n GLY 213 Ca 0.02 -1.82 -0.16 0.00 0.00 0.00 0.00 46.02 44.06 3a2p n GLY 213 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3a2p s LEU 214 N 0.00 2.17 0.01 0.99 1.43 -0.74 -2.84 118.68 119.70 3a2p s LEU 214 Ca 0.22 -0.40 0.09 0.00 -1.03 0.00 0.00 54.13 53.00 3a2p s LEU 214 Cb 0.01 -0.32 -0.02 0.00 0.03 0.00 0.00 46.19 45.89 3a2p s LEU 214 CO 0.16 -0.07 -0.26 -0.36 0.23 0.00 0.00 176.35 176.05 3a2p s PHE 215 N -0.90 2.29 0.14 0.29 0.08 -0.18 -0.83 117.98 118.87 3a2p s PHE 215 Ca -0.03 -0.42 -0.24 0.00 0.12 0.00 0.00 56.93 56.35 3a2p s PHE 215 Cb -0.07 -1.42 0.08 0.00 -0.57 0.00 0.00 43.02 41.04 3a2p s PHE 215 CO 0.01 0.05 1.07 0.00 -0.10 0.00 0.00 175.22 176.24 3a2p s ALA 216 N -0.71 -1.75 -1.12 5.36 0.00 -0.77 -2.00 121.76 120.77 3a2p s ALA 216 Ca 0.11 -0.10 0.09 0.00 0.00 0.00 0.00 51.96 52.06 3a2p s ALA 216 Cb -0.10 0.71 0.11 0.00 0.00 0.00 0.00 23.12 23.84 3a2p s ALA 216 CO 0.01 -1.07 0.88 0.54 0.00 0.00 0.00 175.76 176.12 3a2p n ARG 217 N -0.65 0.82 -4.01 0.00 1.74 -1.25 -0.26 116.66 113.05 3a2p n ARG 217 Ca -0.04 -1.24 -0.10 0.00 -0.77 0.00 0.00 57.85 55.70 3a2p n ARG 217 Cb 0.60 -1.19 -0.11 0.00 -1.02 0.00 0.00 32.46 30.74 3a2p n ARG 217 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 3a2p s SER 218 N -0.84 0.42 0.27 0.55 1.04 -1.26 -4.84 113.70 109.04 3a2p s SER 218 Ca 0.13 -0.54 0.02 0.00 0.48 0.00 0.00 55.95 56.04 3a2p s SER 218 Cb 0.08 0.09 0.37 0.00 0.10 0.00 0.00 66.02 66.67 3a2p s SER 218 CO 0.12 -0.29 1.69 0.58 0.98 0.00 0.00 173.24 176.32 3a2p h VAL 219 N 4.53 1.28 -0.23 5.02 2.07 -1.94 -2.87 116.25 124.11 3a2p h VAL 219 Ca -0.33 -1.36 -0.07 0.00 0.82 0.00 0.00 66.70 65.76 3a2p h VAL 219 Cb 1.20 1.43 -0.01 0.00 -1.52 0.00 0.00 31.29 32.39 3a2p h VAL 219 CO 0.42 0.43 -0.18 0.08 0.02 0.00 0.00 177.57 178.34 3a2p h ARG 220 N 0.41 0.39 -0.64 1.57 0.11 -1.96 -1.98 114.38 112.29 3a2p h ARG 220 Ca 0.05 -0.12 -0.06 0.00 0.10 0.00 0.00 59.98 59.96 3a2p h ARG 220 Cb 0.73 -0.04 -0.03 0.00 1.11 0.00 0.00 29.97 31.75 3a2p h ARG 220 CO 0.06 0.56 0.16 -0.44 0.10 0.00 0.00 179.97 180.41 3a2p h ASP 221 N 0.36 0.94 -0.29 0.08 5.19 -1.93 -1.36 116.42 119.42 3a2p h ASP 221 Ca 0.06 -0.18 -0.04 0.00 -0.62 0.00 0.00 57.03 56.25 3a2p h ASP 221 Cb 0.52 -0.25 -0.01 0.00 0.18 0.00 0.00 39.33 39.78 3a2p h ASP 221 CO 0.03 0.90 0.02 0.40 -3.12 0.00 0.00 179.24 177.48 3a2p h ILE 222 N 0.96 1.25 -0.46 0.35 1.08 -1.36 -0.48 117.51 118.85 3a2p h ILE 222 Ca 0.21 -0.88 0.05 0.00 -0.39 0.00 0.00 64.86 63.85 3a2p h ILE 222 Cb 0.33 1.26 -0.05 0.00 -3.07 0.00 0.00 36.82 35.29 3a2p h ILE 222 CO -0.00 0.28 0.19 0.00 -0.69 0.00 0.00 178.15 177.93 3a2p h ALA 223 N 0.85 0.56 -0.56 1.87 0.00 -1.11 -0.80 119.26 120.07 3a2p h ALA 223 Ca 0.08 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 3a2p h ALA 223 Cb 0.39 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 3a2p h ALA 223 CO 0.01 -0.19 0.03 0.00 0.00 0.00 0.00 179.25 179.11 3a2p h ALA 224 N 1.28 1.01 -0.55 0.00 0.00 -1.09 -2.65 119.26 117.26 3a2p h ALA 224 Ca 0.21 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 3a2p h ALA 224 Cb 0.17 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 3a2p h ALA 224 CO -0.19 0.62 0.17 -0.07 0.00 0.00 0.00 179.25 179.78 3a2p h LEU 225 N 0.87 0.80 -0.73 0.00 3.38 -0.52 -2.65 115.31 116.46 3a2p h LEU 225 Ca 0.17 -0.21 0.05 0.00 0.09 0.00 0.00 57.88 57.98 3a2p h LEU 225 Cb 0.46 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.95 3a2p h LEU 225 CO 0.02 0.80 0.44 -0.07 0.09 0.00 0.00 178.44 179.72 3a2p h LEU 226 N 0.76 0.70 -2.37 1.67 3.38 -0.96 -0.22 115.31 118.27 3a2p h LEU 226 Ca 0.18 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.15 3a2p h LEU 226 Cb 0.29 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 3a2p h LEU 226 CO -0.00 0.46 -0.04 0.44 0.09 0.00 0.00 178.44 179.39 3a2p h ASP 227 N 0.83 0.00 0.10 -0.43 3.32 -1.15 -1.72 116.42 117.37 3a2p h ASP 227 Ca 0.31 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 57.10 3a2p h ASP 227 Cb 0.11 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.65 3a2p h ASP 227 CO -0.15 0.04 -1.36 0.58 -1.72 0.00 0.00 179.24 176.63 3a2p h VAL 228 N 0.00 1.03 -0.17 -1.35 2.07 -0.74 -3.41 116.25 113.67 3a2p h VAL 228 Ca -0.00 -2.37 0.00 0.00 0.82 0.00 0.00 66.70 65.15 3a2p h VAL 228 Cb 0.13 2.67 0.00 0.00 -1.52 0.00 0.00 31.29 32.58 3a2p h VAL 228 CO 0.00 0.66 0.00 1.33 0.02 0.00 0.00 177.57 179.59 3a2p n VAL 229 N -3.99 0.28 -2.36 2.57 0.24 -0.66 -4.77 118.33 109.64 3a2p n VAL 229 Ca -0.25 -0.64 -0.27 0.00 -2.04 0.00 0.00 64.34 61.14 3a2p n VAL 229 Cb 0.86 1.13 0.03 0.00 -1.47 0.00 0.00 33.84 34.40 3a2p n VAL 229 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 3a2p s SER 230 N -1.37 5.52 0.00 -1.34 0.01 -0.65 -4.08 113.70 111.78 3a2p s SER 230 Ca 0.26 0.70 0.00 0.00 1.31 0.00 0.00 55.95 58.22 3a2p s SER 230 Cb 0.16 -1.66 0.00 0.00 0.21 0.00 0.00 66.02 64.73 3a2p s SER 230 CO 0.24 -1.12 0.00 0.61 0.41 0.00 0.00 173.24 173.38 3a2p n GLY 231 N -2.62 3.18 3.72 3.44 0.00 -0.68 -4.96 105.19 107.26 3a2p n GLY 231 Ca 0.05 -1.77 -0.42 0.00 0.00 0.00 0.00 46.02 43.88 3a2p n GLY 231 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3a2p s HIS 232 N -2.08 3.41 0.25 1.61 2.46 -1.26 -4.35 115.29 115.33 3a2p s HIS 232 Ca 0.00 1.29 0.12 0.00 0.47 0.00 0.00 55.06 56.93 3a2p s HIS 232 Cb 0.00 -3.45 -0.05 0.00 -0.13 0.00 0.00 32.58 28.95 3a2p s HIS 232 CO 0.00 -1.39 -0.20 1.03 -2.47 0.00 0.00 174.74 171.70 3a2p s ARG 233 N 0.76 1.66 0.02 2.88 1.81 -1.26 -5.06 118.95 119.75 3a2p s ARG 233 Ca 0.58 -1.68 -0.36 0.00 -1.72 0.00 0.00 55.73 52.55 3a2p s ARG 233 Cb -0.31 -1.81 -0.15 0.00 -0.45 0.00 0.00 34.95 32.23 3a2p s ARG 233 CO 0.31 0.35 1.54 -2.30 -0.68 0.00 0.00 175.30 174.53 3a2p n PRO 234 N -0.36 1.54 0.00 3.54 -0.02 -1.26 -1.57 135.00 136.87 3a2p n PRO 234 Ca -0.07 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 61.96 3a2p n PRO 234 Cb 0.59 -2.27 0.00 0.00 -0.02 0.00 0.00 33.50 31.80 3a2p n PRO 234 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3a2p n GLY 235 N 3.30 2.65 3.67 -1.23 0.00 -1.26 -4.93 105.19 107.38 3a2p n GLY 235 Ca 0.20 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.74 3a2p n GLY 235 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3a2p n ASP 236 N 0.00 2.97 -0.02 1.61 8.00 -0.61 -4.88 116.55 123.62 3a2p n ASP 236 Ca 0.00 1.05 -0.13 0.00 0.71 0.00 0.00 54.79 56.42 3a2p n ASP 236 Cb 0.00 -1.36 -0.10 0.00 -0.02 0.00 0.00 41.12 39.65 3a2p n ASP 236 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 3a2p h THR 237 N 4.31 1.42 -2.03 -3.53 2.02 -1.95 -3.46 112.91 109.69 3a2p h THR 237 Ca -0.47 -1.26 -0.47 0.00 0.77 0.00 0.00 66.41 64.98 3a2p h THR 237 Cb 1.28 2.24 -0.02 0.00 -1.74 0.00 0.00 68.15 69.90 3a2p h THR 237 CO 0.90 0.33 -0.43 -0.36 0.37 0.00 0.00 175.52 176.33 3a2p s PHE 238 N -4.10 3.18 0.02 3.16 0.08 -1.26 -5.11 117.98 113.94 3a2p s PHE 238 Ca -0.16 -0.15 -0.12 0.00 0.12 0.00 0.00 56.93 56.63 3a2p s PHE 238 Cb 0.02 -1.68 0.01 0.00 -0.57 0.00 0.00 43.02 40.80 3a2p s PHE 238 CO 0.68 0.30 0.25 0.00 -0.10 0.00 0.00 175.22 176.35 3a2p s ALA 240 N -2.01 2.95 0.48 0.00 0.00 -1.19 -4.65 121.76 117.34 3a2p s ALA 240 Ca -0.09 -1.60 -0.24 0.00 0.00 0.00 0.00 51.96 50.03 3a2p s ALA 240 Cb -0.03 -0.64 -0.08 0.00 0.00 0.00 0.00 23.12 22.37 3a2p s ALA 240 CO -0.00 0.37 1.36 -2.30 0.00 0.00 0.00 175.76 175.19 3a2p n PRO 241 N -0.33 1.96 -2.90 0.00 -0.02 -1.26 -4.96 135.00 127.50 3a2p n PRO 241 Ca -0.09 0.71 -0.40 0.00 -2.02 0.00 0.00 63.50 61.70 3a2p n PRO 241 Cb 0.57 -2.54 -0.05 0.00 -0.02 0.00 0.00 33.50 31.46 3a2p n PRO 241 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 3a2p s THR 242 N -1.23 4.54 0.48 3.45 2.01 -1.26 -4.94 115.64 118.68 3a2p s THR 242 Ca 0.65 1.80 -0.15 0.00 0.31 0.00 0.00 61.69 64.30 3a2p s THR 242 Cb -0.45 -4.19 -0.07 0.00 0.01 0.00 0.00 72.50 67.79 3a2p s THR 242 CO 0.55 0.40 0.92 0.00 -0.69 0.00 0.00 174.62 175.79 3a2p s ALA 243 N -0.36 3.15 0.18 7.40 0.00 -1.26 -4.99 121.76 125.88 3a2p s ALA 243 Ca 0.40 0.07 0.10 0.00 0.00 0.00 0.00 51.96 52.53 3a2p s ALA 243 Cb -0.22 -3.00 0.12 0.00 0.00 0.00 0.00 23.12 20.02 3a2p s ALA 243 CO 0.26 -0.16 1.47 0.66 0.00 0.00 0.00 175.76 177.99 3a2p h SER 244 N 1.04 0.00 -5.40 0.00 4.64 -2.01 -3.47 113.55 108.35 3a2p h SER 244 Ca -0.47 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 60.68 3a2p h SER 244 Cb 1.19 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 63.13 3a2p h SER 244 CO 0.62 0.76 -0.57 0.00 -0.87 0.00 0.00 176.83 176.77 3a2p s ARG 245 N -3.19 1.00 0.46 4.77 1.70 -1.26 -5.13 118.95 117.30 3a2p s ARG 245 Ca 0.00 -1.39 -0.25 0.00 -0.47 0.00 0.00 55.73 53.62 3a2p s ARG 245 Cb 0.11 0.27 -0.08 0.00 -0.57 0.00 0.00 34.95 34.69 3a2p s ARG 245 CO 0.78 -0.31 1.41 -2.14 -1.08 0.00 0.00 175.30 173.97 3a2p s PRO 246 N -4.04 3.61 0.40 3.89 0.02 -1.26 -4.79 135.00 132.84 3a2p s PRO 246 Ca 0.23 2.38 0.08 0.00 0.02 0.00 0.00 61.00 63.71 3a2p s PRO 246 Cb 0.06 -2.60 0.83 0.00 0.02 0.00 0.00 34.50 32.82 3a2p s PRO 246 CO 0.02 -0.86 2.00 1.88 -0.33 0.00 0.00 177.00 179.71 3a2p h TYR 247 N 2.20 0.42 -0.03 6.54 0.05 -1.97 -0.70 116.97 123.48 3a2p h TYR 247 Ca -0.51 -0.01 0.01 0.00 0.05 0.00 0.00 58.73 58.27 3a2p h TYR 247 Cb 1.27 -0.13 -0.00 0.00 1.01 0.00 0.00 36.73 38.88 3a2p h TYR 247 CO 0.49 0.35 0.03 0.00 -1.05 0.00 0.00 178.16 177.98 3a2p h ALA 248 N 1.70 1.61 0.02 3.88 0.00 -1.91 -2.09 119.26 122.47 3a2p h ALA 248 Ca 0.11 -0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.77 3a2p h ALA 248 Cb 0.11 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 3a2p h ALA 248 CO -0.01 -0.04 -1.31 1.96 0.00 0.00 0.00 179.25 179.85 3a2p h GLN 249 N 0.00 0.05 0.00 0.00 4.20 -1.52 -3.39 115.11 114.45 3a2p h GLN 249 Ca 0.01 -0.08 0.00 0.00 0.06 0.00 0.00 58.65 58.64 3a2p h GLN 249 Cb 0.07 0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.88 3a2p h GLN 249 CO -0.00 1.04 0.00 0.78 -0.67 0.00 0.00 178.83 179.98 3a2p h GLY 250 N -0.67 0.00 1.24 3.46 0.00 -1.14 -3.21 103.07 102.75 3a2p h GLY 250 Ca -0.34 0.00 0.08 0.00 0.00 0.00 0.00 47.33 47.07 3a2p h GLY 250 CO -0.15 0.00 0.30 1.19 0.00 0.00 0.00 176.54 177.88 3a2p h ILE 251 N 0.00 0.43 -0.02 2.60 2.10 -1.58 -0.71 117.51 120.33 3a2p h ILE 251 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 3a2p h ILE 251 Cb 0.35 0.76 0.00 0.00 -1.09 0.00 0.00 36.82 36.84 3a2p h ILE 251 CO 0.00 0.00 -0.08 -1.54 -1.08 0.00 0.00 178.15 175.45 3a2p n SER 252 N -3.76 2.05 -4.78 2.19 3.41 -1.21 -4.41 113.62 107.11 3a2p n SER 252 Ca 0.04 -1.62 -0.37 0.00 -0.26 0.00 0.00 58.87 56.67 3a2p n SER 252 Cb 0.45 0.06 -0.02 0.00 -0.26 0.00 0.00 64.21 64.44 3a2p n SER 252 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3a2p s GLU 253 N -2.10 3.91 -0.40 4.33 2.02 -0.27 -4.99 118.70 121.19 3a2p s GLU 253 Ca 0.31 1.63 -0.22 0.00 0.02 0.00 0.00 54.97 56.71 3a2p s GLU 253 Cb 0.20 -2.42 0.02 0.00 0.10 0.00 0.00 34.13 32.02 3a2p s GLU 253 CO 0.37 -0.39 0.70 1.21 0.02 0.00 0.00 175.26 177.17 3a2p s ASN 254 N -1.50 6.41 0.34 -0.19 3.84 -1.26 -4.90 114.94 117.68 3a2p s ASN 254 Ca 0.62 -0.02 0.26 0.00 0.21 0.00 0.00 52.86 53.93 3a2p s ASN 254 Cb -0.25 -2.35 1.13 0.00 -0.55 0.00 0.00 41.25 39.23 3a2p s ASN 254 CO 0.30 -0.75 1.79 1.55 -2.79 0.00 0.00 177.10 177.20 3a2p h PRO 255 N 8.72 0.00 0.00 0.43 0.13 -1.94 -3.49 132.00 135.84 3a2p h PRO 255 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 3a2p h PRO 255 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 3a2p h PRO 255 CO 0.90 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 179.08 3a2p n GLY 256 N -0.13 -1.97 3.66 1.56 0.00 -1.26 -4.77 105.19 102.27 3a2p n GLY 256 Ca 0.01 -1.53 -0.43 0.00 0.00 0.00 0.00 46.02 44.08 3a2p n GLY 256 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3a2p s SER 257 N -4.00 7.05 0.20 1.61 0.15 -1.26 -4.89 113.70 112.56 3a2p s SER 257 Ca 0.00 1.38 0.06 0.00 0.70 0.00 0.00 55.95 58.09 3a2p s SER 257 Cb 0.00 -2.54 -0.04 0.00 -1.71 0.00 0.00 66.02 61.73 3a2p s SER 257 CO 0.00 -0.72 0.16 -0.76 1.20 0.00 0.00 173.24 173.12 3a2p s LEU 258 N 3.32 3.79 -0.45 3.45 1.43 -1.26 -4.82 118.68 124.14 3a2p s LEU 258 Ca 0.46 -0.19 -0.26 0.00 -1.03 0.00 0.00 54.13 53.10 3a2p s LEU 258 Cb -0.16 -2.37 0.03 0.00 0.03 0.00 0.00 46.19 43.72 3a2p s LEU 258 CO 0.09 0.02 0.98 -0.13 0.23 0.00 0.00 176.35 177.54 3a2p s ARG 259 N -3.41 3.63 -0.12 1.70 1.81 -1.26 -1.12 118.95 120.18 3a2p s ARG 259 Ca 0.32 0.33 0.00 0.00 -1.72 0.00 0.00 55.73 54.65 3a2p s ARG 259 Cb -0.09 -3.90 -0.02 0.00 -0.45 0.00 0.00 34.95 30.49 3a2p s ARG 259 CO 0.24 -1.22 -0.12 0.08 -0.68 0.00 0.00 175.30 173.60 3a2p s VAL 260 N 3.88 3.18 -0.09 3.52 1.01 -0.00 -1.08 120.40 130.82 3a2p s VAL 260 Ca 0.40 -0.63 -0.00 0.00 0.00 0.00 0.00 61.98 61.75 3a2p s VAL 260 Cb -0.10 -2.33 -0.03 0.00 0.00 0.00 0.00 36.38 33.93 3a2p s VAL 260 CO 0.26 0.53 -0.06 -0.83 0.00 0.00 0.00 175.10 175.01 3a2p s GLY 261 N 0.12 1.72 -0.10 4.51 0.00 -0.22 -0.78 107.32 112.56 3a2p s GLY 261 Ca -0.06 -0.86 0.02 0.00 0.00 0.00 0.00 44.72 43.82 3a2p s GLY 261 CO 0.04 -0.52 -0.15 0.14 0.00 0.00 0.00 173.10 172.62 3a2p s VAL 262 N -0.54 2.94 -0.22 1.40 1.01 0.72 -0.56 120.40 125.15 3a2p s VAL 262 Ca 0.08 -0.73 0.00 0.00 0.00 0.00 0.00 61.98 61.34 3a2p s VAL 262 Cb -0.12 -2.19 0.03 0.00 0.00 0.00 0.00 36.38 34.10 3a2p s VAL 262 CO 0.02 0.55 -0.13 -0.22 0.00 0.00 0.00 175.10 175.32 3a2p s LEU 263 N -0.02 2.78 -0.17 3.92 2.96 -0.29 -2.61 118.68 125.25 3a2p s LEU 263 Ca -0.04 -0.87 0.15 0.00 -0.22 0.00 0.00 54.13 53.15 3a2p s LEU 263 Cb -0.14 -1.56 0.43 0.00 0.50 0.00 0.00 46.19 45.42 3a2p s LEU 263 CO 0.04 -0.08 1.20 0.35 -1.32 0.00 0.00 176.35 176.54 3a2p n THR 264 N 4.60 1.62 -3.84 3.68 -2.24 -1.26 -4.32 114.28 112.52 3a2p n THR 264 Ca -0.18 -2.76 -0.09 0.00 -2.27 0.00 0.00 64.05 58.75 3a2p n THR 264 Cb 0.47 0.06 -0.04 0.00 -2.10 0.00 0.00 70.33 68.72 3a2p n THR 264 CO 0.00 0.00 0.00 -1.38 -0.57 0.00 0.00 175.07 173.12 3a2p s HIS 265 N -2.47 0.03 -0.55 4.78 -3.43 -1.26 -4.88 115.29 107.52 3a2p s HIS 265 Ca 0.38 -0.40 -0.22 0.00 -0.80 0.00 0.00 55.06 54.02 3a2p s HIS 265 Cb 0.38 0.35 0.05 0.00 -1.43 0.00 0.00 32.58 31.93 3a2p s HIS 265 CO -0.08 -0.97 0.80 1.21 -2.00 0.00 0.00 174.74 173.71 3a2p s ASN 266 N -2.92 6.27 0.66 7.38 2.47 -1.26 -4.91 114.94 122.62 3a2p s ASN 266 Ca 0.13 -0.70 0.44 0.00 0.42 0.00 0.00 52.86 53.16 3a2p s ASN 266 Cb -0.01 -2.37 2.40 0.00 -1.45 0.00 0.00 41.25 39.82 3a2p s ASN 266 CO 0.02 -1.11 2.36 1.55 -3.72 0.00 0.00 177.10 176.20 3a2p h PRO 267 N 9.21 0.00 0.00 0.43 0.13 -1.94 -1.43 132.00 138.39 3a2p h PRO 267 Ca -0.27 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.68 3a2p h PRO 267 Cb 1.08 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.19 3a2p h PRO 267 CO 1.05 0.00 -0.85 0.28 -0.23 0.00 0.00 178.00 178.24 3a2p h VAL 268 N 0.00 1.59 -0.12 1.56 2.07 -1.74 -3.41 116.25 116.20 3a2p h VAL 268 Ca 0.00 -2.95 -0.05 0.00 0.82 0.00 0.00 66.70 64.52 3a2p h VAL 268 Cb 0.01 2.60 -0.02 0.00 -1.52 0.00 0.00 31.29 32.37 3a2p h VAL 268 CO 0.00 0.84 -0.05 0.61 0.02 0.00 0.00 177.57 178.99 3a2p n GLY 269 N 0.99 0.57 1.02 2.17 0.00 -0.54 -4.92 105.19 104.48 3a2p n GLY 269 Ca -0.00 -0.40 0.11 0.00 0.00 0.00 0.00 46.02 45.73 3a2p n GLY 269 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3a2p n ASP 270 N 0.44 3.03 -3.60 1.61 5.75 -1.26 -4.93 116.55 117.59 3a2p n ASP 270 Ca -0.02 -1.93 -0.06 0.00 -0.01 0.00 0.00 54.79 52.76 3a2p n ASP 270 Cb 0.14 -0.24 -0.04 0.00 -1.03 0.00 0.00 41.12 39.96 3a2p n ASP 270 CO 0.00 0.00 0.00 0.72 -0.11 0.00 0.00 177.20 177.81 3a2p s PHE 271 N -1.53 -0.19 -0.04 2.11 -0.12 -1.26 -5.15 117.98 111.80 3a2p s PHE 271 Ca 0.37 0.28 -0.24 0.00 -0.05 0.00 0.00 56.93 57.28 3a2p s PHE 271 Cb 0.21 0.48 -0.04 0.00 -0.63 0.00 0.00 43.02 43.05 3a2p s PHE 271 CO 0.30 -0.20 0.75 0.00 -0.05 0.00 0.00 175.22 176.02 3a2p s ALA 272 N -1.42 3.32 0.15 1.99 0.00 -1.26 -4.65 121.76 119.90 3a2p s ALA 272 Ca 0.05 0.21 -0.31 0.00 0.00 0.00 0.00 51.96 51.91 3a2p s ALA 272 Cb -0.01 -3.01 -0.09 0.00 0.00 0.00 0.00 23.12 20.01 3a2p s ALA 272 CO -0.04 -0.10 1.45 -1.17 0.00 0.00 0.00 175.76 175.91 3a2p s LEU 273 N 0.71 4.38 0.11 0.00 2.96 -1.26 -4.91 118.68 120.67 3a2p s LEU 273 Ca 0.40 2.47 -0.35 0.00 -0.22 0.00 0.00 54.13 56.43 3a2p s LEU 273 Cb -0.19 -3.59 -0.14 0.00 0.50 0.00 0.00 46.19 42.77 3a2p s LEU 273 CO 0.20 -0.71 1.56 -0.67 -1.32 0.00 0.00 176.35 175.41 3a2p n ASP 274 N 3.67 2.83 -0.27 3.68 2.03 -0.33 -4.85 116.55 123.31 3a2p n ASP 274 Ca 0.11 1.08 0.08 0.00 0.52 0.00 0.00 54.79 56.59 3a2p n ASP 274 Cb 0.41 -1.37 0.32 0.00 -0.72 0.00 0.00 41.12 39.76 3a2p n ASP 274 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 3a2p h PRO 275 N 5.98 0.79 -0.20 -0.67 0.11 -1.90 -1.31 132.00 134.81 3a2p h PRO 275 Ca -0.46 -0.05 -0.16 0.00 0.11 0.00 0.00 66.00 65.45 3a2p h PRO 275 Cb 1.27 -0.18 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 3a2p h PRO 275 CO 0.87 0.53 -0.53 0.93 -0.21 0.00 0.00 178.00 179.59 3a2p h GLU 276 N 0.82 0.56 -0.29 1.05 5.08 -1.98 -0.52 114.58 119.30 3a2p h GLU 276 Ca 0.41 -0.35 -0.04 0.00 -1.00 0.00 0.00 59.36 58.38 3a2p h GLU 276 Cb 0.47 0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 3a2p h GLU 276 CO -0.17 0.95 0.03 0.00 -1.00 0.00 0.00 179.01 178.82 3a2p h ALA 278 N 0.86 0.88 -0.11 0.00 0.00 -1.11 -2.61 119.26 117.17 3a2p h ALA 278 Ca 0.09 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 3a2p h ALA 278 Cb 0.38 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3a2p h ALA 278 CO 0.01 0.32 -0.15 0.00 0.00 0.00 0.00 179.25 179.43 3a2p h ALA 279 N 1.24 1.55 -0.28 0.00 0.00 -0.98 -0.19 119.26 120.60 3a2p h ALA 279 Ca 0.25 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 3a2p h ALA 279 Cb -0.09 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 3a2p h ALA 279 CO -0.05 0.32 -0.06 0.00 0.00 0.00 0.00 179.25 179.46 3a2p h ALA 280 N 1.69 0.39 -0.61 0.00 0.00 -1.06 0.07 119.26 119.74 3a2p h ALA 280 Ca 0.03 -0.27 -0.10 0.00 0.00 0.00 0.00 54.91 54.57 3a2p h ALA 280 Cb 0.37 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 3a2p h ALA 280 CO 0.02 0.19 0.01 0.00 0.00 0.00 0.00 179.25 179.47 3a2p h ALA 281 N 0.78 0.83 -0.64 0.00 0.00 -1.26 -1.88 119.26 117.09 3a2p h ALA 281 Ca 0.07 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 3a2p h ALA 281 Cb 0.53 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 3a2p h ALA 281 CO 0.03 0.67 0.38 -0.09 0.00 0.00 0.00 179.25 180.23 3a2p h ARG 282 N 0.98 0.87 -0.84 0.00 9.65 -0.85 -0.54 114.38 123.65 3a2p h ARG 282 Ca 0.17 -0.08 -0.02 0.00 -1.10 0.00 0.00 59.98 58.95 3a2p h ARG 282 Cb 0.56 -0.18 -0.04 0.00 -1.39 0.00 0.00 29.97 28.92 3a2p h ARG 282 CO 0.03 0.62 0.45 0.78 2.80 0.00 0.00 179.97 184.65 3a2p h GLY 283 N 0.86 1.27 1.06 2.80 0.00 -0.71 -0.97 103.07 107.38 3a2p h GLY 283 Ca 0.23 -0.59 -0.08 0.00 0.00 0.00 0.00 47.33 46.89 3a2p h GLY 283 CO -0.04 0.56 0.09 0.00 0.00 0.00 0.00 176.54 177.15 3a2p h ALA 284 N 1.24 0.86 -0.76 3.60 0.00 -0.83 -1.69 119.26 121.67 3a2p h ALA 284 Ca 0.29 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 3a2p h ALA 284 Cb 0.05 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.57 3a2p h ALA 284 CO -0.04 0.64 0.35 0.00 0.00 0.00 0.00 179.25 180.19 3a2p h ALA 285 N 1.03 0.99 -0.71 0.00 0.00 -0.66 -1.39 119.26 118.52 3a2p h ALA 285 Ca 0.19 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3a2p h ALA 285 Cb 0.46 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 3a2p h ALA 285 CO 0.02 0.57 0.40 0.00 0.00 0.00 0.00 179.25 180.23 3a2p h ALA 286 N 1.18 0.91 -0.79 0.00 0.00 -0.82 -0.01 119.26 119.72 3a2p h ALA 286 Ca 0.26 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 3a2p h ALA 286 Cb 0.14 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 3a2p h ALA 286 CO -0.03 0.41 0.34 0.00 0.00 0.00 0.00 179.25 179.97 3a2p h ALA 287 N 1.20 1.10 -0.41 0.00 0.00 -0.86 -0.41 119.26 119.89 3a2p h ALA 287 Ca 0.25 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.89 3a2p h ALA 287 Cb 0.02 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 3a2p h ALA 287 CO -0.04 0.65 -0.13 -0.07 0.00 0.00 0.00 179.25 179.66 3a2p h LEU 288 N 1.15 0.73 -0.58 0.00 3.38 -0.61 -1.27 115.31 118.10 3a2p h LEU 288 Ca 0.27 -0.22 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 3a2p h LEU 288 Cb 0.18 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 3a2p h LEU 288 CO -0.03 0.88 0.14 0.00 0.09 0.00 0.00 178.44 179.52 3a2p h ALA 289 N 1.19 0.76 0.00 1.53 0.00 -0.38 -1.52 119.26 120.85 3a2p h ALA 289 Ca 0.11 -0.23 -0.03 0.00 0.00 0.00 0.00 54.91 54.76 3a2p h ALA 289 Cb 0.60 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 3a2p h ALA 289 CO 0.04 0.47 -0.14 0.00 0.00 0.00 0.00 179.25 179.61 3a2p h ALA 290 N 1.03 1.38 0.00 0.00 0.00 -0.73 -1.46 119.26 119.47 3a2p h ALA 290 Ca 0.18 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3a2p h ALA 290 Cb 0.35 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.12 3a2p h ALA 290 CO 0.00 0.18 0.00 1.28 0.00 0.00 0.00 179.25 180.71 3a2p n LEU 291 N -3.81 0.00 0.00 0.00 4.77 -0.51 -4.90 117.00 112.55 3a2p n LEU 291 Ca -0.02 0.31 0.00 0.00 -0.03 0.00 0.00 56.01 56.27 3a2p n LEU 291 Cb 0.25 -0.31 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 3a2p n LEU 291 CO 0.32 -0.01 0.00 0.61 -1.33 0.00 0.00 177.39 176.98 3a2p n GLY 292 N 1.26 0.67 3.83 -0.72 0.00 -0.55 -5.01 105.19 104.67 3a2p n GLY 292 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 3a2p n GLY 292 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3a2p s HIS 293 N -2.00 3.26 -0.96 1.61 3.76 -0.86 -4.64 115.29 115.46 3a2p s HIS 293 Ca 0.00 1.45 -0.18 0.00 -0.15 0.00 0.00 55.06 56.18 3a2p s HIS 293 Cb 0.00 -2.87 0.13 0.00 1.11 0.00 0.00 32.58 30.95 3a2p s HIS 293 CO 0.00 -0.80 1.17 0.34 -0.85 0.00 0.00 174.74 174.60 3a2p s ASP 294 N -3.21 6.66 -0.12 1.40 2.15 -0.27 -4.50 116.67 118.77 3a2p s ASP 294 Ca 0.60 -2.10 -0.17 0.00 0.43 0.00 0.00 52.55 51.31 3a2p s ASP 294 Cb -0.13 -2.41 -0.04 0.00 -0.30 0.00 0.00 42.92 40.04 3a2p s ASP 294 CO 0.39 -1.06 0.42 -0.69 -0.17 0.00 0.00 175.17 174.06 3a2p s VAL 295 N 2.70 5.21 0.05 1.11 1.01 -1.26 -0.82 120.40 128.40 3a2p s VAL 295 Ca 0.34 0.82 -0.05 0.00 0.00 0.00 0.00 61.98 63.10 3a2p s VAL 295 Cb -0.04 -3.75 -0.02 0.00 0.00 0.00 0.00 36.38 32.57 3a2p s VAL 295 CO -0.09 0.36 0.08 0.20 0.00 0.00 0.00 175.10 175.66 3a2p s ASN 296 N 0.44 0.25 -0.62 3.32 0.01 0.04 -4.98 114.94 113.40 3a2p s ASN 296 Ca 0.23 -0.69 -0.26 0.00 -0.71 0.00 0.00 52.86 51.42 3a2p s ASN 296 Cb -0.15 0.24 0.04 0.00 0.41 0.00 0.00 41.25 41.79 3a2p s ASN 296 CO 0.09 -0.58 1.14 -1.81 -1.51 0.00 0.00 177.10 174.42 3a2p s ASP 297 N -2.51 6.32 0.10 -1.22 1.01 -1.26 -0.20 116.67 118.91 3a2p s ASP 297 Ca 0.01 -0.26 -0.25 0.00 0.71 0.00 0.00 52.55 52.76 3a2p s ASP 297 Cb 0.03 -2.51 0.08 0.00 1.01 0.00 0.00 42.92 41.52 3a2p s ASP 297 CO -0.08 -1.51 0.66 0.00 0.21 0.00 0.00 175.17 174.45 3a2p s ALA 298 N 4.84 -1.66 0.02 5.23 0.00 -1.07 -4.83 121.76 124.29 3a2p s ALA 298 Ca 0.36 0.69 -0.27 0.00 0.00 0.00 0.00 51.96 52.74 3a2p s ALA 298 Cb -0.10 0.68 0.09 0.00 0.00 0.00 0.00 23.12 23.79 3a2p s ALA 298 CO 0.20 -0.70 0.79 1.52 0.00 0.00 0.00 175.76 177.57 3a2p s TYR 299 N -3.30 -0.44 0.16 0.00 -0.85 -1.26 -2.73 117.35 108.93 3a2p s TYR 299 Ca 0.00 0.38 -0.31 0.00 -0.52 0.00 0.00 57.07 56.62 3a2p s TYR 299 Cb -0.01 0.52 -0.11 0.00 0.38 0.00 0.00 41.96 42.74 3a2p s TYR 299 CO -0.09 -0.62 1.78 -2.14 -1.52 0.00 0.00 175.55 172.95 3a2p s PRO 300 N -2.90 4.13 0.54 -3.49 0.02 -1.26 -4.84 135.00 127.20 3a2p s PRO 300 Ca 0.01 2.59 0.22 0.00 0.02 0.00 0.00 61.00 63.85 3a2p s PRO 300 Cb -0.01 -3.36 1.42 0.00 0.02 0.00 0.00 34.50 32.56 3a2p s PRO 300 CO -0.07 -0.80 2.09 1.49 -0.33 0.00 0.00 177.00 179.38 3a2p h GLU 301 N 7.79 0.00 0.00 5.54 4.81 -1.94 -1.06 114.58 129.73 3a2p h GLU 301 Ca -0.45 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 58.78 3a2p h GLU 301 Cb 1.21 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.59 3a2p h GLU 301 CO 0.95 0.00 -0.01 0.00 -0.73 0.00 0.00 179.01 179.22 3a2p h ALA 302 N 1.86 1.42 0.00 2.92 0.00 -1.88 -1.45 119.26 122.13 3a2p h ALA 302 Ca 0.11 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3a2p h ALA 302 Cb 0.45 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3a2p h ALA 302 CO -0.00 0.01 0.00 1.28 0.00 0.00 0.00 179.25 180.54 3a2p n LEU 303 N -3.70 0.64 0.00 0.00 4.77 -0.40 -1.70 117.00 116.61 3a2p n LEU 303 Ca -0.03 0.69 0.15 0.00 -0.03 0.00 0.00 56.01 56.79 3a2p n LEU 303 Cb 0.09 -0.65 0.84 0.00 -2.33 0.00 0.00 43.42 41.37 3a2p n LEU 303 CO 0.26 -0.67 1.05 0.61 -1.33 0.00 0.00 177.39 177.31 3a2p n GLY 304 N -0.36 -1.10 3.12 -0.72 0.00 -0.55 -4.19 105.19 101.39 3a2p n GLY 304 Ca 0.01 -0.17 -0.28 0.00 0.00 0.00 0.00 46.02 45.58 3a2p n GLY 304 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3a2p s ASP 305 N -2.26 2.45 -0.11 1.61 2.15 -0.69 -4.28 116.67 115.55 3a2p s ASP 305 Ca 0.38 -0.43 0.15 0.00 0.43 0.00 0.00 52.55 53.07 3a2p s ASP 305 Cb 0.21 -1.12 0.26 0.00 -0.30 0.00 0.00 42.92 41.96 3a2p s ASP 305 CO 0.40 0.09 1.13 -1.14 -0.17 0.00 0.00 175.17 175.48 3a2p n ARG 306 N 3.73 1.03 0.29 4.34 0.63 -1.26 -4.74 116.66 120.68 3a2p n ARG 306 Ca -0.21 -2.37 0.15 0.00 -0.92 0.00 0.00 57.85 54.51 3a2p n ARG 306 Cb 0.52 -1.26 0.89 0.00 0.45 0.00 0.00 32.46 33.06 3a2p n ARG 306 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 3a2p h SER 307 N 0.20 0.00 0.16 6.15 4.64 -1.96 -1.71 113.55 121.04 3a2p h SER 307 Ca -0.01 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.29 3a2p h SER 307 Cb 1.12 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.21 3a2p h SER 307 CO 0.00 0.04 -0.08 2.19 -0.87 0.00 0.00 176.83 178.11 3a2p h PHE 308 N 0.00 0.00 -0.12 4.77 -5.15 -1.95 -2.62 116.94 111.86 3a2p h PHE 308 Ca -0.00 0.00 0.04 0.00 -0.20 0.00 0.00 57.97 57.81 3a2p h PHE 308 Cb 0.13 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 36.30 3a2p h PHE 308 CO 0.00 0.08 0.09 1.25 -2.00 0.00 0.00 178.31 177.74 3a2p h LEU 309 N 0.00 0.00 -0.24 2.10 5.85 -1.69 0.27 115.31 121.59 3a2p h LEU 309 Ca -0.00 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.69 3a2p h LEU 309 Cb 0.19 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 3a2p h LEU 309 CO 0.01 0.00 0.03 0.50 -0.34 0.00 0.00 178.44 178.64 3a2p h LYS 310 N 0.00 0.41 -0.60 1.25 3.64 -1.67 0.44 116.57 120.04 3a2p h LYS 310 Ca 0.06 -0.12 -0.02 0.00 -1.27 0.00 0.00 60.65 59.30 3a2p h LYS 310 Cb 0.24 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 31.99 3a2p h LYS 310 CO -0.00 0.55 0.29 -0.44 -2.27 0.00 0.00 179.45 177.58 3a2p h ASP 311 N 0.21 0.79 -0.87 4.20 3.32 -1.35 -2.21 116.42 120.51 3a2p h ASP 311 Ca 0.07 -0.13 -0.01 0.00 0.02 0.00 0.00 57.03 56.98 3a2p h ASP 311 Cb 0.35 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.65 3a2p h ASP 311 CO 0.01 0.71 0.50 0.22 -1.72 0.00 0.00 179.24 178.95 3a2p h TYR 312 N 0.83 1.18 -0.77 4.55 3.20 -0.80 -2.36 116.97 122.79 3a2p h TYR 312 Ca 0.21 -0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.04 3a2p h TYR 312 Cb 0.13 -0.38 -0.04 0.00 1.54 0.00 0.00 36.73 37.98 3a2p h TYR 312 CO 0.00 0.80 0.39 1.03 -1.64 0.00 0.00 178.16 178.74 3a2p h SER 313 N 1.22 0.99 -0.52 -2.11 0.87 -0.39 -0.51 113.55 113.10 3a2p h SER 313 Ca 0.31 -0.12 -0.01 0.00 -1.23 0.00 0.00 61.79 60.74 3a2p h SER 313 Cb -0.00 -0.25 -0.02 0.00 -0.44 0.00 0.00 62.40 61.68 3a2p h SER 313 CO -0.05 0.83 0.29 0.74 -0.53 0.00 0.00 176.83 178.10 3a2p h THR 314 N 1.07 1.17 -0.71 2.23 2.02 -0.93 -0.12 112.91 117.64 3a2p h THR 314 Ca 0.27 -0.43 -0.02 0.00 0.77 0.00 0.00 66.41 67.00 3a2p h THR 314 Cb 0.09 0.52 -0.03 0.00 -1.74 0.00 0.00 68.15 66.99 3a2p h THR 314 CO -0.04 0.18 0.39 0.40 0.37 0.00 0.00 175.52 176.82 3a2p h ILE 315 N 0.69 1.22 -0.69 3.11 2.04 -1.04 -2.39 117.51 120.44 3a2p h ILE 315 Ca 0.18 -0.56 -0.03 0.00 1.00 0.00 0.00 64.86 65.46 3a2p h ILE 315 Cb 0.04 0.29 -0.03 0.00 -0.74 0.00 0.00 36.82 36.38 3a2p h ILE 315 CO -0.03 0.24 0.33 0.00 0.00 0.00 0.00 178.15 178.69 3a2p h ASP 317 N 0.98 -0.01 -0.58 0.00 3.32 -0.53 -0.42 116.42 119.19 3a2p h ASP 317 Ca 0.24 0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.30 3a2p h ASP 317 Cb 0.11 0.05 -0.03 0.00 0.22 0.00 0.00 39.33 39.68 3a2p h ASP 317 CO -0.03 0.02 0.28 0.58 -1.72 0.00 0.00 179.24 178.37 3a2p h VAL 318 N 0.09 1.21 -0.32 -1.35 2.07 -1.22 -1.75 116.25 114.97 3a2p h VAL 318 Ca 0.08 -0.58 0.02 0.00 0.82 0.00 0.00 66.70 67.04 3a2p h VAL 318 Cb 0.08 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 30.36 3a2p h VAL 318 CO -0.12 0.24 0.17 0.00 0.02 0.00 0.00 177.57 177.88 3a2p h ALA 319 N 1.11 0.40 -0.27 1.67 0.00 -0.66 -0.67 119.26 120.84 3a2p h ALA 319 Ca 0.20 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 3a2p h ALA 319 Cb 0.12 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 3a2p h ALA 319 CO -0.03 -0.20 -0.02 0.82 0.00 0.00 0.00 179.25 179.83 3a2p h ILE 320 N 0.36 1.26 -0.41 0.00 1.08 -0.99 -0.71 117.51 118.11 3a2p h ILE 320 Ca 0.13 -0.96 0.08 0.00 -0.39 0.00 0.00 64.86 63.71 3a2p h ILE 320 Cb 0.03 1.36 -0.07 0.00 -3.07 0.00 0.00 36.82 35.07 3a2p h ILE 320 CO -0.08 0.31 -0.01 0.00 -0.69 0.00 0.00 178.15 177.68 3a2p h ALA 321 N 0.81 0.36 0.00 1.87 0.00 -1.08 0.10 119.26 121.33 3a2p h ALA 321 Ca 0.07 0.12 -0.07 0.00 0.00 0.00 0.00 54.91 55.04 3a2p h ALA 321 Cb 0.45 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 3a2p h ALA 321 CO 0.02 -0.40 -0.33 0.00 0.00 0.00 0.00 179.25 178.54 3a2p h ARG 322 N 0.09 0.00 -0.13 0.00 3.08 -1.04 -2.56 114.38 113.83 3a2p h ARG 322 Ca 0.20 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 60.08 3a2p h ARG 322 Cb 0.29 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.33 3a2p h ARG 322 CO -0.34 0.33 -0.64 1.49 -1.07 0.00 0.00 179.97 179.73 3a2p h GLU 323 N 0.00 0.47 -0.30 0.04 4.57 0.19 0.15 114.58 119.70 3a2p h GLU 323 Ca -0.00 -0.34 -0.08 0.00 -1.18 0.00 0.00 59.36 57.76 3a2p h GLU 323 Cb 0.83 0.06 -0.02 0.00 -0.16 0.00 0.00 28.75 29.46 3a2p h GLU 323 CO 0.04 0.95 -0.14 0.82 -1.18 0.00 0.00 179.01 179.51 3a2p h ILE 324 N 0.34 1.24 -0.23 2.32 2.04 -0.53 -1.41 117.51 121.28 3a2p h ILE 324 Ca -0.01 -1.07 -0.10 0.00 1.00 0.00 0.00 64.86 64.68 3a2p h ILE 324 Cb 1.19 1.17 -0.00 0.00 -0.74 0.00 0.00 36.82 38.44 3a2p h ILE 324 CO 0.11 0.35 -0.24 -0.08 0.00 0.00 0.00 178.15 178.29 3a2p h GLU 325 N 0.47 0.57 -0.75 2.37 4.81 -1.07 -2.35 114.58 118.64 3a2p h GLU 325 Ca 0.08 -0.31 -0.01 0.00 -0.13 0.00 0.00 59.36 59.00 3a2p h GLU 325 Cb 0.53 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.88 3a2p h GLU 325 CO 0.03 0.90 0.42 -0.09 -0.73 0.00 0.00 179.01 179.54 3a2p h ARG 326 N 0.27 1.04 -0.24 1.92 2.43 -0.68 -1.78 114.38 117.33 3a2p h ARG 326 Ca 0.04 -0.11 -0.12 0.00 -0.81 0.00 0.00 59.98 58.97 3a2p h ARG 326 Cb 0.80 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 30.13 3a2p h ARG 326 CO 0.06 0.76 -0.36 -0.91 -1.51 0.00 0.00 179.97 178.01 3a2p h ASN 327 N 1.03 0.56 -0.49 -3.80 2.35 -1.27 -2.43 115.58 111.53 3a2p h ASN 327 Ca 0.26 -0.23 -0.01 0.00 -0.55 0.00 0.00 56.30 55.77 3a2p h ASN 327 Cb 0.02 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.21 3a2p h ASN 327 CO -0.04 0.88 0.25 1.23 -1.65 0.00 0.00 177.43 178.09 3a2p h GLY 328 N 1.06 0.74 1.95 2.83 0.00 -0.99 -1.86 103.07 106.80 3a2p h GLY 328 Ca 0.05 -0.35 -0.01 0.00 0.00 0.00 0.00 47.33 47.01 3a2p h GLY 328 CO 0.07 0.34 -0.03 0.83 0.00 0.00 0.00 176.54 177.75 3a2p h GLU 329 N 0.64 0.07 -0.80 4.80 5.08 -1.13 -0.36 114.58 122.89 3a2p h GLU 329 Ca 0.17 -0.01 -0.04 0.00 -1.00 0.00 0.00 59.36 58.48 3a2p h GLU 329 Cb 0.09 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.29 3a2p h GLU 329 CO -0.02 0.11 0.35 -0.07 -1.00 0.00 0.00 179.01 178.38 3a2p h LEU 330 N 0.07 1.07 -0.35 1.33 3.38 -0.85 -2.93 115.31 117.04 3a2p h LEU 330 Ca 0.02 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.84 3a2p h LEU 330 Cb 0.10 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.57 3a2p h LEU 330 CO 0.00 0.92 -0.61 2.30 0.09 0.00 0.00 178.44 181.15 3a2p n ILE 331 N -4.29 0.00 -0.52 1.22 -5.35 -0.87 -4.98 119.36 104.56 3a2p n ILE 331 Ca 0.08 -0.09 0.00 0.00 -0.27 0.00 0.00 62.75 62.47 3a2p n ILE 331 Cb 0.16 0.78 0.00 0.00 -1.74 0.00 0.00 39.64 38.84 3a2p n ILE 331 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3a2p n GLY 332 N 1.45 0.70 3.33 3.28 0.00 -0.22 -5.07 105.19 108.66 3a2p n GLY 332 Ca 0.07 -0.35 -0.14 0.00 0.00 0.00 0.00 46.02 45.60 3a2p n GLY 332 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3a2p s ARG 333 N -0.83 0.58 0.31 1.61 1.70 -0.76 -4.99 118.95 116.57 3a2p s ARG 333 Ca 0.00 0.42 -0.29 0.00 -0.47 0.00 0.00 55.73 55.39 3a2p s ARG 333 Cb 0.00 0.28 -0.10 0.00 -0.57 0.00 0.00 34.95 34.55 3a2p s ARG 333 CO 0.00 -0.10 1.42 -2.14 -1.08 0.00 0.00 175.30 173.39 3a2p s PRO 334 N -0.18 4.25 0.37 3.89 0.02 -1.26 -4.36 135.00 137.72 3a2p s PRO 334 Ca -0.04 2.36 -0.21 0.00 0.02 0.00 0.00 61.00 63.13 3a2p s PRO 334 Cb -0.03 -3.05 -0.10 0.00 0.02 0.00 0.00 34.50 31.33 3a2p s PRO 334 CO 0.02 -0.38 0.90 -0.51 -0.33 0.00 0.00 177.00 176.69 3a2p s LEU 335 N -1.30 4.09 0.49 -5.54 1.43 -1.26 -5.02 118.68 111.57 3a2p s LEU 335 Ca 0.54 1.64 0.02 0.00 -1.03 0.00 0.00 54.13 55.31 3a2p s LEU 335 Cb -0.43 -4.26 -0.02 0.00 0.03 0.00 0.00 46.19 41.51 3a2p s LEU 335 CO 0.52 -0.23 0.02 0.42 0.23 0.00 0.00 176.35 177.31 3a2p s THR 336 N -1.95 1.34 -0.60 5.49 -4.23 -1.26 -4.98 115.64 109.45 3a2p s THR 336 Ca 0.56 -1.98 0.08 0.00 -1.18 0.00 0.00 61.69 59.17 3a2p s THR 336 Cb -0.12 -2.32 0.08 0.00 1.34 0.00 0.00 72.50 71.47 3a2p s THR 336 CO 0.17 0.00 1.19 1.21 -0.54 0.00 0.00 174.62 176.65 3a2p n GLU 337 N -1.22 0.05 0.00 3.99 2.13 -1.26 -0.32 120.64 124.01 3a2p n GLU 337 Ca -0.16 0.51 0.12 0.00 0.66 0.00 0.00 57.16 58.29 3a2p n GLU 337 Cb 0.67 -1.73 0.16 0.00 0.27 0.00 0.00 31.44 30.81 3a2p n GLU 337 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 3a2p n ASP 338 N -1.74 1.53 -0.00 4.31 8.00 -1.26 -4.15 116.55 123.23 3a2p n ASP 338 Ca -0.01 -1.20 0.09 0.00 0.71 0.00 0.00 54.79 54.39 3a2p n ASP 338 Cb 0.08 0.35 -0.15 0.00 -0.02 0.00 0.00 41.12 41.38 3a2p n ASP 338 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3a2p n ASP 339 N -0.39 0.13 -4.55 -2.24 8.00 0.57 -4.74 116.55 113.34 3a2p n ASP 339 Ca 0.10 0.05 -0.25 0.00 0.71 0.00 0.00 54.79 55.40 3a2p n ASP 339 Cb 0.41 1.68 -0.11 0.00 -0.02 0.00 0.00 41.12 43.08 3a2p n ASP 339 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 3a2p s VAL 340 N -3.41 1.69 0.60 2.53 -7.23 -1.22 -0.92 120.40 112.44 3a2p s VAL 340 Ca -0.07 -2.01 -0.16 0.00 -1.81 0.00 0.00 61.98 57.92 3a2p s VAL 340 Cb 0.13 -2.89 -0.03 0.00 0.56 0.00 0.00 36.38 34.15 3a2p s VAL 340 CO 0.89 -0.02 1.08 -1.61 -0.31 0.00 0.00 175.10 175.13 3a2p s GLU 341 N -3.78 3.20 0.29 4.82 2.02 -1.26 -4.86 118.70 119.13 3a2p s GLU 341 Ca 0.35 1.32 0.00 0.00 0.02 0.00 0.00 54.97 56.67 3a2p s GLU 341 Cb 0.09 -2.01 0.52 0.00 0.10 0.00 0.00 34.13 32.83 3a2p s GLU 341 CO 0.17 -0.92 1.88 0.11 0.02 0.00 0.00 175.26 176.52 3a2p h TRP 342 N 0.49 1.10 -0.69 1.61 5.08 -1.98 -1.50 115.95 120.05 3a2p h TRP 342 Ca -0.47 0.03 0.01 0.00 1.08 0.00 0.00 58.89 59.53 3a2p h TRP 342 Cb 1.23 -0.36 -0.03 0.00 -3.00 0.00 0.00 29.16 27.00 3a2p h TRP 342 CO 0.56 0.54 0.46 1.79 -1.28 0.00 0.00 178.44 180.51 3a2p h THR 343 N 1.05 1.18 -0.32 0.12 1.35 -1.96 -1.08 112.91 113.24 3a2p h THR 343 Ca 0.43 -0.32 -0.11 0.00 -0.55 0.00 0.00 66.41 65.86 3a2p h THR 343 Cb 0.28 0.16 -0.01 0.00 -1.73 0.00 0.00 68.15 66.85 3a2p h THR 343 CO -0.18 0.17 -0.23 0.28 -0.25 0.00 0.00 175.52 175.31 3a2p h SER 344 N 0.94 0.75 -0.10 5.36 0.02 -1.66 -3.04 113.55 115.82 3a2p h SER 344 Ca 0.25 -0.44 -0.08 0.00 -0.84 0.00 0.00 61.79 60.69 3a2p h SER 344 Cb -0.11 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.21 3a2p h SER 344 CO -0.05 1.03 -0.16 -0.25 -1.14 0.00 0.00 176.83 176.25 3a2p h TRP 345 N 0.48 0.51 -0.82 3.45 2.91 -1.06 -2.53 115.95 118.89 3a2p h TRP 345 Ca 0.06 -0.09 0.09 0.00 1.13 0.00 0.00 58.89 60.08 3a2p h TRP 345 Cb 0.79 -0.13 -0.07 0.00 -0.51 0.00 0.00 29.16 29.23 3a2p h TRP 345 CO 0.07 0.61 0.48 1.49 -1.03 0.00 0.00 178.44 180.06 3a2p h GLU 346 N 0.43 0.79 0.00 2.65 4.57 -1.10 -0.29 114.58 121.63 3a2p h GLU 346 Ca 0.08 -0.05 -0.04 0.00 -1.18 0.00 0.00 59.36 58.17 3a2p h GLU 346 Cb 0.54 -0.18 -0.01 0.00 -0.16 0.00 0.00 28.75 28.95 3a2p h GLU 346 CO 0.03 0.52 -0.19 0.52 -1.18 0.00 0.00 179.01 178.71 3a2p h MET 347 N 0.81 0.00 -0.51 1.92 2.86 -1.36 -2.05 114.93 116.60 3a2p h MET 347 Ca 0.39 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.98 3a2p h MET 347 Cb 0.32 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.96 3a2p h MET 347 CO -0.23 0.19 0.12 0.28 1.06 0.00 0.00 176.91 178.34 3a2p h VAL 348 N 0.00 1.24 -0.07 -2.22 2.07 -0.95 0.50 116.25 116.82 3a2p h VAL 348 Ca -0.00 -0.85 -0.01 0.00 0.82 0.00 0.00 66.70 66.66 3a2p h VAL 348 Cb 0.43 0.82 -0.00 0.00 -1.52 0.00 0.00 31.29 31.02 3a2p h VAL 348 CO 0.03 0.31 0.01 0.11 0.02 0.00 0.00 177.57 178.04 3a2p h LYS 349 N 0.71 0.11 -0.79 1.57 1.57 -1.20 -2.97 116.57 115.57 3a2p h LYS 349 Ca 0.16 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 3a2p h LYS 349 Cb 0.33 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.59 3a2p h LYS 349 CO 0.00 0.34 0.51 0.00 -0.57 0.00 0.00 179.45 179.74 3a2p h ARG 350 N -0.13 1.05 -0.64 3.15 3.08 -1.25 -2.26 114.38 117.38 3a2p h ARG 350 Ca 0.02 -0.07 0.05 0.00 0.07 0.00 0.00 59.98 60.05 3a2p h ARG 350 Cb 0.29 -0.23 -0.04 0.00 0.08 0.00 0.00 29.97 30.06 3a2p h ARG 350 CO 0.00 0.71 0.42 0.00 -1.07 0.00 0.00 179.97 180.03 3a2p h ALA 351 N 1.49 1.70 0.00 0.04 0.00 -0.75 -0.71 119.26 121.03 3a2p h ALA 351 Ca 0.29 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.17 3a2p h ALA 351 Cb -0.10 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.49 3a2p h ALA 351 CO -0.06 0.21 0.00 -0.44 0.00 0.00 0.00 179.25 178.96 3a2p h ASP 352 N 0.71 0.00 0.12 0.00 3.32 -1.26 -2.00 116.42 117.31 3a2p h ASP 352 Ca 0.26 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.31 3a2p h ASP 352 Cb 0.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.71 3a2p h ASP 352 CO -0.08 0.00 -0.25 0.00 -1.72 0.00 0.00 179.24 177.19 3a2p n GLN 353 N -2.62 1.16 -3.20 3.56 1.13 -0.28 -4.88 117.38 112.25 3a2p n GLN 353 Ca 0.00 -0.79 -0.39 0.00 -1.94 0.00 0.00 57.00 53.88 3a2p n GLN 353 Cb 0.18 -1.48 -0.06 0.00 0.11 0.00 0.00 30.24 28.99 3a2p n GLN 353 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 3a2p s VAL 354 N -2.38 5.10 0.55 5.09 1.01 -0.75 -5.07 120.40 123.94 3a2p s VAL 354 Ca 0.25 1.08 -0.01 0.00 0.00 0.00 0.00 61.98 63.31 3a2p s VAL 354 Cb 0.19 -3.89 0.02 0.00 0.00 0.00 0.00 36.38 32.71 3a2p s VAL 354 CO 0.49 0.21 0.79 0.42 0.00 0.00 0.00 175.10 177.01 3a2p s THR 355 N 1.30 3.15 0.13 3.92 -4.23 -1.26 -4.94 115.64 113.71 3a2p s THR 355 Ca 0.28 -0.47 -0.17 0.00 -1.18 0.00 0.00 61.69 60.15 3a2p s THR 355 Cb -0.16 -3.21 -0.02 0.00 1.34 0.00 0.00 72.50 70.46 3a2p s THR 355 CO 0.11 -0.16 1.74 1.23 -0.54 0.00 0.00 174.62 176.99 3a2p h GLY 356 N 0.05 0.52 1.12 3.99 0.00 -1.99 -1.27 103.07 105.48 3a2p h GLY 356 Ca -0.44 -0.23 -0.03 0.00 0.00 0.00 0.00 47.33 46.63 3a2p h GLY 356 CO 0.56 0.22 0.40 3.21 0.00 0.00 0.00 176.54 180.93 3a2p h ARG 357 N 0.44 1.13 -0.35 4.80 3.08 -1.99 -1.80 114.38 119.69 3a2p h ARG 357 Ca 0.12 -0.15 -0.03 0.00 0.07 0.00 0.00 59.98 59.99 3a2p h ARG 357 Cb 0.06 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 29.88 3a2p h ARG 357 CO -0.02 0.86 0.11 0.00 -1.07 0.00 0.00 179.97 179.85 3a2p h ALA 358 N 1.31 0.45 -0.26 0.04 0.00 -1.86 -0.60 119.26 118.33 3a2p h ALA 358 Ca 0.28 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3a2p h ALA 358 Cb 0.09 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3a2p h ALA 358 CO -0.04 0.09 0.17 0.35 0.00 0.00 0.00 179.25 179.82 3a2p h PHE 359 N 0.41 0.32 -0.86 0.00 3.57 -0.99 -0.86 116.94 118.53 3a2p h PHE 359 Ca 0.11 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.62 3a2p h PHE 359 Cb 0.25 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 38.84 3a2p h PHE 359 CO 0.01 0.20 0.52 0.00 -2.23 0.00 0.00 178.31 176.81 3a2p h ALA 360 N 1.10 1.29 -0.67 2.41 0.00 -1.18 -2.15 119.26 120.06 3a2p h ALA 360 Ca 0.10 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 3a2p h ALA 360 Cb -0.03 -0.35 -0.03 0.00 0.00 0.00 0.00 17.79 17.38 3a2p h ALA 360 CO -0.03 0.61 0.10 0.00 0.00 0.00 0.00 179.25 179.94 3a2p h ALA 361 N 1.38 0.89 -0.70 0.00 0.00 -0.57 -2.12 119.26 118.14 3a2p h ALA 361 Ca 0.31 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 3a2p h ALA 361 Cb -0.05 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.46 3a2p h ALA 361 CO -0.06 0.66 0.27 0.00 0.00 0.00 0.00 179.25 180.12 3a2p h VAL 363 N 1.01 1.21 -0.66 0.00 2.07 -1.22 -2.00 116.25 116.66 3a2p h VAL 363 Ca 0.23 -0.62 0.01 0.00 0.82 0.00 0.00 66.70 67.14 3a2p h VAL 363 Cb 0.23 0.58 -0.03 0.00 -1.52 0.00 0.00 31.29 30.55 3a2p h VAL 363 CO -0.02 0.24 0.44 0.44 0.02 0.00 0.00 177.57 178.70 3a2p h ASP 364 N 0.76 0.76 -0.83 0.57 3.32 -1.00 -1.22 116.42 118.78 3a2p h ASP 364 Ca 0.19 -0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.20 3a2p h ASP 364 Cb 0.15 -0.19 -0.04 0.00 0.22 0.00 0.00 39.33 39.47 3a2p h ASP 364 CO -0.02 0.55 0.44 -0.33 -1.72 0.00 0.00 179.24 178.15 3a2p h GLU 365 N 0.89 1.17 -0.49 3.56 4.39 -0.52 -0.72 114.58 122.86 3a2p h GLU 365 Ca 0.24 -0.15 -0.05 0.00 0.34 0.00 0.00 59.36 59.75 3a2p h GLU 365 Cb -0.10 -0.22 -0.02 0.00 -0.10 0.00 0.00 28.75 28.31 3a2p h GLU 365 CO -0.05 0.87 0.11 -0.07 -1.16 0.00 0.00 179.01 178.71 3a2p h LEU 366 N 1.17 0.75 -0.63 1.33 3.38 -0.67 -1.57 115.31 119.08 3a2p h LEU 366 Ca 0.29 -0.24 -0.04 0.00 0.09 0.00 0.00 57.88 57.99 3a2p h LEU 366 Cb 0.06 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.58 3a2p h LEU 366 CO -0.04 0.79 0.25 0.03 0.09 0.00 0.00 178.44 179.56 3a2p h ARG 367 N 0.67 0.94 -0.55 1.13 2.47 -0.83 0.15 114.38 118.36 3a2p h ARG 367 Ca 0.15 -0.17 -0.05 0.00 -1.26 0.00 0.00 59.98 58.66 3a2p h ARG 367 Cb 0.34 -0.15 -0.02 0.00 -1.65 0.00 0.00 29.97 28.48 3a2p h ARG 367 CO 0.00 0.79 0.16 1.88 0.56 0.00 0.00 179.97 183.37 3a2p h TYR 368 N 0.88 0.90 -0.50 3.04 0.05 -1.00 -1.81 116.97 118.52 3a2p h TYR 368 Ca 0.21 -0.10 -0.05 0.00 0.05 0.00 0.00 58.73 58.84 3a2p h TYR 368 Cb 0.20 -0.26 -0.02 0.00 1.01 0.00 0.00 36.73 37.66 3a2p h TYR 368 CO 0.01 0.77 0.12 -0.92 -1.05 0.00 0.00 178.16 177.09 3a2p h TYR 369 N 0.77 0.85 -0.96 4.88 3.20 -1.04 -2.11 116.97 122.56 3a2p h TYR 369 Ca 0.18 -0.10 0.11 0.00 3.14 0.00 0.00 58.73 62.06 3a2p h TYR 369 Cb 0.30 -0.24 -0.08 0.00 1.54 0.00 0.00 36.73 38.25 3a2p h TYR 369 CO 0.02 0.75 0.59 0.00 -1.64 0.00 0.00 178.16 177.88 3a2p h ALA 370 N 1.00 1.42 -0.42 1.82 0.00 -0.72 -1.02 119.26 121.34 3a2p h ALA 370 Ca 0.16 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.06 3a2p h ALA 370 Cb 0.33 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3a2p h ALA 370 CO 0.00 0.20 0.14 0.78 0.00 0.00 0.00 179.25 180.37 3a2p h GLY 371 N 0.94 0.69 1.05 0.00 0.00 -0.76 -1.16 103.07 103.83 3a2p h GLY 371 Ca 0.47 -0.40 -0.01 0.00 0.00 0.00 0.00 47.33 47.39 3a2p h GLY 371 CO -0.26 0.37 0.53 0.50 0.00 0.00 0.00 176.54 177.68 3a2p h LYS 372 N 0.53 1.26 0.04 4.80 1.57 -0.64 -2.21 116.57 121.93 3a2p h LYS 372 Ca 0.14 -0.13 -0.00 0.00 -1.87 0.00 0.00 60.65 58.79 3a2p h LYS 372 Cb 0.24 -0.26 0.00 0.00 0.08 0.00 0.00 32.23 32.29 3a2p h LYS 372 CO -0.01 0.89 -0.02 0.28 -0.57 0.00 0.00 179.45 180.03 3a2p h VAL 373 N 1.27 1.19 0.00 0.50 2.07 -1.03 -3.20 116.25 117.06 3a2p h VAL 373 Ca 0.33 -0.74 -0.01 0.00 0.82 0.00 0.00 66.70 67.09 3a2p h VAL 373 Cb -0.02 1.68 -0.00 0.00 -1.52 0.00 0.00 31.29 31.43 3a2p h VAL 373 CO -0.06 0.19 -0.06 -0.33 0.02 0.00 0.00 177.57 177.33 3a2p h GLU 374 N -0.38 0.00 -0.01 1.57 5.08 -1.05 -2.70 114.58 117.09 3a2p h GLU 374 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3a2p h GLU 374 Cb 0.35 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.60 3a2p h GLU 374 CO 0.01 0.06 0.01 0.00 -1.00 0.00 0.00 179.01 178.08 3a2p h ARG 375 N 0.00 0.00 -0.62 2.33 3.08 -1.39 -1.56 114.38 116.22 3a2p h ARG 375 Ca -0.00 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.01 3a2p h ARG 375 Cb 0.18 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.21 3a2p h ARG 375 CO 0.01 0.00 0.23 2.35 -1.07 0.00 0.00 179.97 181.49 3a2p h TRP 376 N 0.00 0.97 -0.09 3.04 7.01 -1.64 -0.13 115.95 125.10 3a2p h TRP 376 Ca 0.00 -0.08 -0.17 0.00 2.11 0.00 0.00 58.89 60.75 3a2p h TRP 376 Cb 0.02 -0.29 -0.01 0.00 -2.10 0.00 0.00 29.16 26.78 3a2p h TRP 376 CO 0.00 0.77 -0.68 -1.49 -2.79 0.00 0.00 178.44 174.26 3a2p h TRP 377 N 0.88 0.51 -0.26 2.65 6.55 -1.50 -2.84 115.95 121.93 3a2p h TRP 377 Ca 0.21 -0.21 -0.01 0.00 0.95 0.00 0.00 58.89 59.82 3a2p h TRP 377 Cb 0.23 -0.08 -0.01 0.00 -0.86 0.00 0.00 29.16 28.43 3a2p h TRP 377 CO 0.01 0.95 0.10 1.49 -1.05 0.00 0.00 178.44 179.94 3a2p h GLU 378 N 0.27 0.36 0.00 0.49 4.57 -0.88 -1.70 114.58 117.69 3a2p h GLU 378 Ca -0.02 -0.04 0.00 0.00 -1.18 0.00 0.00 59.36 58.12 3a2p h GLU 378 Cb 1.23 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 29.75 3a2p h GLU 378 CO 0.12 0.30 0.00 0.00 -1.18 0.00 0.00 179.01 178.25 3a2p n ALA 379 N -2.49 2.42 0.00 2.92 0.00 -0.11 -4.85 120.51 118.40 3a2p n ALA 379 Ca 0.01 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.29 3a2p n ALA 379 Cb 0.13 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.17 3a2p n ALA 379 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a2p n GLY 380 N 0.56 1.92 3.76 0.00 0.00 -0.64 -5.09 105.19 105.70 3a2p n GLY 380 Ca 0.18 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 3a2p n GLY 380 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3a2p s TRP 381 N -1.95 3.51 -0.26 1.61 0.52 -1.20 -4.71 118.94 116.47 3a2p s TRP 381 Ca 0.00 1.69 0.01 0.00 0.02 0.00 0.00 56.10 57.83 3a2p s TRP 381 Cb 0.00 -3.25 -0.17 0.00 -1.15 0.00 0.00 33.47 28.91 3a2p s TRP 381 CO 0.00 -0.56 -0.23 -0.25 0.02 0.00 0.00 176.95 175.93 3a2p n ASP 382 N 0.91 2.00 -3.91 2.95 8.00 -0.24 -4.34 116.55 121.93 3a2p n ASP 382 Ca 0.00 -0.12 -0.11 0.00 0.71 0.00 0.00 54.79 55.27 3a2p n ASP 382 Cb 0.46 -0.42 -0.11 0.00 -0.02 0.00 0.00 41.12 41.03 3a2p n ASP 382 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3a2p s LEU 383 N -6.53 1.88 -0.10 0.64 1.43 -1.06 -3.88 118.68 111.05 3a2p s LEU 383 Ca -0.35 -0.23 0.02 0.00 -1.03 0.00 0.00 54.13 52.55 3a2p s LEU 383 Cb 0.09 0.32 -0.01 0.00 0.03 0.00 0.00 46.19 46.62 3a2p s LEU 383 CO 0.59 -0.25 -0.17 -0.22 0.23 0.00 0.00 176.35 176.53 3a2p s LEU 384 N -1.02 2.48 -0.13 1.79 2.96 -0.49 -1.06 118.68 123.21 3a2p s LEU 384 Ca -0.11 -0.39 0.01 0.00 -0.22 0.00 0.00 54.13 53.41 3a2p s LEU 384 Cb -0.07 -1.52 -0.01 0.00 0.50 0.00 0.00 46.19 45.09 3a2p s LEU 384 CO 0.00 0.19 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.44 3a2p s ILE 385 N 0.16 2.77 0.20 6.68 -1.09 0.28 -0.99 121.20 129.20 3a2p s ILE 385 Ca -0.09 -0.76 -0.21 0.00 -2.23 0.00 0.00 60.65 57.35 3a2p s ILE 385 Cb -0.16 -2.15 0.05 0.00 -1.58 0.00 0.00 42.46 38.63 3a2p s ILE 385 CO 0.06 0.53 0.62 -1.48 -1.23 0.00 0.00 174.94 173.43 3a2p s LEU 386 N 0.46 -0.36 0.56 2.97 2.34 -0.49 -1.14 118.68 123.03 3a2p s LEU 386 Ca -0.11 -0.26 -0.20 0.00 0.06 0.00 0.00 54.13 53.62 3a2p s LEU 386 Cb -0.16 2.55 -0.04 0.00 -0.56 0.00 0.00 46.19 47.97 3a2p s LEU 386 CO 0.05 -1.09 1.23 -2.84 -1.06 0.00 0.00 176.35 172.64 3a2p s PRO 387 N -3.82 3.12 0.04 1.48 0.02 -1.26 0.15 135.00 134.72 3a2p s PRO 387 Ca 0.05 1.90 -0.19 0.00 0.02 0.00 0.00 61.00 62.78 3a2p s PRO 387 Cb -0.02 -2.06 -0.15 0.00 0.02 0.00 0.00 34.50 32.28 3a2p s PRO 387 CO -0.06 -1.11 1.29 1.15 -0.33 0.00 0.00 177.00 177.94 3a2p h THR 388 N 1.14 1.37 -2.34 0.99 2.02 -1.71 -3.41 112.91 110.96 3a2p h THR 388 Ca -0.50 -1.53 -0.58 0.00 0.77 0.00 0.00 66.41 64.57 3a2p h THR 388 Cb 1.29 2.01 -0.14 0.00 -1.74 0.00 0.00 68.15 69.57 3a2p h THR 388 CO 0.56 0.45 -0.75 0.68 0.37 0.00 0.00 175.52 176.84 3a2p s VAL 389 N -4.02 2.30 -2.05 3.16 -7.23 -1.26 -4.29 120.40 107.01 3a2p s VAL 389 Ca -0.14 -2.35 0.18 0.00 -1.81 0.00 0.00 61.98 57.86 3a2p s VAL 389 Cb 0.05 -2.27 0.22 0.00 0.56 0.00 0.00 36.38 34.95 3a2p s VAL 389 CO 0.78 -0.43 1.14 0.35 -0.31 0.00 0.00 175.10 176.64 3a2p n THR 390 N -0.58 0.24 -4.18 5.32 -2.24 -0.91 -4.90 114.28 107.03 3a2p n THR 390 Ca -0.06 -0.62 -0.12 0.00 -2.27 0.00 0.00 64.05 60.99 3a2p n THR 390 Cb 0.60 1.16 -0.10 0.00 -2.10 0.00 0.00 70.33 69.90 3a2p n THR 390 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3a2p s ARG 391 N -1.37 1.24 0.72 -0.78 1.70 -1.26 -1.19 118.95 118.01 3a2p s ARG 391 Ca 0.25 -1.60 -0.13 0.00 -0.47 0.00 0.00 55.73 53.77 3a2p s ARG 391 Cb 0.16 0.29 0.03 0.00 -0.57 0.00 0.00 34.95 34.86 3a2p s ARG 391 CO 0.23 -0.41 1.11 -0.65 -1.08 0.00 0.00 175.30 174.50 3a2p s GLN 392 N -4.14 2.47 0.06 3.89 -1.52 -1.26 -4.94 119.66 114.22 3a2p s GLN 392 Ca 0.38 1.35 -0.31 0.00 -1.95 0.00 0.00 55.36 54.83 3a2p s GLN 392 Cb 0.06 -1.91 -0.07 0.00 -0.22 0.00 0.00 33.01 30.87 3a2p s GLN 392 CO 0.12 -1.50 1.41 0.99 -0.25 0.00 0.00 175.29 176.06 3a2p s THR 393 N -2.52 3.49 0.74 -0.19 2.01 -1.26 -4.99 115.64 112.91 3a2p s THR 393 Ca 0.65 0.98 -0.13 0.00 0.31 0.00 0.00 61.69 63.51 3a2p s THR 393 Cb -0.20 -3.63 0.04 0.00 0.01 0.00 0.00 72.50 68.72 3a2p s THR 393 CO 0.48 0.03 1.11 -2.16 -0.69 0.00 0.00 174.62 173.39 3a2p s PRO 394 N 1.83 2.36 0.49 4.92 0.04 -1.26 -4.84 135.00 138.54 3a2p s PRO 394 Ca 0.65 1.34 -0.15 0.00 0.04 0.00 0.00 61.00 62.88 3a2p s PRO 394 Cb -0.34 -1.90 -0.07 0.00 0.04 0.00 0.00 34.50 32.22 3a2p s PRO 394 CO 0.29 -1.58 0.93 -1.21 0.04 0.00 0.00 177.00 175.46 3a2p s GLU 395 N -4.48 3.90 0.33 4.56 2.02 -1.26 -0.80 118.70 122.97 3a2p s GLU 395 Ca 0.65 0.82 -0.28 0.00 0.02 0.00 0.00 54.97 56.18 3a2p s GLU 395 Cb -0.20 -2.20 -0.13 0.00 0.10 0.00 0.00 34.13 31.70 3a2p s GLU 395 CO 0.49 -0.22 1.25 -0.89 0.02 0.00 0.00 175.26 175.92 3a2p n ILE 396 N -1.53 2.01 0.00 -1.63 2.08 -0.39 -1.34 119.36 118.55 3a2p n ILE 396 Ca 0.05 -0.50 0.00 0.00 0.56 0.00 0.00 62.75 62.86 3a2p n ILE 396 Cb 0.54 -1.48 0.00 0.00 -0.75 0.00 0.00 39.64 37.95 3a2p n ILE 396 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 3a2p n GLY 397 N 0.84 2.72 0.19 7.39 0.00 -1.26 -4.90 105.19 110.17 3a2p n GLY 397 Ca 0.05 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.97 3a2p n GLY 397 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 3a2p h GLU 398 N 1.96 0.59 0.00 1.61 4.81 -1.59 -3.23 114.58 118.73 3a2p h GLU 398 Ca 0.00 -0.17 0.00 0.00 -0.13 0.00 0.00 59.36 59.06 3a2p h GLU 398 Cb 0.00 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.32 3a2p h GLU 398 CO 0.00 0.68 -0.31 1.28 -0.73 0.00 0.00 179.01 179.93 3a2p n LEU 399 N -4.56 0.48 -4.64 1.64 4.77 -1.26 -4.79 117.00 108.64 3a2p n LEU 399 Ca -0.02 0.30 -0.42 0.00 -0.03 0.00 0.00 56.01 55.85 3a2p n LEU 399 Cb 0.24 -0.31 -0.04 0.00 -2.33 0.00 0.00 43.42 40.98 3a2p n LEU 399 CO 0.39 -0.02 0.67 -0.04 -1.33 0.00 0.00 177.39 177.06 3a2p s MET 400 N -3.07 4.14 0.29 3.23 -1.94 -1.22 -4.97 119.30 115.76 3a2p s MET 400 Ca 0.10 0.90 -0.11 0.00 -1.71 0.00 0.00 55.69 54.88 3a2p s MET 400 Cb 0.16 -3.67 -0.07 0.00 2.01 0.00 0.00 34.83 33.26 3a2p s MET 400 CO 0.64 -0.58 0.63 -0.51 -0.01 0.00 0.00 175.02 175.19 3a2p s LEU 401 N 2.94 4.07 0.38 -0.03 1.43 -1.26 -4.99 118.68 121.22 3a2p s LEU 401 Ca 0.35 1.02 -0.25 0.00 -1.03 0.00 0.00 54.13 54.22 3a2p s LEU 401 Cb -0.15 -3.82 -0.09 0.00 0.03 0.00 0.00 46.19 42.16 3a2p s LEU 401 CO 0.09 -0.17 1.11 0.00 0.23 0.00 0.00 176.35 177.60 3a2p s ALA 402 N -1.98 3.17 -0.52 4.21 0.00 -1.26 -4.87 121.76 120.52 3a2p s ALA 402 Ca 0.49 0.85 0.00 0.00 0.00 0.00 0.00 51.96 53.31 3a2p s ALA 402 Cb -0.11 -3.33 0.00 0.00 0.00 0.00 0.00 23.12 19.68 3a2p s ALA 402 CO 0.23 -0.35 0.69 1.17 0.00 0.00 0.00 175.76 177.50 3a2p n LYS 403 N 0.21 0.00 -0.28 0.00 0.00 -1.26 -0.15 118.16 116.69 3a2p n LYS 403 Ca 0.04 0.22 0.09 0.00 0.00 0.00 0.00 58.31 58.65 3a2p n LYS 403 Cb 0.47 -1.74 0.24 0.00 0.00 0.00 0.00 35.03 34.00 3a2p n LYS 403 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3a2p n GLY 404 N -1.19 2.65 3.76 3.14 0.00 -1.26 -5.00 105.19 107.29 3a2p n GLY 404 Ca 0.00 -0.58 -0.41 0.00 0.00 0.00 0.00 46.02 45.03 3a2p n GLY 404 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3a2p s THR 405 N -1.02 3.19 -1.22 2.61 2.01 0.79 -4.95 115.64 117.05 3a2p s THR 405 Ca 0.36 1.15 -0.12 0.00 0.31 0.00 0.00 61.69 63.40 3a2p s THR 405 Cb 0.19 -3.73 0.19 0.00 0.01 0.00 0.00 72.50 69.15 3a2p s THR 405 CO 0.24 0.26 1.53 -0.67 -0.69 0.00 0.00 174.62 175.28 3a2p n ASP 406 N 1.31 5.28 0.31 3.53 4.64 -1.26 -4.83 116.55 125.53 3a2p n ASP 406 Ca 0.00 -3.04 -0.12 0.00 -1.38 0.00 0.00 54.79 50.25 3a2p n ASP 406 Cb 0.43 -1.51 -0.06 0.00 -1.04 0.00 0.00 41.12 38.94 3a2p n ASP 406 CO 0.00 0.00 0.00 -0.07 -0.82 0.00 0.00 177.20 176.31 3a2p h LEU 407 N 8.74 -0.68 -2.76 -2.67 3.38 -1.92 -3.49 115.31 115.91 3a2p h LEU 407 Ca 0.32 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.31 3a2p h LEU 407 Cb 0.80 0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.72 3a2p h LEU 407 CO 1.33 -0.48 -0.25 -0.62 0.09 0.00 0.00 178.44 178.51 3a2p n GLU 408 N -4.14 -0.93 -2.63 1.13 1.02 -1.26 -4.62 120.64 109.20 3a2p n GLU 408 Ca -0.10 1.12 -0.20 0.00 -0.02 0.00 0.00 57.16 57.96 3a2p n GLU 408 Cb 0.31 -2.48 0.01 0.00 -0.02 0.00 0.00 31.44 29.26 3a2p n GLU 408 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3a2p n GLY 409 N -0.02 -0.45 3.62 0.62 0.00 -1.26 -5.00 105.19 102.70 3a2p n GLY 409 Ca 0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.93 3a2p n GLY 409 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3a2p s ARG 410 N -5.26 0.58 0.31 1.61 3.52 -1.26 -5.00 118.95 113.45 3a2p s ARG 410 Ca 0.12 0.56 -0.25 0.00 -0.13 0.00 0.00 55.73 56.03 3a2p s ARG 410 Cb -0.05 0.28 -0.15 0.00 -1.56 0.00 0.00 34.95 33.47 3a2p s ARG 410 CO 0.15 -0.10 0.48 1.04 -0.81 0.00 0.00 175.30 176.06 3a2p n GLN 411 N 1.97 0.30 0.19 5.12 1.13 -1.26 -4.85 117.38 119.98 3a2p n GLN 411 Ca -0.13 0.11 0.07 0.00 -1.94 0.00 0.00 57.00 55.11 3a2p n GLN 411 Cb 0.56 -1.22 0.28 0.00 0.11 0.00 0.00 30.24 29.97 3a2p n GLN 411 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 3a2p h SER 412 N 0.90 0.00 1.03 1.08 4.64 -1.96 -2.67 113.55 116.58 3a2p h SER 412 Ca -0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 3a2p h SER 412 Cb 1.42 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.51 3a2p h SER 412 CO 0.54 0.33 -0.00 0.00 -0.87 0.00 0.00 176.83 176.82 3a2p n ALA 413 N -2.23 2.34 -0.66 5.18 0.00 -1.26 -3.28 120.51 120.59 3a2p n ALA 413 Ca 0.01 -0.10 0.09 0.00 0.00 0.00 0.00 53.44 53.44 3a2p n ALA 413 Cb 0.55 -1.47 0.35 0.00 0.00 0.00 0.00 19.45 18.89 3a2p n ALA 413 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3a2p n PHE 414 N -1.56 1.49 -4.27 0.00 3.72 -1.01 -3.06 117.46 112.77 3a2p n PHE 414 Ca 0.07 -0.63 -0.17 0.00 -0.05 0.00 0.00 57.45 56.66 3a2p n PHE 414 Cb 0.35 -0.27 -0.11 0.00 -0.94 0.00 0.00 39.48 38.51 3a2p n PHE 414 CO 0.00 0.00 0.00 0.96 -0.05 0.00 0.00 176.76 177.67 3a2p s ILE 415 N -1.95 1.41 0.00 4.37 -4.36 -1.21 -4.65 121.20 114.81 3a2p s ILE 415 Ca 0.50 -1.93 0.00 0.00 -0.26 0.00 0.00 60.65 58.96 3a2p s ILE 415 Cb 0.33 -1.75 0.00 0.00 1.25 0.00 0.00 42.46 42.30 3a2p s ILE 415 CO 0.23 -0.54 0.00 -1.20 0.24 0.00 0.00 174.94 173.67 3a2p n SER 416 N 0.12 0.00 0.06 4.36 7.64 -1.26 -1.45 113.62 123.09 3a2p n SER 416 Ca -0.12 0.00 0.07 0.00 1.01 0.00 0.00 58.87 59.83 3a2p n SER 416 Cb 0.59 0.00 0.51 0.00 -1.01 0.00 0.00 64.21 64.29 3a2p n SER 416 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 3a2p h GLY 417 N 0.00 0.39 1.36 0.23 0.00 -1.97 -2.71 103.07 100.38 3a2p h GLY 417 Ca 0.00 -0.14 -0.26 0.00 0.00 0.00 0.00 47.33 46.93 3a2p h GLY 417 CO 0.00 0.13 -1.05 1.76 0.00 0.00 0.00 176.54 177.38 3a2p h SER 418 N 0.35 0.74 -0.77 0.19 0.02 -1.51 -3.31 113.55 109.27 3a2p h SER 418 Ca 0.13 -0.62 0.11 0.00 -0.84 0.00 0.00 61.79 60.57 3a2p h SER 418 Cb 0.09 -0.23 -0.08 0.00 0.14 0.00 0.00 62.40 62.33 3a2p h SER 418 CO -0.03 1.42 0.40 0.25 -1.14 0.00 0.00 176.83 177.73 3a2p h LEU 419 N 0.30 0.53 -1.87 5.07 5.85 -1.09 -0.50 115.31 123.60 3a2p h LEU 419 Ca -0.12 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.66 3a2p h LEU 419 Cb 1.70 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.71 3a2p h LEU 419 CO 0.19 0.28 0.00 1.56 -0.34 0.00 0.00 178.44 180.14 3a2p h GLN 420 N 0.65 0.00 0.06 1.25 4.20 -1.63 0.27 115.11 119.92 3a2p h GLN 420 Ca 0.39 0.00 -0.25 0.00 0.06 0.00 0.00 58.65 58.85 3a2p h GLN 420 Cb 0.43 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.22 3a2p h GLN 420 CO -0.29 0.00 -1.09 0.52 -0.67 0.00 0.00 178.83 177.31 3a2p h MET 421 N 0.00 0.36 -0.06 1.46 2.86 -1.20 -2.42 114.93 115.93 3a2p h MET 421 Ca 0.00 -0.48 0.00 0.00 -2.06 0.00 0.00 59.70 57.16 3a2p h MET 421 Cb 0.26 0.16 0.00 0.00 0.06 0.00 0.00 31.60 32.07 3a2p h MET 421 CO 0.00 1.17 0.00 1.47 1.06 0.00 0.00 176.91 180.61 3a2p n LEU 422 N -3.66 1.99 -0.27 1.22 -0.00 -0.89 -4.63 117.00 110.76 3a2p n LEU 422 Ca -0.08 -1.15 0.03 0.00 -0.00 0.00 0.00 56.01 54.81 3a2p n LEU 422 Cb 0.92 -0.03 0.25 0.00 -0.00 0.00 0.00 43.42 44.56 3a2p n LEU 422 CO 0.53 0.41 1.25 0.00 -0.00 0.00 0.00 177.39 179.57 3a2p h ALA 423 N 1.96 1.51 -0.01 1.47 0.00 -1.14 -1.22 119.26 121.83 3a2p h ALA 423 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3a2p h ALA 423 Cb 0.46 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3a2p h ALA 423 CO 0.00 0.40 -0.15 1.19 0.00 0.00 0.00 179.25 180.69 3a2p n PHE 424 N -4.46 0.00 -0.07 0.00 3.01 -1.26 -4.32 117.46 110.36 3a2p n PHE 424 Ca 0.11 0.00 -0.09 0.00 1.01 0.00 0.00 57.45 58.48 3a2p n PHE 424 Cb 0.14 -0.07 -0.08 0.00 -0.01 0.00 0.00 39.48 39.46 3a2p n PHE 424 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 3a2p n THR 425 N -0.30 0.84 0.15 4.37 -2.24 -0.93 -4.70 114.28 111.47 3a2p n THR 425 Ca 0.15 -0.37 0.06 0.00 -2.27 0.00 0.00 64.05 61.62 3a2p n THR 425 Cb 0.35 -0.94 0.55 0.00 -2.10 0.00 0.00 70.33 68.19 3a2p n THR 425 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 3a2p h VAL 426 N 0.00 1.05 -0.36 2.28 3.04 -1.10 -2.53 116.25 118.62 3a2p h VAL 426 Ca -0.33 -0.10 0.09 0.00 -1.01 0.00 0.00 66.70 65.35 3a2p h VAL 426 Cb 1.57 0.80 -0.02 0.00 -2.01 0.00 0.00 31.29 31.64 3a2p h VAL 426 CO -0.03 0.05 0.26 -0.65 -1.01 0.00 0.00 177.57 176.18 3a2p h PRO 427 N 0.23 0.10 0.00 4.17 0.11 -1.83 -0.64 132.00 134.13 3a2p h PRO 427 Ca 0.06 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.17 3a2p h PRO 427 Cb -0.02 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 31.07 3a2p h PRO 427 CO -0.01 0.06 -0.29 1.19 -0.21 0.00 0.00 178.00 178.74 3a2p n PHE 428 N -4.45 0.10 0.08 0.65 3.72 -0.95 -1.62 117.46 114.98 3a2p n PHE 428 Ca 0.05 0.03 -0.14 0.00 -0.05 0.00 0.00 57.45 57.34 3a2p n PHE 428 Cb 0.37 -0.42 -0.07 0.00 -0.94 0.00 0.00 39.48 38.42 3a2p n PHE 428 CO 0.00 0.00 0.00 -0.91 -0.05 0.00 0.00 176.76 175.80 3a2p h ASN 429 N 0.00 0.52 -0.10 4.37 4.21 -1.17 -0.26 115.58 123.14 3a2p h ASN 429 Ca 0.00 -0.45 -0.09 0.00 1.21 0.00 0.00 56.30 56.97 3a2p h ASN 429 Cb 0.54 -0.16 0.00 0.00 -1.12 0.00 0.00 38.32 37.58 3a2p h ASN 429 CO 0.00 1.27 -0.29 0.58 -1.29 0.00 0.00 177.43 177.69 3a2p h VAL 430 N 0.19 1.40 0.00 2.81 2.07 -1.27 -3.22 116.25 118.23 3a2p h VAL 430 Ca -0.10 -1.63 -0.07 0.00 0.82 0.00 0.00 66.70 65.73 3a2p h VAL 430 Cb 1.69 2.18 -0.01 0.00 -1.52 0.00 0.00 31.29 33.62 3a2p h VAL 430 CO 0.18 0.47 -0.32 0.77 0.02 0.00 0.00 177.57 178.69 3a2p h SER 431 N -0.07 0.00 -0.01 0.57 4.64 -1.37 -3.43 113.55 113.88 3a2p h SER 431 Ca -0.01 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.31 3a2p h SER 431 Cb 0.91 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.00 3a2p h SER 431 CO 0.06 0.32 -0.00 0.61 -0.87 0.00 0.00 176.83 176.95 3a2p n GLY 432 N 0.48 0.45 3.80 -0.77 0.00 -0.12 -4.95 105.19 104.08 3a2p n GLY 432 Ca 0.01 -0.07 -0.34 0.00 0.00 0.00 0.00 46.02 45.61 3a2p n GLY 432 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3a2p s GLN 433 N -0.37 3.92 0.18 1.61 -0.21 -1.19 -1.04 119.66 122.58 3a2p s GLN 433 Ca 0.00 1.35 -0.30 0.00 0.02 0.00 0.00 55.36 56.42 3a2p s GLN 433 Cb 0.00 -2.18 -0.09 0.00 1.00 0.00 0.00 33.01 31.75 3a2p s GLN 433 CO 0.00 -0.32 1.33 -1.25 -2.12 0.00 0.00 175.29 172.92 3a2p s PRO 434 N -3.11 4.37 -0.02 2.91 0.04 -1.26 -4.64 135.00 133.30 3a2p s PRO 434 Ca 0.65 2.06 -0.00 0.00 0.04 0.00 0.00 61.00 63.75 3a2p s PRO 434 Cb -0.16 -3.20 0.02 0.00 0.04 0.00 0.00 34.50 31.20 3a2p s PRO 434 CO 0.20 -0.29 0.03 0.00 0.04 0.00 0.00 177.00 176.98 3a2p s ALA 435 N 0.31 0.04 0.03 8.56 0.00 -0.20 -2.22 121.76 128.28 3a2p s ALA 435 Ca 0.58 0.28 0.07 0.00 0.00 0.00 0.00 51.96 52.89 3a2p s ALA 435 Cb -0.37 -0.22 -0.02 0.00 0.00 0.00 0.00 23.12 22.51 3a2p s ALA 435 CO 0.37 -0.09 -0.22 -1.50 0.00 0.00 0.00 175.76 174.31 3a2p s ILE 436 N 0.88 1.77 -0.20 0.00 2.07 -0.51 -1.05 121.20 124.15 3a2p s ILE 436 Ca -0.07 -1.16 -0.05 0.00 -1.41 0.00 0.00 60.65 57.95 3a2p s ILE 436 Cb -0.10 -1.51 -0.03 0.00 0.13 0.00 0.00 42.46 40.95 3a2p s ILE 436 CO -0.03 0.31 0.01 -0.55 -1.91 0.00 0.00 174.94 172.78 3a2p s SER 437 N -1.00 4.91 -0.13 4.50 0.15 -0.01 -1.26 113.70 120.86 3a2p s SER 437 Ca 0.09 -0.18 -0.02 0.00 0.70 0.00 0.00 55.95 56.53 3a2p s SER 437 Cb -0.09 -1.84 -0.03 0.00 -1.71 0.00 0.00 66.02 62.35 3a2p s SER 437 CO 0.01 0.06 -0.05 -0.76 1.20 0.00 0.00 173.24 173.71 3a2p s LEU 438 N 1.00 3.23 -1.34 3.45 1.43 0.69 -1.93 118.68 125.21 3a2p s LEU 438 Ca 0.02 -0.09 -0.10 0.00 -1.03 0.00 0.00 54.13 52.92 3a2p s LEU 438 Cb -0.14 -1.75 -0.06 0.00 0.03 0.00 0.00 46.19 44.26 3a2p s LEU 438 CO 0.02 0.23 2.54 -0.81 0.23 0.00 0.00 176.35 178.55 3a2p n PRO 439 N 3.12 2.95 0.07 1.29 -0.04 -1.26 -0.68 135.00 140.46 3a2p n PRO 439 Ca -0.18 -2.02 0.03 0.00 -0.04 0.00 0.00 63.50 61.30 3a2p n PRO 439 Cb 0.53 -2.78 -0.04 0.00 -0.04 0.00 0.00 33.50 31.17 3a2p n PRO 439 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 3a2p h ILE 440 N 3.38 0.43 -1.65 0.52 2.04 -1.89 -3.44 117.51 116.90 3a2p h ILE 440 Ca 0.69 -1.78 -0.55 0.00 1.00 0.00 0.00 64.86 64.22 3a2p h ILE 440 Cb 0.33 1.97 -0.07 0.00 -0.74 0.00 0.00 36.82 38.31 3a2p h ILE 440 CO 1.72 0.24 -0.49 -0.83 0.00 0.00 0.00 178.15 178.79 3a2p s GLY 441 N -4.63 2.22 -0.10 5.37 0.00 -0.05 -5.00 107.32 105.13 3a2p s GLY 441 Ca -0.01 -2.01 -0.07 0.00 0.00 0.00 0.00 44.72 42.62 3a2p s GLY 441 CO 0.79 -1.85 0.25 1.06 0.00 0.00 0.00 173.10 173.35 3a2p s MET 442 N -3.92 0.26 0.90 2.90 -1.94 -1.26 -1.02 119.30 115.22 3a2p s MET 442 Ca 0.41 0.40 -0.12 0.00 -1.71 0.00 0.00 55.69 54.67 3a2p s MET 442 Cb 0.01 0.06 0.13 0.00 2.01 0.00 0.00 34.83 37.05 3a2p s MET 442 CO 0.23 -0.07 1.12 -1.54 -0.01 0.00 0.00 175.02 174.75 3a2p s SER 443 N 0.47 3.54 0.32 3.03 1.04 0.11 -4.86 113.70 117.35 3a2p s SER 443 Ca -0.03 1.09 0.25 0.00 0.48 0.00 0.00 55.95 57.74 3a2p s SER 443 Cb -0.04 -1.72 1.12 0.00 0.10 0.00 0.00 66.02 65.48 3a2p s SER 443 CO -0.02 -2.54 1.76 0.77 0.98 0.00 0.00 173.24 174.18 3a2p h SER 444 N -1.49 0.00 -0.47 7.02 4.64 -1.99 -2.22 113.55 119.04 3a2p h SER 444 Ca -0.50 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 60.60 3a2p h SER 444 Cb 1.32 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 63.28 3a2p h SER 444 CO 0.60 0.00 0.07 -0.90 -0.87 0.00 0.00 176.83 175.73 3a2p n ASP 445 N -2.37 2.99 -0.74 4.97 5.75 -1.26 -4.97 116.55 120.91 3a2p n ASP 445 Ca 0.01 -3.62 -0.08 0.00 -0.01 0.00 0.00 54.79 51.09 3a2p n ASP 445 Cb 0.19 -0.66 -0.02 0.00 -1.03 0.00 0.00 41.12 39.60 3a2p n ASP 445 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3a2p n GLY 446 N -1.00 0.52 3.63 6.12 0.00 -0.84 -5.05 105.19 108.56 3a2p n GLY 446 Ca 0.37 -0.63 -0.35 0.00 0.00 0.00 0.00 46.02 45.41 3a2p n GLY 446 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 3a2p s MET 447 N -3.52 3.56 0.44 1.61 -1.94 -1.26 -4.84 119.30 113.35 3a2p s MET 447 Ca 0.00 -0.40 -0.24 0.00 -1.71 0.00 0.00 55.69 53.34 3a2p s MET 447 Cb 0.00 -3.00 -0.09 0.00 2.01 0.00 0.00 34.83 33.75 3a2p s MET 447 CO 0.00 0.43 1.20 -2.30 -0.01 0.00 0.00 175.02 174.34 3a2p n PRO 448 N 3.01 1.72 -3.89 2.03 -0.02 -1.26 0.06 135.00 136.64 3a2p n PRO 448 Ca -0.18 0.62 -0.27 0.00 -2.02 0.00 0.00 63.50 61.65 3a2p n PRO 448 Cb 0.53 -2.31 -0.17 0.00 -0.02 0.00 0.00 33.50 31.53 3a2p n PRO 448 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3a2p s ILE 449 N -1.24 1.02 0.32 4.25 1.01 -0.19 -4.54 121.20 121.83 3a2p s ILE 449 Ca 0.63 -0.37 -0.12 0.00 0.00 0.00 0.00 60.65 60.80 3a2p s ILE 449 Cb -0.51 -1.09 -0.08 0.00 0.01 0.00 0.00 42.46 40.79 3a2p s ILE 449 CO 0.56 0.29 0.68 -0.83 0.00 0.00 0.00 174.94 175.65 3a2p s GLY 450 N 1.70 2.18 -0.14 6.18 0.00 -1.24 -0.87 107.32 115.13 3a2p s GLY 450 Ca 0.04 -0.15 0.01 0.00 0.00 0.00 0.00 44.72 44.61 3a2p s GLY 450 CO -0.08 0.02 -0.16 0.14 0.00 0.00 0.00 173.10 173.03 3a2p s VAL 451 N -2.05 2.69 -0.11 1.40 1.01 0.15 -2.06 120.40 121.43 3a2p s VAL 451 Ca 0.51 -0.77 -0.06 0.00 0.00 0.00 0.00 61.98 61.66 3a2p s VAL 451 Cb -0.10 -2.12 -0.04 0.00 0.00 0.00 0.00 36.38 34.11 3a2p s VAL 451 CO 0.23 0.52 0.12 -1.58 0.00 0.00 0.00 175.10 174.39 3a2p s GLN 452 N 0.66 3.36 -0.07 2.72 0.74 0.12 -0.23 119.66 126.97 3a2p s GLN 452 Ca -0.08 -0.19 0.03 0.00 0.05 0.00 0.00 55.36 55.17 3a2p s GLN 452 Cb -0.16 -3.12 0.01 0.00 1.10 0.00 0.00 33.01 30.84 3a2p s GLN 452 CO 0.02 0.76 -0.16 0.42 -0.55 0.00 0.00 175.29 175.78 3a2p s ILE 453 N -1.02 1.42 -0.09 -2.34 -1.09 -0.39 -1.40 121.20 116.30 3a2p s ILE 453 Ca 0.15 -0.67 0.03 0.00 -2.23 0.00 0.00 60.65 57.94 3a2p s ILE 453 Cb -0.12 -1.25 0.00 0.00 -1.58 0.00 0.00 42.46 39.51 3a2p s ILE 453 CO 0.04 0.42 -0.20 -0.69 -1.23 0.00 0.00 174.94 173.28 3a2p s VAL 454 N 0.40 1.74 0.44 2.92 1.01 -0.16 -1.43 120.40 125.32 3a2p s VAL 454 Ca -0.12 -0.83 0.06 0.00 0.00 0.00 0.00 61.98 61.09 3a2p s VAL 454 Cb -0.15 -1.52 -0.04 0.00 0.00 0.00 0.00 36.38 34.67 3a2p s VAL 454 CO 0.04 0.49 0.16 0.00 0.00 0.00 0.00 175.10 175.79 3a2p s ALA 455 N 0.44 3.69 0.78 5.51 0.00 -0.94 -1.40 121.76 129.85 3a2p s ALA 455 Ca -0.17 -1.81 -0.13 0.00 0.00 0.00 0.00 51.96 49.84 3a2p s ALA 455 Cb -0.17 -0.28 0.07 0.00 0.00 0.00 0.00 23.12 22.74 3a2p s ALA 455 CO 0.07 -0.17 1.19 0.00 0.00 0.00 0.00 175.76 176.84 3a2p s ALA 456 N -2.67 1.94 -0.08 0.00 0.00 -1.25 -4.05 121.76 115.65 3a2p s ALA 456 Ca 0.35 0.77 -0.38 0.00 0.00 0.00 0.00 51.96 52.70 3a2p s ALA 456 Cb 0.04 -3.46 -0.16 0.00 0.00 0.00 0.00 23.12 19.54 3a2p s ALA 456 CO 0.19 -2.13 1.55 0.98 0.00 0.00 0.00 175.76 176.36 3a2p n TYR 457 N -3.19 1.82 -0.74 0.00 9.36 -1.26 -0.80 117.16 122.34 3a2p n TYR 457 Ca 0.13 0.55 0.00 0.00 3.32 0.00 0.00 57.90 61.90 3a2p n TYR 457 Cb 0.51 -2.41 0.00 0.00 -0.63 0.00 0.00 39.34 36.81 3a2p n TYR 457 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3a2p n GLY 458 N 3.38 1.43 2.64 2.98 0.00 -1.26 -4.92 105.19 109.43 3a2p n GLY 458 Ca 0.22 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.92 3a2p n GLY 458 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3a2p n ARG 459 N -2.00 2.54 0.29 1.61 5.12 0.02 -4.59 116.66 119.65 3a2p n ARG 459 Ca 0.00 -2.86 0.16 0.00 -1.93 0.00 0.00 57.85 53.22 3a2p n ARG 459 Cb 0.00 -2.18 0.90 0.00 -1.16 0.00 0.00 32.46 30.02 3a2p n ARG 459 CO 0.00 0.00 0.00 0.93 -1.93 0.00 0.00 177.63 176.63 3a2p h GLU 460 N 2.88 0.00 -0.05 5.56 3.07 -1.93 -2.24 114.58 121.88 3a2p h GLU 460 Ca 0.47 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 59.33 3a2p h GLU 460 Cb 0.43 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.34 3a2p h GLU 460 CO 1.15 0.04 0.03 0.38 -1.40 0.00 0.00 179.01 179.20 3a2p h ASP 461 N 0.00 0.06 -0.53 1.42 2.03 -1.98 0.36 116.42 117.79 3a2p h ASP 461 Ca -0.00 -0.09 -0.11 0.00 -0.73 0.00 0.00 57.03 56.10 3a2p h ASP 461 Cb 0.11 -0.02 -0.02 0.00 -0.83 0.00 0.00 39.33 38.58 3a2p h ASP 461 CO 0.00 0.13 -0.10 -0.07 -1.03 0.00 0.00 179.24 178.18 3a2p h LEU 462 N -0.01 1.01 0.02 0.15 3.38 -1.83 -2.09 115.31 115.94 3a2p h LEU 462 Ca 0.02 -0.33 0.01 0.00 0.09 0.00 0.00 57.88 57.67 3a2p h LEU 462 Cb 0.08 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 3a2p h LEU 462 CO -0.00 1.11 -0.05 0.25 0.09 0.00 0.00 178.44 179.84 3a2p h LEU 463 N 0.90 -0.13 -1.12 1.67 5.85 -1.18 -1.39 115.31 119.92 3a2p h LEU 463 Ca 0.14 0.02 -0.08 0.00 0.84 0.00 0.00 57.88 58.80 3a2p h LEU 463 Cb 0.66 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.72 3a2p h LEU 463 CO 0.05 -0.07 -0.20 -0.07 -0.34 0.00 0.00 178.44 177.81 3a2p h LEU 464 N -0.09 0.37 -0.03 2.25 3.38 -0.89 -0.01 115.31 120.28 3a2p h LEU 464 Ca 0.01 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 57.87 3a2p h LEU 464 Cb 0.10 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.75 3a2p h LEU 464 CO -0.03 0.59 0.01 1.56 0.09 0.00 0.00 178.44 180.66 3a2p h GLN 465 N 0.35 0.05 -0.04 1.13 4.20 -1.05 0.08 115.11 119.83 3a2p h GLN 465 Ca 0.06 -0.01 -0.11 0.00 0.06 0.00 0.00 58.65 58.65 3a2p h GLN 465 Cb 0.55 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.31 3a2p h GLN 465 CO 0.04 0.20 -0.48 0.28 -0.67 0.00 0.00 178.83 178.19 3a2p h VAL 466 N -0.11 1.34 -0.54 -0.54 2.07 -1.09 -2.21 116.25 115.17 3a2p h VAL 466 Ca 0.01 -1.67 -0.07 0.00 0.82 0.00 0.00 66.70 65.79 3a2p h VAL 466 Cb 0.16 1.85 -0.02 0.00 -1.52 0.00 0.00 31.29 31.77 3a2p h VAL 466 CO -0.00 0.48 0.07 0.00 0.02 0.00 0.00 177.57 178.15 3a2p h ALA 467 N 1.43 0.72 -0.50 1.67 0.00 -0.77 -1.22 119.26 120.60 3a2p h ALA 467 Ca 0.00 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 3a2p h ALA 467 Cb 0.88 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 3a2p h ALA 467 CO 0.07 0.48 0.19 0.00 0.00 0.00 0.00 179.25 179.98 3a2p h ALA 468 N 0.98 1.39 -0.48 0.00 0.00 -0.66 0.52 119.26 121.01 3a2p h ALA 468 Ca 0.16 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.87 3a2p h ALA 468 Cb 0.43 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 3a2p h ALA 468 CO 0.01 0.46 0.06 1.96 0.00 0.00 0.00 179.25 181.74 3a2p h GLN 469 N 0.71 0.81 -0.18 0.00 4.20 -0.81 -2.03 115.11 117.82 3a2p h GLN 469 Ca 0.17 -0.23 -0.13 0.00 0.06 0.00 0.00 58.65 58.52 3a2p h GLN 469 Cb 0.16 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.84 3a2p h GLN 469 CO -0.01 0.83 -0.43 -0.07 -0.67 0.00 0.00 178.83 178.47 3a2p h LEU 470 N 0.68 0.45 -1.45 1.46 3.38 -0.69 -1.36 115.31 117.77 3a2p h LEU 470 Ca 0.14 -0.21 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 3a2p h LEU 470 Cb 0.42 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.03 3a2p h LEU 470 CO 0.01 0.83 0.06 -0.08 0.09 0.00 0.00 178.44 179.36 3a2p h GLU 471 N 0.35 0.42 0.08 1.13 4.81 -0.71 0.31 114.58 120.96 3a2p h GLU 471 Ca 0.03 -0.06 -0.25 0.00 -0.13 0.00 0.00 59.36 58.94 3a2p h GLU 471 Cb 0.91 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.20 3a2p h GLU 471 CO 0.08 0.40 -1.16 0.78 -0.73 0.00 0.00 179.01 178.38 3a2p h GLY 472 N 0.65 0.19 1.57 1.92 0.00 -0.92 -2.72 103.07 103.77 3a2p h GLY 472 Ca 0.10 -0.50 -0.27 0.00 0.00 0.00 0.00 47.33 46.67 3a2p h GLY 472 CO -0.00 0.44 -1.30 0.00 0.00 0.00 0.00 176.54 175.68 3a2p h ALA 473 N 0.74 0.29 -2.03 3.60 0.00 -0.78 -3.38 119.26 117.71 3a2p h ALA 473 Ca -0.09 -1.02 -0.51 0.00 0.00 0.00 0.00 54.91 53.29 3a2p h ALA 473 Cb 1.90 0.08 -0.41 0.00 0.00 0.00 0.00 17.79 19.36 3a2p h ALA 473 CO 0.18 1.17 -1.00 1.28 0.00 0.00 0.00 179.25 180.88 3a2p n LEU 474 N -3.40 2.21 -4.63 0.00 4.77 0.10 -5.08 117.00 110.97 3a2p n LEU 474 Ca -0.09 -5.17 -0.45 0.00 -0.03 0.00 0.00 56.01 50.27 3a2p n LEU 474 Cb 1.01 0.24 -0.02 0.00 -2.33 0.00 0.00 43.42 42.31 3a2p n LEU 474 CO 0.50 2.27 0.77 -0.81 -1.33 0.00 0.00 177.39 178.79 3a2p n PRO 475 N 0.06 1.65 -0.00 3.23 -0.04 -1.02 -4.76 135.00 134.12 3a2p n PRO 475 Ca 0.27 0.58 0.02 0.00 -0.04 0.00 0.00 63.50 64.33 3a2p n PRO 475 Cb 0.58 -2.09 -0.02 0.00 -0.04 0.00 0.00 33.50 31.93 3a2p n PRO 475 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 3a2p n TRP 476 N 0.86 0.00 -0.00 0.54 2.14 -1.26 -4.70 117.44 115.02 3a2p n TRP 476 Ca 0.10 0.00 0.22 0.00 2.07 0.00 0.00 57.50 59.89 3a2p n TRP 476 Cb 0.31 -0.01 0.72 0.00 -0.81 0.00 0.00 31.31 31.53 3a2p n TRP 476 CO 0.00 0.00 0.00 -0.24 2.07 0.00 0.00 177.69 179.52 3a2p h VAL 477 N 0.00 0.53 0.00 -1.67 3.04 -1.91 -0.70 116.25 115.54 3a2p h VAL 477 Ca 0.00 0.00 -0.03 0.00 -1.01 0.00 0.00 66.70 65.66 3a2p h VAL 477 Cb 0.10 0.65 -0.00 0.00 -2.01 0.00 0.00 31.29 30.03 3a2p h VAL 477 CO 0.00 0.00 -0.13 0.00 -1.01 0.00 0.00 177.57 176.43 3a2p h ALA 478 N 1.59 1.70 -2.71 3.17 0.00 -2.01 -3.43 119.26 117.57 3a2p h ALA 478 Ca 0.27 -0.12 -0.53 0.00 0.00 0.00 0.00 54.91 54.52 3a2p h ALA 478 Cb 1.20 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 3a2p h ALA 478 CO -0.00 0.17 0.17 1.03 0.00 0.00 0.00 179.25 180.61 3a2p s ARG 479 N -4.67 4.54 0.01 0.00 0.52 -0.27 -5.08 118.95 114.00 3a2p s ARG 479 Ca -0.04 1.13 0.00 0.00 -0.52 0.00 0.00 55.73 56.30 3a2p s ARG 479 Cb 0.16 -3.28 -0.01 0.00 0.52 0.00 0.00 34.95 32.34 3a2p s ARG 479 CO 0.67 0.52 -0.02 1.03 0.02 0.00 0.00 175.30 177.52 3a2p s ARG 480 N -0.92 0.15 0.62 3.54 0.52 -1.26 -5.08 118.95 116.52 3a2p s ARG 480 Ca 0.36 -0.25 -0.19 0.00 -0.52 0.00 0.00 55.73 55.14 3a2p s ARG 480 Cb -0.22 -0.00 -0.02 0.00 0.52 0.00 0.00 34.95 35.22 3a2p s ARG 480 CO 0.25 -0.01 1.25 -1.25 0.02 0.00 0.00 175.30 175.57 3a2p s PRO 481 N -0.56 2.78 0.48 3.54 0.04 -1.26 -4.90 135.00 135.13 3a2p s PRO 481 Ca -0.06 1.95 0.16 0.00 0.04 0.00 0.00 61.00 63.09 3a2p s PRO 481 Cb -0.04 -1.90 1.16 0.00 0.04 0.00 0.00 34.50 33.76 3a2p s PRO 481 CO -0.00 -1.39 2.06 1.96 0.04 0.00 0.00 177.00 179.67 3a2p h GLN 482 N 0.75 0.20 -0.46 4.56 1.08 -1.78 -1.29 115.11 118.18 3a2p h GLN 482 Ca -0.51 -0.01 0.13 0.00 -1.45 0.00 0.00 58.65 56.81 3a2p h GLN 482 Cb 1.32 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 28.68 3a2p h GLN 482 CO 0.54 0.13 0.49 1.25 -0.95 0.00 0.00 178.83 180.30 3a2p h LEU 483 N 0.21 0.00 -3.66 1.46 5.85 -1.78 0.90 115.31 118.28 3a2p h LEU 483 Ca 0.15 0.00 -0.31 0.00 0.84 0.00 0.00 57.88 58.57 3a2p h LEU 483 Cb 0.35 0.00 -0.18 0.00 0.37 0.00 0.00 40.66 41.19 3a2p h LEU 483 CO -0.03 0.00 0.27 0.18 -0.34 0.00 0.00 178.44 178.52 3a2p n LEU 484 N -3.69 5.46 0.00 2.25 4.32 -0.49 -5.09 117.00 119.75 3a2p n LEU 484 Ca 0.08 -3.57 0.00 0.00 -0.02 0.00 0.00 56.01 52.50 3a2p n LEU 484 Cb 0.68 -0.73 0.00 0.00 -1.62 0.00 0.00 43.42 41.75 3a2p n LEU 484 CO 0.27 1.07 0.00 0.59 -1.22 0.00 0.00 177.39 178.10