#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3c3p s PRO 3 N 0.00 4.16 -0.09 0.38 0.04 -1.26 -4.96 135.00 133.27 3c3p s PRO 3 Ca 0.00 1.57 -0.10 0.00 0.04 0.00 0.00 61.00 62.50 3c3p s PRO 3 Cb 0.00 -2.58 -0.03 0.00 0.04 0.00 0.00 34.50 31.93 3c3p s PRO 3 CO 0.00 -0.16 -0.20 -0.89 0.04 0.00 0.00 177.00 175.79 3c3p n ILE 4 N -0.02 1.05 -3.66 0.56 2.08 -1.26 -4.99 119.36 113.12 3c3p n ILE 4 Ca 0.05 0.25 -0.37 0.00 0.56 0.00 0.00 62.75 63.24 3c3p n ILE 4 Cb 0.49 -1.98 -0.07 0.00 -0.75 0.00 0.00 39.64 37.33 3c3p n ILE 4 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 3c3p s VAL 5 N -2.25 5.32 0.15 1.39 1.01 -1.26 -5.04 120.40 119.71 3c3p s VAL 5 Ca -0.17 0.47 -0.34 0.00 0.00 0.00 0.00 61.98 61.94 3c3p s VAL 5 Cb 0.02 -3.56 -0.16 0.00 0.00 0.00 0.00 36.38 32.69 3c3p s VAL 5 CO 0.25 0.51 1.31 -0.67 0.00 0.00 0.00 175.10 176.50 3c3p n ASP 6 N 2.67 1.85 0.16 3.32 2.03 -1.26 -4.78 116.55 120.54 3c3p n ASP 6 Ca -0.15 1.13 0.16 0.00 0.52 0.00 0.00 54.79 56.44 3c3p n ASP 6 Cb 0.53 -1.26 0.75 0.00 -0.72 0.00 0.00 41.12 40.42 3c3p n ASP 6 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 3c3p h SER 7 N 4.23 0.00 -0.12 1.67 4.64 -1.99 -1.33 113.55 120.65 3c3p h SER 7 Ca -0.45 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 60.63 3c3p h SER 7 Cb 1.32 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.42 3c3p h SER 7 CO 0.76 0.00 -0.83 0.03 -0.87 0.00 0.00 176.83 175.92 3c3p h ARG 8 N 0.00 0.78 -0.48 4.77 3.08 -1.99 -1.85 114.38 118.69 3c3p h ARG 8 Ca 0.11 -0.68 -0.05 0.00 0.07 0.00 0.00 59.98 59.44 3c3p h ARG 8 Cb 0.51 0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.69 3c3p h ARG 8 CO -0.00 1.27 0.12 0.82 -1.07 0.00 0.00 179.97 181.11 3c3p h ILE 9 N 0.51 1.24 -0.72 2.04 1.08 -1.71 -1.31 117.51 118.63 3c3p h ILE 9 Ca -0.07 -0.82 0.00 0.00 -0.39 0.00 0.00 64.86 63.58 3c3p h ILE 9 Cb 1.47 0.86 -0.04 0.00 -3.07 0.00 0.00 36.82 36.05 3c3p h ILE 9 CO 0.17 0.29 0.46 1.23 -0.69 0.00 0.00 178.15 179.62 3c3p h GLY 10 N 0.64 1.03 1.05 5.37 0.00 -1.22 -0.64 103.07 109.30 3c3p h GLY 10 Ca 0.15 -0.40 -0.10 0.00 0.00 0.00 0.00 47.33 46.98 3c3p h GLY 10 CO 0.00 0.39 -0.09 0.00 0.00 0.00 0.00 176.54 176.84 3c3p h ALA 11 N 1.25 0.68 -0.27 3.60 0.00 -1.19 -1.60 119.26 121.73 3c3p h ALA 11 Ca 0.26 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 3c3p h ALA 11 Cb -0.08 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.52 3c3p h ALA 11 CO -0.05 0.57 0.15 -0.92 0.00 0.00 0.00 179.25 179.00 3c3p h TYR 12 N 0.80 0.38 -0.31 0.00 3.20 -0.93 -0.71 116.97 119.39 3c3p h TYR 12 Ca 0.13 -0.01 -0.05 0.00 3.14 0.00 0.00 58.73 61.94 3c3p h TYR 12 Cb 0.64 -0.12 -0.02 0.00 1.54 0.00 0.00 36.73 38.78 3c3p h TYR 12 CO 0.05 0.31 -0.01 -0.07 -1.64 0.00 0.00 178.16 176.80 3c3p h LEU 13 N 0.33 0.45 -0.53 2.82 3.38 -0.99 -1.99 115.31 118.78 3c3p h LEU 13 Ca 0.10 -0.08 -0.14 0.00 0.09 0.00 0.00 57.88 57.84 3c3p h LEU 13 Cb 0.06 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.68 3c3p h LEU 13 CO -0.02 0.52 -0.37 0.44 0.09 0.00 0.00 178.44 179.11 3c3p h ASP 14 N 0.46 0.84 0.28 -0.43 3.32 -0.90 -2.95 116.42 117.04 3c3p h ASP 14 Ca 0.10 -0.37 -0.06 0.00 0.02 0.00 0.00 57.03 56.72 3c3p h ASP 14 Cb 0.31 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.62 3c3p h ASP 14 CO 0.01 1.12 -0.28 1.23 -1.72 0.00 0.00 179.24 179.60 3c3p h GLY 15 N 0.90 0.00 2.00 2.75 0.00 -0.42 -2.24 103.07 106.07 3c3p h GLY 15 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.39 3c3p h GLY 15 CO 0.08 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.66 3c3p n LEU 16 N -4.21 0.54 -4.76 3.11 4.77 -0.91 -4.89 117.00 110.66 3c3p n LEU 16 Ca -0.02 0.59 -0.39 0.00 -0.03 0.00 0.00 56.01 56.16 3c3p n LEU 16 Cb 0.32 -0.47 0.02 0.00 -2.33 0.00 0.00 43.42 40.96 3c3p n LEU 16 CO 0.38 -0.33 1.02 -0.76 -1.33 0.00 0.00 177.39 176.36 3c3p s LEU 17 N -4.12 4.03 1.03 2.23 1.43 -0.84 -5.01 118.68 117.43 3c3p s LEU 17 Ca 0.08 2.82 -0.17 0.00 -1.03 0.00 0.00 54.13 55.83 3c3p s LEU 17 Cb 0.11 -4.06 0.23 0.00 0.03 0.00 0.00 46.19 42.51 3c3p s LEU 17 CO 0.45 -1.27 1.27 -2.16 0.23 0.00 0.00 176.35 174.88 3c3p s PRO 18 N -2.59 0.09 0.33 1.29 0.04 -1.26 -4.97 135.00 127.93 3c3p s PRO 18 Ca 0.64 -0.34 -0.29 0.00 0.04 0.00 0.00 61.00 61.05 3c3p s PRO 18 Cb -0.41 -1.77 -0.10 0.00 0.04 0.00 0.00 34.50 32.25 3c3p s PRO 18 CO 0.52 -2.79 1.32 -2.00 0.04 0.00 0.00 177.00 174.08 3c3p s GLU 19 N -5.78 4.35 0.48 4.56 2.12 -1.26 -4.97 118.70 118.19 3c3p s GLU 19 Ca 0.74 2.23 -0.21 0.00 0.36 0.00 0.00 54.97 58.09 3c3p s GLU 19 Cb -0.05 -3.07 -0.08 0.00 0.26 0.00 0.00 34.13 31.19 3c3p s GLU 19 CO 0.54 -0.21 1.06 0.00 -0.54 0.00 0.00 175.26 176.11 3c3p s ALA 20 N -1.08 2.89 0.24 6.30 0.00 -1.26 -5.00 121.76 123.84 3c3p s ALA 20 Ca 0.49 0.68 -0.30 0.00 0.00 0.00 0.00 51.96 52.83 3c3p s ALA 20 Cb -0.40 -3.28 -0.10 0.00 0.00 0.00 0.00 23.12 19.34 3c3p s ALA 20 CO 0.53 -0.39 1.41 0.34 0.00 0.00 0.00 175.76 177.65 3c3p s ASP 21 N -1.83 6.71 0.52 0.00 -1.08 -1.26 -4.87 116.67 114.85 3c3p s ASP 21 Ca 0.66 2.61 0.24 0.00 -0.52 0.00 0.00 52.55 55.54 3c3p s ASP 21 Cb -0.19 -2.62 1.41 0.00 -1.46 0.00 0.00 42.92 40.06 3c3p s ASP 21 CO 0.23 -0.66 2.10 1.55 0.52 0.00 0.00 175.17 178.91 3c3p h PRO 22 N 5.09 0.00 -0.84 4.34 0.13 -1.98 -0.62 132.00 138.11 3c3p h PRO 22 Ca -0.46 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.65 3c3p h PRO 22 Cb 1.22 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.31 3c3p h PRO 22 CO 0.77 0.10 0.42 0.28 -0.23 0.00 0.00 178.00 179.35 3c3p h VAL 23 N 0.00 1.25 -0.14 1.56 2.07 -1.98 1.04 116.25 120.05 3c3p h VAL 23 Ca -0.00 -0.69 -0.08 0.00 0.82 0.00 0.00 66.70 66.75 3c3p h VAL 23 Cb 0.23 0.16 -0.00 0.00 -1.52 0.00 0.00 31.29 30.16 3c3p h VAL 23 CO 0.01 0.30 -0.23 0.58 0.02 0.00 0.00 177.57 178.25 3c3p h VAL 24 N 1.19 1.36 -0.56 2.57 2.07 -1.62 -3.07 116.25 118.19 3c3p h VAL 24 Ca 0.29 -1.47 -0.04 0.00 0.82 0.00 0.00 66.70 66.31 3c3p h VAL 24 Cb 0.09 1.97 -0.03 0.00 -1.52 0.00 0.00 31.29 31.80 3c3p h VAL 24 CO -0.04 0.43 0.20 0.00 0.02 0.00 0.00 177.57 178.18 3c3p h ALA 25 N 0.57 1.30 0.00 1.67 0.00 -0.36 -2.08 119.26 120.35 3c3p h ALA 25 Ca 0.01 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3c3p h ALA 25 Cb 0.80 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.37 3c3p h ALA 25 CO 0.05 0.51 0.00 0.00 0.00 0.00 0.00 179.25 179.81 3c3p n ALA 26 N -2.46 1.75 0.00 0.00 0.00 0.35 -2.70 120.51 117.46 3c3p n ALA 26 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 3c3p n ALA 26 Cb 0.18 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.63 3c3p n ALA 26 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 3c3p n GLU 28 N 0.54 0.00 0.12 0.00 1.02 -0.78 -2.20 120.64 119.34 3c3p n GLU 28 Ca 0.00 0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 57.03 3c3p n GLU 28 Cb 0.15 0.00 -0.07 0.00 -0.02 0.00 0.00 31.44 31.50 3c3p n GLU 28 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 3c3p h GLN 29 N 0.00 -0.36 -1.00 3.49 4.20 -1.79 -2.63 115.11 117.02 3c3p h GLN 29 Ca 0.00 0.02 0.20 0.00 0.06 0.00 0.00 58.65 58.94 3c3p h GLN 29 Cb 0.00 0.08 -0.11 0.00 0.30 0.00 0.00 27.48 27.75 3c3p h GLN 29 CO 0.00 -0.02 0.61 0.82 -0.67 0.00 0.00 178.83 179.57 3c3p h ILE 30 N -0.92 0.67 -0.35 2.54 2.04 -1.75 1.00 117.51 120.74 3c3p h ILE 30 Ca -0.04 -0.25 -0.05 0.00 1.00 0.00 0.00 64.86 65.52 3c3p h ILE 30 Cb 0.50 -0.11 -0.01 0.00 -0.74 0.00 0.00 36.82 36.46 3c3p h ILE 30 CO 0.06 0.13 0.02 0.00 0.00 0.00 0.00 178.15 178.37 3c3p h ALA 31 N 1.66 0.47 -0.43 1.87 0.00 -1.83 -1.18 119.26 119.82 3c3p h ALA 31 Ca 0.59 -0.23 -0.10 0.00 0.00 0.00 0.00 54.91 55.17 3c3p h ALA 31 Cb 0.97 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 3c3p h ALA 31 CO -0.39 0.21 -0.12 -0.09 0.00 0.00 0.00 179.25 178.86 3c3p h ARG 32 N 0.43 0.84 0.00 0.00 1.12 -0.79 0.11 114.38 116.09 3c3p h ARG 32 Ca 0.10 -0.33 0.00 0.00 -1.11 0.00 0.00 59.98 58.64 3c3p h ARG 32 Cb 0.42 -0.04 0.00 0.00 -0.01 0.00 0.00 29.97 30.34 3c3p h ARG 32 CO 0.01 0.96 0.00 -0.85 -3.11 0.00 0.00 179.97 176.98 3c3p n GLU 33 N -4.28 0.99 0.00 0.20 0.28 0.21 -2.67 120.64 115.37 3c3p n GLU 33 Ca -0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.99 3c3p n GLU 33 Cb 0.38 -1.39 0.00 0.00 1.43 0.00 0.00 31.44 31.86 3c3p n GLU 33 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 3c3p n ARG 34 N -0.89 -0.38 -3.71 3.44 1.74 -0.46 -5.03 116.66 111.37 3c3p n ARG 34 Ca 0.18 -0.32 -0.22 0.00 -0.77 0.00 0.00 57.85 56.73 3c3p n ARG 34 Cb 0.08 -0.81 0.03 0.00 -1.02 0.00 0.00 32.46 30.75 3c3p n ARG 34 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3c3p n ASN 35 N -0.04 -1.53 -4.35 0.55 2.85 -0.07 -4.98 115.26 107.69 3c3p n ASN 35 Ca 0.00 -0.81 -0.35 0.00 -0.11 0.00 0.00 54.58 53.31 3c3p n ASN 35 Cb 0.08 -4.09 -0.14 0.00 1.24 0.00 0.00 39.78 36.87 3c3p n ASN 35 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 3c3p s ILE 36 N -3.63 3.57 0.29 -1.44 1.01 0.19 -5.04 121.20 116.16 3c3p s ILE 36 Ca 0.06 -0.43 -0.28 0.00 0.00 0.00 0.00 60.65 60.00 3c3p s ILE 36 Cb -0.03 -2.63 -0.09 0.00 0.01 0.00 0.00 42.46 39.72 3c3p s ILE 36 CO 0.81 0.42 1.03 -2.16 0.00 0.00 0.00 174.94 175.03 3c3p s PRO 37 N 1.37 4.63 0.06 2.79 0.04 -1.26 -4.58 135.00 138.06 3c3p s PRO 37 Ca 0.04 1.62 -0.00 0.00 0.04 0.00 0.00 61.00 62.70 3c3p s PRO 37 Cb -0.14 -3.08 -0.04 0.00 0.04 0.00 0.00 34.50 31.27 3c3p s PRO 37 CO -0.01 0.26 -0.04 0.96 0.04 0.00 0.00 177.00 178.21 3c3p s ILE 38 N -1.28 0.36 0.17 0.56 -4.36 -1.26 -4.65 121.20 110.73 3c3p s ILE 38 Ca 0.46 -1.84 -0.32 0.00 -0.26 0.00 0.00 60.65 58.70 3c3p s ILE 38 Cb -0.27 -1.55 -0.11 0.00 1.25 0.00 0.00 42.46 41.77 3c3p s ILE 38 CO 0.35 -0.96 1.72 -0.69 0.24 0.00 0.00 174.94 175.60 3c3p s VAL 39 N -3.81 2.35 1.02 8.37 1.01 -1.26 -4.99 120.40 123.09 3c3p s VAL 39 Ca 0.08 0.14 -0.12 0.00 0.00 0.00 0.00 61.98 62.08 3c3p s VAL 39 Cb 0.07 -3.09 0.20 0.00 0.00 0.00 0.00 36.38 33.56 3c3p s VAL 39 CO -0.08 0.01 1.09 1.51 0.00 0.00 0.00 175.10 177.62 3c3p s ASP 40 N 1.69 2.44 0.15 3.32 1.47 -1.26 -4.75 116.67 119.73 3c3p s ASP 40 Ca 0.76 1.22 -0.12 0.00 1.18 0.00 0.00 52.55 55.58 3c3p s ASP 40 Cb -0.47 -1.89 0.01 0.00 -0.34 0.00 0.00 42.92 40.23 3c3p s ASP 40 CO 0.33 -3.25 1.58 -0.09 0.68 0.00 0.00 175.17 174.42 3c3p h ARG 41 N -1.97 0.90 -0.66 2.11 2.43 -1.99 -0.67 114.38 114.52 3c3p h ARG 41 Ca -0.55 -0.32 -0.02 0.00 -0.81 0.00 0.00 59.98 58.28 3c3p h ARG 41 Cb 1.33 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.78 3c3p h ARG 41 CO 0.57 0.96 0.33 1.96 -1.51 0.00 0.00 179.97 182.28 3c3p h GLN 42 N 0.75 0.93 -0.18 0.20 1.08 -2.00 -0.70 115.11 115.20 3c3p h GLN 42 Ca 0.13 -0.11 -0.11 0.00 -1.45 0.00 0.00 58.65 57.10 3c3p h GLN 42 Cb 0.59 -0.18 0.00 0.00 -0.05 0.00 0.00 27.48 27.84 3c3p h GLN 42 CO 0.04 0.71 -0.33 1.15 -0.95 0.00 0.00 178.83 179.44 3c3p h THR 43 N 0.93 1.34 -0.88 -0.54 2.02 -1.82 -2.44 112.91 111.52 3c3p h THR 43 Ca 0.23 -1.57 0.03 0.00 0.77 0.00 0.00 66.41 65.88 3c3p h THR 43 Cb 0.07 1.90 -0.05 0.00 -1.74 0.00 0.00 68.15 68.33 3c3p h THR 43 CO -0.03 0.48 0.57 1.23 0.37 0.00 0.00 175.52 178.14 3c3p h GLY 44 N 0.20 1.28 1.36 2.16 0.00 -0.85 -0.58 103.07 106.64 3c3p h GLY 44 Ca 0.01 -0.44 -0.06 0.00 0.00 0.00 0.00 47.33 46.85 3c3p h GLY 44 CO 0.07 0.38 0.08 3.21 0.00 0.00 0.00 176.54 180.29 3c3p h ARG 45 N 1.12 0.79 -0.44 4.80 3.08 -1.06 -1.03 114.38 121.65 3c3p h ARG 45 Ca 0.35 -0.18 -0.13 0.00 0.07 0.00 0.00 59.98 60.09 3c3p h ARG 45 Cb -0.01 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 3c3p h ARG 45 CO -0.11 0.75 -0.24 1.25 -1.07 0.00 0.00 179.97 180.54 3c3p h LEU 46 N 0.76 0.93 -0.46 3.04 5.85 -0.90 -1.60 115.31 122.93 3c3p h LEU 46 Ca 0.16 -0.36 0.01 0.00 0.84 0.00 0.00 57.88 58.53 3c3p h LEU 46 Cb 0.34 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 3c3p h LEU 46 CO 0.01 1.12 0.30 -0.07 -0.34 0.00 0.00 178.44 179.46 3c3p h LEU 47 N 0.78 0.52 -0.24 2.25 3.38 -0.54 -0.36 115.31 121.10 3c3p h LEU 47 Ca 0.10 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.06 3c3p h LEU 47 Cb 0.80 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 3c3p h LEU 47 CO 0.07 0.37 0.14 0.22 0.09 0.00 0.00 178.44 179.33 3c3p h TYR 48 N 0.61 0.26 -0.39 1.13 3.20 -1.04 -1.31 116.97 119.43 3c3p h TYR 48 Ca 0.17 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.03 3c3p h TYR 48 Cb -0.06 -0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.11 3c3p h TYR 48 CO -0.05 0.16 0.18 1.25 -1.64 0.00 0.00 178.16 178.07 3c3p h LEU 49 N 0.29 0.51 -0.66 2.82 6.46 -0.99 0.18 115.31 123.92 3c3p h LEU 49 Ca 0.09 -0.13 -0.01 0.00 -0.12 0.00 0.00 57.88 57.71 3c3p h LEU 49 Cb -0.01 -0.13 -0.03 0.00 -0.73 0.00 0.00 40.66 39.76 3c3p h LEU 49 CO -0.04 0.50 0.36 -0.07 -0.62 0.00 0.00 178.44 178.56 3c3p h LEU 50 N 0.49 0.83 -0.65 2.25 3.38 -0.96 -1.46 115.31 119.19 3c3p h LEU 50 Ca 0.13 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 3c3p h LEU 50 Cb 0.12 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.63 3c3p h LEU 50 CO -0.02 0.69 0.31 0.00 0.09 0.00 0.00 178.44 179.52 3c3p h ALA 51 N 1.17 0.84 -0.73 1.53 0.00 -0.85 0.09 119.26 121.31 3c3p h ALA 51 Ca 0.23 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 3c3p h ALA 51 Cb 0.05 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 3c3p h ALA 51 CO -0.04 0.41 0.31 0.00 0.00 0.00 0.00 179.25 179.93 3c3p h ARG 52 N 0.90 1.09 0.01 0.00 2.47 -0.48 0.10 114.38 118.48 3c3p h ARG 52 Ca 0.22 -0.19 -0.20 0.00 -1.26 0.00 0.00 59.98 58.56 3c3p h ARG 52 Cb 0.12 -0.18 -0.02 0.00 -1.65 0.00 0.00 29.97 28.24 3c3p h ARG 52 CO -0.03 0.89 -0.91 -0.84 0.56 0.00 0.00 179.97 179.64 3c3p h ILE 53 N 1.05 1.58 -0.03 2.04 3.07 -1.07 -3.17 117.51 120.98 3c3p h ILE 53 Ca 0.25 -2.90 -0.13 0.00 1.55 0.00 0.00 64.86 63.63 3c3p h ILE 53 Cb 0.19 2.61 -0.02 0.00 -0.27 0.00 0.00 36.82 39.33 3c3p h ILE 53 CO -0.02 0.83 -0.57 0.50 -1.05 0.00 0.00 178.15 177.84 3c3p h LYS 54 N 0.04 0.09 -6.20 0.16 1.63 -0.65 -3.48 116.57 108.16 3c3p h LYS 54 Ca -0.03 -0.06 -0.43 0.00 -0.85 0.00 0.00 60.65 59.28 3c3p h LYS 54 Cb 1.58 0.01 0.07 0.00 -0.60 0.00 0.00 32.23 33.28 3c3p h LYS 54 CO 0.13 0.63 -0.91 1.04 -3.45 0.00 0.00 179.45 176.89 3c3p n GLN 55 N -3.88 -2.06 -2.41 1.90 6.02 -0.01 -4.93 117.38 112.02 3c3p n GLN 55 Ca -0.02 0.49 -0.34 0.00 -0.01 0.00 0.00 57.00 57.13 3c3p n GLN 55 Cb 0.58 -4.42 -0.02 0.00 1.02 0.00 0.00 30.24 27.40 3c3p n GLN 55 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 3c3p s PRO 56 N -5.97 3.67 -0.06 -1.09 0.04 -1.26 -4.94 135.00 125.40 3c3p s PRO 56 Ca 0.34 1.33 0.07 0.00 0.04 0.00 0.00 61.00 62.79 3c3p s PRO 56 Cb -0.12 -2.08 -0.24 0.00 0.04 0.00 0.00 34.50 32.11 3c3p s PRO 56 CO 0.85 -0.54 0.60 1.96 0.04 0.00 0.00 177.00 179.91 3c3p h GLN 57 N 1.28 0.07 -3.47 4.56 4.20 -1.91 -3.45 115.11 116.39 3c3p h GLN 57 Ca -0.49 -0.13 -0.37 0.00 0.06 0.00 0.00 58.65 57.73 3c3p h GLN 57 Cb 1.22 0.05 -0.37 0.00 0.30 0.00 0.00 27.48 28.68 3c3p h GLN 57 CO 0.59 0.70 -0.74 -1.17 -0.67 0.00 0.00 178.83 177.53 3c3p s LEU 58 N -6.36 0.51 -0.13 1.46 2.96 -1.26 -1.13 118.68 114.74 3c3p s LEU 58 Ca -0.09 0.03 0.02 0.00 -0.22 0.00 0.00 54.13 53.87 3c3p s LEU 58 Cb 0.08 -0.20 0.00 0.00 0.50 0.00 0.00 46.19 46.57 3c3p s LEU 58 CO 0.81 -0.20 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.75 3c3p s VAL 59 N 1.80 2.27 -0.13 1.68 1.01 -0.37 -0.50 120.40 126.17 3c3p s VAL 59 Ca 0.01 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.07 3c3p s VAL 59 Cb -0.12 -1.91 -0.01 0.00 0.00 0.00 0.00 36.38 34.34 3c3p s VAL 59 CO -0.03 0.55 -0.15 -0.69 0.00 0.00 0.00 175.10 174.77 3c3p s VAL 60 N 0.57 2.85 -0.47 2.92 1.01 0.28 -0.27 120.40 127.30 3c3p s VAL 60 Ca -0.12 -0.73 0.03 0.00 0.00 0.00 0.00 61.98 61.16 3c3p s VAL 60 Cb -0.17 -2.18 0.13 0.00 0.00 0.00 0.00 36.38 34.16 3c3p s VAL 60 CO 0.04 0.53 0.22 -0.69 0.00 0.00 0.00 175.10 175.19 3c3p s VAL 61 N 0.39 2.23 -0.82 2.92 1.01 0.12 -1.60 120.40 124.65 3c3p s VAL 61 Ca -0.12 -2.94 -0.23 0.00 0.00 0.00 0.00 61.98 58.69 3c3p s VAL 61 Cb -0.16 -2.57 0.07 0.00 0.00 0.00 0.00 36.38 33.71 3c3p s VAL 61 CO 0.06 -0.78 1.21 -2.16 0.00 0.00 0.00 175.10 173.42 3c3p s PRO 62 N 0.09 3.34 0.00 2.72 0.05 -1.26 -1.31 135.00 138.64 3c3p s PRO 62 Ca 0.16 -0.91 0.00 0.00 0.05 0.00 0.00 61.00 60.30 3c3p s PRO 62 Cb -0.24 -4.63 0.00 0.00 0.05 0.00 0.00 34.50 29.68 3c3p s PRO 62 CO -0.02 -2.00 0.00 0.41 0.05 0.00 0.00 177.00 175.44 3c3p n GLY 63 N 5.77 0.68 3.15 0.56 0.00 0.33 -4.82 105.19 110.86 3c3p n GLY 63 Ca 0.13 -1.22 0.04 0.00 0.00 0.00 0.00 46.02 44.97 3c3p n GLY 63 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3c3p s ASP 64 N -0.07 -1.50 0.12 1.61 2.15 -1.26 -4.95 116.67 112.78 3c3p s ASP 64 Ca 0.00 0.01 -0.32 0.00 0.43 0.00 0.00 52.55 52.67 3c3p s ASP 64 Cb 0.00 1.94 -0.12 0.00 -0.30 0.00 0.00 42.92 44.44 3c3p s ASP 64 CO 0.00 -0.25 1.78 0.61 -0.17 0.00 0.00 175.17 177.14 3c3p n GLY 65 N 5.19 1.55 2.79 2.66 0.00 -1.26 -1.55 105.19 114.57 3c3p n GLY 65 Ca 0.06 0.70 -0.02 0.00 0.00 0.00 0.00 46.02 46.77 3c3p n GLY 65 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3c3p n LEU 66 N 5.11 0.58 -1.11 0.99 4.77 -1.26 -1.99 117.00 124.08 3c3p n LEU 66 Ca 0.18 0.06 -0.12 0.00 -0.03 0.00 0.00 56.01 56.09 3c3p n LEU 66 Cb 0.35 -2.24 -0.03 0.00 -2.33 0.00 0.00 43.42 39.17 3c3p n LEU 66 CO 0.66 -0.86 -0.13 0.61 -1.33 0.00 0.00 177.39 176.34 3c3p n GLY 67 N 0.70 0.77 0.47 -0.72 0.00 -0.59 -4.21 105.19 101.61 3c3p n GLY 67 Ca -0.02 -0.43 -0.18 0.00 0.00 0.00 0.00 46.02 45.39 3c3p n GLY 67 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3c3p h ALA 69 N -0.83 1.45 -0.65 0.00 0.00 -1.92 -1.96 119.26 115.35 3c3p h ALA 69 Ca -0.08 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 3c3p h ALA 69 Cb 0.85 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 3c3p h ALA 69 CO 0.04 0.45 0.31 0.77 0.00 0.00 0.00 179.25 180.81 3c3p h SER 70 N 1.10 0.84 -0.17 0.00 0.02 -1.91 -1.93 113.55 111.51 3c3p h SER 70 Ca 0.37 -0.09 -0.00 0.00 -0.84 0.00 0.00 61.79 61.23 3c3p h SER 70 Cb 0.07 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.39 3c3p h SER 70 CO -0.12 0.71 0.09 -0.25 -1.14 0.00 0.00 176.83 176.13 3c3p h TRP 71 N 0.92 0.23 -0.69 3.45 7.01 -0.31 0.23 115.95 126.80 3c3p h TRP 71 Ca 0.23 -0.01 -0.04 0.00 2.11 0.00 0.00 58.89 61.18 3c3p h TRP 71 Cb 0.10 -0.07 -0.03 0.00 -2.10 0.00 0.00 29.16 27.06 3c3p h TRP 71 CO 0.01 0.22 0.28 -1.49 -2.79 0.00 0.00 178.44 174.68 3c3p h TRP 72 N 0.17 1.05 -0.23 2.65 4.06 -1.22 -2.68 115.95 119.76 3c3p h TRP 72 Ca 0.06 -0.08 -0.20 0.00 2.06 0.00 0.00 58.89 60.74 3c3p h TRP 72 Cb 0.07 -0.31 0.00 0.00 -1.00 0.00 0.00 29.16 27.92 3c3p h TRP 72 CO -0.04 0.81 -0.64 0.74 -3.56 0.00 0.00 178.44 175.75 3c3p h PHE 73 N 0.98 1.05 -0.73 0.49 0.04 -1.25 -3.10 116.94 114.43 3c3p h PHE 73 Ca 0.23 -0.41 0.01 0.00 2.80 0.00 0.00 57.97 60.61 3c3p h PHE 73 Cb 0.20 -0.18 -0.04 0.00 2.20 0.00 0.00 35.95 38.13 3c3p h PHE 73 CO 0.01 1.23 0.48 0.00 -0.60 0.00 0.00 178.31 179.44 3c3p h ALA 74 N 0.67 1.50 0.00 2.45 0.00 -0.43 -1.41 119.26 122.04 3c3p h ALA 74 Ca -0.01 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 3c3p h ALA 74 Cb 1.25 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 18.75 3c3p h ALA 74 CO 0.14 0.45 -0.13 0.00 0.00 0.00 0.00 179.25 179.71 3c3p h ARG 75 N 0.96 0.00 -0.01 0.00 3.08 -1.41 -3.14 114.38 113.86 3c3p h ARG 75 Ca 0.27 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.32 3c3p h ARG 75 Cb -0.08 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.97 3c3p h ARG 75 CO -0.06 0.13 -0.37 0.00 -1.07 0.00 0.00 179.97 178.59 3c3p n ALA 76 N -2.32 3.33 -2.66 0.04 0.00 -0.54 -4.99 120.51 113.36 3c3p n ALA 76 Ca -0.02 -0.52 -0.24 0.00 0.00 0.00 0.00 53.44 52.66 3c3p n ALA 76 Cb 0.23 -0.97 -0.07 0.00 0.00 0.00 0.00 19.45 18.64 3c3p n ALA 76 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 3c3p s ILE 77 N -2.50 3.61 0.76 0.00 -4.36 -1.15 -4.48 121.20 113.08 3c3p s ILE 77 Ca 0.21 -1.71 -0.10 0.00 -0.26 0.00 0.00 60.65 58.79 3c3p s ILE 77 Cb 0.19 -2.89 0.06 0.00 1.25 0.00 0.00 42.46 41.07 3c3p s ILE 77 CO 0.55 -0.28 1.11 -0.94 0.24 0.00 0.00 174.94 175.62 3c3p s SER 78 N -3.44 4.77 0.54 4.36 1.04 -1.26 -4.95 113.70 114.76 3c3p s SER 78 Ca 0.30 0.74 0.30 0.00 0.48 0.00 0.00 55.95 57.77 3c3p s SER 78 Cb -0.07 -1.34 1.53 0.00 0.10 0.00 0.00 66.02 66.24 3c3p s SER 78 CO 0.20 -1.70 2.09 0.40 0.98 0.00 0.00 173.24 175.20 3c3p h ILE 79 N -0.84 0.44 0.00 -1.02 2.04 -1.98 -1.57 117.51 114.58 3c3p h ILE 79 Ca -0.45 -0.49 0.00 0.00 1.00 0.00 0.00 64.86 64.92 3c3p h ILE 79 Cb 1.31 1.34 0.00 0.00 -0.74 0.00 0.00 36.82 38.73 3c3p h ILE 79 CO 0.64 0.09 -0.20 0.77 0.00 0.00 0.00 178.15 179.45 3c3p h SER 80 N 0.00 0.00 -2.43 1.72 4.64 -1.96 -3.46 113.55 112.06 3c3p h SER 80 Ca -0.00 -0.05 -0.44 0.00 -0.47 0.00 0.00 61.79 60.83 3c3p h SER 80 Cb 0.33 0.00 0.04 0.00 -0.31 0.00 0.00 62.40 62.46 3c3p h SER 80 CO 0.01 0.03 -0.05 -0.44 -0.87 0.00 0.00 176.83 175.50 3c3p s SER 81 N -4.74 5.32 0.00 4.97 0.01 -0.59 -5.04 113.70 113.63 3c3p s SER 81 Ca 0.08 -0.04 -0.04 0.00 1.31 0.00 0.00 55.95 57.27 3c3p s SER 81 Cb 0.11 -0.87 -0.01 0.00 0.21 0.00 0.00 66.02 65.47 3c3p s SER 81 CO 0.65 -1.10 0.06 -0.13 0.41 0.00 0.00 173.24 173.13 3c3p s ARG 82 N -4.72 0.35 -0.17 12.44 1.81 -0.28 -4.79 118.95 123.58 3c3p s ARG 82 Ca 0.57 -0.38 -0.02 0.00 -1.72 0.00 0.00 55.73 54.18 3c3p s ARG 82 Cb -0.10 0.14 -0.01 0.00 -0.45 0.00 0.00 34.95 34.52 3c3p s ARG 82 CO 0.38 -0.07 -0.08 0.08 -0.68 0.00 0.00 175.30 174.92 3c3p s VAL 83 N -1.15 3.28 0.37 3.52 1.01 -0.55 -1.23 120.40 125.64 3c3p s VAL 83 Ca -0.12 -0.56 0.08 0.00 0.00 0.00 0.00 61.98 61.38 3c3p s VAL 83 Cb -0.07 -2.43 -0.04 0.00 0.00 0.00 0.00 36.38 33.84 3c3p s VAL 83 CO 0.00 0.48 0.22 -0.69 0.00 0.00 0.00 175.10 175.11 3c3p s VAL 84 N 0.83 2.93 0.00 2.92 1.01 0.63 -0.13 120.40 128.58 3c3p s VAL 84 Ca -0.03 -1.57 0.00 0.00 0.00 0.00 0.00 61.98 60.38 3c3p s VAL 84 Cb -0.15 -3.02 0.00 0.00 0.00 0.00 0.00 36.38 33.21 3c3p s VAL 84 CO 0.01 -0.12 0.00 -0.38 0.00 0.00 0.00 175.10 174.61 3c3p n ILE 86 N -1.28 0.00 -3.76 2.22 -0.00 -0.42 0.10 119.36 116.22 3c3p n ILE 86 Ca -0.01 0.00 -0.13 0.00 -0.00 0.00 0.00 62.75 62.61 3c3p n ILE 86 Cb 0.62 0.00 -0.10 0.00 -0.00 0.00 0.00 39.64 40.16 3c3p n ILE 86 CO 0.00 0.00 0.00 -0.62 -0.00 0.00 0.00 176.55 175.93 3c3p s ASP 87 N 0.00 -0.29 0.01 4.38 2.15 -0.88 0.12 116.67 122.16 3c3p s ASP 87 Ca 0.00 0.45 0.24 0.00 0.43 0.00 0.00 52.55 53.67 3c3p s ASP 87 Cb 0.00 0.55 1.04 0.00 -0.30 0.00 0.00 42.92 44.20 3c3p s ASP 87 CO 0.00 -0.24 1.78 -0.81 -0.17 0.00 0.00 175.17 175.73 3c3p n PRO 88 N 2.28 0.01 -3.70 4.34 -0.04 -0.98 -0.70 135.00 136.19 3c3p n PRO 88 Ca -0.16 0.09 -0.38 0.00 -0.04 0.00 0.00 63.50 63.00 3c3p n PRO 88 Cb 0.57 -1.51 -0.12 0.00 -0.04 0.00 0.00 33.50 32.40 3c3p n PRO 88 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 3c3p s ASP 89 N -3.03 5.36 0.56 3.54 -1.08 -1.26 -4.69 116.67 116.06 3c3p s ASP 89 Ca 0.12 -0.76 0.29 0.00 -0.52 0.00 0.00 52.55 51.68 3c3p s ASP 89 Cb 0.16 -1.94 1.46 0.00 -1.46 0.00 0.00 42.92 41.15 3c3p s ASP 89 CO 0.45 -0.24 1.91 0.03 0.52 0.00 0.00 175.17 177.84 3c3p h ARG 90 N 8.30 0.00 0.00 4.34 3.08 -1.99 -0.76 114.38 127.35 3c3p h ARG 90 Ca -0.30 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 59.69 3c3p h ARG 90 Cb 1.12 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.16 3c3p h ARG 90 CO 0.62 0.00 -0.31 -0.44 -1.07 0.00 0.00 179.97 178.76 3c3p h ASP 91 N 0.00 0.00 0.20 7.04 3.32 -1.98 -1.48 116.42 123.52 3c3p h ASP 91 Ca 0.32 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 57.10 3c3p h ASP 91 Cb 1.39 0.00 0.03 0.00 0.22 0.00 0.00 39.33 40.97 3c3p h ASP 91 CO -0.00 0.31 -1.15 0.78 -1.72 0.00 0.00 179.24 177.46 3c3p h ASN 92 N 0.00 0.67 -0.58 6.45 2.35 -1.50 -2.42 115.58 120.55 3c3p h ASN 92 Ca -0.00 -0.93 -0.08 0.00 -0.55 0.00 0.00 56.30 54.73 3c3p h ASN 92 Cb 0.84 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.97 3c3p h ASN 92 CO 0.04 1.56 0.03 0.58 -1.65 0.00 0.00 177.43 177.99 3c3p h VAL 93 N -0.09 1.26 -0.41 2.81 2.07 -1.45 -1.71 116.25 118.73 3c3p h VAL 93 Ca -0.20 -1.08 -0.14 0.00 0.82 0.00 0.00 66.70 66.10 3c3p h VAL 93 Cb 1.91 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 32.48 3c3p h VAL 93 CO 0.22 0.39 -0.29 -0.08 0.02 0.00 0.00 177.57 177.83 3c3p h GLU 94 N 0.89 0.90 -0.48 1.57 4.57 -1.36 0.74 114.58 121.41 3c3p h GLU 94 Ca 0.17 -0.42 -0.02 0.00 -1.18 0.00 0.00 59.36 57.91 3c3p h GLU 94 Cb 0.50 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.06 3c3p h GLU 94 CO 0.02 1.07 0.23 1.25 -1.18 0.00 0.00 179.01 180.41 3c3p h HIS 95 N 0.76 0.69 -0.53 0.92 2.76 -1.26 -1.46 115.15 117.05 3c3p h HIS 95 Ca 0.09 -0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.18 3c3p h HIS 95 Cb 0.86 -0.22 -0.02 0.00 1.55 0.00 0.00 27.41 29.58 3c3p h HIS 95 CO 0.05 0.55 0.17 0.00 -1.30 0.00 0.00 177.93 177.41 3c3p h ALA 96 N 1.07 0.69 -0.37 5.26 0.00 -1.08 -3.03 119.26 121.81 3c3p h ALA 96 Ca 0.17 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.90 3c3p h ALA 96 Cb 0.12 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3c3p h ALA 96 CO -0.02 0.34 0.24 -0.09 0.00 0.00 0.00 179.25 179.71 3c3p h ARG 97 N 0.72 0.47 -0.07 0.00 2.43 -0.49 -1.36 114.38 116.08 3c3p h ARG 97 Ca 0.17 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.31 3c3p h ARG 97 Cb 0.26 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.71 3c3p h ARG 97 CO -0.01 0.31 0.00 0.54 -1.51 0.00 0.00 179.97 179.30 3c3p n ARG 98 N -4.85 0.01 0.00 0.20 1.74 -0.58 0.12 116.66 113.30 3c3p n ARG 98 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 3c3p n ARG 98 Cb 0.04 -1.02 0.00 0.00 -1.02 0.00 0.00 32.46 30.46 3c3p n ARG 98 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 3c3p n LEU 100 N 0.51 0.00 0.00 0.55 4.77 -0.51 -0.74 117.00 121.58 3c3p n LEU 100 Ca 0.00 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.85 3c3p n LEU 100 Cb 0.00 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.00 3c3p n LEU 100 CO 0.00 0.00 0.64 -0.74 -1.33 0.00 0.00 177.39 175.96 3c3p h HIS 101 N 0.00 -0.03 -0.70 -1.77 2.76 -0.55 0.25 115.15 115.12 3c3p h HIS 101 Ca 0.00 -0.00 0.06 0.00 -2.20 0.00 0.00 60.37 58.23 3c3p h HIS 101 Cb 0.00 0.01 -0.06 0.00 1.55 0.00 0.00 27.41 28.91 3c3p h HIS 101 CO 0.00 0.42 0.39 -0.44 -1.30 0.00 0.00 177.93 177.00 3c3p h ASP 102 N -0.48 0.59 0.85 3.26 3.32 -1.16 -1.14 116.42 121.66 3c3p h ASP 102 Ca -0.00 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.08 3c3p h ASP 102 Cb 0.45 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.92 3c3p h ASP 102 CO 0.00 0.38 -0.21 0.59 -1.72 0.00 0.00 179.24 178.28 3c3p n ASN 103 N -4.76 0.27 0.00 6.45 5.03 -1.21 -4.94 115.26 116.10 3c3p n ASN 103 Ca 0.09 0.22 0.00 0.00 0.87 0.00 0.00 54.58 55.76 3c3p n ASN 103 Cb 0.18 -0.22 0.00 0.00 -1.02 0.00 0.00 39.78 38.72 3c3p n ASN 103 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3c3p n GLY 104 N 1.48 2.68 0.00 7.41 0.00 0.70 -4.90 105.19 112.56 3c3p n GLY 104 Ca 0.06 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.11 3c3p n GLY 104 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3c3p n LEU 105 N 0.00 0.00 0.15 0.99 4.77 -0.15 -2.78 117.00 119.97 3c3p n LEU 105 Ca 0.00 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.10 3c3p n LEU 105 Cb 0.00 0.00 0.53 0.00 -2.33 0.00 0.00 43.42 41.62 3c3p n LEU 105 CO 0.00 0.00 0.86 -0.29 -1.33 0.00 0.00 177.39 176.63 3c3p h ILE 106 N 0.00 0.00 0.00 -0.08 6.09 -1.74 -1.07 117.51 120.72 3c3p h ILE 106 Ca 0.00 -0.19 0.00 0.00 -1.37 0.00 0.00 64.86 63.30 3c3p h ILE 106 Cb 0.00 0.88 0.00 0.00 0.47 0.00 0.00 36.82 38.17 3c3p h ILE 106 CO 0.00 0.00 0.00 -0.90 -3.07 0.00 0.00 178.15 174.18 3c3p n ASP 107 N -2.29 0.00 0.00 2.19 5.75 -1.12 -3.19 116.55 117.89 3c3p n ASP 107 Ca 0.01 0.36 0.00 0.00 -0.01 0.00 0.00 54.79 55.15 3c3p n ASP 107 Cb 0.19 -0.44 0.00 0.00 -1.03 0.00 0.00 41.12 39.84 3c3p n ASP 107 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 3c3p n ARG 108 N -1.44 0.41 -4.52 0.11 0.63 -0.41 -5.02 116.66 106.43 3c3p n ARG 108 Ca 0.05 -0.65 -0.23 0.00 -0.92 0.00 0.00 57.85 56.10 3c3p n ARG 108 Cb 0.19 -0.81 -0.16 0.00 0.45 0.00 0.00 32.46 32.12 3c3p n ARG 108 CO 0.00 0.00 0.00 0.08 -2.51 0.00 0.00 177.63 175.20 3c3p s VAL 109 N -0.26 1.01 -0.27 5.15 1.01 -1.19 -1.48 120.40 124.37 3c3p s VAL 109 Ca 0.00 -0.44 -0.08 0.00 0.00 0.00 0.00 61.98 61.47 3c3p s VAL 109 Cb 0.00 -0.92 -0.02 0.00 0.00 0.00 0.00 36.38 35.44 3c3p s VAL 109 CO 0.00 0.32 0.09 -0.70 0.00 0.00 0.00 175.10 174.81 3c3p s GLU 110 N 0.48 3.52 -0.08 2.72 2.12 0.81 -4.88 118.70 123.39 3c3p s GLU 110 Ca -0.10 -0.58 0.02 0.00 0.36 0.00 0.00 54.97 54.67 3c3p s GLU 110 Cb -0.13 -3.38 -0.02 0.00 0.26 0.00 0.00 34.13 30.85 3c3p s GLU 110 CO 0.02 -0.27 -0.12 -0.51 -0.54 0.00 0.00 175.26 173.84 3c3p s LEU 111 N 1.60 2.83 -0.01 2.70 1.43 -1.26 -4.27 118.68 121.69 3c3p s LEU 111 Ca 0.05 -0.20 0.01 0.00 -1.03 0.00 0.00 54.13 52.96 3c3p s LEU 111 Cb -0.16 -1.60 0.01 0.00 0.03 0.00 0.00 46.19 44.47 3c3p s LEU 111 CO 0.04 0.30 -0.01 -1.10 0.23 0.00 0.00 176.35 175.81 3c3p s GLN 112 N -0.43 0.19 -0.25 1.70 -0.21 -1.26 -5.04 119.66 114.37 3c3p s GLN 112 Ca 0.05 0.01 -0.21 0.00 0.02 0.00 0.00 55.36 55.23 3c3p s GLN 112 Cb -0.12 -0.29 -0.02 0.00 1.00 0.00 0.00 33.01 33.58 3c3p s GLN 112 CO 0.02 -0.04 0.65 0.08 -2.12 0.00 0.00 175.29 173.88 3c3p s VAL 113 N 0.46 4.97 -2.44 1.09 1.01 -1.26 -2.07 120.40 122.17 3c3p s VAL 113 Ca -0.04 1.18 0.00 0.00 0.00 0.00 0.00 61.98 63.11 3c3p s VAL 113 Cb -0.07 -3.95 0.00 0.00 0.00 0.00 0.00 36.38 32.36 3c3p s VAL 113 CO -0.01 0.02 0.00 0.61 0.00 0.00 0.00 175.10 175.72 3c3p n GLY 114 N 4.09 -1.02 3.62 4.51 0.00 0.12 -4.92 105.19 111.59 3c3p n GLY 114 Ca -0.00 -0.95 -0.43 0.00 0.00 0.00 0.00 46.02 44.64 3c3p n GLY 114 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3c3p s ASP 115 N -4.00 6.60 0.14 1.61 2.15 -1.26 -2.33 116.67 119.58 3c3p s ASP 115 Ca 0.00 1.00 -0.23 0.00 0.43 0.00 0.00 52.55 53.75 3c3p s ASP 115 Cb 0.00 -2.54 0.01 0.00 -0.30 0.00 0.00 42.92 40.09 3c3p s ASP 115 CO 0.00 -1.18 1.63 -0.65 -0.17 0.00 0.00 175.17 174.80 3c3p h PRO 116 N 9.55 -0.26 0.01 4.34 0.11 -1.91 -1.10 132.00 142.73 3c3p h PRO 116 Ca -0.26 0.02 -0.19 0.00 0.11 0.00 0.00 66.00 65.68 3c3p h PRO 116 Cb 1.09 0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.24 3c3p h PRO 116 CO 1.06 -0.18 -0.91 -0.07 -0.21 0.00 0.00 178.00 177.69 3c3p h LEU 117 N -0.27 0.06 -0.55 2.35 3.38 -1.92 -0.66 115.31 117.70 3c3p h LEU 117 Ca 0.12 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 3c3p h LEU 117 Cb 0.46 -0.02 -0.03 0.00 0.09 0.00 0.00 40.66 41.17 3c3p h LEU 117 CO -0.36 0.94 0.27 1.23 0.09 0.00 0.00 178.44 180.61 3c3p h GLY 118 N 2.51 0.84 0.68 0.83 0.00 -1.94 -1.49 103.07 104.50 3c3p h GLY 118 Ca -0.02 -0.41 -0.14 0.00 0.00 0.00 0.00 47.33 46.76 3c3p h GLY 118 CO 0.12 0.39 -0.58 -2.22 0.00 0.00 0.00 176.54 174.25 3c3p h ILE 119 N 0.74 1.48 -0.56 2.60 2.04 -1.19 -3.31 117.51 119.31 3c3p h ILE 119 Ca 0.19 -2.19 0.07 0.00 1.00 0.00 0.00 64.86 63.93 3c3p h ILE 119 Cb 0.10 2.81 -0.03 0.00 -0.74 0.00 0.00 36.82 38.96 3c3p h ILE 119 CO -0.03 0.62 0.37 0.00 0.00 0.00 0.00 178.15 179.12 3c3p h ALA 120 N 0.24 1.90 0.00 1.87 0.00 -1.03 -1.96 119.26 120.28 3c3p h ALA 120 Ca -0.08 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.81 3c3p h ALA 120 Cb 1.34 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 19.01 3c3p h ALA 120 CO 0.11 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.36 3c3p n ALA 121 N -2.50 1.41 0.86 0.00 0.00 -0.57 -1.23 120.51 118.48 3c3p n ALA 121 Ca 0.08 0.04 0.13 0.00 0.00 0.00 0.00 53.44 53.69 3c3p n ALA 121 Cb 0.27 -1.24 0.36 0.00 0.00 0.00 0.00 19.45 18.84 3c3p n ALA 121 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3c3p n GLY 122 N -0.55 -1.41 3.86 0.00 0.00 -0.74 -4.88 105.19 101.46 3c3p n GLY 122 Ca 0.01 -0.21 -0.31 0.00 0.00 0.00 0.00 46.02 45.51 3c3p n GLY 122 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3c3p s GLN 123 N -3.05 3.80 0.08 1.61 -1.52 -0.37 -5.09 119.66 115.13 3c3p s GLN 123 Ca 0.11 0.78 0.03 0.00 -1.95 0.00 0.00 55.36 54.33 3c3p s GLN 123 Cb 0.16 -2.17 -0.03 0.00 -0.22 0.00 0.00 33.01 30.75 3c3p s GLN 123 CO 0.64 -0.32 -0.10 1.03 -0.25 0.00 0.00 175.29 176.30 3c3p s ARG 124 N -4.40 0.78 -1.46 2.91 1.81 -1.26 -4.65 118.95 112.67 3c3p s ARG 124 Ca 0.56 -1.07 -0.08 0.00 -1.72 0.00 0.00 55.73 53.42 3c3p s ARG 124 Cb -0.10 -0.47 0.05 0.00 -0.45 0.00 0.00 34.95 33.97 3c3p s ARG 124 CO 0.39 0.07 0.77 -0.25 -0.68 0.00 0.00 175.30 175.60 3c3p n ASP 125 N 0.75 -2.68 -4.71 0.23 8.00 -0.40 -4.92 116.55 112.83 3c3p n ASP 125 Ca -0.18 -0.86 -0.42 0.00 0.71 0.00 0.00 54.79 54.05 3c3p n ASP 125 Cb 0.57 -3.67 -0.03 0.00 -0.02 0.00 0.00 41.12 37.97 3c3p n ASP 125 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3c3p s ILE 126 N -3.54 2.98 -0.12 0.53 1.01 -0.03 -4.39 121.20 117.64 3c3p s ILE 126 Ca 0.34 0.64 0.01 0.00 0.00 0.00 0.00 60.65 61.65 3c3p s ILE 126 Cb -0.18 -3.41 -0.24 0.00 0.01 0.00 0.00 42.46 38.64 3c3p s ILE 126 CO 0.85 0.03 0.34 0.47 0.00 0.00 0.00 174.94 176.63 3c3p n ASP 127 N 4.42 1.64 -3.79 3.58 8.00 0.35 -0.44 116.55 130.31 3c3p n ASP 127 Ca 0.14 0.20 -0.20 0.00 0.71 0.00 0.00 54.79 55.64 3c3p n ASP 127 Cb 0.40 -0.47 -0.17 0.00 -0.02 0.00 0.00 41.12 40.87 3c3p n ASP 127 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3c3p s ILE 128 N -2.56 0.25 -0.26 0.53 1.01 -0.92 -1.03 121.20 118.23 3c3p s ILE 128 Ca -0.19 0.12 -0.03 0.00 0.00 0.00 0.00 60.65 60.55 3c3p s ILE 128 Cb 0.07 -0.38 0.02 0.00 0.01 0.00 0.00 42.46 42.18 3c3p s ILE 128 CO 0.77 0.20 -0.03 -0.22 0.00 0.00 0.00 174.94 175.66 3c3p s LEU 129 N 1.49 3.30 0.45 2.97 2.96 -0.77 -0.56 118.68 128.52 3c3p s LEU 129 Ca -0.03 -0.78 0.02 0.00 -0.22 0.00 0.00 54.13 53.13 3c3p s LEU 129 Cb -0.13 -1.72 0.01 0.00 0.50 0.00 0.00 46.19 44.84 3c3p s LEU 129 CO -0.03 -0.13 0.65 0.12 -1.32 0.00 0.00 176.35 175.64 3c3p s PHE 130 N 1.38 3.08 -0.23 5.38 5.36 -0.63 -1.04 117.98 131.28 3c3p s PHE 130 Ca 0.01 0.03 -0.04 0.00 -0.96 0.00 0.00 56.93 55.97 3c3p s PHE 130 Cb -0.16 -2.36 0.12 0.00 -0.34 0.00 0.00 43.02 40.28 3c3p s PHE 130 CO -0.03 -0.42 0.42 0.34 -1.46 0.00 0.00 175.22 174.07 3c3p s ASP 132 N -4.27 -0.11 0.25 6.13 -1.08 -1.26 -4.08 116.67 112.25 3c3p s ASP 132 Ca 0.50 0.58 0.21 0.00 -0.52 0.00 0.00 52.55 53.32 3c3p s ASP 132 Cb -0.10 1.32 0.97 0.00 -1.46 0.00 0.00 42.92 43.65 3c3p s ASP 132 CO 0.36 -0.27 1.63 0.00 0.52 0.00 0.00 175.17 177.41 3c3p h ASP 134 N 0.00 0.18 0.00 0.00 3.32 -1.80 -3.35 116.42 114.77 3c3p h ASP 134 Ca 0.00 -0.12 -0.22 0.00 0.02 0.00 0.00 57.03 56.71 3c3p h ASP 134 Cb 0.20 -0.05 -0.04 0.00 0.22 0.00 0.00 39.33 39.65 3c3p h ASP 134 CO 0.00 0.85 -2.10 0.52 -1.72 0.00 0.00 179.24 176.79 3c3p n VAL 135 N -3.75 0.83 -4.23 -1.35 0.31 -0.90 -5.00 118.33 104.23 3c3p n VAL 135 Ca -0.02 -0.65 -0.19 0.00 -0.01 0.00 0.00 64.34 63.47 3c3p n VAL 135 Cb 0.70 -0.35 -0.12 0.00 -0.91 0.00 0.00 33.84 33.16 3c3p n VAL 135 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 3c3p s PHE 136 N -2.70 1.20 -0.56 3.52 0.08 -0.70 -5.09 117.98 113.74 3c3p s PHE 136 Ca -0.08 -0.42 -0.25 0.00 0.12 0.00 0.00 56.93 56.31 3c3p s PHE 136 Cb 0.07 -0.69 0.04 0.00 -0.57 0.00 0.00 43.02 41.88 3c3p s PHE 136 CO 0.74 0.05 0.97 1.21 -0.10 0.00 0.00 175.22 178.08 3c3p s ASN 137 N -1.50 6.34 0.24 1.36 2.47 -1.26 -4.47 114.94 118.12 3c3p s ASN 137 Ca -0.01 -0.32 -0.05 0.00 0.42 0.00 0.00 52.86 52.90 3c3p s ASN 137 Cb -0.09 -2.45 0.45 0.00 -1.45 0.00 0.00 41.25 37.71 3c3p s ASN 137 CO 0.02 -1.26 1.70 1.23 -3.72 0.00 0.00 177.10 175.06 3c3p h GLY 138 N 11.10 1.03 0.69 1.21 0.00 -1.94 -1.62 103.07 113.54 3c3p h GLY 138 Ca -0.26 -0.06 0.06 0.00 0.00 0.00 0.00 47.33 47.07 3c3p h GLY 138 CO 1.10 -0.17 0.45 0.00 0.00 0.00 0.00 176.54 177.91 3c3p h ALA 139 N 1.59 1.03 -0.53 3.60 0.00 -1.92 0.11 119.26 123.13 3c3p h ALA 139 Ca 0.41 0.01 -0.11 0.00 0.00 0.00 0.00 54.91 55.21 3c3p h ALA 139 Cb 0.68 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 3c3p h ALA 139 CO -0.48 0.15 -0.10 -0.44 0.00 0.00 0.00 179.25 178.38 3c3p h ASP 140 N 0.81 1.01 -0.62 0.00 5.19 -1.74 -0.41 116.42 120.66 3c3p h ASP 140 Ca 0.34 -0.35 -0.04 0.00 -0.62 0.00 0.00 57.03 56.36 3c3p h ASP 140 Cb 0.19 -0.27 -0.03 0.00 0.18 0.00 0.00 39.33 39.40 3c3p h ASP 140 CO -0.18 1.12 0.24 0.58 -3.12 0.00 0.00 179.24 177.88 3c3p h VAL 141 N 0.88 1.23 -0.03 -1.35 2.07 -0.72 -2.44 116.25 115.89 3c3p h VAL 141 Ca 0.14 -0.74 -0.14 0.00 0.82 0.00 0.00 66.70 66.79 3c3p h VAL 141 Cb 0.66 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 3c3p h VAL 141 CO 0.05 0.29 -0.61 0.25 0.02 0.00 0.00 177.57 177.57 3c3p h LEU 142 N 0.86 0.11 -0.51 2.57 5.85 -0.77 -2.84 115.31 120.59 3c3p h LEU 142 Ca 0.20 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 58.85 3c3p h LEU 142 Cb 0.21 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 3c3p h LEU 142 CO -0.02 0.69 0.27 -0.08 -0.34 0.00 0.00 178.44 178.96 3c3p h GLU 143 N 0.07 0.71 -0.50 1.25 4.57 -0.80 -0.68 114.58 119.21 3c3p h GLU 143 Ca -0.01 -0.09 0.00 0.00 -1.18 0.00 0.00 59.36 58.08 3c3p h GLU 143 Cb 1.09 -0.14 0.00 0.00 -0.16 0.00 0.00 28.75 29.54 3c3p h GLU 143 CO 0.09 0.57 0.00 0.54 -1.18 0.00 0.00 179.01 179.03 3c3p n ARG 144 N -4.63 1.03 0.00 1.92 1.74 -0.94 -4.77 116.66 111.01 3c3p n ARG 144 Ca 0.02 -0.03 0.00 0.00 -0.77 0.00 0.00 57.85 57.07 3c3p n ARG 144 Cb 0.10 -1.26 0.00 0.00 -1.02 0.00 0.00 32.46 30.28 3c3p n ARG 144 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 3c3p n ASN 146 N -0.24 0.00 0.19 0.55 5.15 -0.26 -4.68 115.26 115.97 3c3p n ASN 146 Ca 0.00 0.00 0.14 0.00 -0.60 0.00 0.00 54.58 54.12 3c3p n ASN 146 Cb 0.13 0.00 0.65 0.00 -0.53 0.00 0.00 39.78 40.03 3c3p n ASN 146 CO 0.00 0.00 0.00 0.08 1.40 0.00 0.00 177.26 178.74 3c3p h ARG 147 N 0.00 0.00 -0.00 1.20 -0.00 -1.86 -1.81 114.38 111.91 3c3p h ARG 147 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.98 3c3p h ARG 147 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 29.97 3c3p h ARG 147 CO 0.00 0.00 -0.77 0.00 -0.00 0.00 0.00 179.97 179.20 3c3p s LEU 149 N -2.92 4.34 0.70 0.00 1.43 -0.68 -0.85 118.68 120.69 3c3p s LEU 149 Ca 0.11 1.70 -0.10 0.00 -1.03 0.00 0.00 54.13 54.81 3c3p s LEU 149 Cb 0.17 -3.88 0.02 0.00 0.03 0.00 0.00 46.19 42.54 3c3p s LEU 149 CO 0.78 -0.03 1.07 0.00 0.23 0.00 0.00 176.35 178.39 3c3p s ALA 150 N -1.58 2.94 0.27 4.21 0.00 0.42 -4.57 121.76 123.45 3c3p s ALA 150 Ca 0.48 -0.47 -0.30 0.00 0.00 0.00 0.00 51.96 51.67 3c3p s ALA 150 Cb -0.18 -2.93 -0.13 0.00 0.00 0.00 0.00 23.12 19.88 3c3p s ALA 150 CO 0.23 -1.16 1.40 1.17 0.00 0.00 0.00 175.76 177.40 3c3p n LYS 151 N -2.98 2.12 -2.70 0.00 4.81 -1.26 -2.11 118.16 116.05 3c3p n LYS 151 Ca 0.07 0.75 -0.20 0.00 -0.87 0.00 0.00 58.31 58.06 3c3p n LYS 151 Cb 0.58 -2.41 0.01 0.00 0.02 0.00 0.00 35.03 33.23 3c3p n LYS 151 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 3c3p n ASN 152 N 1.85 -5.43 -4.72 3.14 5.03 -0.49 -4.97 115.26 109.67 3c3p n ASN 152 Ca 0.10 -0.10 -0.34 0.00 0.87 0.00 0.00 54.58 55.11 3c3p n ASN 152 Cb 0.33 -4.48 0.10 0.00 -1.02 0.00 0.00 39.78 34.71 3c3p n ASN 152 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3c3p s ALA 153 N -3.00 2.05 -0.19 5.41 0.00 -0.90 -4.60 121.76 120.54 3c3p s ALA 153 Ca 0.13 0.86 -0.01 0.00 0.00 0.00 0.00 51.96 52.94 3c3p s ALA 153 Cb -0.06 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.59 3c3p s ALA 153 CO 0.17 -1.98 -0.13 -1.17 0.00 0.00 0.00 175.76 172.65 3c3p s LEU 154 N -5.30 2.50 -0.13 0.00 2.96 -0.20 -0.84 118.68 117.68 3c3p s LEU 154 Ca 0.74 -0.51 -0.20 0.00 -0.22 0.00 0.00 54.13 53.95 3c3p s LEU 154 Cb -0.29 -1.59 -0.04 0.00 0.50 0.00 0.00 46.19 44.77 3c3p s LEU 154 CO 0.47 0.02 0.55 -0.76 -1.32 0.00 0.00 176.35 175.31 3c3p s LEU 155 N 1.20 4.25 -0.25 -0.68 1.43 0.12 -1.84 118.68 122.92 3c3p s LEU 155 Ca 0.02 0.88 0.02 0.00 -1.03 0.00 0.00 54.13 54.02 3c3p s LEU 155 Cb -0.14 -2.81 0.06 0.00 0.03 0.00 0.00 46.19 43.33 3c3p s LEU 155 CO -0.06 -0.08 -0.08 -0.63 0.23 0.00 0.00 176.35 175.73 3c3p s ILE 156 N 0.96 1.87 -0.22 -0.59 1.01 -0.21 -1.29 121.20 122.74 3c3p s ILE 156 Ca 0.29 -1.44 0.02 0.00 0.00 0.00 0.00 60.65 59.51 3c3p s ILE 156 Cb -0.16 -2.05 0.04 0.00 0.01 0.00 0.00 42.46 40.30 3c3p s ILE 156 CO 0.12 -0.06 -0.16 0.00 0.00 0.00 0.00 174.94 174.83 3c3p s ALA 157 N 1.24 2.44 0.58 9.38 0.00 0.20 -4.29 121.76 131.31 3c3p s ALA 157 Ca -0.07 -1.46 -0.04 0.00 0.00 0.00 0.00 51.96 50.39 3c3p s ALA 157 Cb -0.19 -1.36 0.02 0.00 0.00 0.00 0.00 23.12 21.59 3c3p s ALA 157 CO -0.06 -0.72 0.86 0.14 0.00 0.00 0.00 175.76 175.99 3c3p s VAL 158 N 1.21 3.25 -1.39 0.00 -7.23 -1.26 -0.70 120.40 114.28 3c3p s VAL 158 Ca -0.01 -0.26 -0.08 0.00 -1.81 0.00 0.00 61.98 59.82 3c3p s VAL 158 Cb -0.16 -3.28 0.03 0.00 0.56 0.00 0.00 36.38 33.53 3c3p s VAL 158 CO -0.09 -0.26 1.00 0.59 -0.31 0.00 0.00 175.10 176.03 3c3p n ASN 159 N -2.53 -4.28 0.17 4.85 3.02 -0.99 -1.25 115.26 114.26 3c3p n ASN 159 Ca 0.05 -0.69 0.06 0.00 -0.03 0.00 0.00 54.58 53.98 3c3p n ASN 159 Cb 0.59 -4.47 0.09 0.00 -0.61 0.00 0.00 39.78 35.37 3c3p n ASN 159 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3c3p h ALA 160 N 0.96 0.81 0.00 5.41 0.00 -1.22 -3.38 119.26 121.84 3c3p h ALA 160 Ca -0.58 -0.27 -0.10 0.00 0.00 0.00 0.00 54.91 53.96 3c3p h ALA 160 Cb 1.37 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 19.09 3c3p h ALA 160 CO 0.59 0.37 -1.43 1.28 0.00 0.00 0.00 179.25 180.06 3c3p n LEU 161 N -3.17 0.00 -3.74 0.00 4.77 -0.18 -3.52 117.00 111.15 3c3p n LEU 161 Ca 0.03 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.91 3c3p n LEU 161 Cb 0.65 0.14 -0.06 0.00 -2.33 0.00 0.00 43.42 41.81 3c3p n LEU 161 CO 0.38 0.14 0.03 0.00 -1.33 0.00 0.00 177.39 176.61 3c3p s ARG 162 N -2.21 0.94 0.40 3.23 1.70 -0.72 -1.08 118.95 121.19 3c3p s ARG 162 Ca -0.03 -0.78 -0.26 0.00 -0.47 0.00 0.00 55.73 54.19 3c3p s ARG 162 Cb 0.02 0.40 -0.09 0.00 -0.57 0.00 0.00 34.95 34.72 3c3p s ARG 162 CO 0.27 -0.33 1.20 -0.98 -1.08 0.00 0.00 175.30 174.38 3c3p s ARG 163 N -3.64 4.06 0.00 3.89 1.70 -1.26 -4.51 118.95 119.19 3c3p s ARG 163 Ca 0.03 1.92 0.00 0.00 -0.47 0.00 0.00 55.73 57.21 3c3p s ARG 163 Cb 0.03 -2.72 0.00 0.00 -0.57 0.00 0.00 34.95 31.68 3c3p s ARG 163 CO -0.10 -0.34 0.84 0.41 -1.08 0.00 0.00 175.30 175.03 3c3p n GLY 164 N 0.67 1.77 3.52 3.88 0.00 -1.26 -5.03 105.19 108.74 3c3p n GLY 164 Ca 0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 3c3p n GLY 164 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 3c3p s LEU 178 N 0.00 1.22 0.32 0.99 2.34 -0.24 -4.94 118.68 118.37 3c3p s LEU 178 Ca 0.00 1.70 -0.18 0.00 0.06 0.00 0.00 54.13 55.72 3c3p s LEU 178 Cb 0.00 -3.69 0.03 0.00 -0.56 0.00 0.00 46.19 41.97 3c3p s LEU 178 CO 0.00 -4.07 0.72 0.00 -1.06 0.00 0.00 176.35 171.94 3c3p s ARG 179 N -4.46 1.96 0.33 1.48 1.70 -1.23 -4.88 118.95 113.85 3c3p s ARG 179 Ca 0.68 -1.22 0.05 0.00 -0.47 0.00 0.00 55.73 54.77 3c3p s ARG 179 Cb -0.25 0.60 0.69 0.00 -0.57 0.00 0.00 34.95 35.43 3c3p s ARG 179 CO 0.64 -0.90 1.88 1.49 -1.08 0.00 0.00 175.30 177.33 3c3p h GLU 180 N 2.02 0.81 0.00 3.89 4.57 -1.99 -1.10 114.58 122.79 3c3p h GLU 180 Ca -0.25 -0.05 -0.02 0.00 -1.18 0.00 0.00 59.36 57.86 3c3p h GLU 180 Cb 1.25 -0.18 -0.00 0.00 -0.16 0.00 0.00 28.75 29.65 3c3p h GLU 180 CO 0.32 0.53 -0.10 0.35 -1.18 0.00 0.00 179.01 178.93 3c3p h PHE 181 N 0.83 0.00 -0.60 0.92 3.57 -1.97 -0.31 116.94 119.39 3c3p h PHE 181 Ca 0.43 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.89 3c3p h PHE 181 Cb 0.51 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.23 3c3p h PHE 181 CO -0.00 0.10 0.23 -0.91 -2.23 0.00 0.00 178.31 175.49 3c3p h ASN 182 N 0.00 0.83 -0.37 0.41 2.35 -1.55 -0.50 115.58 116.75 3c3p h ASN 182 Ca -0.00 -0.18 -0.12 0.00 -0.55 0.00 0.00 56.30 55.45 3c3p h ASN 182 Cb 0.22 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.36 3c3p h ASN 182 CO 0.01 0.79 -0.22 0.45 -1.65 0.00 0.00 177.43 176.80 3c3p h HIS 183 N 0.83 0.99 0.43 1.19 3.86 -1.15 -2.47 115.15 118.82 3c3p h HIS 183 Ca 0.20 -0.23 -0.02 0.00 -1.16 0.00 0.00 60.37 59.15 3c3p h HIS 183 Cb 0.22 -0.23 0.00 0.00 1.06 0.00 0.00 27.41 28.46 3c3p h HIS 183 CO 0.01 1.00 -0.21 1.25 0.86 0.00 0.00 177.93 180.85 3c3p h HIS 184 N 0.75 -0.53 0.00 2.45 -0.00 -1.02 -3.26 115.15 113.54 3c3p h HIS 184 Ca 0.10 -0.01 -0.08 0.00 -0.00 0.00 0.00 60.37 60.38 3c3p h HIS 184 Cb 0.77 0.18 -0.01 0.00 -0.00 0.00 0.00 27.41 28.34 3c3p h HIS 184 CO 0.04 -0.21 -0.37 1.25 -0.00 0.00 0.00 177.93 178.65 3c3p h LEU 185 N -0.92 0.00 -1.05 0.26 5.85 -1.15 -1.44 115.31 116.85 3c3p h LEU 185 Ca -0.06 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.66 3c3p h LEU 185 Cb 0.56 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.59 3c3p h LEU 185 CO 0.10 0.37 -0.02 0.28 -0.34 0.00 0.00 178.44 178.82 3c3p h SER 186 N 0.00 0.00 -0.72 1.25 0.02 -1.55 -2.53 113.55 110.03 3c3p h SER 186 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3c3p h SER 186 Cb 0.71 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.25 3c3p h SER 186 CO 0.05 0.02 0.00 0.54 -1.14 0.00 0.00 176.83 176.30 3c3p n ARG 187 N -3.11 2.66 -3.32 3.45 1.74 -0.55 -4.84 116.66 112.69 3c3p n ARG 187 Ca 0.01 -2.58 -0.45 0.00 -0.77 0.00 0.00 57.85 54.06 3c3p n ARG 187 Cb 0.38 -1.56 -0.07 0.00 -1.02 0.00 0.00 32.46 30.19 3c3p n ARG 187 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3c3p s ARG 188 N -1.04 3.01 0.15 5.56 0.52 -0.95 -4.91 118.95 121.29 3c3p s ARG 188 Ca 0.48 -1.36 0.13 0.00 -0.52 0.00 0.00 55.73 54.47 3c3p s ARG 188 Cb 0.25 -4.17 0.66 0.00 0.52 0.00 0.00 34.95 32.20 3c3p s ARG 188 CO 0.33 -1.16 1.41 2.89 0.02 0.00 0.00 175.30 178.79 3c3p n ARG 189 N 5.44 0.08 0.00 3.54 -4.01 -1.26 -1.66 116.66 118.79 3c3p n ARG 189 Ca -0.12 0.50 0.14 0.00 -1.04 0.00 0.00 57.85 57.34 3c3p n ARG 189 Cb 0.43 -1.72 0.55 0.00 -3.04 0.00 0.00 32.46 28.68 3c3p n ARG 189 CO 0.00 0.00 0.00 -0.40 -3.04 0.00 0.00 177.63 174.19 3c3p n ASP 190 N -1.88 1.34 -4.13 2.89 5.75 -1.26 -4.83 116.55 114.43 3c3p n ASP 190 Ca 0.00 -1.41 -0.18 0.00 -0.01 0.00 0.00 54.79 53.20 3c3p n ASP 190 Cb 0.07 0.01 -0.12 0.00 -1.03 0.00 0.00 41.12 40.04 3c3p n ASP 190 CO 0.00 0.00 0.00 -0.36 -0.11 0.00 0.00 177.20 176.73 3c3p s PHE 191 N -2.04 1.05 -0.23 2.11 0.40 -0.66 -1.51 117.98 117.10 3c3p s PHE 191 Ca 0.38 -0.41 -0.06 0.00 -0.60 0.00 0.00 56.93 56.23 3c3p s PHE 191 Cb 0.21 -0.61 -0.03 0.00 0.51 0.00 0.00 43.02 43.10 3c3p s PHE 191 CO 0.35 0.02 0.04 0.12 0.70 0.00 0.00 175.22 176.44 3c3p s PHE 192 N -1.10 3.07 0.09 0.36 5.36 -0.08 -4.82 117.98 120.86 3c3p s PHE 192 Ca -0.02 -0.45 0.08 0.00 -0.96 0.00 0.00 56.93 55.58 3c3p s PHE 192 Cb -0.09 -2.16 -0.03 0.00 -0.34 0.00 0.00 43.02 40.40 3c3p s PHE 192 CO 0.01 -0.30 -0.21 -0.08 -1.46 0.00 0.00 175.22 173.19 3c3p s THR 193 N 1.31 1.70 0.00 0.12 -1.32 -1.26 -1.08 115.64 115.10 3c3p s THR 193 Ca 0.04 -1.49 -0.14 0.00 -1.21 0.00 0.00 61.69 58.89 3c3p s THR 193 Cb -0.15 -1.53 0.02 0.00 -1.51 0.00 0.00 72.50 69.33 3c3p s THR 193 CO 0.02 -0.03 0.30 0.28 -2.21 0.00 0.00 174.62 172.98 3c3p s THR 194 N -1.12 0.07 -0.19 5.08 -1.32 -0.67 -5.02 115.64 112.47 3c3p s THR 194 Ca 0.06 -0.54 -0.00 0.00 -1.21 0.00 0.00 61.69 60.00 3c3p s THR 194 Cb -0.10 -0.69 0.01 0.00 -1.51 0.00 0.00 72.50 70.22 3c3p s THR 194 CO 0.04 -0.30 -0.15 -0.63 -2.21 0.00 0.00 174.62 171.37 3c3p s ILE 195 N -1.63 2.45 -0.22 5.08 1.01 -1.26 -0.77 121.20 125.86 3c3p s ILE 195 Ca -0.12 -0.81 -0.17 0.00 0.00 0.00 0.00 60.65 59.56 3c3p s ILE 195 Cb -0.04 -2.06 -0.03 0.00 0.01 0.00 0.00 42.46 40.34 3c3p s ILE 195 CO 0.02 0.51 0.46 -0.69 0.00 0.00 0.00 174.94 175.24 3c3p s VAL 196 N 1.34 5.14 -0.42 2.92 1.01 0.24 -4.93 120.40 125.70 3c3p s VAL 196 Ca 0.05 0.81 -0.06 0.00 0.00 0.00 0.00 61.98 62.78 3c3p s VAL 196 Cb -0.13 -3.78 -0.19 0.00 0.00 0.00 0.00 36.38 32.27 3c3p s VAL 196 CO -0.10 0.18 3.14 -0.81 0.00 0.00 0.00 175.10 177.50 3c3p n PRO 197 N 4.92 2.22 -3.71 2.72 -0.04 -1.26 -1.33 135.00 138.52 3c3p n PRO 197 Ca -0.06 -1.21 -0.36 0.00 -0.04 0.00 0.00 63.50 61.82 3c3p n PRO 197 Cb 0.50 -2.17 -0.07 0.00 -0.04 0.00 0.00 33.50 31.73 3c3p n PRO 197 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3c3p s VAL 198 N 1.58 5.37 0.00 0.52 1.01 -1.26 -4.56 120.40 123.06 3c3p s VAL 198 Ca 0.60 0.36 0.00 0.00 0.00 0.00 0.00 61.98 62.95 3c3p s VAL 198 Cb 0.25 -3.51 0.00 0.00 0.00 0.00 0.00 36.38 33.12 3c3p s VAL 198 CO -0.02 0.51 0.00 0.61 0.00 0.00 0.00 175.10 176.20 3c3p n GLY 199 N 2.72 4.04 1.02 4.51 0.00 -1.26 -0.59 105.19 115.63 3c3p n GLY 199 Ca -0.16 0.10 0.07 0.00 0.00 0.00 0.00 46.02 46.03 3c3p n GLY 199 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3c3p n ASN 200 N 7.39 2.95 0.00 1.61 3.02 -1.26 -4.81 115.26 124.17 3c3p n ASN 200 Ca 0.00 -2.14 0.00 0.00 -0.03 0.00 0.00 54.58 52.41 3c3p n ASN 200 Cb 0.00 -0.39 0.00 0.00 -0.61 0.00 0.00 39.78 38.78 3c3p n ASN 200 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3c3p n GLY 201 N 1.09 0.89 2.93 7.41 0.00 0.24 -1.01 105.19 116.74 3c3p n GLY 201 Ca 0.17 -1.37 -0.28 0.00 0.00 0.00 0.00 46.02 44.54 3c3p n GLY 201 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3c3p s VAL 202 N -0.51 1.25 -0.14 1.61 1.01 -0.44 -1.63 120.40 121.55 3c3p s VAL 202 Ca 0.00 -0.59 -0.20 0.00 0.00 0.00 0.00 61.98 61.19 3c3p s VAL 202 Cb 0.00 -1.32 -0.04 0.00 0.00 0.00 0.00 36.38 35.02 3c3p s VAL 202 CO 0.00 0.26 0.57 -0.22 0.00 0.00 0.00 175.10 175.71 3c3p s LEU 203 N 1.59 4.23 -0.16 3.92 2.96 0.13 -0.59 118.68 130.76 3c3p s LEU 203 Ca 0.02 0.88 0.01 0.00 -0.22 0.00 0.00 54.13 54.83 3c3p s LEU 203 Cb -0.14 -2.83 0.01 0.00 0.50 0.00 0.00 46.19 43.73 3c3p s LEU 203 CO -0.08 -0.12 -0.19 -0.76 -1.32 0.00 0.00 176.35 173.88 3c3p s LEU 204 N 1.12 2.23 -0.14 -0.68 1.43 0.05 -0.62 118.68 122.06 3c3p s LEU 204 Ca 0.29 -0.58 0.00 0.00 -1.03 0.00 0.00 54.13 52.81 3c3p s LEU 204 Cb -0.16 -1.50 0.02 0.00 0.03 0.00 0.00 46.19 44.59 3c3p s LEU 204 CO 0.12 0.05 -0.13 -0.83 0.23 0.00 0.00 176.35 175.78 3c3p s GLY 205 N 1.02 1.08 -0.26 -3.19 0.00 -0.41 -1.68 107.32 103.88 3c3p s GLY 205 Ca -0.02 -0.84 -0.10 0.00 0.00 0.00 0.00 44.72 43.76 3c3p s GLY 205 CO -0.06 0.55 0.15 -0.47 0.00 0.00 0.00 173.10 173.27 3c3p s TYR 206 N 1.49 3.21 -0.28 1.90 5.04 -0.24 0.13 117.35 128.60 3c3p s TYR 206 Ca 0.04 0.02 -0.29 0.00 -2.44 0.00 0.00 57.07 54.40 3c3p s TYR 206 Cb -0.13 -2.30 -0.01 0.00 0.35 0.00 0.00 41.96 39.87 3c3p s TYR 206 CO -0.10 -0.13 1.49 0.50 -1.34 0.00 0.00 175.55 175.97 3c3p s ARG 207 N 1.48 3.78 0.15 4.97 3.52 -0.02 -0.90 118.95 131.93 3c3p s ARG 207 Ca 0.07 1.41 0.18 0.00 -0.13 0.00 0.00 55.73 57.26 3c3p s ARG 207 Cb -0.15 -3.99 0.79 0.00 -1.56 0.00 0.00 34.95 30.04 3c3p s ARG 207 CO 0.07 -1.31 1.55 1.28 -0.81 0.00 0.00 175.30 176.09 3c3p n LEU 208 N 8.33 0.36 0.00 -0.88 4.77 -0.57 -3.50 117.00 125.51 3c3p n LEU 208 Ca 0.17 0.60 0.00 0.00 -0.03 0.00 0.00 56.01 56.76 3c3p n LEU 208 Cb 0.46 -0.57 0.00 0.00 -2.33 0.00 0.00 43.42 40.98 3c3p n LEU 208 CO 0.65 -0.49 0.09 -1.54 -1.33 0.00 0.00 177.39 174.77