#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 13pk s LYS 6 N 0.00 1.91 0.37 5.31 -0.14 -1.26 -1.04 119.74 124.89 13pk s LYS 6 Ca 0.00 0.41 -0.19 0.00 -1.36 0.00 0.00 55.97 54.83 13pk s LYS 6 Cb 0.00 -1.92 -0.10 0.00 -1.68 0.00 0.00 37.83 34.13 13pk s LYS 6 CO 0.00 -1.69 0.85 0.21 -0.76 0.00 0.00 175.35 173.96 13pk s LYS 7 N -5.30 4.17 0.38 1.68 2.20 0.34 -4.20 119.74 119.01 13pk s LYS 7 Ca 0.61 0.95 0.08 0.00 -0.36 0.00 0.00 55.97 57.25 13pk s LYS 7 Cb -0.13 -2.36 -0.02 0.00 -1.51 0.00 0.00 37.83 33.81 13pk s LYS 7 CO 0.53 0.09 0.39 0.45 -0.36 0.00 0.00 175.35 176.44 13pk s SER 8 N -2.14 5.32 0.38 1.43 0.15 -1.26 0.41 113.70 117.98 13pk s SER 8 Ca 0.57 -0.55 0.06 0.00 0.70 0.00 0.00 55.95 56.73 13pk s SER 8 Cb -0.11 -0.79 0.77 0.00 -1.71 0.00 0.00 66.02 64.19 13pk s SER 8 CO 0.16 -0.54 2.00 0.16 1.20 0.00 0.00 173.24 176.22 13pk h ILE 9 N 1.03 1.07 -0.90 6.45 3.07 -1.80 -1.22 117.51 125.21 13pk h ILE 9 Ca -0.43 -0.24 0.20 0.00 1.55 0.00 0.00 64.86 65.94 13pk h ILE 9 Cb 1.26 0.32 -0.07 0.00 -0.27 0.00 0.00 36.82 38.06 13pk h ILE 9 CO 0.55 0.13 0.59 0.78 -1.05 0.00 0.00 178.15 179.15 13pk h ASN 10 N 0.69 0.43 0.01 2.16 -0.26 -1.94 0.37 115.58 117.04 13pk h ASN 10 Ca 0.24 0.04 0.00 0.00 -0.56 0.00 0.00 56.30 56.02 13pk h ASN 10 Cb 0.10 -0.04 0.00 0.00 -1.06 0.00 0.00 38.32 37.32 13pk h ASN 10 CO -0.07 0.18 -0.01 -0.62 -1.06 0.00 0.00 177.43 175.85 13pk n GLU 11 N -4.52 1.34 -3.69 0.81 4.71 -0.46 -4.89 120.64 113.93 13pk n GLU 11 Ca 0.19 -0.53 -0.29 0.00 -0.01 0.00 0.00 57.16 56.52 13pk n GLU 11 Cb 0.68 -1.49 -0.04 0.00 -1.01 0.00 0.00 31.44 29.58 13pk n GLU 11 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 13pk s ASP 13 N -2.84 6.29 -0.03 0.00 2.15 -1.26 -4.91 116.67 116.07 13pk s ASP 13 Ca 0.39 -0.13 0.11 0.00 0.43 0.00 0.00 52.55 53.36 13pk s ASP 13 Cb -0.12 -2.26 -0.17 0.00 -0.30 0.00 0.00 42.92 40.07 13pk s ASP 13 CO 0.27 -0.49 0.22 0.18 -0.17 0.00 0.00 175.17 175.19 13pk n LEU 14 N 5.71 0.00 -4.64 -1.34 4.77 -1.26 -4.86 117.00 115.37 13pk n LEU 14 Ca -0.05 0.00 -0.56 0.00 -0.03 0.00 0.00 56.01 55.37 13pk n LEU 14 Cb 0.49 0.03 -0.07 0.00 -2.33 0.00 0.00 43.42 41.54 13pk n LEU 14 CO 0.45 0.03 1.05 1.17 -1.33 0.00 0.00 177.39 178.76 13pk n LYS 15 N -1.96 0.94 -1.34 3.23 3.00 -1.12 -0.38 118.16 120.53 13pk n LYS 15 Ca -0.04 0.34 -0.12 0.00 -0.00 0.00 0.00 58.31 58.49 13pk n LYS 15 Cb 0.37 -1.98 -0.05 0.00 0.00 0.00 0.00 35.03 33.37 13pk n LYS 15 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 13pk n GLY 16 N 3.18 1.15 3.68 3.14 0.00 0.12 -4.86 105.19 111.59 13pk n GLY 16 Ca 0.23 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.93 13pk n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 13pk s LYS 17 N -3.01 2.71 -0.40 1.61 1.02 0.49 -4.95 119.74 117.21 13pk s LYS 17 Ca 0.00 -0.68 -0.25 0.00 0.02 0.00 0.00 55.97 55.06 13pk s LYS 17 Cb 0.00 -2.63 0.02 0.00 -0.52 0.00 0.00 37.83 34.70 13pk s LYS 17 CO 0.00 0.60 0.88 0.15 -0.92 0.00 0.00 175.35 176.06 13pk s LYS 18 N -1.75 3.69 -0.23 1.68 1.02 -1.26 -1.88 119.74 121.00 13pk s LYS 18 Ca 0.21 0.33 -0.13 0.00 0.02 0.00 0.00 55.97 56.40 13pk s LYS 18 Cb -0.12 -3.86 -0.04 0.00 -0.52 0.00 0.00 37.83 33.30 13pk s LYS 18 CO 0.12 -1.03 0.29 0.08 -0.92 0.00 0.00 175.35 173.89 13pk s VAL 19 N 3.48 5.27 -0.36 3.17 1.01 -0.32 0.08 120.40 132.72 13pk s VAL 19 Ca 0.36 0.45 -0.23 0.00 0.00 0.00 0.00 61.98 62.56 13pk s VAL 19 Cb -0.12 -3.62 0.01 0.00 0.00 0.00 0.00 36.38 32.65 13pk s VAL 19 CO 0.21 0.29 0.75 -0.76 0.00 0.00 0.00 175.10 175.59 13pk s LEU 20 N 1.27 4.16 -0.17 3.92 1.02 0.92 -1.77 118.68 128.04 13pk s LEU 20 Ca 0.13 0.30 0.01 0.00 0.02 0.00 0.00 54.13 54.59 13pk s LEU 20 Cb -0.14 -2.98 0.01 0.00 0.02 0.00 0.00 46.19 43.10 13pk s LEU 20 CO 0.07 -0.71 -0.18 -0.63 0.02 0.00 0.00 176.35 174.91 13pk s ILE 21 N 3.02 2.30 -0.45 -0.59 1.01 -0.76 -0.35 121.20 125.38 13pk s ILE 21 Ca 0.30 -0.88 -0.18 0.00 0.00 0.00 0.00 60.65 59.89 13pk s ILE 21 Cb -0.13 -1.96 0.04 0.00 0.01 0.00 0.00 42.46 40.41 13pk s ILE 21 CO 0.17 0.53 0.49 -0.60 0.00 0.00 0.00 174.94 175.52 13pk s ARG 22 N 1.06 3.10 0.35 2.79 3.00 -0.93 -1.41 118.95 126.90 13pk s ARG 22 Ca -0.01 -0.83 0.08 0.00 -1.00 0.00 0.00 55.73 53.97 13pk s ARG 22 Cb -0.14 -4.01 -0.04 0.00 0.00 0.00 0.00 34.95 30.76 13pk s ARG 22 CO -0.06 -0.97 0.21 0.14 0.00 0.00 0.00 175.30 174.62 13pk s VAL 23 N 2.24 3.10 -0.59 7.11 -7.23 -0.87 -0.55 120.40 123.61 13pk s VAL 23 Ca 0.13 -1.57 -0.07 0.00 -1.81 0.00 0.00 61.98 58.66 13pk s VAL 23 Cb -0.18 -3.04 0.15 0.00 0.56 0.00 0.00 36.38 33.87 13pk s VAL 23 CO 0.13 -0.15 0.44 -0.62 -0.31 0.00 0.00 175.10 174.59 13pk s ASP 24 N -3.92 5.69 -0.29 4.85 2.15 -1.26 -4.44 116.67 119.45 13pk s ASP 24 Ca 0.40 -2.41 0.11 0.00 0.43 0.00 0.00 52.55 51.08 13pk s ASP 24 Cb -0.03 -1.98 0.60 0.00 -0.30 0.00 0.00 42.92 41.22 13pk s ASP 24 CO 0.24 -0.54 1.61 0.49 -0.17 0.00 0.00 175.17 176.80 13pk n PHE 25 N 4.20 1.68 -1.49 -5.34 3.72 -1.26 -4.47 117.46 114.50 13pk n PHE 25 Ca 0.02 -1.31 -0.42 0.00 -0.05 0.00 0.00 57.45 55.69 13pk n PHE 25 Cb 0.41 -0.55 -0.02 0.00 -0.94 0.00 0.00 39.48 38.37 13pk n PHE 25 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 13pk n ASN 26 N -0.67 3.73 -4.85 4.37 5.15 -1.21 -4.80 115.26 116.98 13pk n ASN 26 Ca 0.35 -2.76 -0.32 0.00 -0.60 0.00 0.00 54.58 51.26 13pk n ASN 26 Cb 1.18 -1.46 -0.05 0.00 -0.53 0.00 0.00 39.78 38.92 13pk n ASN 26 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 13pk s VAL 27 N 3.73 4.63 0.11 3.44 -7.23 -1.26 -4.80 120.40 119.01 13pk s VAL 27 Ca 0.51 1.01 -0.31 0.00 -1.81 0.00 0.00 61.98 61.38 13pk s VAL 27 Cb 0.14 -3.66 -0.09 0.00 0.56 0.00 0.00 36.38 33.34 13pk s VAL 27 CO -0.02 -0.38 1.62 -2.84 -0.31 0.00 0.00 175.10 173.17 13pk s PRO 28 N -3.42 4.21 0.02 4.82 0.02 -1.25 -4.89 135.00 134.51 13pk s PRO 28 Ca 0.56 2.34 0.06 0.00 0.02 0.00 0.00 61.00 63.99 13pk s PRO 28 Cb -0.10 -3.42 -0.02 0.00 0.02 0.00 0.00 34.50 30.98 13pk s PRO 28 CO 0.22 -0.68 -0.19 0.14 -0.33 0.00 0.00 177.00 176.16 13pk s VAL 29 N 2.02 1.54 -0.04 3.83 -7.23 -1.26 -0.69 120.40 118.57 13pk s VAL 29 Ca 0.72 -1.04 -0.01 0.00 -1.81 0.00 0.00 61.98 59.85 13pk s VAL 29 Cb -0.41 -1.33 0.03 0.00 0.56 0.00 0.00 36.38 35.23 13pk s VAL 29 CO 0.32 0.26 0.02 -0.75 -0.31 0.00 0.00 175.10 174.64 13pk s LYS 30 N -0.92 0.21 -1.45 4.82 2.20 0.98 -4.81 119.74 120.78 13pk s LYS 30 Ca 0.07 0.18 -0.09 0.00 -0.36 0.00 0.00 55.97 55.77 13pk s LYS 30 Cb -0.08 -0.56 0.05 0.00 -1.51 0.00 0.00 37.83 35.73 13pk s LYS 30 CO 0.01 -0.23 0.93 0.09 -0.36 0.00 0.00 175.35 175.80 13pk n ASN 31 N 4.67 -3.97 -0.26 1.43 5.03 -1.26 -1.78 115.26 119.12 13pk n ASN 31 Ca -0.16 -0.76 -0.03 0.00 0.87 0.00 0.00 54.58 54.50 13pk n ASN 31 Cb 0.50 -4.10 -0.01 0.00 -1.02 0.00 0.00 39.78 35.15 13pk n ASN 31 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 13pk n GLY 32 N -1.69 0.59 3.23 7.41 0.00 -1.26 -5.01 105.19 108.47 13pk n GLY 32 Ca -0.06 -0.25 -0.24 0.00 0.00 0.00 0.00 46.02 45.47 13pk n GLY 32 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 13pk s LYS 33 N -1.58 1.19 0.02 1.61 1.02 -0.74 -4.88 119.74 116.38 13pk s LYS 33 Ca 0.00 -0.95 -0.30 0.00 0.02 0.00 0.00 55.97 54.74 13pk s LYS 33 Cb 0.00 -1.31 -0.05 0.00 -0.52 0.00 0.00 37.83 35.94 13pk s LYS 33 CO 0.00 0.32 1.31 0.42 -0.92 0.00 0.00 175.35 176.49 13pk s ILE 34 N -0.92 3.84 -0.59 2.17 1.01 -1.26 -0.01 121.20 125.44 13pk s ILE 34 Ca 0.05 1.25 0.22 0.00 0.00 0.00 0.00 60.65 62.17 13pk s ILE 34 Cb -0.09 -3.80 -0.25 0.00 0.01 0.00 0.00 42.46 38.33 13pk s ILE 34 CO 0.02 0.03 0.78 0.35 0.00 0.00 0.00 174.94 176.13 13pk n THR 35 N 4.39 0.03 -3.65 2.92 -2.24 0.13 -4.89 114.28 110.97 13pk n THR 35 Ca 0.11 -0.22 -0.03 0.00 -2.27 0.00 0.00 64.05 61.64 13pk n THR 35 Cb 0.45 0.49 -0.05 0.00 -2.10 0.00 0.00 70.33 69.12 13pk n THR 35 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 13pk s ASN 36 N -3.71 -1.03 -0.31 3.42 3.84 -1.25 -5.03 114.94 110.88 13pk s ASN 36 Ca 0.02 1.51 0.09 0.00 0.21 0.00 0.00 52.86 54.68 13pk s ASN 36 Cb 0.15 1.98 0.55 0.00 -0.55 0.00 0.00 41.25 43.38 13pk s ASN 36 CO 0.87 -0.23 1.55 -0.90 -2.79 0.00 0.00 177.10 175.61 13pk n ASP 37 N 5.14 2.92 -0.27 -4.21 5.75 -1.26 -3.90 116.55 120.72 13pk n ASP 37 Ca -0.14 -3.65 0.10 0.00 -0.01 0.00 0.00 54.79 51.09 13pk n ASP 37 Cb 0.52 -0.67 0.35 0.00 -1.03 0.00 0.00 41.12 40.29 13pk n ASP 37 CO 0.00 0.00 0.00 0.22 -0.11 0.00 0.00 177.20 177.31 13pk h TYR 38 N 1.15 0.86 -0.07 2.11 3.20 -1.97 0.49 116.97 122.74 13pk h TYR 38 Ca 0.27 0.02 -0.09 0.00 3.14 0.00 0.00 58.73 62.08 13pk h TYR 38 Cb 1.87 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 39.86 13pk h TYR 38 CO 1.09 0.35 -0.36 0.00 -1.64 0.00 0.00 178.16 177.60 13pk h ARG 39 N 0.76 0.13 -0.00 1.82 3.08 -1.86 -0.79 114.38 117.53 13pk h ARG 39 Ca 0.42 -0.05 -0.06 0.00 0.07 0.00 0.00 59.98 60.36 13pk h ARG 39 Cb 0.58 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.62 13pk h ARG 39 CO -0.19 0.48 -0.23 0.82 -1.07 0.00 0.00 179.97 179.79 13pk h ILE 40 N 0.12 1.56 -0.83 2.04 2.04 -1.21 -3.06 117.51 118.16 13pk h ILE 40 Ca 0.01 -1.95 0.10 0.00 1.00 0.00 0.00 64.86 64.02 13pk h ILE 40 Cb 0.70 2.79 -0.06 0.00 -0.74 0.00 0.00 36.82 39.51 13pk h ILE 40 CO 0.05 0.53 0.54 0.03 0.00 0.00 0.00 178.15 179.31 13pk h ARG 41 N -0.53 0.77 0.00 2.37 3.08 -0.97 -0.53 114.38 118.57 13pk h ARG 41 Ca -0.03 -0.05 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 13pk h ARG 41 Cb 0.99 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 30.87 13pk h ARG 41 CO 0.05 0.51 -0.06 0.77 -1.07 0.00 0.00 179.97 180.17 13pk h SER 42 N 0.79 0.00 0.45 7.04 0.02 -1.11 -2.26 113.55 118.48 13pk h SER 42 Ca 0.39 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.34 13pk h SER 42 Cb 0.43 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.97 13pk h SER 42 CO -0.15 0.06 -0.59 0.00 -1.14 0.00 0.00 176.83 175.00 13pk n ALA 43 N -2.15 3.67 -0.15 3.77 0.00 -0.22 -4.46 120.51 120.97 13pk n ALA 43 Ca -0.01 -0.38 -0.03 0.00 0.00 0.00 0.00 53.44 53.02 13pk n ALA 43 Cb 0.25 -1.07 0.04 0.00 0.00 0.00 0.00 19.45 18.67 13pk n ALA 43 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 13pk h LEU 44 N 0.00 -0.34 -0.47 0.00 3.38 -1.20 -2.89 115.31 113.79 13pk h LEU 44 Ca 0.00 0.13 0.09 0.00 0.09 0.00 0.00 57.88 58.20 13pk h LEU 44 Cb 0.52 0.26 -0.10 0.00 0.09 0.00 0.00 40.66 41.43 13pk h LEU 44 CO 0.00 -0.12 -0.24 -0.65 0.09 0.00 0.00 178.44 177.51 13pk h PRO 45 N 0.05 -0.14 -0.57 1.13 0.11 -1.79 0.30 132.00 131.09 13pk h PRO 45 Ca 0.24 0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.35 13pk h PRO 45 Cb 0.36 0.03 -0.03 0.00 0.11 0.00 0.00 31.00 31.48 13pk h PRO 45 CO -0.46 -0.09 0.34 1.15 -0.21 0.00 0.00 178.00 178.73 13pk h THR 46 N -0.14 1.17 -0.49 -1.15 2.02 -1.83 -0.15 112.91 112.34 13pk h THR 46 Ca 0.22 -0.39 -0.07 0.00 0.77 0.00 0.00 66.41 66.94 13pk h THR 46 Cb 0.48 0.40 -0.02 0.00 -1.74 0.00 0.00 68.15 67.27 13pk h THR 46 CO -0.56 0.18 0.03 -0.07 0.37 0.00 0.00 175.52 175.47 13pk h LEU 47 N 0.77 0.76 -0.41 2.58 3.38 -1.02 -2.33 115.31 119.03 13pk h LEU 47 Ca 0.20 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 13pk h LEU 47 Cb -0.01 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 13pk h LEU 47 CO -0.04 0.81 0.24 0.50 0.09 0.00 0.00 178.44 180.04 13pk h LYS 48 N 0.75 0.56 0.30 1.13 3.64 0.12 -1.70 116.57 121.37 13pk h LYS 48 Ca 0.15 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 13pk h LYS 48 Cb 0.41 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 32.09 13pk h LYS 48 CO 0.01 0.42 -0.37 -0.22 -2.27 0.00 0.00 179.45 177.03 13pk h LYS 49 N 0.54 -0.69 -0.97 1.90 3.11 -0.58 0.38 116.57 120.25 13pk h LYS 49 Ca 0.15 0.05 0.02 0.00 -2.81 0.00 0.00 60.65 58.06 13pk h LYS 49 Cb 0.01 0.16 -0.05 0.00 -1.00 0.00 0.00 32.23 31.35 13pk h LYS 49 CO -0.03 -0.46 0.64 -0.24 -2.81 0.00 0.00 179.45 176.56 13pk h VAL 50 N -0.71 1.21 -0.51 2.00 3.04 -1.32 0.19 116.25 120.15 13pk h VAL 50 Ca -0.01 -0.44 -0.07 0.00 -1.01 0.00 0.00 66.70 65.17 13pk h VAL 50 Cb 0.67 -0.17 -0.02 0.00 -2.01 0.00 0.00 31.29 29.75 13pk h VAL 50 CO -0.11 0.23 0.04 -0.07 -1.01 0.00 0.00 177.57 176.65 13pk h LEU 51 N 1.27 0.84 -0.99 3.16 3.38 -0.79 -0.08 115.31 122.10 13pk h LEU 51 Ca 0.37 -0.29 -0.05 0.00 0.09 0.00 0.00 57.88 58.01 13pk h LEU 51 Cb -0.07 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.42 13pk h LEU 51 CO -0.10 0.92 0.17 0.74 0.09 0.00 0.00 178.44 180.26 13pk h THR 52 N 0.74 1.23 0.00 0.22 2.02 0.51 -2.30 112.91 115.34 13pk h THR 52 Ca 0.15 -0.81 0.00 0.00 0.77 0.00 0.00 66.41 66.52 13pk h THR 52 Cb 0.46 0.60 0.00 0.00 -1.74 0.00 0.00 68.15 67.47 13pk h THR 52 CO 0.02 0.31 0.00 -0.62 0.37 0.00 0.00 175.52 175.60 13pk n GLU 53 N -4.28 0.69 -0.55 6.66 -0.58 0.61 -4.90 120.64 118.28 13pk n GLU 53 Ca 0.04 0.01 0.00 0.00 -0.42 0.00 0.00 57.16 56.79 13pk n GLU 53 Cb 0.22 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.59 13pk n GLU 53 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 13pk n GLY 54 N 1.00 0.66 0.00 0.62 0.00 -0.86 -2.81 105.19 103.80 13pk n GLY 54 Ca 0.18 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.64 13pk n GLY 54 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 13pk n GLY 55 N -2.55 1.80 3.15 -0.02 0.00 -0.09 0.12 105.19 107.61 13pk n GLY 55 Ca 0.00 -2.11 -0.15 0.00 0.00 0.00 0.00 46.02 43.76 13pk n GLY 55 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 13pk s SER 56 N -1.00 1.36 -0.11 1.61 1.04 -0.79 -0.18 113.70 115.63 13pk s SER 56 Ca 0.00 -0.73 0.01 0.00 0.48 0.00 0.00 55.95 55.71 13pk s SER 56 Cb 0.00 0.01 -0.02 0.00 0.10 0.00 0.00 66.02 66.11 13pk s SER 56 CO 0.00 -0.22 -0.14 0.00 0.98 0.00 0.00 173.24 173.86 13pk s VAL 58 N 0.07 1.62 0.07 0.00 0.11 -0.73 0.39 120.40 121.93 13pk s VAL 58 Ca -0.05 -1.68 -0.16 0.00 -2.93 0.00 0.00 61.98 57.15 13pk s VAL 58 Cb -0.15 -2.09 -0.06 0.00 -1.53 0.00 0.00 36.38 32.55 13pk s VAL 58 CO 0.04 -0.44 0.50 -0.76 -3.33 0.00 0.00 175.10 171.11 13pk s LEU 59 N 1.28 4.45 -0.04 2.54 1.43 0.64 -1.84 118.68 127.14 13pk s LEU 59 Ca 0.05 1.08 0.04 0.00 -1.03 0.00 0.00 54.13 54.27 13pk s LEU 59 Cb -0.18 -2.90 0.00 0.00 0.03 0.00 0.00 46.19 43.14 13pk s LEU 59 CO -0.12 0.24 -0.15 -0.04 0.23 0.00 0.00 176.35 176.51 13pk s MET 60 N -1.38 1.60 0.38 1.70 -1.94 -0.50 -1.47 119.30 117.68 13pk s MET 60 Ca 0.30 -0.51 -0.16 0.00 -1.71 0.00 0.00 55.69 53.61 13pk s MET 60 Cb -0.17 -1.39 0.06 0.00 2.01 0.00 0.00 34.83 35.34 13pk s MET 60 CO 0.17 0.18 0.80 0.45 -0.01 0.00 0.00 175.02 176.61 13pk s SER 61 N 0.18 0.00 0.13 3.03 0.15 -1.26 -2.05 113.70 113.89 13pk s SER 61 Ca -0.06 -1.13 0.04 0.00 0.70 0.00 0.00 55.95 55.51 13pk s SER 61 Cb -0.12 0.84 -0.04 0.00 -1.71 0.00 0.00 66.02 64.99 13pk s SER 61 CO 0.02 -1.66 -0.10 -1.38 1.20 0.00 0.00 173.24 171.32 13pk s HIS 62 N -2.30 1.20 -0.04 3.44 -3.43 -1.26 -1.16 115.29 111.74 13pk s HIS 62 Ca 0.16 -0.75 0.00 0.00 -0.80 0.00 0.00 55.06 53.67 13pk s HIS 62 Cb -0.05 -0.62 0.02 0.00 -1.43 0.00 0.00 32.58 30.50 13pk s HIS 62 CO 0.11 0.05 -0.02 -1.17 -2.00 0.00 0.00 174.74 171.72 13pk s LEU 63 N -3.03 1.18 0.00 5.38 2.96 -1.26 -3.29 118.68 120.61 13pk s LEU 63 Ca 0.14 -0.07 0.00 0.00 -0.22 0.00 0.00 54.13 53.98 13pk s LEU 63 Cb 0.02 -0.33 0.00 0.00 0.50 0.00 0.00 46.19 46.38 13pk s LEU 63 CO 0.00 -0.09 0.00 0.61 -1.32 0.00 0.00 176.35 175.55 13pk n GLY 64 N 4.19 1.42 2.27 7.98 0.00 -1.26 -4.35 105.19 115.44 13pk n GLY 64 Ca -0.24 -0.63 -0.25 0.00 0.00 0.00 0.00 46.02 44.90 13pk n GLY 64 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 13pk n ARG 65 N 5.87 0.65 -1.83 1.61 1.74 -1.26 -5.10 116.66 118.34 13pk n ARG 65 Ca 0.00 -3.29 -0.33 0.00 -0.77 0.00 0.00 57.85 53.45 13pk n ARG 65 Cb 0.00 -1.42 0.04 0.00 -1.02 0.00 0.00 32.46 30.06 13pk n ARG 65 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 13pk s PRO 66 N -0.87 2.89 0.27 5.56 0.04 -1.26 -4.93 135.00 136.70 13pk s PRO 66 Ca 0.34 1.42 -0.01 0.00 0.04 0.00 0.00 61.00 62.80 13pk s PRO 66 Cb 0.13 -1.96 0.49 0.00 0.04 0.00 0.00 34.50 33.19 13pk s PRO 66 CO -0.13 -1.19 1.84 0.87 0.04 0.00 0.00 177.00 178.43 13pk h LYS 67 N 0.21 0.97 0.00 4.56 6.56 -1.87 -3.47 116.57 123.52 13pk h LYS 67 Ca -0.47 -0.06 0.00 0.00 -1.06 0.00 0.00 60.65 59.06 13pk h LYS 67 Cb 1.25 -0.22 0.00 0.00 -0.57 0.00 0.00 32.23 32.69 13pk h LYS 67 CO 0.55 0.64 0.00 0.41 -2.06 0.00 0.00 179.45 178.99 13pk n GLY 68 N -1.35 -1.50 3.08 3.86 0.00 -1.24 -4.77 105.19 103.27 13pk n GLY 68 Ca 0.17 -1.56 -0.11 0.00 0.00 0.00 0.00 46.02 44.53 13pk n GLY 68 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 13pk s ILE 69 N -2.89 0.09 0.30 -0.61 2.07 -0.40 -4.69 121.20 115.06 13pk s ILE 69 Ca 0.00 -0.71 -0.29 0.00 -1.41 0.00 0.00 60.65 58.24 13pk s ILE 69 Cb 0.00 -0.39 -0.10 0.00 0.13 0.00 0.00 42.46 42.10 13pk s ILE 69 CO 0.00 -0.39 1.22 -2.84 -1.91 0.00 0.00 174.94 171.02 13pk s PRO 70 N -1.36 4.47 0.29 3.50 0.02 -1.26 -0.56 135.00 140.10 13pk s PRO 70 Ca -0.15 2.03 0.03 0.00 0.02 0.00 0.00 61.00 62.94 13pk s PRO 70 Cb -0.08 -3.13 0.70 0.00 0.02 0.00 0.00 34.50 32.01 13pk s PRO 70 CO 0.01 -0.03 1.70 0.52 -0.33 0.00 0.00 177.00 178.87 13pk h MET 71 N 3.73 0.41 -0.50 5.54 2.86 -1.96 0.42 114.93 125.44 13pk h MET 71 Ca -0.48 -0.02 0.08 0.00 -2.06 0.00 0.00 59.70 57.22 13pk h MET 71 Cb 1.22 -0.09 -0.07 0.00 0.06 0.00 0.00 31.60 32.72 13pk h MET 71 CO 0.67 0.27 0.12 0.00 1.06 0.00 0.00 176.91 179.03 13pk h ALA 72 N 1.69 0.58 0.00 6.32 0.00 -2.04 -0.36 119.26 125.45 13pk h ALA 72 Ca 0.54 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.55 13pk h ALA 72 Cb 1.00 0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.91 13pk h ALA 72 CO -0.51 -0.29 0.00 1.96 0.00 0.00 0.00 179.25 180.42 13pk h GLN 73 N 0.27 0.00 -0.07 0.00 4.20 -1.29 -3.08 115.11 115.13 13pk h GLN 73 Ca 0.25 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.96 13pk h GLN 73 Cb 0.32 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.10 13pk h GLN 73 CO -0.31 0.00 0.03 0.00 -0.67 0.00 0.00 178.83 177.88 13pk h ALA 74 N 2.08 0.09 -0.97 3.87 0.00 -0.78 -3.13 119.26 120.41 13pk h ALA 74 Ca 0.00 -0.08 0.27 0.00 0.00 0.00 0.00 54.91 55.11 13pk h ALA 74 Cb 0.32 -0.03 -0.18 0.00 0.00 0.00 0.00 17.79 17.90 13pk h ALA 74 CO 0.00 -0.35 0.03 0.41 0.00 0.00 0.00 179.25 179.34 13pk n GLY 75 N -0.75 -1.32 0.12 0.00 0.00 -1.17 0.46 105.19 102.54 13pk n GLY 75 Ca -0.06 0.95 -0.11 0.00 0.00 0.00 0.00 46.02 46.80 13pk n GLY 75 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 13pk h LYS 76 N 0.00 0.29 0.15 1.61 6.56 -1.75 -2.43 116.57 121.00 13pk h LYS 76 Ca 0.60 -0.05 0.00 0.00 -1.06 0.00 0.00 60.65 60.14 13pk h LYS 76 Cb 1.24 -0.05 -0.01 0.00 -0.57 0.00 0.00 32.23 32.84 13pk h LYS 76 CO -0.91 0.36 -0.15 0.82 -2.06 0.00 0.00 179.45 177.51 13pk h ILE 77 N 0.15 0.67 -0.56 1.86 1.08 0.01 -1.70 117.51 119.02 13pk h ILE 77 Ca 0.06 0.00 0.14 0.00 -0.39 0.00 0.00 64.86 64.67 13pk h ILE 77 Cb 0.18 0.67 -0.03 0.00 -3.07 0.00 0.00 36.82 34.57 13pk h ILE 77 CO -0.00 0.00 0.39 0.03 -0.69 0.00 0.00 178.15 177.88 13pk h ARG 78 N -0.33 0.12 -0.59 2.37 3.08 -0.95 0.40 114.38 118.49 13pk h ARG 78 Ca 0.00 -0.01 -0.04 0.00 0.07 0.00 0.00 59.98 60.01 13pk h ARG 78 Cb 0.31 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.31 13pk h ARG 78 CO -0.04 0.08 0.21 0.77 -1.07 0.00 0.00 179.97 179.93 13pk h SER 79 N 0.12 0.83 0.31 7.04 0.02 -0.82 0.37 113.55 121.42 13pk h SER 79 Ca 0.27 -0.19 -0.06 0.00 -0.84 0.00 0.00 61.79 60.98 13pk h SER 79 Cb 0.90 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.21 13pk h SER 79 CO -0.03 0.79 -0.27 0.74 -1.14 0.00 0.00 176.83 176.92 13pk h THR 80 N 0.82 1.12 0.00 -2.27 2.02 0.27 -3.46 112.91 111.40 13pk h THR 80 Ca 0.19 -0.95 0.00 0.00 0.77 0.00 0.00 66.41 66.43 13pk h THR 80 Cb 0.24 1.52 0.00 0.00 -1.74 0.00 0.00 68.15 68.17 13pk h THR 80 CO -0.01 0.26 0.00 0.61 0.37 0.00 0.00 175.52 176.75 13pk n GLY 81 N -0.68 0.93 3.99 2.16 0.00 0.12 -5.10 105.19 106.60 13pk n GLY 81 Ca -0.02 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.76 13pk n GLY 81 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 13pk s GLY 82 N -1.79 1.76 -0.31 -0.02 0.00 -1.00 -4.96 107.32 101.00 13pk s GLY 82 Ca 0.00 -1.66 -0.10 0.00 0.00 0.00 0.00 44.72 42.96 13pk s GLY 82 CO 0.00 -1.09 0.16 0.14 0.00 0.00 0.00 173.10 172.31 13pk s VAL 83 N -3.17 4.74 -0.07 1.40 1.01 -1.26 -4.05 120.40 118.99 13pk s VAL 83 Ca 0.66 -0.34 -0.36 0.00 0.00 0.00 0.00 61.98 61.94 13pk s VAL 83 Cb -0.06 -3.40 -0.14 0.00 0.00 0.00 0.00 36.38 32.79 13pk s VAL 83 CO 0.45 0.08 1.73 -2.65 0.00 0.00 0.00 175.10 174.70 13pk n PRO 84 N 5.00 1.80 -0.94 2.72 -0.02 -1.26 -1.48 135.00 140.81 13pk n PRO 84 Ca -0.14 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 62.00 13pk n PRO 84 Cb 0.49 -2.42 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 13pk n PRO 84 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 13pk n GLY 85 N 3.95 0.32 3.66 -1.23 0.00 -1.26 -4.72 105.19 105.92 13pk n GLY 85 Ca 0.22 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.78 13pk n GLY 85 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 13pk n PHE 86 N -2.40 2.10 -3.57 1.61 7.35 -0.55 -4.59 117.46 117.42 13pk n PHE 86 Ca 0.00 0.40 -0.26 0.00 -0.76 0.00 0.00 57.45 56.83 13pk n PHE 86 Cb 0.18 -2.47 -0.16 0.00 0.35 0.00 0.00 39.48 37.39 13pk n PHE 86 CO 0.00 0.00 0.00 -0.65 -0.76 0.00 0.00 176.76 175.35 13pk s GLN 87 N 0.13 0.13 0.38 -4.13 -0.21 -1.26 -5.04 119.66 109.65 13pk s GLN 87 Ca 0.73 -0.24 0.24 0.00 0.02 0.00 0.00 55.36 56.11 13pk s GLN 87 Cb -0.69 -1.50 1.34 0.00 1.00 0.00 0.00 33.01 33.15 13pk s GLN 87 CO 0.45 -0.82 1.50 0.94 -2.12 0.00 0.00 175.29 175.25 13pk n GLN 88 N 5.27 -0.05 0.01 2.91 -0.06 -1.26 0.26 117.38 124.46 13pk n GLN 88 Ca -0.06 1.27 0.11 0.00 -2.00 0.00 0.00 57.00 56.32 13pk n GLN 88 Cb 0.46 -2.37 0.46 0.00 -4.06 0.00 0.00 30.24 24.73 13pk n GLN 88 CO 0.00 0.00 0.00 0.36 -0.20 0.00 0.00 177.06 177.22 13pk n LYS 89 N -4.97 0.02 -0.30 3.69 0.00 -1.26 -3.29 118.16 112.05 13pk n LYS 89 Ca 0.37 0.15 0.08 0.00 -0.00 0.00 0.00 58.31 58.91 13pk n LYS 89 Cb 1.33 -1.54 0.14 0.00 -0.00 0.00 0.00 35.03 34.96 13pk n LYS 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 13pk n ALA 90 N -1.53 2.58 -1.78 0.58 0.00 0.14 -4.93 120.51 115.58 13pk n ALA 90 Ca 0.05 -2.62 -0.36 0.00 0.00 0.00 0.00 53.44 50.51 13pk n ALA 90 Cb 0.26 -0.40 -0.01 0.00 0.00 0.00 0.00 19.45 19.30 13pk n ALA 90 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 13pk s THR 91 N -2.56 3.32 -2.61 0.00 2.01 -1.18 -4.50 115.64 110.12 13pk s THR 91 Ca 0.30 0.89 0.24 0.00 0.31 0.00 0.00 61.69 63.43 13pk s THR 91 Cb 0.28 -3.40 0.39 0.00 0.01 0.00 0.00 72.50 69.77 13pk s THR 91 CO -0.01 -0.11 1.46 0.18 -0.69 0.00 0.00 174.62 175.46 13pk n LEU 92 N -0.86 2.51 -0.06 4.42 4.77 -1.26 -4.47 117.00 122.05 13pk n LEU 92 Ca 0.09 -0.95 -0.07 0.00 -0.03 0.00 0.00 56.01 55.04 13pk n LEU 92 Cb 0.50 -0.09 -0.01 0.00 -2.33 0.00 0.00 43.42 41.50 13pk n LEU 92 CO 0.44 0.48 0.74 0.50 -1.33 0.00 0.00 177.39 178.22 13pk h LYS 93 N 3.62 -0.14 0.00 3.23 3.64 -1.95 0.52 116.57 125.49 13pk h LYS 93 Ca 0.00 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.38 13pk h LYS 93 Cb 0.78 0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.63 13pk h LYS 93 CO 0.00 -0.09 -0.04 -1.00 -2.27 0.00 0.00 179.45 176.05 13pk h PRO 94 N -0.15 0.00 -0.22 1.90 0.13 -1.90 0.23 132.00 131.99 13pk h PRO 94 Ca 0.14 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 65.14 13pk h PRO 94 Cb 0.37 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.49 13pk h PRO 94 CO -0.36 0.04 -0.44 0.28 -0.23 0.00 0.00 178.00 177.29 13pk h VAL 95 N 0.00 1.31 -0.67 1.56 2.07 -1.27 -1.41 116.25 117.84 13pk h VAL 95 Ca -0.00 -1.62 -0.01 0.00 0.82 0.00 0.00 66.70 65.88 13pk h VAL 95 Cb 0.07 1.61 -0.03 0.00 -1.52 0.00 0.00 31.29 31.42 13pk h VAL 95 CO 0.00 0.51 0.36 0.00 0.02 0.00 0.00 177.57 178.46 13pk h ALA 96 N 1.09 0.85 -0.19 1.67 0.00 0.65 0.88 119.26 124.21 13pk h ALA 96 Ca 0.03 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 13pk h ALA 96 Cb 0.94 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 13pk h ALA 96 CO 0.08 0.38 0.02 -0.22 0.00 0.00 0.00 179.25 179.50 13pk h LYS 97 N 0.91 0.32 -0.08 0.00 3.11 -1.09 -1.89 116.57 117.84 13pk h LYS 97 Ca 0.23 -0.09 -0.00 0.00 -2.81 0.00 0.00 60.65 57.98 13pk h LYS 97 Cb 0.05 -0.03 -0.00 0.00 -1.00 0.00 0.00 32.23 31.24 13pk h LYS 97 CO -0.04 0.50 0.04 -0.09 -2.81 0.00 0.00 179.45 177.05 13pk h ARG 98 N 0.09 0.12 -0.81 1.90 9.65 -0.99 -2.06 114.38 122.27 13pk h ARG 98 Ca 0.05 -0.02 0.12 0.00 -1.10 0.00 0.00 59.98 59.03 13pk h ARG 98 Cb 0.35 -0.02 -0.08 0.00 -1.39 0.00 0.00 29.97 28.82 13pk h ARG 98 CO 0.01 0.18 0.43 1.25 2.80 0.00 0.00 179.97 184.64 13pk h LEU 99 N 0.02 0.57 -1.19 3.80 5.85 -0.81 0.50 115.31 124.05 13pk h LEU 99 Ca 0.03 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.82 13pk h LEU 99 Cb 0.10 -0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.06 13pk h LEU 99 CO -0.00 0.29 0.50 -1.28 -0.34 0.00 0.00 178.44 177.61 13pk h SER 100 N 0.68 0.91 -0.41 1.25 0.87 -1.00 -0.11 113.55 115.74 13pk h SER 100 Ca 0.42 -0.04 -0.13 0.00 -1.23 0.00 0.00 61.79 60.81 13pk h SER 100 Cb 0.48 -0.23 -0.01 0.00 -0.44 0.00 0.00 62.40 62.21 13pk h SER 100 CO -0.30 0.68 -0.24 -0.33 -0.53 0.00 0.00 176.83 176.11 13pk h GLU 101 N 1.06 0.89 -0.16 2.24 5.08 -0.26 -2.10 114.58 121.34 13pk h GLU 101 Ca 0.28 -0.41 -0.15 0.00 -1.00 0.00 0.00 59.36 58.09 13pk h GLU 101 Cb -0.09 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.15 13pk h GLU 101 CO -0.06 1.06 -0.47 -0.07 -1.00 0.00 0.00 179.01 178.47 13pk h LEU 102 N 0.71 0.69 -0.84 1.33 3.38 -0.76 -3.17 115.31 116.66 13pk h LEU 102 Ca 0.09 -0.59 0.00 0.00 0.09 0.00 0.00 57.88 57.47 13pk h LEU 102 Cb 0.82 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.36 13pk h LEU 102 CO 0.07 1.16 0.00 -0.07 0.09 0.00 0.00 178.44 179.69 13pk h LEU 103 N 0.26 0.00 0.96 1.67 4.07 -1.09 -3.47 115.31 117.71 13pk h LEU 103 Ca -0.01 0.00 -0.26 0.00 0.08 0.00 0.00 57.88 57.69 13pk h LEU 103 Cb 1.09 0.00 0.02 0.00 1.08 0.00 0.00 40.66 42.86 13pk h LEU 103 CO 0.10 0.00 -0.37 0.18 -1.08 0.00 0.00 178.44 177.27 13pk n LEU 104 N -2.79 -2.03 -3.53 1.67 4.77 -0.80 -5.00 117.00 109.28 13pk n LEU 104 Ca 0.02 -0.12 -0.12 0.00 -0.03 0.00 0.00 56.01 55.76 13pk n LEU 104 Cb 0.34 -2.07 -0.04 0.00 -2.33 0.00 0.00 43.42 39.33 13pk n LEU 104 CO 0.27 0.05 0.28 0.00 -1.33 0.00 0.00 177.39 176.65 13pk s ARG 105 N -5.05 1.15 0.63 3.23 1.70 -1.11 -5.07 118.95 114.43 13pk s ARG 105 Ca 0.12 -0.54 -0.18 0.00 -0.47 0.00 0.00 55.73 54.67 13pk s ARG 105 Cb -0.05 0.52 -0.02 0.00 -0.57 0.00 0.00 34.95 34.83 13pk s ARG 105 CO 0.15 -0.47 1.25 -2.14 -1.08 0.00 0.00 175.30 173.01 13pk s PRO 106 N -3.58 2.68 -0.10 3.89 0.02 -1.26 -4.46 135.00 132.20 13pk s PRO 106 Ca 0.01 1.94 -0.01 0.00 0.02 0.00 0.00 61.00 62.96 13pk s PRO 106 Cb 0.00 -1.88 0.03 0.00 0.02 0.00 0.00 34.50 32.68 13pk s PRO 106 CO -0.11 -1.46 -0.02 0.08 -0.33 0.00 0.00 177.00 175.16 13pk s VAL 107 N -1.53 0.65 -0.17 3.83 1.01 -1.26 -4.34 120.40 118.59 13pk s VAL 107 Ca 0.80 -0.12 -0.17 0.00 0.00 0.00 0.00 61.98 62.49 13pk s VAL 107 Cb -0.34 -0.79 -0.04 0.00 0.00 0.00 0.00 36.38 35.21 13pk s VAL 107 CO 0.37 0.25 0.45 0.28 0.00 0.00 0.00 175.10 176.45 13pk s THR 108 N 1.86 5.18 -0.40 3.92 -1.32 -0.14 -4.89 115.64 119.84 13pk s THR 108 Ca 0.04 0.84 -0.19 0.00 -1.21 0.00 0.00 61.69 61.17 13pk s THR 108 Cb -0.13 -3.78 0.01 0.00 -1.51 0.00 0.00 72.50 67.09 13pk s THR 108 CO -0.07 0.27 0.56 0.12 -2.21 0.00 0.00 174.62 173.29 13pk s PHE 109 N 1.08 3.13 -0.58 9.09 5.36 -1.26 -0.62 117.98 134.18 13pk s PHE 109 Ca 0.23 -0.03 -0.25 0.00 -0.96 0.00 0.00 56.93 55.92 13pk s PHE 109 Cb -0.15 -3.11 0.04 0.00 -0.34 0.00 0.00 43.02 39.47 13pk s PHE 109 CO 0.09 -0.72 1.01 0.00 -1.46 0.00 0.00 175.22 174.14 13pk s ALA 110 N 2.53 3.10 -0.99 11.12 0.00 0.45 -4.92 121.76 133.05 13pk s ALA 110 Ca 0.19 -1.26 0.00 0.00 0.00 0.00 0.00 51.96 50.89 13pk s ALA 110 Cb -0.15 -3.84 0.00 0.00 0.00 0.00 0.00 23.12 19.13 13pk s ALA 110 CO 0.16 -2.54 0.73 -0.35 0.00 0.00 0.00 175.76 173.75 13pk n PRO 111 N 7.78 0.00 -3.52 0.00 -0.04 -1.26 -0.09 135.00 137.86 13pk n PRO 111 Ca 0.02 0.26 -0.09 0.00 -0.04 0.00 0.00 63.50 63.66 13pk n PRO 111 Cb 0.48 -1.58 -0.09 0.00 -0.04 0.00 0.00 33.50 32.26 13pk n PRO 111 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 13pk s ASP 112 N -2.45 -0.07 0.50 3.54 -1.08 -1.26 -4.67 116.67 111.17 13pk s ASP 112 Ca 0.00 0.68 0.24 0.00 -0.52 0.00 0.00 52.55 52.95 13pk s ASP 112 Cb 0.00 1.26 1.32 0.00 -1.46 0.00 0.00 42.92 44.04 13pk s ASP 112 CO 0.00 -0.26 2.04 0.00 0.52 0.00 0.00 175.17 177.47 13pk n LEU 114 N -3.80 3.03 -2.73 0.00 4.77 -1.26 -4.32 117.00 112.69 13pk n LEU 114 Ca -0.02 -1.47 -0.05 0.00 -0.03 0.00 0.00 56.01 54.44 13pk n LEU 114 Cb 0.25 -0.35 0.05 0.00 -2.33 0.00 0.00 43.42 41.04 13pk n LEU 114 CO 0.32 0.74 -0.01 -3.20 -1.33 0.00 0.00 177.39 173.91 13pk n ASN 115 N 1.17 1.15 -0.24 -1.43 5.15 -0.79 -4.86 115.26 115.40 13pk n ASN 115 Ca 0.19 -2.41 0.06 0.00 -0.60 0.00 0.00 54.58 51.82 13pk n ASN 115 Cb 0.49 -0.36 0.11 0.00 -0.53 0.00 0.00 39.78 39.49 13pk n ASN 115 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 13pk n ALA 116 N -0.37 2.27 -0.19 5.20 0.00 -1.21 -4.74 120.51 121.48 13pk n ALA 116 Ca 0.06 -1.86 -0.00 0.00 0.00 0.00 0.00 53.44 51.65 13pk n ALA 116 Cb 0.82 -0.31 0.09 0.00 0.00 0.00 0.00 19.45 20.05 13pk n ALA 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 13pk h ALA 117 N 0.52 0.60 -0.20 0.00 0.00 -1.92 -0.39 119.26 117.87 13pk h ALA 117 Ca 0.00 0.16 0.05 0.00 0.00 0.00 0.00 54.91 55.12 13pk h ALA 117 Cb 0.87 0.25 -0.07 0.00 0.00 0.00 0.00 17.79 18.84 13pk h ALA 117 CO 0.03 -0.36 -0.39 0.38 0.00 0.00 0.00 179.25 178.91 13pk h ASP 118 N 0.16 -1.25 -0.46 0.00 2.03 -2.00 0.23 116.42 115.13 13pk h ASP 118 Ca 0.30 0.18 -0.05 0.00 -0.73 0.00 0.00 57.03 56.73 13pk h ASP 118 Cb 0.46 0.53 -0.02 0.00 -0.83 0.00 0.00 39.33 39.47 13pk h ASP 118 CO -0.45 -0.39 0.11 0.58 -1.03 0.00 0.00 179.24 178.05 13pk h VAL 119 N -0.43 1.24 -0.24 4.15 2.07 -1.81 -2.89 116.25 118.34 13pk h VAL 119 Ca 0.10 -0.84 -0.00 0.00 0.82 0.00 0.00 66.70 66.77 13pk h VAL 119 Cb 0.60 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 31.26 13pk h VAL 119 CO -0.43 0.30 0.13 0.58 0.02 0.00 0.00 177.57 178.17 13pk h VAL 120 N 0.62 1.11 -0.94 2.57 2.07 -0.60 -2.76 116.25 118.32 13pk h VAL 120 Ca 0.14 -0.30 0.12 0.00 0.82 0.00 0.00 66.70 67.48 13pk h VAL 120 Cb 0.34 0.88 -0.07 0.00 -1.52 0.00 0.00 31.29 30.91 13pk h VAL 120 CO 0.00 0.11 0.60 0.77 0.02 0.00 0.00 177.57 179.07 13pk h SER 121 N 0.28 0.82 0.13 0.57 4.64 -0.44 -0.28 113.55 119.28 13pk h SER 121 Ca 0.08 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 13pk h SER 121 Cb 0.06 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.02 13pk h SER 121 CO -0.01 0.45 0.00 0.29 -0.87 0.00 0.00 176.83 176.69 13pk n LYS 122 N -4.57 0.66 -1.53 4.77 5.02 -1.05 -4.87 118.16 116.59 13pk n LYS 122 Ca 0.17 0.02 -0.32 0.00 -2.02 0.00 0.00 58.31 56.16 13pk n LYS 122 Cb 0.36 -1.50 0.07 0.00 -0.02 0.00 0.00 35.03 33.94 13pk n LYS 122 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 13pk s MET 123 N -2.17 2.52 0.11 1.97 -1.94 -0.12 -5.06 119.30 114.62 13pk s MET 123 Ca 0.33 1.32 -0.05 0.00 -1.71 0.00 0.00 55.69 55.58 13pk s MET 123 Cb 0.17 -1.92 -0.02 0.00 2.01 0.00 0.00 34.83 35.07 13pk s MET 123 CO 0.31 -1.46 0.14 -1.12 -0.01 0.00 0.00 175.02 172.88 13pk s SER 124 N -2.88 0.22 0.25 3.03 0.01 -1.26 -5.07 113.70 108.00 13pk s SER 124 Ca 0.65 -0.93 -0.30 0.00 1.31 0.00 0.00 55.95 56.68 13pk s SER 124 Cb -0.20 0.33 -0.14 0.00 0.21 0.00 0.00 66.02 66.22 13pk s SER 124 CO 0.48 -0.75 1.13 -2.65 0.41 0.00 0.00 173.24 171.85 13pk n PRO 125 N -0.08 1.44 0.00 12.44 -0.02 -1.26 -1.39 135.00 146.13 13pk n PRO 125 Ca -0.10 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 61.89 13pk n PRO 125 Cb 0.63 -1.97 0.00 0.00 -0.02 0.00 0.00 33.50 32.14 13pk n PRO 125 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 13pk n GLY 126 N 1.56 2.49 3.81 -1.23 0.00 0.74 -4.93 105.19 107.64 13pk n GLY 126 Ca 0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.79 13pk n GLY 126 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 13pk s ASP 127 N -1.34 6.83 -0.06 1.61 1.11 -0.49 -4.90 116.67 119.43 13pk s ASP 127 Ca 0.00 1.78 -0.00 0.00 0.18 0.00 0.00 52.55 54.51 13pk s ASP 127 Cb 0.00 -2.55 0.02 0.00 1.07 0.00 0.00 42.92 41.46 13pk s ASP 127 CO 0.00 -0.43 -0.03 -0.69 1.18 0.00 0.00 175.17 175.20 13pk s VAL 128 N -2.05 0.49 -0.07 -1.27 1.01 -1.26 -0.09 120.40 117.16 13pk s VAL 128 Ca 0.62 -0.02 0.03 0.00 0.00 0.00 0.00 61.98 62.61 13pk s VAL 128 Cb -0.12 -0.58 0.01 0.00 0.00 0.00 0.00 36.38 35.69 13pk s VAL 128 CO 0.16 0.25 -0.16 -0.69 0.00 0.00 0.00 175.10 174.66 13pk s VAL 129 N 1.44 1.43 -0.16 2.92 1.01 0.16 -0.96 120.40 126.23 13pk s VAL 129 Ca -0.03 -0.67 -0.02 0.00 0.00 0.00 0.00 61.98 61.27 13pk s VAL 129 Cb -0.13 -1.26 -0.01 0.00 0.00 0.00 0.00 36.38 34.98 13pk s VAL 129 CO -0.03 0.42 -0.09 -0.22 0.00 0.00 0.00 175.10 175.18 13pk s LEU 130 N 0.40 2.83 0.31 3.92 2.96 0.21 -0.26 118.68 129.05 13pk s LEU 130 Ca -0.12 -0.33 -0.14 0.00 -0.22 0.00 0.00 54.13 53.32 13pk s LEU 130 Cb -0.15 -1.67 -0.08 0.00 0.50 0.00 0.00 46.19 44.78 13pk s LEU 130 CO 0.04 0.10 0.70 -0.76 -1.32 0.00 0.00 176.35 175.12 13pk s LEU 131 N 0.73 4.07 1.01 -0.68 1.43 -0.54 -0.41 118.68 124.29 13pk s LEU 131 Ca -0.04 1.19 -0.11 0.00 -1.03 0.00 0.00 54.13 54.14 13pk s LEU 131 Cb -0.15 -3.99 0.20 0.00 0.03 0.00 0.00 46.19 42.28 13pk s LEU 131 CO 0.02 -0.19 1.10 -0.70 0.23 0.00 0.00 176.35 176.81 13pk s GLU 132 N -3.00 0.23 -0.48 1.70 2.56 0.87 -4.60 118.70 115.98 13pk s GLU 132 Ca 0.53 1.31 -0.44 0.00 0.00 0.00 0.00 54.97 56.37 13pk s GLU 132 Cb -0.10 -1.65 -0.19 0.00 2.00 0.00 0.00 34.13 34.19 13pk s GLU 132 CO 0.19 -3.10 1.92 -1.71 -0.56 0.00 0.00 175.26 172.01 13pk n ASN 133 N -4.53 1.08 0.30 -1.70 2.85 -1.26 -4.39 115.26 107.61 13pk n ASN 133 Ca 0.09 0.87 0.19 0.00 -0.11 0.00 0.00 54.58 55.62 13pk n ASN 133 Cb 0.53 -0.93 0.86 0.00 1.24 0.00 0.00 39.78 41.48 13pk n ASN 133 CO 0.00 0.00 0.00 -0.37 -2.11 0.00 0.00 177.26 174.78 13pk h VAL 134 N 6.18 0.00 -0.00 3.44 -1.51 -1.44 -2.35 116.25 120.57 13pk h VAL 134 Ca -0.25 -0.34 0.00 0.00 -1.23 0.00 0.00 66.70 64.87 13pk h VAL 134 Cb 1.39 1.34 0.00 0.00 -2.13 0.00 0.00 31.29 31.89 13pk h VAL 134 CO 1.04 0.00 0.00 0.54 -1.23 0.00 0.00 177.57 177.92 13pk n ARG 135 N -3.07 1.00 0.03 5.19 1.74 -1.26 -2.81 116.66 117.48 13pk n ARG 135 Ca -0.01 -0.00 0.11 0.00 -0.77 0.00 0.00 57.85 57.18 13pk n ARG 135 Cb 0.23 -1.14 0.45 0.00 -1.02 0.00 0.00 32.46 30.98 13pk n ARG 135 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 13pk n PHE 136 N -0.64 0.23 -4.91 -1.55 3.01 -0.88 -3.71 117.46 109.01 13pk n PHE 136 Ca 0.07 0.08 -0.33 0.00 1.01 0.00 0.00 57.45 58.28 13pk n PHE 136 Cb 0.03 -0.63 -0.15 0.00 -0.01 0.00 0.00 39.48 38.72 13pk n PHE 136 CO 0.00 0.00 0.00 0.71 1.01 0.00 0.00 176.76 178.48 13pk s TYR 137 N -3.06 2.74 0.48 1.38 2.02 -1.12 -1.28 117.35 118.51 13pk s TYR 137 Ca 0.09 -0.76 0.21 0.00 -0.37 0.00 0.00 57.07 56.24 13pk s TYR 137 Cb 0.13 -1.80 1.32 0.00 -0.40 0.00 0.00 41.96 41.20 13pk s TYR 137 CO 0.41 -0.27 2.09 0.87 -1.57 0.00 0.00 175.55 177.08 13pk h LYS 138 N 6.71 0.00 0.00 -0.62 1.57 -1.07 -2.77 116.57 120.38 13pk h LYS 138 Ca -0.24 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.51 13pk h LYS 138 Cb 1.22 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.53 13pk h LYS 138 CO 0.53 0.10 -0.17 1.05 -0.57 0.00 0.00 179.45 180.39 13pk h GLU 139 N 0.00 0.00 -0.55 3.15 9.09 -1.89 -2.07 114.58 122.31 13pk h GLU 139 Ca -0.00 0.00 0.10 0.00 0.05 0.00 0.00 59.36 59.51 13pk h GLU 139 Cb 0.20 0.00 -0.08 0.00 -1.65 0.00 0.00 28.75 27.23 13pk h GLU 139 CO 0.01 0.17 0.12 1.49 0.05 0.00 0.00 179.01 180.85 13pk h GLU 140 N 0.00 0.25 -0.61 1.06 4.22 -1.75 -2.17 114.58 115.59 13pk h GLU 140 Ca -0.00 -0.02 0.00 0.00 0.08 0.00 0.00 59.36 59.42 13pk h GLU 140 Cb 0.45 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.64 13pk h GLU 140 CO 0.02 0.17 0.00 0.41 -2.18 0.00 0.00 179.01 177.43 13pk n GLY 141 N -1.30 2.65 3.66 1.92 0.00 -1.07 -1.26 105.19 109.80 13pk n GLY 141 Ca 0.07 -0.69 -0.38 0.00 0.00 0.00 0.00 46.02 45.02 13pk n GLY 141 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 13pk n SER 142 N 1.22 1.41 0.13 1.61 2.88 -0.80 -4.88 113.62 115.19 13pk n SER 142 Ca 0.21 0.86 0.12 0.00 -1.33 0.00 0.00 58.87 58.73 13pk n SER 142 Cb 0.61 -1.45 0.16 0.00 -0.75 0.00 0.00 64.21 62.78 13pk n SER 142 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 13pk h LYS 143 N 0.74 0.00 -6.09 -1.46 6.56 -1.91 -3.43 116.57 110.98 13pk h LYS 143 Ca -0.49 0.00 -0.59 0.00 -1.06 0.00 0.00 60.65 58.51 13pk h LYS 143 Cb 1.35 0.00 -0.11 0.00 -0.57 0.00 0.00 32.23 32.90 13pk h LYS 143 CO 0.53 0.00 0.72 0.15 -2.06 0.00 0.00 179.45 178.78 13pk s LYS 144 N -3.23 3.38 0.35 3.15 1.02 -1.26 -4.90 119.74 118.25 13pk s LYS 144 Ca 0.05 -0.12 0.12 0.00 0.02 0.00 0.00 55.97 56.05 13pk s LYS 144 Cb 0.09 -4.05 0.95 0.00 -0.52 0.00 0.00 37.83 34.30 13pk s LYS 144 CO 0.70 -1.59 1.76 0.00 -0.92 0.00 0.00 175.35 175.30 13pk h ALA 145 N 9.43 1.95 -0.38 5.17 0.00 -1.98 0.24 119.26 133.68 13pk h ALA 145 Ca -0.26 0.09 0.06 0.00 0.00 0.00 0.00 54.91 54.80 13pk h ALA 145 Cb 1.07 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.80 13pk h ALA 145 CO 1.13 -0.37 0.06 1.57 0.00 0.00 0.00 179.25 181.65 13pk h LYS 146 N 0.54 0.18 -0.27 0.00 2.10 -1.97 0.16 116.57 117.32 13pk h LYS 146 Ca 0.61 -0.01 -0.01 0.00 -2.00 0.00 0.00 60.65 59.24 13pk h LYS 146 Cb 1.26 -0.04 -0.01 0.00 -0.90 0.00 0.00 32.23 32.54 13pk h LYS 146 CO -0.38 0.12 0.14 -0.44 -2.00 0.00 0.00 179.45 176.89 13pk h ASP 147 N 0.19 0.34 0.07 7.07 3.32 -0.92 -1.42 116.42 125.07 13pk h ASP 147 Ca 0.19 -0.11 0.01 0.00 0.02 0.00 0.00 57.03 57.13 13pk h ASP 147 Cb 0.23 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.67 13pk h ASP 147 CO -0.25 0.36 -0.11 0.03 -1.72 0.00 0.00 179.24 177.55 13pk h ARG 148 N 0.30 -0.21 -0.31 3.56 3.08 -0.88 -2.34 114.38 117.58 13pk h ARG 148 Ca 0.09 0.01 0.01 0.00 0.07 0.00 0.00 59.98 60.17 13pk h ARG 148 Cb 0.10 0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.18 13pk h ARG 148 CO -0.01 -0.14 0.21 0.93 -1.07 0.00 0.00 179.97 179.89 13pk h GLU 149 N -0.22 0.37 0.01 0.04 5.08 -0.50 0.58 114.58 119.94 13pk h GLU 149 Ca 0.02 -0.02 0.02 0.00 -1.00 0.00 0.00 59.36 58.37 13pk h GLU 149 Cb 0.23 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.37 13pk h GLU 149 CO -0.05 0.24 -0.10 0.00 -1.00 0.00 0.00 179.01 178.10 13pk h ALA 150 N 1.81 -0.11 0.09 3.43 0.00 -0.71 0.22 119.26 124.00 13pk h ALA 150 Ca 0.12 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 13pk h ALA 150 Cb 0.02 0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.98 13pk h ALA 150 CO -0.03 -0.59 -0.04 1.98 0.00 0.00 0.00 179.25 180.57 13pk h MET 151 N -0.17 -0.12 -0.83 0.00 1.85 -1.25 -2.93 114.93 111.47 13pk h MET 151 Ca 0.03 0.01 0.19 0.00 -0.61 0.00 0.00 59.70 59.32 13pk h MET 151 Cb 0.21 0.03 -0.06 0.00 0.43 0.00 0.00 31.60 32.22 13pk h MET 151 CO -0.09 0.16 0.56 0.00 -0.40 0.00 0.00 176.91 177.13 13pk h ALA 152 N 0.48 2.24 -0.76 0.39 0.00 -0.60 -0.31 119.26 120.70 13pk h ALA 152 Ca -0.01 0.01 0.06 0.00 0.00 0.00 0.00 54.91 54.96 13pk h ALA 152 Cb 0.33 -0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.04 13pk h ALA 152 CO 0.02 -0.49 0.45 0.87 0.00 0.00 0.00 179.25 180.10 13pk h LYS 153 N 0.36 0.81 0.09 0.00 1.57 -0.37 0.18 116.57 119.19 13pk h LYS 153 Ca 0.42 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 59.15 13pk h LYS 153 Cb 1.09 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.22 13pk h LYS 153 CO -0.13 0.53 -0.04 0.82 -0.57 0.00 0.00 179.45 180.06 13pk h ILE 154 N 0.83 1.13 -0.74 1.86 2.04 -1.11 -2.85 117.51 118.67 13pk h ILE 154 Ca 0.34 -0.86 0.01 0.00 1.00 0.00 0.00 64.86 65.35 13pk h ILE 154 Cb 0.17 1.68 -0.04 0.00 -0.74 0.00 0.00 36.82 37.89 13pk h ILE 154 CO -0.18 0.21 0.48 -0.07 0.00 0.00 0.00 178.15 178.60 13pk h LEU 155 N -0.52 0.83 -2.29 1.44 4.07 -1.22 -1.69 115.31 115.93 13pk h LEU 155 Ca -0.01 -0.02 0.01 0.00 0.08 0.00 0.00 57.88 57.94 13pk h LEU 155 Cb 0.43 -0.20 -0.00 0.00 1.08 0.00 0.00 40.66 41.97 13pk h LEU 155 CO 0.02 0.60 0.04 0.00 -1.08 0.00 0.00 178.44 178.02 13pk h ALA 156 N 1.28 1.73 0.00 1.53 0.00 -0.65 0.16 119.26 123.31 13pk h ALA 156 Ca 0.28 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.18 13pk h ALA 156 Cb -0.09 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.70 13pk h ALA 156 CO -0.07 -0.07 0.00 -1.13 0.00 0.00 0.00 179.25 177.98 13pk n SER 157 N -4.04 0.25 0.11 0.00 3.41 -0.64 -3.23 113.62 109.49 13pk n SER 157 Ca -0.02 0.55 -0.03 0.00 -0.26 0.00 0.00 58.87 59.11 13pk n SER 157 Cb 0.14 -0.61 0.10 0.00 -0.26 0.00 0.00 64.21 63.58 13pk n SER 157 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 13pk h TYR 158 N 0.00 0.06 -3.90 7.33 0.05 -0.72 -3.48 116.97 116.31 13pk h TYR 158 Ca 0.00 -0.03 -0.31 0.00 0.05 0.00 0.00 58.73 58.44 13pk h TYR 158 Cb 0.37 -0.01 -0.08 0.00 1.01 0.00 0.00 36.73 38.02 13pk h TYR 158 CO 0.00 0.73 -0.29 0.41 -1.05 0.00 0.00 178.16 177.96 13pk n GLY 159 N 0.48 3.08 0.03 3.88 0.00 -1.20 -4.95 105.19 106.52 13pk n GLY 159 Ca -0.01 -1.77 -0.03 0.00 0.00 0.00 0.00 46.02 44.21 13pk n GLY 159 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 13pk n ASP 160 N -2.02 0.67 -4.85 1.61 8.00 0.11 -4.96 116.55 115.12 13pk n ASP 160 Ca 0.05 0.15 -0.37 0.00 0.71 0.00 0.00 54.79 55.32 13pk n ASP 160 Cb 0.42 -0.59 -0.06 0.00 -0.02 0.00 0.00 41.12 40.87 13pk n ASP 160 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 13pk s VAL 161 N -1.64 5.37 -0.07 2.53 0.11 -1.05 -4.93 120.40 120.72 13pk s VAL 161 Ca -0.09 0.39 0.01 0.00 -2.93 0.00 0.00 61.98 59.35 13pk s VAL 161 Cb 0.01 -3.50 -0.03 0.00 -1.53 0.00 0.00 36.38 31.34 13pk s VAL 161 CO 0.14 0.58 -0.08 -0.47 -3.33 0.00 0.00 175.10 171.95 13pk s TYR 162 N -0.85 2.91 -0.01 1.54 6.14 -1.26 -0.06 117.35 125.77 13pk s TYR 162 Ca 0.17 -0.01 -0.01 0.00 0.64 0.00 0.00 57.07 57.86 13pk s TYR 162 Cb -0.13 -1.71 0.01 0.00 0.42 0.00 0.00 41.96 40.55 13pk s TYR 162 CO 0.06 0.30 0.02 0.96 0.64 0.00 0.00 175.55 177.53 13pk s ILE 163 N -0.77 -0.01 -0.19 3.14 -4.36 0.53 -1.80 121.20 117.73 13pk s ILE 163 Ca 0.12 0.03 -0.05 0.00 -0.26 0.00 0.00 60.65 60.48 13pk s ILE 163 Cb -0.11 -0.04 -0.03 0.00 1.25 0.00 0.00 42.46 43.53 13pk s ILE 163 CO 0.01 0.01 0.01 -0.55 0.24 0.00 0.00 174.94 174.66 13pk s SER 164 N 0.15 4.97 0.00 4.36 0.15 0.15 -2.19 113.70 121.29 13pk s SER 164 Ca -0.01 -0.15 0.00 0.00 0.70 0.00 0.00 55.95 56.49 13pk s SER 164 Cb -0.02 -1.85 0.00 0.00 -1.71 0.00 0.00 66.02 62.45 13pk s SER 164 CO -0.00 0.09 0.63 -0.67 1.20 0.00 0.00 173.24 174.49 13pk n ASP 165 N 4.08 1.16 -2.80 5.45 2.03 0.29 -0.54 116.55 126.21 13pk n ASP 165 Ca -0.17 -1.38 -0.29 0.00 0.52 0.00 0.00 54.79 53.47 13pk n ASP 165 Cb 0.52 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.86 13pk n ASP 165 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 13pk n ALA 166 N -0.19 6.73 -1.84 -1.67 0.00 -0.04 -4.13 120.51 119.38 13pk n ALA 166 Ca 0.00 -3.16 -0.42 0.00 0.00 0.00 0.00 53.44 49.86 13pk n ALA 166 Cb 0.17 -2.57 -0.03 0.00 0.00 0.00 0.00 19.45 17.03 13pk n ALA 166 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 13pk s PHE 167 N -0.32 2.96 0.00 0.00 2.19 -1.26 -1.34 117.98 120.21 13pk s PHE 167 Ca 0.61 0.60 0.00 0.00 0.33 0.00 0.00 56.93 58.47 13pk s PHE 167 Cb 0.28 -4.01 0.00 0.00 -1.31 0.00 0.00 43.02 37.98 13pk s PHE 167 CO -0.11 -3.66 0.00 0.41 1.83 0.00 0.00 175.22 173.69 13pk n GLY 168 N 3.43 1.63 0.00 13.12 0.00 -1.26 -4.47 105.19 117.64 13pk n GLY 168 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 13pk n GLY 168 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 13pk n THR 169 N 0.00 0.08 0.29 2.61 -1.04 -0.45 -4.68 114.28 111.09 13pk n THR 169 Ca 0.00 -0.10 0.17 0.00 -2.04 0.00 0.00 64.05 62.07 13pk n THR 169 Cb 0.00 1.26 0.85 0.00 -1.82 0.00 0.00 70.33 70.62 13pk n THR 169 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 13pk h ALA 170 N 0.00 1.14 0.00 2.41 0.00 -1.81 0.13 119.26 121.12 13pk h ALA 170 Ca 0.00 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 13pk h ALA 170 Cb 0.77 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 13pk h ALA 170 CO 0.00 0.07 -0.11 1.12 0.00 0.00 0.00 179.25 180.33 13pk h HIS 171 N 0.00 0.00 -2.59 0.00 2.07 -1.90 -1.66 115.15 111.07 13pk h HIS 171 Ca -0.00 0.00 -0.59 0.00 -2.85 0.00 0.00 60.37 56.93 13pk h HIS 171 Cb 0.29 0.00 -0.12 0.00 2.57 0.00 0.00 27.41 30.16 13pk h HIS 171 CO 0.00 0.04 0.76 1.03 -3.07 0.00 0.00 177.93 176.69 13pk s ARG 172 N -3.20 3.17 -0.72 5.12 1.81 0.44 -4.70 118.95 120.87 13pk s ARG 172 Ca 0.06 -0.53 -0.26 0.00 -1.72 0.00 0.00 55.73 53.28 13pk s ARG 172 Cb 0.06 -4.19 -0.02 0.00 -0.45 0.00 0.00 34.95 30.35 13pk s ARG 172 CO 0.68 -1.92 1.78 0.34 -0.68 0.00 0.00 175.30 175.50 13pk s ASP 173 N 3.63 5.43 0.40 0.23 2.15 -1.26 -4.65 116.67 122.60 13pk s ASP 173 Ca 0.28 -0.10 0.04 0.00 0.43 0.00 0.00 52.55 53.20 13pk s ASP 173 Cb -0.13 -2.54 -0.02 0.00 -0.30 0.00 0.00 42.92 39.92 13pk s ASP 173 CO 0.13 -2.34 0.14 -0.94 -0.17 0.00 0.00 175.17 171.99 13pk s SER 174 N 7.32 2.66 0.12 -0.34 1.04 -1.26 -4.92 113.70 118.31 13pk s SER 174 Ca 0.62 -1.68 -0.30 0.00 0.48 0.00 0.00 55.95 55.08 13pk s SER 174 Cb -0.10 0.51 -0.08 0.00 0.10 0.00 0.00 66.02 66.44 13pk s SER 174 CO 0.13 -0.94 1.59 0.00 0.98 0.00 0.00 173.24 175.00 13pk h ALA 175 N 1.83 -0.66 0.00 5.32 0.00 -1.42 0.16 119.26 124.49 13pk h ALA 175 Ca -0.34 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.42 13pk h ALA 175 Cb 1.27 0.69 -0.01 0.00 0.00 0.00 0.00 17.79 19.73 13pk h ALA 175 CO 0.55 -0.94 -0.44 1.79 0.00 0.00 0.00 179.25 180.20 13pk h THR 176 N -0.59 0.81 0.11 0.00 1.35 -1.91 0.67 112.91 113.35 13pk h THR 176 Ca 0.04 -1.97 -0.19 0.00 -0.55 0.00 0.00 66.41 63.74 13pk h THR 176 Cb 0.65 2.27 0.01 0.00 -1.73 0.00 0.00 68.15 69.35 13pk h THR 176 CO -0.27 0.43 -0.88 0.24 -0.25 0.00 0.00 175.52 174.79 13pk h MET 177 N 0.00 0.23 0.00 4.72 2.07 -1.80 -3.41 114.93 116.75 13pk h MET 177 Ca -0.00 -0.40 -0.00 0.00 -2.07 0.00 0.00 59.70 57.22 13pk h MET 177 Cb 1.24 0.15 -0.00 0.00 -1.87 0.00 0.00 31.60 31.12 13pk h MET 177 CO 0.06 1.19 -1.01 0.25 1.07 0.00 0.00 176.91 178.47 13pk n THR 178 N -4.15 0.01 -0.05 2.22 -2.24 0.40 -4.67 114.28 105.81 13pk n THR 178 Ca -0.17 -0.01 -0.10 0.00 -2.27 0.00 0.00 64.05 61.50 13pk n THR 178 Cb 0.79 -0.86 -0.04 0.00 -2.10 0.00 0.00 70.33 68.13 13pk n THR 178 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 13pk h GLY 179 N 0.03 0.30 0.88 3.38 0.00 0.11 -2.16 103.07 105.60 13pk h GLY 179 Ca -0.01 -0.13 -0.04 0.00 0.00 0.00 0.00 47.33 47.16 13pk h GLY 179 CO -0.00 0.12 -0.42 -2.22 0.00 0.00 0.00 176.54 174.02 13pk h ILE 180 N 0.25 0.00 -1.00 2.60 2.04 -1.15 -0.33 117.51 119.92 13pk h ILE 180 Ca 0.07 -0.13 0.23 0.00 1.00 0.00 0.00 64.86 66.03 13pk h ILE 180 Cb 0.03 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.01 13pk h ILE 180 CO -0.01 0.00 0.63 1.55 0.00 0.00 0.00 178.15 180.32 13pk h PRO 181 N -1.31 0.51 0.55 2.37 0.13 -1.75 0.55 132.00 133.05 13pk h PRO 181 Ca -0.12 -0.03 -0.02 0.00 -0.87 0.00 0.00 66.00 64.96 13pk h PRO 181 Cb 0.90 -0.11 -0.00 0.00 0.13 0.00 0.00 31.00 31.91 13pk h PRO 181 CO 0.20 0.34 -0.34 -0.22 -0.23 0.00 0.00 178.00 177.75 13pk h LYS 182 N 0.52 -0.80 -0.23 0.86 3.64 -1.20 0.21 116.57 119.59 13pk h LYS 182 Ca 0.57 0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.96 13pk h LYS 182 Cb 1.24 0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 33.23 13pk h LYS 182 CO -0.32 -0.53 -0.05 0.82 -2.27 0.00 0.00 179.45 177.10 13pk h ILE 183 N -0.83 1.17 0.00 2.00 2.04 0.87 -2.42 117.51 120.34 13pk h ILE 183 Ca -0.07 -0.71 -0.15 0.00 1.00 0.00 0.00 64.86 64.93 13pk h ILE 183 Cb 0.67 1.06 -0.02 0.00 -0.74 0.00 0.00 36.82 37.79 13pk h ILE 183 CO 0.07 0.23 -0.70 0.25 0.00 0.00 0.00 178.15 178.00 13pk h LEU 184 N 0.33 0.00 0.00 1.44 5.85 0.04 -3.48 115.31 119.50 13pk h LEU 184 Ca 0.07 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.79 13pk h LEU 184 Cb 0.31 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.34 13pk h LEU 184 CO 0.01 0.70 0.00 0.61 -0.34 0.00 0.00 178.44 179.43 13pk n GLY 185 N 1.24 0.58 3.46 3.75 0.00 0.72 -5.03 105.19 109.91 13pk n GLY 185 Ca 0.01 -0.33 -0.11 0.00 0.00 0.00 0.00 46.02 45.59 13pk n GLY 185 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 13pk s ASN 186 N -2.30 -0.40 0.00 1.61 2.20 -1.03 -5.03 114.94 109.99 13pk s ASN 186 Ca 0.00 -0.24 0.00 0.00 -0.94 0.00 0.00 52.86 51.68 13pk s ASN 186 Cb 0.00 0.58 0.00 0.00 -2.00 0.00 0.00 41.25 39.83 13pk s ASN 186 CO 0.00 -1.00 0.00 0.61 -2.94 0.00 0.00 177.10 173.77 13pk n GLY 187 N -0.35 1.61 3.64 0.45 0.00 -1.24 -4.34 105.19 104.95 13pk n GLY 187 Ca -0.14 0.25 -0.29 0.00 0.00 0.00 0.00 46.02 45.85 13pk n GLY 187 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 13pk s ALA 188 N -0.06 3.37 -0.20 4.61 0.00 -0.74 -1.20 121.76 127.53 13pk s ALA 188 Ca 0.00 -1.51 -0.10 0.00 0.00 0.00 0.00 51.96 50.34 13pk s ALA 188 Cb 0.00 0.24 -0.05 0.00 0.00 0.00 0.00 23.12 23.31 13pk s ALA 188 CO 0.00 -0.13 0.15 0.00 0.00 0.00 0.00 175.76 175.78 13pk s ALA 189 N -2.89 3.67 1.20 0.00 0.00 0.17 -0.67 121.76 123.24 13pk s ALA 189 Ca 0.24 -0.69 -0.20 0.00 0.00 0.00 0.00 51.96 51.32 13pk s ALA 189 Cb 0.06 -2.21 0.29 0.00 0.00 0.00 0.00 23.12 21.26 13pk s ALA 189 CO 0.12 0.12 1.14 0.20 0.00 0.00 0.00 175.76 177.33 13pk s GLY 190 N 0.44 1.61 0.27 0.00 0.00 0.29 -2.41 107.32 107.53 13pk s GLY 190 Ca 0.09 -1.04 0.02 0.00 0.00 0.00 0.00 44.72 43.78 13pk s GLY 190 CO -0.01 -0.14 1.70 -0.97 0.00 0.00 0.00 173.10 173.68 13pk h TYR 191 N -2.56 0.54 -0.22 1.90 0.05 -1.95 -2.58 116.97 112.16 13pk h TYR 191 Ca -0.44 -0.12 -0.06 0.00 0.05 0.00 0.00 58.73 58.16 13pk h TYR 191 Cb 1.28 -0.13 -0.01 0.00 1.01 0.00 0.00 36.73 38.89 13pk h TYR 191 CO -2.32 0.72 -0.11 1.25 -1.05 0.00 0.00 178.16 176.65 13pk h LEU 192 N 0.42 0.47 -0.33 3.88 5.85 -1.86 0.18 115.31 123.92 13pk h LEU 192 Ca 0.06 -0.42 0.07 0.00 0.84 0.00 0.00 57.88 58.43 13pk h LEU 192 Cb 0.72 -0.13 -0.08 0.00 0.37 0.00 0.00 40.66 41.53 13pk h LEU 192 CO 0.05 0.78 -0.25 -0.03 -0.34 0.00 0.00 178.44 178.66 13pk h MET 193 N 0.16 -0.21 -0.07 1.25 4.05 -1.69 0.17 114.93 118.60 13pk h MET 193 Ca 0.05 0.01 0.01 0.00 -0.28 0.00 0.00 59.70 59.49 13pk h MET 193 Cb 0.61 0.05 -0.01 0.00 -0.80 0.00 0.00 31.60 31.45 13pk h MET 193 CO 0.03 -0.14 0.00 0.93 0.23 0.00 0.00 176.91 177.97 13pk h GLU 194 N -0.22 0.03 -0.49 0.39 5.08 -1.33 -0.06 114.58 117.98 13pk h GLU 194 Ca 0.16 -0.00 0.09 0.00 -1.00 0.00 0.00 59.36 58.62 13pk h GLU 194 Cb 0.48 -0.01 -0.08 0.00 0.50 0.00 0.00 28.75 29.64 13pk h GLU 194 CO -0.45 0.02 0.01 -0.22 -1.00 0.00 0.00 179.01 177.36 13pk h LYS 195 N 0.03 0.12 0.23 2.33 3.64 0.75 -1.66 116.57 122.01 13pk h LYS 195 Ca 0.03 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.39 13pk h LYS 195 Cb 0.03 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 13pk h LYS 195 CO -0.05 0.08 -0.11 0.93 -2.27 0.00 0.00 179.45 178.03 13pk h GLU 196 N 0.12 -0.29 -0.77 1.90 4.39 -0.44 -2.53 114.58 116.96 13pk h GLU 196 Ca 0.25 0.02 0.08 0.00 0.34 0.00 0.00 59.36 60.05 13pk h GLU 196 Cb 0.37 0.07 -0.07 0.00 -0.10 0.00 0.00 28.75 29.02 13pk h GLU 196 CO -0.40 0.08 0.43 0.82 -1.16 0.00 0.00 179.01 178.77 13pk h ILE 197 N -0.76 0.93 -0.07 3.13 2.04 -0.92 -1.50 117.51 120.36 13pk h ILE 197 Ca -0.03 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.57 13pk h ILE 197 Cb 0.50 0.11 -0.00 0.00 -0.74 0.00 0.00 36.82 36.69 13pk h ILE 197 CO 0.05 0.14 0.02 0.28 0.00 0.00 0.00 178.15 178.63 13pk h SER 198 N 0.75 0.10 0.08 1.72 0.02 -1.35 0.42 113.55 115.29 13pk h SER 198 Ca 0.36 -0.24 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 13pk h SER 198 Cb 0.30 -0.03 -0.01 0.00 0.14 0.00 0.00 62.40 62.80 13pk h SER 198 CO -0.23 0.31 -0.08 0.22 -1.14 0.00 0.00 176.83 175.92 13pk h TYR 199 N -0.11 -0.19 -0.82 3.45 5.03 -1.27 0.56 116.97 123.62 13pk h TYR 199 Ca 0.02 0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.32 13pk h TYR 199 Cb 0.25 0.07 -0.04 0.00 1.55 0.00 0.00 36.73 38.57 13pk h TYR 199 CO 0.01 -0.12 0.45 0.74 -1.32 0.00 0.00 178.16 177.92 13pk h PHE 200 N -0.17 1.11 0.17 -3.82 0.04 -1.20 0.13 116.94 113.22 13pk h PHE 200 Ca 0.00 -0.02 -0.00 0.00 2.80 0.00 0.00 57.97 60.75 13pk h PHE 200 Cb 0.16 -0.36 -0.01 0.00 2.20 0.00 0.00 35.95 37.95 13pk h PHE 200 CO -0.11 0.77 -0.19 0.00 -0.60 0.00 0.00 178.31 178.18 13pk h ALA 201 N 1.35 -0.88 -0.78 2.45 0.00 0.46 0.76 119.26 122.62 13pk h ALA 201 Ca 0.29 -0.07 0.13 0.00 0.00 0.00 0.00 54.91 55.26 13pk h ALA 201 Cb 0.02 0.46 -0.05 0.00 0.00 0.00 0.00 17.79 18.21 13pk h ALA 201 CO -0.05 -0.90 0.52 1.57 0.00 0.00 0.00 179.25 180.39 13pk h LYS 202 N -0.37 0.53 0.19 0.00 5.09 -0.78 -2.42 116.57 118.79 13pk h LYS 202 Ca -0.02 -0.03 -0.31 0.00 0.09 0.00 0.00 60.65 60.37 13pk h LYS 202 Cb 0.33 -0.12 0.02 0.00 0.10 0.00 0.00 32.23 32.56 13pk h LYS 202 CO -0.03 0.35 -1.44 0.28 -2.09 0.00 0.00 179.45 176.51 13pk h VAL 203 N 0.54 1.30 0.00 0.07 2.07 -0.48 -3.32 116.25 116.43 13pk h VAL 203 Ca 0.38 -2.82 0.00 0.00 0.82 0.00 0.00 66.70 65.08 13pk h VAL 203 Cb 0.72 2.94 0.00 0.00 -1.52 0.00 0.00 31.29 33.43 13pk h VAL 203 CO -0.14 0.84 0.00 -0.07 0.02 0.00 0.00 177.57 178.22 13pk h LEU 204 N 0.11 0.00 0.42 2.57 3.38 0.89 -3.15 115.31 119.53 13pk h LEU 204 Ca -0.22 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.73 13pk h LEU 204 Cb 2.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.83 13pk h LEU 204 CO 0.23 0.00 -0.20 1.23 0.09 0.00 0.00 178.44 179.78 13pk h GLY 205 N 3.20 -0.59 -6.76 0.83 0.00 -1.55 -3.41 103.07 94.79 13pk h GLY 205 Ca 0.00 0.22 -0.58 0.00 0.00 0.00 0.00 47.33 46.97 13pk h GLY 205 CO 0.00 -0.22 -0.80 0.21 0.00 0.00 0.00 176.54 175.73 13pk s ASN 206 N -2.99 3.30 0.20 0.19 2.47 -1.24 -5.12 114.94 111.75 13pk s ASN 206 Ca -0.08 -2.17 -0.18 0.00 0.42 0.00 0.00 52.86 50.84 13pk s ASN 206 Cb 0.01 -0.61 -0.08 0.00 -1.45 0.00 0.00 41.25 39.12 13pk s ASN 206 CO 0.25 -0.32 0.68 -2.16 -3.72 0.00 0.00 177.10 171.83 13pk s PRO 207 N 1.02 4.17 0.36 0.43 0.04 -1.19 -4.93 135.00 134.90 13pk s PRO 207 Ca 0.16 0.77 -0.28 0.00 0.04 0.00 0.00 61.00 61.69 13pk s PRO 207 Cb -0.22 -2.88 -0.11 0.00 0.04 0.00 0.00 34.50 31.32 13pk s PRO 207 CO -0.05 0.41 1.48 -2.30 0.04 0.00 0.00 177.00 176.58 13pk n PRO 208 N 0.72 2.61 -4.17 0.56 -0.02 -1.26 -4.99 135.00 128.45 13pk n PRO 208 Ca -0.03 0.92 -0.28 0.00 -2.02 0.00 0.00 63.50 62.08 13pk n PRO 208 Cb 0.51 -2.64 -0.08 0.00 -0.02 0.00 0.00 33.50 31.28 13pk n PRO 208 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 13pk s ARG 209 N -1.83 2.45 0.72 -0.52 3.00 -1.26 -3.56 118.95 117.95 13pk s ARG 209 Ca 0.55 -0.98 -0.12 0.00 0.00 0.00 0.00 55.73 55.18 13pk s ARG 209 Cb -0.49 -2.44 0.03 0.00 0.00 0.00 0.00 34.95 32.05 13pk s ARG 209 CO 0.61 0.50 1.09 -2.14 0.00 0.00 0.00 175.30 175.36 13pk s PRO 210 N -2.61 2.58 -0.22 3.54 0.02 -1.26 -4.35 135.00 132.70 13pk s PRO 210 Ca 0.26 1.18 0.00 0.00 0.02 0.00 0.00 61.00 62.47 13pk s PRO 210 Cb -0.10 -1.94 0.03 0.00 0.02 0.00 0.00 34.50 32.51 13pk s PRO 210 CO 0.18 -1.40 -0.13 -1.17 -0.33 0.00 0.00 177.00 174.16 13pk s LEU 211 N -5.51 2.75 -0.12 -5.54 2.96 -1.26 -0.91 118.68 111.05 13pk s LEU 211 Ca 0.62 -0.82 -0.03 0.00 -0.22 0.00 0.00 54.13 53.68 13pk s LEU 211 Cb -0.17 -1.57 -0.03 0.00 0.50 0.00 0.00 46.19 44.91 13pk s LEU 211 CO 0.51 -0.07 -0.02 0.54 -1.32 0.00 0.00 176.35 175.99 13pk s VAL 212 N 1.29 4.12 -0.22 1.68 0.11 -0.52 -0.30 120.40 126.55 13pk s VAL 212 Ca 0.01 -0.30 -0.06 0.00 -2.93 0.00 0.00 61.98 58.71 13pk s VAL 212 Cb -0.15 -2.76 -0.02 0.00 -1.53 0.00 0.00 36.38 31.91 13pk s VAL 212 CO -0.08 0.55 0.02 0.00 -3.33 0.00 0.00 175.10 172.25 13pk s ALA 213 N -0.27 3.05 -0.30 1.54 0.00 -0.19 -1.18 121.76 124.41 13pk s ALA 213 Ca 0.05 -1.06 -0.07 0.00 0.00 0.00 0.00 51.96 50.88 13pk s ALA 213 Cb -0.12 -1.86 0.01 0.00 0.00 0.00 0.00 23.12 21.14 13pk s ALA 213 CO 0.02 -0.30 0.10 0.42 0.00 0.00 0.00 175.76 176.00 13pk s ILE 214 N 1.26 4.11 -0.09 0.00 1.09 0.34 -0.39 121.20 127.52 13pk s ILE 214 Ca 0.04 -0.63 0.03 0.00 -1.10 0.00 0.00 60.65 58.98 13pk s ILE 214 Cb -0.15 -3.12 0.01 0.00 -1.06 0.00 0.00 42.46 38.15 13pk s ILE 214 CO 0.02 0.07 -0.17 0.54 -0.10 0.00 0.00 174.94 175.29 13pk s VAL 215 N 1.53 1.60 0.00 2.92 0.11 -0.07 -1.06 120.40 125.43 13pk s VAL 215 Ca 0.03 -0.73 0.00 0.00 -2.93 0.00 0.00 61.98 58.35 13pk s VAL 215 Cb -0.17 -1.42 0.00 0.00 -1.53 0.00 0.00 36.38 33.26 13pk s VAL 215 CO 0.03 0.46 0.00 0.61 -3.33 0.00 0.00 175.10 172.87 13pk n GLY 216 N 3.86 5.47 7.00 6.54 0.00 0.80 -1.82 105.19 127.04 13pk n GLY 216 Ca -0.20 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 44.92 13pk n GLY 216 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 13pk n GLY 217 N 0.00 0.24 0.00 -0.02 0.00 -0.36 -4.43 105.19 100.61 13pk n GLY 217 Ca 0.00 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 45.06 13pk n GLY 217 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 13pk n ALA 218 N 6.74 0.00 -2.76 4.61 0.00 -1.26 -0.16 120.51 127.68 13pk n ALA 218 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.25 13pk n ALA 218 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 13pk n ALA 218 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 13pk n LYS 219 N 0.00 -3.01 -0.20 0.00 5.02 -1.26 -4.81 118.16 113.90 13pk n LYS 219 Ca 0.00 0.73 -0.05 0.00 -2.02 0.00 0.00 58.31 56.97 13pk n LYS 219 Cb 0.00 -5.44 0.01 0.00 -0.02 0.00 0.00 35.03 29.58 13pk n LYS 219 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 13pk h VAL 220 N -0.54 0.17 -0.96 -0.18 2.07 -1.94 -0.00 116.25 114.87 13pk h VAL 220 Ca -0.42 0.00 0.20 0.00 0.82 0.00 0.00 66.70 67.30 13pk h VAL 220 Cb 1.30 0.17 -0.08 0.00 -1.52 0.00 0.00 31.29 31.16 13pk h VAL 220 CO 0.49 0.00 0.61 0.77 0.02 0.00 0.00 177.57 179.46 13pk h SER 221 N -0.16 0.56 0.01 0.57 4.64 -1.99 0.54 113.55 117.72 13pk h SER 221 Ca 0.24 0.06 -0.19 0.00 -0.47 0.00 0.00 61.79 61.43 13pk h SER 221 Cb 0.55 -0.04 -0.03 0.00 -0.31 0.00 0.00 62.40 62.58 13pk h SER 221 CO -0.68 0.21 -1.02 0.44 -0.87 0.00 0.00 176.83 174.91 13pk h ASP 222 N 0.55 0.03 -0.83 4.97 5.19 -1.73 -3.34 116.42 121.26 13pk h ASP 222 Ca 0.52 -0.64 0.02 0.00 -0.62 0.00 0.00 57.03 56.31 13pk h ASP 222 Cb 1.09 -0.01 -0.04 0.00 0.18 0.00 0.00 39.33 40.55 13pk h ASP 222 CO -0.26 1.40 0.55 0.50 -3.12 0.00 0.00 179.24 178.31 13pk h LYS 223 N -0.94 1.05 -0.03 3.56 3.64 -0.60 -1.40 116.57 121.85 13pk h LYS 223 Ca -0.27 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.03 13pk h LYS 223 Cb 1.28 -0.24 -0.00 0.00 -0.41 0.00 0.00 32.23 32.86 13pk h LYS 223 CO -0.15 0.69 -0.03 0.97 -2.27 0.00 0.00 179.45 178.67 13pk h ILE 224 N 1.08 1.04 0.00 2.00 2.10 -0.08 0.26 117.51 123.91 13pk h ILE 224 Ca 0.32 -0.18 0.00 0.00 1.08 0.00 0.00 64.86 66.07 13pk h ILE 224 Cb -0.05 1.06 0.00 0.00 -1.09 0.00 0.00 36.82 36.74 13pk h ILE 224 CO -0.08 0.06 0.00 0.00 -1.08 0.00 0.00 178.15 177.04 13pk n GLN 225 N -4.48 0.09 0.07 2.19 6.02 -0.53 -2.61 117.38 118.14 13pk n GLN 225 Ca -0.02 0.09 0.11 0.00 -0.01 0.00 0.00 57.00 57.17 13pk n GLN 225 Cb 0.13 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 29.87 13pk n GLN 225 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 13pk n LEU 226 N -1.45 0.67 -0.20 1.08 4.77 0.08 -4.30 117.00 117.65 13pk n LEU 226 Ca 0.07 0.23 -0.07 0.00 -0.03 0.00 0.00 56.01 56.21 13pk n LEU 226 Cb 0.25 -0.06 0.03 0.00 -2.33 0.00 0.00 43.42 41.31 13pk n LEU 226 CO 0.21 -0.13 1.01 -0.07 -1.33 0.00 0.00 177.39 177.08 13pk h LEU 227 N 0.00 0.76 -0.51 2.23 3.38 -1.50 -3.07 115.31 116.60 13pk h LEU 227 Ca 0.00 -0.14 0.07 0.00 0.09 0.00 0.00 57.88 57.90 13pk h LEU 227 Cb 0.96 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.46 13pk h LEU 227 CO 0.00 0.68 0.20 0.44 0.09 0.00 0.00 178.44 179.85 13pk h ASP 228 N 0.78 0.22 0.00 -0.43 3.32 -1.75 -1.56 116.42 117.01 13pk h ASP 228 Ca 0.20 0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.30 13pk h ASP 228 Cb 0.13 0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.71 13pk h ASP 228 CO -0.02 0.16 0.00 -0.46 -1.72 0.00 0.00 179.24 177.19 13pk n ASN 229 N -4.98 0.36 0.00 6.45 6.94 -1.16 -3.12 115.26 119.74 13pk n ASN 229 Ca 0.05 -1.81 0.00 0.00 -0.02 0.00 0.00 54.58 52.80 13pk n ASN 229 Cb 0.19 -0.18 0.00 0.00 -2.36 0.00 0.00 39.78 37.43 13pk n ASN 229 CO 0.00 0.00 0.00 1.15 -1.03 0.00 0.00 177.26 177.38 13pk n MET 230 N -0.28 -0.49 0.23 -3.83 0.00 -0.59 -3.17 117.12 108.97 13pk n MET 230 Ca 0.00 -0.43 0.08 0.00 0.00 0.00 0.00 57.70 57.34 13pk n MET 230 Cb 0.09 -0.86 0.54 0.00 0.00 0.00 0.00 33.22 32.99 13pk n MET 230 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 175.97 175.90 13pk h LEU 231 N 0.00 0.00 -0.75 3.17 3.38 -1.48 -2.17 115.31 117.46 13pk h LEU 231 Ca 0.00 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.84 13pk h LEU 231 Cb 0.18 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 13pk h LEU 231 CO 0.00 0.23 -0.59 1.56 0.09 0.00 0.00 178.44 179.72 13pk h GLN 232 N 0.00 0.11 0.11 1.13 7.50 -1.85 -3.29 115.11 118.82 13pk h GLN 232 Ca -0.00 -0.07 -0.33 0.00 0.50 0.00 0.00 58.65 58.74 13pk h GLN 232 Cb 0.49 0.01 -0.02 0.00 0.05 0.00 0.00 27.48 28.02 13pk h GLN 232 CO 0.03 0.67 -1.76 0.00 -1.50 0.00 0.00 178.83 176.27 13pk h ARG 233 N 0.08 0.23 -6.85 1.46 2.47 -1.75 -3.48 114.38 106.54 13pk h ARG 233 Ca -0.01 -0.40 -0.48 0.00 -1.26 0.00 0.00 59.98 57.84 13pk h ARG 233 Cb 1.07 0.15 0.03 0.00 -1.65 0.00 0.00 29.97 29.57 13pk h ARG 233 CO 0.08 1.07 0.03 0.96 0.56 0.00 0.00 179.97 182.67 13pk s ILE 234 N -2.59 4.46 -0.09 2.04 -4.36 -0.87 -4.86 121.20 114.93 13pk s ILE 234 Ca -0.14 -0.11 0.08 0.00 -0.26 0.00 0.00 60.65 60.22 13pk s ILE 234 Cb 0.07 -3.69 -0.12 0.00 1.25 0.00 0.00 42.46 39.98 13pk s ILE 234 CO 0.82 -0.60 0.03 0.47 0.24 0.00 0.00 174.94 175.90 13pk n ASP 235 N -2.21 2.69 -4.06 4.36 8.00 0.59 -4.69 116.55 121.23 13pk n ASP 235 Ca 0.01 -0.00 -0.15 0.00 0.71 0.00 0.00 54.79 55.36 13pk n ASP 235 Cb 0.56 0.72 -0.12 0.00 -0.02 0.00 0.00 41.12 42.26 13pk n ASP 235 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 13pk s TYR 236 N -2.23 0.75 -0.27 1.24 1.51 -0.80 -1.38 117.35 116.17 13pk s TYR 236 Ca -0.05 -0.40 -0.02 0.00 -1.01 0.00 0.00 57.07 55.59 13pk s TYR 236 Cb 0.03 -0.45 0.09 0.00 -0.11 0.00 0.00 41.96 41.51 13pk s TYR 236 CO 0.38 -0.04 0.08 -1.17 -1.11 0.00 0.00 175.55 173.69 13pk s LEU 237 N -1.27 1.78 -0.10 -1.29 2.96 -0.16 -1.02 118.68 119.57 13pk s LEU 237 Ca -0.06 -1.36 -0.19 0.00 -0.22 0.00 0.00 54.13 52.30 13pk s LEU 237 Cb -0.08 -0.75 -0.04 0.00 0.50 0.00 0.00 46.19 45.82 13pk s LEU 237 CO 0.01 -0.38 0.53 -0.76 -1.32 0.00 0.00 176.35 174.43 13pk s LEU 238 N 1.73 4.29 -0.14 -0.68 1.43 0.47 -0.36 118.68 125.42 13pk s LEU 238 Ca 0.06 0.91 0.02 0.00 -1.03 0.00 0.00 54.13 54.10 13pk s LEU 238 Cb -0.17 -2.79 0.01 0.00 0.03 0.00 0.00 46.19 43.27 13pk s LEU 238 CO -0.21 -0.02 -0.21 -0.63 0.23 0.00 0.00 176.35 175.51 13pk s ILE 239 N 0.62 1.97 0.00 -0.59 1.01 -0.50 -0.89 121.20 122.82 13pk s ILE 239 Ca 0.29 -0.92 0.00 0.00 0.00 0.00 0.00 60.65 60.02 13pk s ILE 239 Cb -0.16 -1.75 0.00 0.00 0.01 0.00 0.00 42.46 40.56 13pk s ILE 239 CO 0.12 0.53 0.00 0.61 0.00 0.00 0.00 174.94 176.20 13pk n GLY 240 N 4.15 5.48 7.00 6.18 0.00 -0.76 -4.01 105.19 123.24 13pk n GLY 240 Ca -0.20 -1.46 0.00 0.00 0.00 0.00 0.00 46.02 44.36 13pk n GLY 240 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 13pk n GLY 241 N 0.59 0.76 0.17 -0.02 0.00 -0.21 -3.05 105.19 103.43 13pk n GLY 241 Ca 0.00 -0.79 0.03 0.00 0.00 0.00 0.00 46.02 45.26 13pk n GLY 241 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 13pk h ALA 242 N -0.89 1.15 -1.01 4.61 0.00 -0.85 -3.22 119.26 119.06 13pk h ALA 242 Ca 0.00 -0.40 0.25 0.00 0.00 0.00 0.00 54.91 54.76 13pk h ALA 242 Cb 0.00 -0.07 -0.13 0.00 0.00 0.00 0.00 17.79 17.59 13pk h ALA 242 CO 0.00 0.55 0.60 1.98 0.00 0.00 0.00 179.25 182.38 13pk h MET 243 N 0.00 0.53 -0.37 0.00 1.85 -1.61 -2.71 114.93 112.63 13pk h MET 243 Ca -0.00 -0.03 0.04 0.00 -0.61 0.00 0.00 59.70 59.09 13pk h MET 243 Cb 0.84 -0.12 -0.04 0.00 0.43 0.00 0.00 31.60 32.72 13pk h MET 243 CO 0.06 0.35 0.14 0.00 -0.40 0.00 0.00 176.91 177.06 13pk h ALA 244 N 1.74 0.43 -0.89 0.39 0.00 -1.54 -3.15 119.26 116.23 13pk h ALA 244 Ca 0.65 0.04 0.14 0.00 0.00 0.00 0.00 54.91 55.74 13pk h ALA 244 Cb 1.29 0.01 -0.09 0.00 0.00 0.00 0.00 17.79 19.00 13pk h ALA 244 CO -0.48 -0.25 0.50 1.88 0.00 0.00 0.00 179.25 180.90 13pk h TYR 245 N 0.30 0.89 -0.51 0.00 0.05 -1.70 0.14 116.97 116.14 13pk h TYR 245 Ca 0.17 0.03 0.01 0.00 0.05 0.00 0.00 58.73 58.98 13pk h TYR 245 Cb 0.13 -0.26 -0.03 0.00 1.01 0.00 0.00 36.73 37.58 13pk h TYR 245 CO -0.14 0.27 0.34 1.15 -1.05 0.00 0.00 178.16 178.73 13pk h THR 246 N 0.74 1.13 -0.28 -2.88 2.02 -1.70 -0.48 112.91 111.46 13pk h THR 246 Ca 0.47 -0.24 -0.04 0.00 0.77 0.00 0.00 66.41 67.38 13pk h THR 246 Cb 0.60 0.38 -0.01 0.00 -1.74 0.00 0.00 68.15 67.38 13pk h THR 246 CO -0.33 0.13 0.01 -0.26 0.37 0.00 0.00 175.52 175.44 13pk h PHE 247 N 0.69 0.53 -0.90 3.16 0.04 -1.12 -0.88 116.94 118.45 13pk h PHE 247 Ca 0.19 -0.09 -0.00 0.00 2.80 0.00 0.00 57.97 60.87 13pk h PHE 247 Cb -0.08 -0.14 -0.04 0.00 2.20 0.00 0.00 35.95 37.89 13pk h PHE 247 CO -0.04 0.62 0.56 -0.07 -0.60 0.00 0.00 178.31 178.78 13pk h LEU 248 N 0.28 1.07 -0.58 1.54 3.38 -0.55 -1.76 115.31 118.70 13pk h LEU 248 Ca 0.08 -0.06 -0.12 0.00 0.09 0.00 0.00 57.88 57.88 13pk h LEU 248 Cb 0.40 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 13pk h LEU 248 CO 0.01 0.81 -0.17 0.50 0.09 0.00 0.00 178.44 179.68 13pk h LYS 249 N 1.24 0.96 0.00 1.13 3.64 -0.89 -1.50 116.57 121.15 13pk h LYS 249 Ca 0.33 -0.38 -0.00 0.00 -1.27 0.00 0.00 60.65 59.33 13pk h LYS 249 Cb -0.08 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 31.69 13pk h LYS 249 CO -0.06 1.04 -0.02 0.00 -2.27 0.00 0.00 179.45 178.14 13pk h ALA 250 N 0.96 1.89 0.00 5.00 0.00 -0.73 -0.00 119.26 126.37 13pk h ALA 250 Ca 0.12 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.01 13pk h ALA 250 Cb 0.72 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.51 13pk h ALA 250 CO 0.06 0.02 -0.19 1.96 0.00 0.00 0.00 179.25 181.10 13pk h GLN 251 N 0.00 0.00 0.00 0.00 4.20 -0.50 -3.47 115.11 115.34 13pk h GLN 251 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 13pk h GLN 251 Cb 0.03 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.81 13pk h GLN 251 CO 0.00 0.00 0.00 0.41 -0.67 0.00 0.00 178.83 178.57 13pk n GLY 252 N 1.20 1.53 3.94 3.46 0.00 -0.01 -5.09 105.19 110.21 13pk n GLY 252 Ca 0.04 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.85 13pk n GLY 252 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 13pk s TYR 253 N -2.00 3.25 -0.03 1.61 2.02 -0.65 -5.00 117.35 116.54 13pk s TYR 253 Ca 0.00 -0.12 -0.29 0.00 -0.37 0.00 0.00 57.07 56.29 13pk s TYR 253 Cb 0.00 -1.68 -0.03 0.00 -0.40 0.00 0.00 41.96 39.86 13pk s TYR 253 CO 0.00 0.31 0.97 -1.12 -1.57 0.00 0.00 175.55 174.13 13pk s SER 254 N -4.01 7.31 -0.00 2.29 0.01 -1.26 -4.28 113.70 113.76 13pk s SER 254 Ca 0.37 1.59 0.16 0.00 1.31 0.00 0.00 55.95 59.39 13pk s SER 254 Cb -0.09 -2.56 -0.18 0.00 0.21 0.00 0.00 66.02 63.41 13pk s SER 254 CO 0.29 -0.30 0.67 -0.38 0.41 0.00 0.00 173.24 173.93 13pk n ILE 255 N 4.05 0.00 -4.37 1.44 -0.00 -1.26 0.42 119.36 119.64 13pk n ILE 255 Ca 0.06 -0.13 0.00 0.00 -0.00 0.00 0.00 62.75 62.68 13pk n ILE 255 Cb 0.50 0.96 0.00 0.00 -0.00 0.00 0.00 39.64 41.11 13pk n ILE 255 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 13pk n GLY 256 N 1.39 2.87 1.42 7.39 0.00 -1.23 -1.85 105.19 115.17 13pk n GLY 256 Ca 0.03 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.71 13pk n GLY 256 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 13pk n LYS 257 N 14.00 3.03 -1.91 1.61 5.02 0.20 -4.97 118.16 135.14 13pk n LYS 257 Ca 0.00 -1.88 -0.32 0.00 -2.02 0.00 0.00 58.31 54.09 13pk n LYS 257 Cb 0.00 -1.91 0.02 0.00 -0.02 0.00 0.00 35.03 33.12 13pk n LYS 257 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 13pk s SER 258 N -0.45 5.64 0.22 4.39 0.01 -0.77 -4.71 113.70 118.03 13pk s SER 258 Ca 0.33 1.78 -0.32 0.00 1.31 0.00 0.00 55.95 59.05 13pk s SER 258 Cb 0.26 -2.53 -0.12 0.00 0.21 0.00 0.00 66.02 63.84 13pk s SER 258 CO 0.09 -1.26 1.65 1.17 0.41 0.00 0.00 173.24 175.30 13pk n LYS 259 N -2.32 2.59 -3.69 12.44 0.00 -1.26 -4.99 118.16 120.93 13pk n LYS 259 Ca 0.09 0.93 -0.14 0.00 0.00 0.00 0.00 58.31 59.19 13pk n LYS 259 Cb 0.53 -2.74 -0.09 0.00 0.00 0.00 0.00 35.03 32.73 13pk n LYS 259 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 13pk s GLU 261 N -0.49 4.13 0.54 0.00 0.41 -1.26 -4.86 118.70 117.17 13pk s GLU 261 Ca -0.06 -3.01 0.34 0.00 -0.41 0.00 0.00 54.97 51.82 13pk s GLU 261 Cb -0.03 -4.65 1.51 0.00 -1.78 0.00 0.00 34.13 29.17 13pk s GLU 261 CO 0.03 -1.36 1.85 0.93 -0.49 0.00 0.00 175.26 176.23 13pk h GLU 262 N 6.89 0.00 -0.49 1.61 4.39 -1.97 0.47 114.58 125.47 13pk h GLU 262 Ca 0.20 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.90 13pk h GLU 262 Cb 0.89 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.54 13pk h GLU 262 CO 1.04 0.00 0.00 -1.13 -1.16 0.00 0.00 179.01 177.76 13pk n SER 263 N -4.19 1.87 0.00 1.42 3.41 -1.26 -3.71 113.62 111.16 13pk n SER 263 Ca 0.21 -2.13 0.00 0.00 -0.26 0.00 0.00 58.87 56.69 13pk n SER 263 Cb 1.07 -0.33 0.00 0.00 -0.26 0.00 0.00 64.21 64.69 13pk n SER 263 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 13pk n LYS 264 N 0.24 0.20 -0.25 4.33 4.01 0.16 -4.83 118.16 122.02 13pk n LYS 264 Ca 0.09 -0.31 0.05 0.00 -0.51 0.00 0.00 58.31 57.63 13pk n LYS 264 Cb 0.36 -0.79 0.18 0.00 -0.51 0.00 0.00 35.03 34.27 13pk n LYS 264 CO 0.00 0.00 0.00 -0.07 -1.11 0.00 0.00 177.40 176.22 13pk h LEU 265 N 0.00 0.16 -0.67 -0.35 3.38 -1.63 0.44 115.31 116.63 13pk h LEU 265 Ca 0.00 0.12 -0.13 0.00 0.09 0.00 0.00 57.88 57.96 13pk h LEU 265 Cb 0.11 0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 13pk h LEU 265 CO 0.00 0.04 -0.38 -0.33 0.09 0.00 0.00 178.44 177.86 13pk h GLU 266 N 0.36 0.60 -0.51 1.13 5.08 -1.88 -2.07 114.58 117.28 13pk h GLU 266 Ca 0.40 -0.29 -0.01 0.00 -1.00 0.00 0.00 59.36 58.46 13pk h GLU 266 Cb 0.64 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.86 13pk h GLU 266 CO -0.44 0.88 0.28 0.35 -1.00 0.00 0.00 179.01 179.09 13pk h PHE 267 N 0.49 0.69 -0.44 4.33 3.57 -1.13 -1.55 116.94 122.90 13pk h PHE 267 Ca 0.05 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.54 13pk h PHE 267 Cb 0.89 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 39.38 13pk h PHE 267 CO 0.04 0.50 0.28 0.00 -2.23 0.00 0.00 178.31 176.91 13pk h ALA 268 N 1.12 0.56 -0.89 2.41 0.00 -0.02 -1.00 119.26 121.44 13pk h ALA 268 Ca 0.18 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 13pk h ALA 268 Cb 0.04 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 17.62 13pk h ALA 268 CO -0.03 -0.01 0.55 0.00 0.00 0.00 0.00 179.25 179.77 13pk h ARG 269 N 0.58 1.20 -0.36 0.00 3.08 -0.90 -0.05 114.38 117.93 13pk h ARG 269 Ca 0.16 -0.10 -0.14 0.00 0.07 0.00 0.00 59.98 59.98 13pk h ARG 269 Cb -0.05 -0.26 -0.01 0.00 0.08 0.00 0.00 29.97 29.73 13pk h ARG 269 CO -0.04 0.82 -0.34 1.03 -1.07 0.00 0.00 179.97 180.37 13pk h SER 270 N 1.22 0.85 -0.36 7.04 0.87 -0.95 -1.94 113.55 120.28 13pk h SER 270 Ca 0.32 -0.36 -0.08 0.00 -1.23 0.00 0.00 61.79 60.44 13pk h SER 270 Cb -0.08 -0.24 -0.02 0.00 -0.44 0.00 0.00 62.40 61.62 13pk h SER 270 CO -0.06 1.11 -0.04 0.25 -0.53 0.00 0.00 176.83 177.55 13pk h LEU 271 N 0.68 0.74 -0.99 2.23 6.46 -0.62 0.12 115.31 123.93 13pk h LEU 271 Ca 0.07 -0.19 -0.09 0.00 -0.12 0.00 0.00 57.88 57.55 13pk h LEU 271 Cb 0.89 -0.20 -0.01 0.00 -0.73 0.00 0.00 40.66 40.61 13pk h LEU 271 CO 0.08 0.83 -0.20 -0.07 -0.62 0.00 0.00 178.44 178.47 13pk h LEU 272 N 0.71 0.49 0.14 2.25 3.38 -0.67 -0.29 115.31 121.33 13pk h LEU 272 Ca 0.13 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 13pk h LEU 272 Cb 0.50 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.11 13pk h LEU 272 CO 0.03 0.70 -0.07 0.50 0.09 0.00 0.00 178.44 179.69 13pk h LYS 273 N 0.45 -0.19 -0.95 1.13 1.63 -0.53 -2.15 116.57 115.97 13pk h LYS 273 Ca 0.07 0.01 0.05 0.00 -0.85 0.00 0.00 60.65 59.93 13pk h LYS 273 Cb 0.60 0.04 -0.06 0.00 -0.60 0.00 0.00 32.23 32.21 13pk h LYS 273 CO 0.04 0.05 0.61 0.87 -3.45 0.00 0.00 179.45 177.57 13pk h LYS 274 N -0.41 1.12 -0.28 1.90 1.57 -0.81 -0.68 116.57 118.98 13pk h LYS 274 Ca -0.02 -0.07 0.06 0.00 -1.87 0.00 0.00 60.65 58.75 13pk h LYS 274 Cb 0.32 -0.25 -0.05 0.00 0.08 0.00 0.00 32.23 32.33 13pk h LYS 274 CO 0.03 0.74 -0.08 0.00 -0.57 0.00 0.00 179.45 179.57 13pk h ALA 275 N 1.41 0.18 0.03 3.86 0.00 -0.81 0.76 119.26 124.68 13pk h ALA 275 Ca 0.39 0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.42 13pk h ALA 275 Cb 0.08 0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 13pk h ALA 275 CO -0.14 -0.47 -0.11 0.93 0.00 0.00 0.00 179.25 179.46 13pk h GLU 276 N -0.01 -0.19 -0.97 0.00 5.08 -0.62 -0.38 114.58 117.49 13pk h GLU 276 Ca 0.14 0.01 0.10 0.00 -1.00 0.00 0.00 59.36 58.61 13pk h GLU 276 Cb 0.22 0.04 -0.08 0.00 0.50 0.00 0.00 28.75 29.43 13pk h GLU 276 CO -0.29 -0.13 0.62 -0.44 -1.00 0.00 0.00 179.01 177.77 13pk h ASP 277 N -0.20 0.91 -0.29 1.42 5.19 -0.02 -0.40 116.42 123.03 13pk h ASP 277 Ca 0.03 0.03 0.00 0.00 -0.62 0.00 0.00 57.03 56.47 13pk h ASP 277 Cb 0.23 -0.15 0.00 0.00 0.18 0.00 0.00 39.33 39.59 13pk h ASP 277 CO -0.08 0.52 0.00 0.54 -3.12 0.00 0.00 179.24 177.10 13pk n ARG 278 N -4.57 2.00 -3.51 3.56 5.12 0.25 -4.91 116.66 114.61 13pk n ARG 278 Ca 0.17 -1.17 -0.18 0.00 -1.93 0.00 0.00 57.85 54.74 13pk n ARG 278 Cb 0.31 -1.42 0.07 0.00 -1.16 0.00 0.00 32.46 30.26 13pk n ARG 278 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 13pk n LYS 279 N 0.36 -5.87 -4.10 5.56 5.02 -0.16 -4.82 118.16 114.16 13pk n LYS 279 Ca 0.11 0.77 -0.34 0.00 -2.02 0.00 0.00 58.31 56.84 13pk n LYS 279 Cb 0.38 -5.63 -0.15 0.00 -0.02 0.00 0.00 35.03 29.60 13pk n LYS 279 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 13pk s VAL 280 N -3.46 2.43 -0.66 -0.18 1.01 -0.21 -4.74 120.40 114.59 13pk s VAL 280 Ca 0.02 -0.82 -0.24 0.00 0.00 0.00 0.00 61.98 60.94 13pk s VAL 280 Cb -0.00 -2.05 0.05 0.00 0.00 0.00 0.00 36.38 34.38 13pk s VAL 280 CO 0.76 0.51 1.07 -1.58 0.00 0.00 0.00 175.10 175.86 13pk s GLN 281 N 1.30 3.19 -0.00 2.72 0.74 -0.48 -4.21 119.66 122.92 13pk s GLN 281 Ca 0.04 -0.51 -0.23 0.00 0.05 0.00 0.00 55.36 54.71 13pk s GLN 281 Cb -0.13 -4.18 -0.05 0.00 1.10 0.00 0.00 33.01 29.75 13pk s GLN 281 CO -0.10 -1.86 0.70 0.08 -0.55 0.00 0.00 175.29 173.56 13pk s VAL 282 N 4.62 4.87 -0.05 1.34 1.01 -1.26 -0.99 120.40 129.93 13pk s VAL 282 Ca 0.28 1.48 0.03 0.00 0.00 0.00 0.00 61.98 63.77 13pk s VAL 282 Cb -0.13 -4.05 0.01 0.00 0.00 0.00 0.00 36.38 32.21 13pk s VAL 282 CO 0.14 0.34 -0.14 -0.63 0.00 0.00 0.00 175.10 174.81 13pk s ILE 283 N 0.17 1.26 0.39 2.22 1.01 0.52 -4.92 121.20 121.85 13pk s ILE 283 Ca 0.36 -0.58 0.08 0.00 0.00 0.00 0.00 60.65 60.51 13pk s ILE 283 Cb -0.19 -1.11 -0.06 0.00 0.01 0.00 0.00 42.46 41.11 13pk s ILE 283 CO 0.20 0.38 0.07 -0.76 0.00 0.00 0.00 174.94 174.83 13pk s LEU 284 N 0.37 3.00 0.33 2.97 1.43 -1.26 -1.41 118.68 124.10 13pk s LEU 284 Ca -0.10 -1.13 -0.28 0.00 -1.03 0.00 0.00 54.13 51.59 13pk s LEU 284 Cb -0.14 -1.26 -0.13 0.00 0.03 0.00 0.00 46.19 44.70 13pk s LEU 284 CO 0.03 -0.41 1.25 -2.65 0.23 0.00 0.00 176.35 174.80 13pk n PRO 285 N -1.06 2.01 -0.07 1.29 -0.02 -1.26 -4.90 135.00 130.99 13pk n PRO 285 Ca -0.03 0.70 -0.13 0.00 -2.02 0.00 0.00 63.50 62.02 13pk n PRO 285 Cb 0.64 -2.26 -0.14 0.00 -0.02 0.00 0.00 33.50 31.73 13pk n PRO 285 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 13pk n ILE 286 N 0.36 1.53 -4.14 4.25 5.41 -1.26 -4.77 119.36 120.74 13pk n ILE 286 Ca 0.06 -0.74 -0.13 0.00 1.00 0.00 0.00 62.75 62.94 13pk n ILE 286 Cb 0.35 -1.02 -0.08 0.00 -0.71 0.00 0.00 39.64 38.18 13pk n ILE 286 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 176.55 178.06 13pk s ASP 287 N -6.12 0.40 0.14 4.38 -4.77 -1.26 -3.02 116.67 106.42 13pk s ASP 287 Ca -0.17 -1.33 -0.03 0.00 -3.30 0.00 0.00 52.55 47.73 13pk s ASP 287 Cb 0.07 0.50 -0.03 0.00 -1.09 0.00 0.00 42.92 42.37 13pk s ASP 287 CO 0.76 -1.02 0.11 -1.00 0.70 0.00 0.00 175.17 174.72 13pk s HIS 288 N -3.85 0.76 -0.19 2.11 3.76 -1.26 -2.10 115.29 114.51 13pk s HIS 288 Ca 0.33 -1.13 -0.02 0.00 -0.15 0.00 0.00 55.06 54.09 13pk s HIS 288 Cb 0.03 -0.39 -0.00 0.00 1.11 0.00 0.00 32.58 33.33 13pk s HIS 288 CO 0.15 -0.56 -0.09 0.08 -0.85 0.00 0.00 174.74 173.46 13pk s VAL 289 N -4.03 3.06 0.33 -0.90 1.01 -0.46 -1.31 120.40 118.11 13pk s VAL 289 Ca 0.23 -0.61 0.03 0.00 0.00 0.00 0.00 61.98 61.62 13pk s VAL 289 Cb 0.07 -2.35 -0.04 0.00 0.00 0.00 0.00 36.38 34.05 13pk s VAL 289 CO 0.01 0.47 0.11 0.00 0.00 0.00 0.00 175.10 175.69 13pk s HIS 291 N -3.43 -0.42 -0.37 0.00 2.46 -0.67 -1.24 115.29 111.63 13pk s HIS 291 Ca 0.33 0.20 0.27 0.00 0.47 0.00 0.00 55.06 56.33 13pk s HIS 291 Cb 0.06 0.57 0.88 0.00 -0.13 0.00 0.00 32.58 33.96 13pk s HIS 291 CO 0.15 -0.79 1.78 1.79 -2.47 0.00 0.00 174.74 175.20 13pk h THR 292 N 2.00 0.00 -3.33 0.89 1.35 -1.87 0.16 112.91 112.11 13pk h THR 292 Ca -0.28 -0.57 -0.09 0.00 -0.55 0.00 0.00 66.41 64.91 13pk h THR 292 Cb 1.28 1.52 -0.17 0.00 -1.73 0.00 0.00 68.15 69.05 13pk h THR 292 CO 0.33 0.00 -0.25 -1.83 -0.25 0.00 0.00 175.52 173.53 13pk s GLU 293 N -3.34 0.82 -0.78 4.72 -1.05 -1.26 -4.79 118.70 113.01 13pk s GLU 293 Ca 0.06 -0.53 -0.13 0.00 -0.15 0.00 0.00 54.97 54.21 13pk s GLU 293 Cb 0.09 0.35 -0.10 0.00 -0.44 0.00 0.00 34.13 34.03 13pk s GLU 293 CO 0.56 -0.26 1.96 0.34 0.95 0.00 0.00 175.26 178.80 13pk n PHE 294 N 0.52 1.50 -3.86 4.83 -0.00 -1.26 -4.75 117.46 114.44 13pk n PHE 294 Ca -0.18 -1.79 -0.12 0.00 -0.00 0.00 0.00 57.45 55.36 13pk n PHE 294 Cb 0.60 -1.61 -0.12 0.00 -0.00 0.00 0.00 39.48 38.35 13pk n PHE 294 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.76 176.91 13pk s LYS 295 N 4.29 0.26 0.44 -4.13 1.02 -1.26 -5.14 119.74 115.23 13pk s LYS 295 Ca 0.46 -0.08 -0.23 0.00 0.02 0.00 0.00 55.97 56.14 13pk s LYS 295 Cb 0.12 0.11 -0.08 0.00 -0.52 0.00 0.00 37.83 37.46 13pk s LYS 295 CO 0.05 -0.05 1.13 0.00 -0.92 0.00 0.00 175.35 175.56 13pk s ALA 296 N -0.53 3.00 -0.21 5.17 0.00 -1.26 -4.99 121.76 122.94 13pk s ALA 296 Ca -0.06 0.87 -0.12 0.00 0.00 0.00 0.00 51.96 52.65 13pk s ALA 296 Cb -0.04 -3.35 0.07 0.00 0.00 0.00 0.00 23.12 19.79 13pk s ALA 296 CO 0.00 -0.54 0.51 0.54 0.00 0.00 0.00 175.76 176.27 13pk s VAL 297 N -1.58 -0.02 0.28 0.00 0.11 -1.26 -5.09 120.40 112.85 13pk s VAL 297 Ca 0.62 0.06 -0.30 0.00 -2.93 0.00 0.00 61.98 59.43 13pk s VAL 297 Cb -0.27 -0.74 -0.11 0.00 -1.53 0.00 0.00 36.38 33.73 13pk s VAL 297 CO 0.33 0.02 1.54 -1.81 -3.33 0.00 0.00 175.10 171.85 13pk s ASP 298 N 1.40 6.47 -0.82 3.54 1.11 -1.26 -3.54 116.67 123.56 13pk s ASP 298 Ca -0.09 2.86 -0.02 0.00 0.18 0.00 0.00 52.55 55.48 13pk s ASP 298 Cb -0.07 -2.63 -0.02 0.00 1.07 0.00 0.00 42.92 41.27 13pk s ASP 298 CO -0.14 -0.84 0.75 -1.20 1.18 0.00 0.00 175.17 174.92 13pk n SER 299 N 2.15 -7.44 -4.27 0.27 7.64 -1.26 -5.02 113.62 105.69 13pk n SER 299 Ca 0.07 -0.25 -0.28 0.00 1.01 0.00 0.00 58.87 59.43 13pk n SER 299 Cb 0.38 -5.18 0.17 0.00 -1.01 0.00 0.00 64.21 58.57 13pk n SER 299 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 13pk s PRO 300 N -3.40 0.90 -0.01 1.43 0.04 -1.23 -5.01 135.00 127.71 13pk s PRO 300 Ca 0.11 -0.71 -0.30 0.00 0.04 0.00 0.00 61.00 60.14 13pk s PRO 300 Cb -0.02 -2.01 -0.05 0.00 0.04 0.00 0.00 34.50 32.47 13pk s PRO 300 CO 0.75 -2.15 1.33 -1.17 0.04 0.00 0.00 177.00 175.81 13pk s LEU 301 N -5.66 4.31 -0.25 -3.56 2.96 -0.37 -4.82 118.68 111.28 13pk s LEU 301 Ca 0.72 2.02 -0.01 0.00 -0.22 0.00 0.00 54.13 56.64 13pk s LEU 301 Cb -0.04 -3.56 0.03 0.00 0.50 0.00 0.00 46.19 43.12 13pk s LEU 301 CO 0.50 -0.67 -0.06 -0.51 -1.32 0.00 0.00 176.35 174.29 13pk s ILE 302 N 2.30 2.85 0.98 6.68 1.10 -1.26 0.87 121.20 134.72 13pk s ILE 302 Ca 0.61 -1.08 -0.12 0.00 -0.51 0.00 0.00 60.65 59.55 13pk s ILE 302 Cb -0.29 -2.47 0.18 0.00 0.15 0.00 0.00 42.46 40.02 13pk s ILE 302 CO 0.25 0.16 1.10 0.42 -2.11 0.00 0.00 174.94 174.76 13pk s THR 303 N 1.31 2.09 -0.13 4.00 -4.23 -0.42 -4.95 115.64 113.31 13pk s THR 303 Ca -0.01 0.03 0.08 0.00 -1.18 0.00 0.00 61.69 60.61 13pk s THR 303 Cb -0.17 -2.56 -0.13 0.00 1.34 0.00 0.00 72.50 70.98 13pk s THR 303 CO -0.04 -0.04 -0.01 -0.62 -0.54 0.00 0.00 174.62 173.36 13pk n GLU 304 N -4.10 1.54 -1.32 3.99 -0.58 -1.26 -4.34 120.64 114.56 13pk n GLU 304 Ca 0.05 0.02 -0.02 0.00 -0.42 0.00 0.00 57.16 56.79 13pk n GLU 304 Cb 0.57 -1.30 0.01 0.00 -0.57 0.00 0.00 31.44 30.15 13pk n GLU 304 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 13pk n ASP 305 N -2.59 0.41 0.09 1.62 8.00 -1.26 -4.68 116.55 118.14 13pk n ASP 305 Ca -0.22 -1.19 0.12 0.00 0.71 0.00 0.00 54.79 54.22 13pk n ASP 305 Cb 0.85 -0.04 0.19 0.00 -0.02 0.00 0.00 41.12 42.10 13pk n ASP 305 CO 0.00 0.00 0.00 1.56 -0.39 0.00 0.00 177.20 178.37 13pk h GLN 306 N 0.00 0.00 -6.78 -1.24 7.50 -1.84 -3.35 115.11 109.41 13pk h GLN 306 Ca -0.03 0.00 -0.50 0.00 0.50 0.00 0.00 58.65 58.61 13pk h GLN 306 Cb 0.15 0.00 0.01 0.00 0.05 0.00 0.00 27.48 27.68 13pk h GLN 306 CO 0.05 0.00 0.45 -0.80 -1.50 0.00 0.00 178.83 177.02 13pk s ASN 307 N -4.59 7.36 -0.10 1.46 0.01 -1.26 -4.65 114.94 113.16 13pk s ASN 307 Ca 0.06 2.18 0.02 0.00 -0.71 0.00 0.00 52.86 54.41 13pk s ASN 307 Cb 0.12 -2.62 -0.02 0.00 0.41 0.00 0.00 41.25 39.14 13pk s ASN 307 CO 0.70 -0.08 -0.16 -0.63 -1.51 0.00 0.00 177.10 175.43 13pk s ILE 308 N -1.07 2.83 0.32 0.60 1.01 0.17 -4.83 121.20 120.23 13pk s ILE 308 Ca 0.44 -0.76 -0.28 0.00 0.00 0.00 0.00 60.65 60.04 13pk s ILE 308 Cb -0.30 -2.14 -0.13 0.00 0.01 0.00 0.00 42.46 39.90 13pk s ILE 308 CO 0.38 0.55 1.30 -2.65 0.00 0.00 0.00 174.94 174.52 13pk n PRO 309 N 3.18 2.08 -0.35 2.79 -0.02 -1.26 -3.52 135.00 137.89 13pk n PRO 309 Ca -0.18 0.73 0.26 0.00 -2.02 0.00 0.00 63.50 62.29 13pk n PRO 309 Cb 0.53 -2.31 0.53 0.00 -0.02 0.00 0.00 33.50 32.22 13pk n PRO 309 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 13pk h GLU 310 N 2.78 0.32 -0.01 -0.52 3.07 -1.95 0.75 114.58 119.03 13pk h GLU 310 Ca -0.46 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.38 13pk h GLU 310 Cb 1.28 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 29.12 13pk h GLU 310 CO 0.64 0.21 -0.01 0.41 -1.40 0.00 0.00 179.01 178.87 13pk n GLY 311 N -1.45 -0.37 3.75 -3.84 0.00 -1.26 -3.69 105.19 98.32 13pk n GLY 311 Ca 0.29 -0.36 -0.23 0.00 0.00 0.00 0.00 46.02 45.72 13pk n GLY 311 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 13pk s HIS 312 N -2.04 2.75 -0.05 1.61 3.76 0.26 -4.34 115.29 117.23 13pk s HIS 312 Ca 0.40 -0.35 0.02 0.00 -0.15 0.00 0.00 55.06 54.98 13pk s HIS 312 Cb 0.21 -1.64 0.02 0.00 1.11 0.00 0.00 32.58 32.28 13pk s HIS 312 CO 0.36 0.33 -0.08 0.00 -0.85 0.00 0.00 174.74 174.49 13pk s MET 313 N -3.86 1.24 0.03 1.40 0.23 0.54 0.61 119.30 119.48 13pk s MET 313 Ca 0.38 -0.26 -0.30 0.00 -1.03 0.00 0.00 55.69 54.47 13pk s MET 313 Cb -0.03 -1.10 -0.05 0.00 -1.53 0.00 0.00 34.83 32.12 13pk s MET 313 CO 0.23 -0.01 1.19 0.00 -2.03 0.00 0.00 175.02 174.40 13pk s ALA 314 N 0.72 3.41 -0.55 3.16 0.00 -1.26 -1.67 121.76 125.57 13pk s ALA 314 Ca -0.12 0.78 0.07 0.00 0.00 0.00 0.00 51.96 52.68 13pk s ALA 314 Cb -0.15 -3.46 -0.01 0.00 0.00 0.00 0.00 23.12 19.50 13pk s ALA 314 CO 0.02 -0.52 0.46 1.28 0.00 0.00 0.00 175.76 177.00 13pk n LEU 315 N 4.29 0.86 -3.57 0.00 4.77 0.21 -4.82 117.00 118.73 13pk n LEU 315 Ca 0.09 -0.72 -0.08 0.00 -0.03 0.00 0.00 56.01 55.28 13pk n LEU 315 Cb 0.46 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.54 13pk n LEU 315 CO 0.55 0.18 0.62 -0.62 -1.33 0.00 0.00 177.39 176.80 13pk s ASP 316 N -1.16 -0.35 0.39 -1.43 2.15 -1.09 -0.83 116.67 114.35 13pk s ASP 316 Ca 0.05 -0.14 -0.24 0.00 0.43 0.00 0.00 52.55 52.65 13pk s ASP 316 Cb 0.05 0.48 -0.09 0.00 -0.30 0.00 0.00 42.92 43.05 13pk s ASP 316 CO 0.18 -0.81 1.01 0.27 -0.17 0.00 0.00 175.17 175.65 13pk s ILE 317 N -3.34 3.96 0.84 4.11 -4.36 -1.25 -1.35 121.20 119.81 13pk s ILE 317 Ca 0.06 1.46 -0.12 0.00 -0.26 0.00 0.00 60.65 61.80 13pk s ILE 317 Cb -0.01 -3.73 0.13 0.00 1.25 0.00 0.00 42.46 40.09 13pk s ILE 317 CO -0.06 -0.04 1.19 -0.83 0.24 0.00 0.00 174.94 175.44 13pk s GLY 318 N -1.72 1.70 0.26 6.27 0.00 -0.89 -4.46 107.32 108.47 13pk s GLY 318 Ca 0.57 -1.00 -0.03 0.00 0.00 0.00 0.00 44.72 44.27 13pk s GLY 318 CO 0.23 -0.41 1.82 -0.56 0.00 0.00 0.00 173.10 174.18 13pk h PRO 319 N -1.15 0.82 -0.27 2.90 0.13 -1.91 -0.55 132.00 131.98 13pk h PRO 319 Ca -0.44 -0.05 -0.09 0.00 -0.87 0.00 0.00 66.00 64.54 13pk h PRO 319 Cb 1.29 -0.19 -0.01 0.00 0.13 0.00 0.00 31.00 32.22 13pk h PRO 319 CO 0.52 0.54 -0.24 0.87 -0.23 0.00 0.00 178.00 179.47 13pk h LYS 320 N 0.85 0.50 -0.28 0.86 1.57 -1.94 -1.51 116.57 116.62 13pk h LYS 320 Ca 0.43 -0.19 -0.07 0.00 -1.87 0.00 0.00 60.65 58.95 13pk h LYS 320 Cb 0.41 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.68 13pk h LYS 320 CO -0.26 0.71 -0.11 1.15 -0.57 0.00 0.00 179.45 180.37 13pk h THR 321 N 0.45 1.29 -0.90 -0.16 2.02 -1.58 -2.04 112.91 111.99 13pk h THR 321 Ca 0.07 -1.17 0.06 0.00 0.77 0.00 0.00 66.41 66.13 13pk h THR 321 Cb 0.66 1.48 -0.06 0.00 -1.74 0.00 0.00 68.15 68.49 13pk h THR 321 CO 0.05 0.37 0.59 0.40 0.37 0.00 0.00 175.52 177.29 13pk h ILE 322 N 0.30 1.09 0.13 3.11 2.04 -0.84 0.32 117.51 123.66 13pk h ILE 322 Ca 0.06 -0.36 -0.01 0.00 1.00 0.00 0.00 64.86 65.56 13pk h ILE 322 Cb 0.61 -0.05 0.00 0.00 -0.74 0.00 0.00 36.82 36.64 13pk h ILE 322 CO 0.04 0.19 -0.06 -0.33 0.00 0.00 0.00 178.15 177.98 13pk h GLU 323 N 1.05 -0.17 -0.00 2.37 5.08 -1.07 0.13 114.58 121.97 13pk h GLU 323 Ca 0.38 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.75 13pk h GLU 323 Cb 0.15 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.44 13pk h GLU 323 CO -0.13 0.07 0.00 -0.22 -1.00 0.00 0.00 179.01 177.73 13pk h LYS 324 N -0.39 0.00 -0.35 2.33 1.63 -0.81 0.12 116.57 119.09 13pk h LYS 324 Ca -0.02 -0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.79 13pk h LYS 324 Cb 0.32 -0.00 -0.02 0.00 -0.60 0.00 0.00 32.23 31.93 13pk h LYS 324 CO 0.03 0.01 0.23 1.88 -3.45 0.00 0.00 179.45 178.15 13pk h TYR 325 N -0.00 0.44 -0.73 1.91 -1.99 -0.93 0.35 116.97 116.02 13pk h TYR 325 Ca 0.00 0.01 -0.03 0.00 2.00 0.00 0.00 58.73 60.71 13pk h TYR 325 Cb 0.01 -0.15 -0.03 0.00 2.00 0.00 0.00 36.73 38.55 13pk h TYR 325 CO -0.08 0.28 0.35 0.28 -0.00 0.00 0.00 178.16 178.99 13pk h VAL 326 N 0.48 1.24 0.13 -2.88 2.07 -0.59 -0.69 116.25 116.01 13pk h VAL 326 Ca 0.13 -0.68 -0.01 0.00 0.82 0.00 0.00 66.70 66.97 13pk h VAL 326 Cb -0.06 0.33 0.00 0.00 -1.52 0.00 0.00 31.29 30.05 13pk h VAL 326 CO -0.03 0.28 -0.06 -0.61 0.02 0.00 0.00 177.57 177.17 13pk h GLN 327 N 1.03 -0.17 -0.55 1.57 4.15 -0.10 -1.52 115.11 119.52 13pk h GLN 327 Ca 0.25 0.01 -0.05 0.00 0.77 0.00 0.00 58.65 59.64 13pk h GLN 327 Cb 0.12 0.04 -0.03 0.00 0.21 0.00 0.00 27.48 27.83 13pk h GLN 327 CO -0.03 -0.06 0.15 0.00 -1.93 0.00 0.00 178.83 176.96 13pk h THR 328 N -0.24 1.22 -0.09 2.39 1.03 -0.17 -1.10 112.91 115.95 13pk h THR 328 Ca -0.02 -0.79 -0.00 0.00 -0.01 0.00 0.00 66.41 65.59 13pk h THR 328 Cb 0.19 0.64 -0.01 0.00 -1.07 0.00 0.00 68.15 67.91 13pk h THR 328 CO 0.03 0.30 0.03 0.40 -0.01 0.00 0.00 175.52 176.27 13pk h ILE 329 N 0.81 1.04 0.00 0.00 2.04 -0.89 0.34 117.51 120.85 13pk h ILE 329 Ca 0.18 -0.13 -0.04 0.00 1.00 0.00 0.00 64.86 65.87 13pk h ILE 329 Cb 0.27 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 37.29 13pk h ILE 329 CO -0.00 0.05 -0.17 1.23 0.00 0.00 0.00 178.15 179.25 13pk h GLY 330 N 0.19 0.00 0.85 5.37 0.00 -0.15 -2.81 103.07 106.52 13pk h GLY 330 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.36 13pk h GLY 330 CO -0.00 0.00 -0.03 0.28 0.00 0.00 0.00 176.54 176.79 13pk n LYS 331 N -3.38 0.92 -3.63 4.80 5.02 0.12 -4.92 118.16 117.09 13pk n LYS 331 Ca -0.00 -0.20 -0.21 0.00 -2.02 0.00 0.00 58.31 55.87 13pk n LYS 331 Cb 0.38 -1.50 -0.03 0.00 -0.02 0.00 0.00 35.03 33.86 13pk n LYS 331 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 13pk n LYS 333 N -1.50 5.04 -3.86 0.00 5.02 -0.09 -4.86 118.16 117.92 13pk n LYS 333 Ca 0.02 -0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.19 13pk n LYS 333 Cb 0.61 -0.74 -0.14 0.00 -0.02 0.00 0.00 35.03 34.74 13pk n LYS 333 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 13pk s SER 334 N -1.52 -0.03 -0.06 4.39 0.01 -0.72 -1.25 113.70 114.54 13pk s SER 334 Ca 0.01 0.05 -0.02 0.00 1.31 0.00 0.00 55.95 57.30 13pk s SER 334 Cb 0.03 0.06 0.04 0.00 0.21 0.00 0.00 66.02 66.36 13pk s SER 334 CO 0.18 -0.01 0.11 0.00 0.41 0.00 0.00 173.24 173.93 13pk s ALA 335 N 0.00 -0.08 -0.19 1.44 0.00 0.89 -1.44 121.76 122.38 13pk s ALA 335 Ca -0.00 0.49 0.01 0.00 0.00 0.00 0.00 51.96 52.46 13pk s ALA 335 Cb -0.00 -0.53 0.03 0.00 0.00 0.00 0.00 23.12 22.61 13pk s ALA 335 CO 0.00 -0.31 -0.17 0.42 0.00 0.00 0.00 175.76 175.71 13pk s ILE 336 N 1.61 1.96 -0.09 0.00 1.01 -0.32 -0.63 121.20 124.73 13pk s ILE 336 Ca -0.04 -1.02 0.04 0.00 0.00 0.00 0.00 60.65 59.63 13pk s ILE 336 Cb -0.12 -1.86 -0.01 0.00 0.01 0.00 0.00 42.46 40.48 13pk s ILE 336 CO -0.05 0.39 -0.21 0.86 0.00 0.00 0.00 174.94 175.93 13pk s TRP 337 N 1.30 2.59 -0.13 3.97 -0.00 0.63 -0.50 118.94 126.80 13pk s TRP 337 Ca 0.02 -0.84 -0.04 0.00 -0.00 0.00 0.00 56.10 55.24 13pk s TRP 337 Cb -0.14 -1.71 0.06 0.00 -0.00 0.00 0.00 33.47 31.68 13pk s TRP 337 CO -0.11 -0.30 0.20 1.21 -0.00 0.00 0.00 176.95 177.95 13pk s ASN 338 N 0.17 0.89 0.00 5.86 3.84 -0.22 -1.10 114.94 124.38 13pk s ASN 338 Ca -0.12 0.20 0.00 0.00 0.21 0.00 0.00 52.86 53.15 13pk s ASN 338 Cb -0.16 0.38 0.00 0.00 -0.55 0.00 0.00 41.25 40.92 13pk s ASN 338 CO 0.07 -0.27 0.00 0.61 -2.79 0.00 0.00 177.10 174.72 13pk n GLY 339 N 5.33 2.22 3.69 1.21 0.00 -1.26 -0.14 105.19 116.24 13pk n GLY 339 Ca -0.05 -1.22 -0.38 0.00 0.00 0.00 0.00 46.02 44.37 13pk n GLY 339 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 13pk n PRO 340 N 1.91 1.20 0.11 1.61 -0.02 -1.26 -3.58 135.00 134.97 13pk n PRO 340 Ca 0.00 0.46 0.13 0.00 -2.02 0.00 0.00 63.50 62.06 13pk n PRO 340 Cb 0.00 -2.41 0.44 0.00 -0.02 0.00 0.00 33.50 31.51 13pk n PRO 340 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 13pk n MET 341 N -1.33 0.23 -1.08 -0.52 2.81 -1.26 -1.23 117.12 114.74 13pk n MET 341 Ca 0.14 0.30 -0.00 0.00 -1.81 0.00 0.00 57.70 56.32 13pk n MET 341 Cb 0.47 -1.83 0.00 0.00 -0.71 0.00 0.00 33.22 31.15 13pk n MET 341 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 13pk n GLY 342 N 0.79 1.94 2.77 3.03 0.00 -1.26 -1.04 105.19 111.40 13pk n GLY 342 Ca 0.04 -1.01 -0.42 0.00 0.00 0.00 0.00 46.02 44.63 13pk n GLY 342 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 13pk n VAL 343 N -0.01 3.48 0.33 1.61 0.31 -0.01 -4.75 118.33 119.29 13pk n VAL 343 Ca -0.00 -3.06 0.16 0.00 -0.01 0.00 0.00 64.34 61.42 13pk n VAL 343 Cb 0.01 -2.60 0.86 0.00 -0.91 0.00 0.00 33.84 31.20 13pk n VAL 343 CO 0.00 0.00 0.00 2.19 -1.32 0.00 0.00 176.83 177.70 13pk h PHE 344 N 6.06 0.00 0.00 3.52 -0.00 -1.86 -0.42 116.94 124.24 13pk h PHE 344 Ca 0.56 0.00 -0.01 0.00 -0.00 0.00 0.00 57.97 58.53 13pk h PHE 344 Cb 0.65 0.00 -0.00 0.00 -0.00 0.00 0.00 35.95 36.60 13pk h PHE 344 CO 1.46 0.00 -0.04 0.93 -0.00 0.00 0.00 178.31 180.66 13pk h GLU 345 N 0.00 0.00 -5.16 6.09 3.07 -1.88 -3.40 114.58 113.31 13pk h GLU 345 Ca 0.00 0.00 -0.64 0.00 -0.50 0.00 0.00 59.36 58.22 13pk h GLU 345 Cb 0.58 0.00 -0.22 0.00 -0.84 0.00 0.00 28.75 28.28 13pk h GLU 345 CO 0.00 0.04 -0.65 -1.64 -1.40 0.00 0.00 179.01 175.36 13pk s MET 346 N -4.16 3.68 0.21 2.33 -1.94 -0.17 -5.02 119.30 114.23 13pk s MET 346 Ca -0.03 -0.49 -0.17 0.00 -1.71 0.00 0.00 55.69 53.28 13pk s MET 346 Cb 0.13 -3.09 0.21 0.00 2.01 0.00 0.00 34.83 34.09 13pk s MET 346 CO 0.51 0.07 1.58 0.28 -0.01 0.00 0.00 175.02 177.45 13pk h VAL 347 N 5.29 0.13 0.00 -6.03 2.07 -1.85 0.42 116.25 116.29 13pk h VAL 347 Ca -0.35 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.17 13pk h VAL 347 Cb 1.18 0.13 -0.00 0.00 -1.52 0.00 0.00 31.29 31.08 13pk h VAL 347 CO 0.62 0.00 -0.00 1.55 0.02 0.00 0.00 177.57 179.76 13pk h PRO 348 N -0.08 0.00 -0.26 1.57 0.13 -1.92 -2.08 132.00 129.36 13pk h PRO 348 Ca 0.30 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 65.39 13pk h PRO 348 Cb 0.57 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.68 13pk h PRO 348 CO -0.80 0.00 -0.01 0.66 -0.23 0.00 0.00 178.00 177.62 13pk n TYR 349 N -3.14 0.91 0.46 1.56 4.01 0.10 -4.59 117.16 116.47 13pk n TYR 349 Ca -0.03 -1.06 0.09 0.00 -0.16 0.00 0.00 57.90 56.74 13pk n TYR 349 Cb 0.07 -0.35 -0.12 0.00 -0.31 0.00 0.00 39.34 38.64 13pk n TYR 349 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 13pk n SER 350 N -0.74 0.81 -0.18 7.72 3.41 -0.78 -3.22 113.62 120.64 13pk n SER 350 Ca 0.24 -0.50 -0.01 0.00 -0.26 0.00 0.00 58.87 58.34 13pk n SER 350 Cb 0.91 1.38 0.08 0.00 -0.26 0.00 0.00 64.21 66.32 13pk n SER 350 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 13pk h LYS 351 N 0.00 0.14 -0.34 4.33 1.57 -1.81 -1.83 116.57 118.63 13pk h LYS 351 Ca 0.00 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.79 13pk h LYS 351 Cb 0.61 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.87 13pk h LYS 351 CO 0.00 0.09 0.17 0.78 -0.57 0.00 0.00 179.45 179.92 13pk h GLY 352 N 0.14 0.46 0.96 3.86 0.00 -1.82 0.67 103.07 107.34 13pk h GLY 352 Ca 0.28 -0.12 -0.00 0.00 0.00 0.00 0.00 47.33 47.48 13pk h GLY 352 CO -0.44 0.10 0.15 -0.84 0.00 0.00 0.00 176.54 175.51 13pk h THR 353 N 0.36 1.11 0.00 4.70 2.02 -1.74 -2.38 112.91 116.98 13pk h THR 353 Ca 0.14 -0.28 -0.10 0.00 0.77 0.00 0.00 66.41 66.95 13pk h THR 353 Cb 0.05 0.83 -0.01 0.00 -1.74 0.00 0.00 68.15 67.27 13pk h THR 353 CO -0.09 0.11 -0.45 -0.26 0.37 0.00 0.00 175.52 175.19 13pk h PHE 354 N 0.31 0.00 -0.28 3.16 0.04 -1.20 -2.06 116.94 116.92 13pk h PHE 354 Ca 0.09 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.83 13pk h PHE 354 Cb 0.04 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.18 13pk h PHE 354 CO -0.04 0.45 0.04 0.00 -0.60 0.00 0.00 178.31 178.17 13pk h ALA 355 N 1.55 0.37 -0.53 2.45 0.00 -0.50 0.10 119.26 122.70 13pk h ALA 355 Ca -0.00 -0.19 -0.04 0.00 0.00 0.00 0.00 54.91 54.68 13pk h ALA 355 Cb 0.88 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 13pk h ALA 355 CO 0.06 0.06 0.19 0.82 0.00 0.00 0.00 179.25 180.37 13pk h ILE 356 N 0.27 1.23 -0.10 0.00 1.08 -1.34 -0.52 117.51 118.13 13pk h ILE 356 Ca 0.08 -0.73 0.01 0.00 -0.39 0.00 0.00 64.86 63.83 13pk h ILE 356 Cb 0.34 0.71 -0.01 0.00 -3.07 0.00 0.00 36.82 34.79 13pk h ILE 356 CO 0.01 0.27 0.03 0.00 -0.69 0.00 0.00 178.15 177.77 13pk h ALA 357 N 1.04 0.10 -0.56 1.87 0.00 -1.09 -0.66 119.26 119.96 13pk h ALA 357 Ca 0.17 0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.13 13pk h ALA 357 Cb 0.24 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 13pk h ALA 357 CO -0.01 -0.43 0.32 -0.22 0.00 0.00 0.00 179.25 178.91 13pk h LYS 358 N 0.08 0.61 -0.75 0.00 3.64 -0.51 -0.82 116.57 118.82 13pk h LYS 358 Ca 0.04 -0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 59.32 13pk h LYS 358 Cb 0.03 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 31.68 13pk h LYS 358 CO -0.05 0.41 0.23 0.00 -2.27 0.00 0.00 179.45 177.77 13pk h ALA 359 N 1.27 0.99 -0.23 5.00 0.00 -0.76 -1.16 119.26 124.36 13pk h ALA 359 Ca 0.23 -0.23 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 13pk h ALA 359 Cb 0.07 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 13pk h ALA 359 CO -0.12 0.67 -0.28 0.52 0.00 0.00 0.00 179.25 180.04 13pk h MET 360 N 1.11 0.60 -0.32 0.00 2.86 -0.64 -1.18 114.93 117.36 13pk h MET 360 Ca 0.24 -0.33 -0.12 0.00 -2.06 0.00 0.00 59.70 57.43 13pk h MET 360 Cb 0.31 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.99 13pk h MET 360 CO -0.01 0.93 -0.25 0.78 1.06 0.00 0.00 176.91 179.42 13pk h GLY 361 N 0.29 0.80 1.01 8.32 0.00 -1.09 -2.29 103.07 110.11 13pk h GLY 361 Ca 0.03 -0.78 0.01 0.00 0.00 0.00 0.00 47.33 46.58 13pk h GLY 361 CO 0.07 0.71 0.38 -0.09 0.00 0.00 0.00 176.54 177.60 13pk h ARG 362 N 0.50 0.75 -0.50 4.80 2.43 -1.26 0.30 114.38 121.39 13pk h ARG 362 Ca 0.06 -0.05 0.03 0.00 -0.81 0.00 0.00 59.98 59.21 13pk h ARG 362 Cb 0.82 -0.17 -0.04 0.00 -0.42 0.00 0.00 29.97 30.16 13pk h ARG 362 CO 0.07 0.50 0.28 0.78 -1.51 0.00 0.00 179.97 180.09 13pk h GLY 363 N 0.78 0.70 0.62 2.80 0.00 -1.13 0.39 103.07 107.23 13pk h GLY 363 Ca 0.21 -0.20 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 13pk h GLY 363 CO -0.05 0.16 -0.09 -0.84 0.00 0.00 0.00 176.54 175.72 13pk h THR 364 N 0.55 1.38 -0.71 4.70 2.02 -1.06 0.42 112.91 120.22 13pk h THR 364 Ca 0.21 -1.28 0.04 0.00 0.77 0.00 0.00 66.41 66.15 13pk h THR 364 Cb 0.06 2.06 -0.04 0.00 -1.74 0.00 0.00 68.15 68.50 13pk h THR 364 CO -0.12 0.36 0.47 -0.74 0.37 0.00 0.00 175.52 175.86 13pk h HIS 365 N -0.25 0.81 0.00 3.16 -0.00 -0.05 -0.84 115.15 117.98 13pk h HIS 365 Ca 0.01 0.02 -0.08 0.00 -0.00 0.00 0.00 60.37 60.32 13pk h HIS 365 Cb 0.62 -0.27 -0.02 0.00 -0.00 0.00 0.00 27.41 27.74 13pk h HIS 365 CO 0.10 0.46 -1.92 0.39 -0.00 0.00 0.00 177.93 176.96 13pk n GLU 366 N -4.46 0.73 -0.10 5.26 1.02 0.13 -4.76 120.64 118.47 13pk n GLU 366 Ca 0.09 -0.13 0.01 0.00 -0.02 0.00 0.00 57.16 57.11 13pk n GLU 366 Cb 0.15 -1.43 0.01 0.00 -0.02 0.00 0.00 31.44 30.14 13pk n GLU 366 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 13pk n HIS 367 N -2.26 0.00 -1.06 -0.32 8.25 0.09 -5.01 115.22 114.91 13pk n HIS 367 Ca -0.10 -0.17 -0.02 0.00 -0.26 0.00 0.00 57.72 57.17 13pk n HIS 367 Cb 0.63 -0.03 -0.01 0.00 1.12 0.00 0.00 29.99 31.70 13pk n HIS 367 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 13pk n GLY 368 N -0.20 0.48 3.63 -1.41 0.00 -0.32 -4.93 105.19 102.44 13pk n GLY 368 Ca 0.01 -0.17 -0.50 0.00 0.00 0.00 0.00 46.02 45.36 13pk n GLY 368 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 13pk n LEU 369 N -0.23 2.38 -4.53 0.99 -0.00 -0.91 -4.85 117.00 109.86 13pk n LEU 369 Ca -0.02 1.09 -0.43 0.00 -0.00 0.00 0.00 56.01 56.65 13pk n LEU 369 Cb 0.21 -1.30 -0.04 0.00 -0.00 0.00 0.00 43.42 42.29 13pk n LEU 369 CO 0.03 -0.64 0.73 -0.32 -0.00 0.00 0.00 177.39 177.18 13pk s MET 370 N 1.02 3.36 -0.13 1.96 -2.45 -0.38 -3.88 119.30 118.80 13pk s MET 370 Ca 0.83 -0.20 -0.04 0.00 -1.25 0.00 0.00 55.69 55.03 13pk s MET 370 Cb -0.83 -4.03 -0.03 0.00 1.25 0.00 0.00 34.83 31.19 13pk s MET 370 CO 0.44 -1.42 0.01 -1.54 1.05 0.00 0.00 175.02 173.56 13pk s SER 371 N 2.71 5.21 -0.08 1.11 1.04 -1.26 -0.07 113.70 122.35 13pk s SER 371 Ca 0.31 0.04 0.00 0.00 0.48 0.00 0.00 55.95 56.79 13pk s SER 371 Cb -0.12 -1.70 0.02 0.00 0.10 0.00 0.00 66.02 64.32 13pk s SER 371 CO 0.20 0.26 -0.05 -0.63 0.98 0.00 0.00 173.24 174.00 13pk s ILE 372 N -0.17 0.72 -0.03 -1.02 1.01 0.20 -1.50 121.20 120.41 13pk s ILE 372 Ca 0.05 -0.15 0.05 0.00 0.00 0.00 0.00 60.65 60.61 13pk s ILE 372 Cb -0.12 -0.76 -0.03 0.00 0.01 0.00 0.00 42.46 41.55 13pk s ILE 372 CO 0.02 0.30 -0.17 -0.63 0.00 0.00 0.00 174.94 174.45 13pk s ILE 373 N 1.45 2.81 0.04 2.92 1.01 -0.61 -0.27 121.20 128.55 13pk s ILE 373 Ca -0.02 -0.89 -0.00 0.00 0.00 0.00 0.00 60.65 59.74 13pk s ILE 373 Cb -0.13 -2.09 -0.03 0.00 0.01 0.00 0.00 42.46 40.21 13pk s ILE 373 CO -0.04 0.54 -0.03 -0.83 0.00 0.00 0.00 174.94 174.58 13pk s GLY 374 N -0.84 0.42 0.00 6.18 0.00 -0.26 -0.83 107.32 111.99 13pk s GLY 374 Ca 0.12 -1.02 0.00 0.00 0.00 0.00 0.00 44.72 43.81 13pk s GLY 374 CO 0.01 -1.12 0.00 0.61 0.00 0.00 0.00 173.10 172.60 13pk n GLY 375 N 0.57 2.54 0.28 0.20 0.00 0.11 -4.21 105.19 104.68 13pk n GLY 375 Ca -0.17 -1.71 -0.16 0.00 0.00 0.00 0.00 46.02 43.98 13pk n GLY 375 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 13pk h GLY 376 N 0.00 -0.64 1.49 -0.02 0.00 -1.87 -0.37 103.07 101.66 13pk h GLY 376 Ca 0.00 0.25 -0.12 0.00 0.00 0.00 0.00 47.33 47.47 13pk h GLY 376 CO 0.00 -0.24 -0.33 -0.55 0.00 0.00 0.00 176.54 175.42 13pk h ASP 377 N -0.61 0.59 -0.12 0.19 3.32 -1.95 -2.01 116.42 115.83 13pk h ASP 377 Ca -0.05 -0.24 -0.01 0.00 0.02 0.00 0.00 57.03 56.75 13pk h ASP 377 Cb 0.49 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.87 13pk h ASP 377 CO 0.07 0.88 0.04 0.28 -1.72 0.00 0.00 179.24 178.79 13pk h SER 378 N 0.49 0.17 -0.92 6.45 0.02 -1.76 -0.97 113.55 117.03 13pk h SER 378 Ca 0.06 -0.19 0.04 0.00 -0.84 0.00 0.00 61.79 60.86 13pk h SER 378 Cb 0.80 -0.05 -0.06 0.00 0.14 0.00 0.00 62.40 63.24 13pk h SER 378 CO 0.07 0.31 0.60 0.00 -1.14 0.00 0.00 176.83 176.67 13pk h ALA 379 N 0.86 1.23 -0.82 3.77 0.00 -0.89 0.16 119.26 123.57 13pk h ALA 379 Ca 0.04 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 13pk h ALA 379 Cb 0.20 -0.32 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 13pk h ALA 379 CO -0.00 0.45 0.39 0.77 0.00 0.00 0.00 179.25 180.86 13pk h SER 380 N 1.15 1.08 -0.02 0.00 0.02 -1.12 0.14 113.55 114.80 13pk h SER 380 Ca 0.37 -0.13 -0.00 0.00 -0.84 0.00 0.00 61.79 61.19 13pk h SER 380 Cb 0.03 -0.28 -0.00 0.00 0.14 0.00 0.00 62.40 62.29 13pk h SER 380 CO -0.13 0.91 0.01 0.00 -1.14 0.00 0.00 176.83 176.48 13pk h ALA 381 N 1.25 0.03 -0.78 3.77 0.00 0.17 0.12 119.26 123.80 13pk h ALA 381 Ca 0.28 -0.11 0.13 0.00 0.00 0.00 0.00 54.91 55.22 13pk h ALA 381 Cb 0.13 -0.01 -0.09 0.00 0.00 0.00 0.00 17.79 17.82 13pk h ALA 381 CO -0.03 -0.37 0.38 0.00 0.00 0.00 0.00 179.25 179.23 13pk h ALA 382 N 0.80 1.13 -0.00 0.00 0.00 -0.25 -0.73 119.26 120.22 13pk h ALA 382 Ca 0.01 0.08 -0.16 0.00 0.00 0.00 0.00 54.91 54.84 13pk h ALA 382 Cb 0.21 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 13pk h ALA 382 CO -0.00 -0.11 -0.77 0.93 0.00 0.00 0.00 179.25 179.30 13pk h GLU 383 N 0.57 0.00 -0.23 0.00 5.08 -0.50 -1.09 114.58 118.41 13pk h GLU 383 Ca 0.42 -0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.64 13pk h GLU 383 Cb 0.56 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.80 13pk h GLU 383 CO -0.35 0.77 -0.42 1.25 -1.00 0.00 0.00 179.01 179.26 13pk h LEU 384 N 0.00 0.58 -0.01 1.33 5.85 0.39 -3.04 115.31 120.41 13pk h LEU 384 Ca -0.01 -0.27 -0.16 0.00 0.84 0.00 0.00 57.88 58.29 13pk h LEU 384 Cb 1.37 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 42.21 13pk h LEU 384 CO 0.10 0.94 -0.75 0.77 -0.34 0.00 0.00 178.44 179.15 13pk h SER 385 N 0.45 0.00 0.00 1.25 4.64 -1.12 -3.47 113.55 115.29 13pk h SER 385 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 13pk h SER 385 Cb 0.93 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.02 13pk h SER 385 CO 0.08 0.75 0.00 0.61 -0.87 0.00 0.00 176.83 177.40 13pk n GLY 386 N 1.28 0.59 0.00 -0.77 0.00 -0.49 -4.92 105.19 100.88 13pk n GLY 386 Ca 0.01 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.17 13pk n GLY 386 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 13pk n GLU 387 N -2.00 0.10 -0.20 1.61 -0.58 -0.77 -3.79 120.64 115.01 13pk n GLU 387 Ca 0.00 0.00 -0.06 0.00 -0.42 0.00 0.00 57.16 56.68 13pk n GLU 387 Cb 0.00 -1.50 0.03 0.00 -0.57 0.00 0.00 31.44 29.40 13pk n GLU 387 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 13pk h ALA 388 N 3.09 0.73 0.00 0.62 0.00 -1.76 -2.23 119.26 119.72 13pk h ALA 388 Ca 0.00 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 13pk h ALA 388 Cb 0.45 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 13pk h ALA 388 CO 0.00 0.18 -0.17 1.57 0.00 0.00 0.00 179.25 180.83 13pk h LYS 389 N 0.78 0.00 -0.00 0.00 2.10 -1.88 -2.46 116.57 115.10 13pk h LYS 389 Ca 0.21 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.86 13pk h LYS 389 Cb -0.06 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.27 13pk h LYS 389 CO -0.04 0.17 -0.12 0.54 -2.00 0.00 0.00 179.45 178.00 13pk n ARG 390 N -4.13 0.46 -1.80 0.07 1.74 -0.85 -4.89 116.66 107.26 13pk n ARG 390 Ca -0.02 -0.14 -0.30 0.00 -0.77 0.00 0.00 57.85 56.62 13pk n ARG 390 Cb 0.25 -1.50 0.05 0.00 -1.02 0.00 0.00 32.46 30.24 13pk n ARG 390 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 13pk s MET 391 N -2.64 2.91 0.27 5.56 -1.94 -0.93 -4.34 119.30 118.19 13pk s MET 391 Ca 0.24 0.60 0.13 0.00 -1.71 0.00 0.00 55.69 54.95 13pk s MET 391 Cb 0.20 -2.02 0.26 0.00 2.01 0.00 0.00 34.83 35.28 13pk s MET 391 CO 0.51 -1.03 1.54 0.77 -0.01 0.00 0.00 175.02 176.80 13pk h SER 392 N -0.66 0.00 -1.59 3.03 0.02 -1.57 -3.46 113.55 109.32 13pk h SER 392 Ca -0.45 0.00 0.16 0.00 -0.84 0.00 0.00 61.79 60.66 13pk h SER 392 Cb 1.24 0.00 -0.26 0.00 0.14 0.00 0.00 62.40 63.51 13pk h SER 392 CO 0.62 0.62 0.36 -2.28 -1.14 0.00 0.00 176.83 175.01 13pk s HIS 393 N -3.27 -0.53 -0.32 3.45 2.46 -0.65 -4.99 115.29 111.44 13pk s HIS 393 Ca 0.01 0.98 -0.04 0.00 0.47 0.00 0.00 55.06 56.47 13pk s HIS 393 Cb 0.11 0.32 0.04 0.00 -0.13 0.00 0.00 32.58 32.91 13pk s HIS 393 CO 0.75 -0.26 0.05 0.54 -2.47 0.00 0.00 174.74 173.35 13pk s VAL 394 N 1.88 3.42 0.53 0.89 0.11 -1.26 -1.57 120.40 124.39 13pk s VAL 394 Ca -0.05 -1.20 -0.10 0.00 -2.93 0.00 0.00 61.98 57.70 13pk s VAL 394 Cb -0.04 -2.92 -0.05 0.00 -1.53 0.00 0.00 36.38 31.83 13pk s VAL 394 CO -0.16 -0.11 0.91 -0.55 -3.33 0.00 0.00 175.10 171.86 13pk s SER 395 N 1.34 6.34 0.00 3.54 0.15 -0.01 -4.97 113.70 120.09 13pk s SER 395 Ca -0.03 1.24 0.21 0.00 0.70 0.00 0.00 55.95 58.07 13pk s SER 395 Cb -0.19 -2.38 0.61 0.00 -1.71 0.00 0.00 66.02 62.35 13pk s SER 395 CO 0.01 -0.67 1.48 0.35 1.20 0.00 0.00 173.24 175.61 13pk n THR 396 N -2.22 0.31 -3.82 6.45 -2.24 -1.26 -4.03 114.28 107.46 13pk n THR 396 Ca 0.04 -0.49 -0.33 0.00 -2.27 0.00 0.00 64.05 60.99 13pk n THR 396 Cb 0.54 0.61 -0.05 0.00 -2.10 0.00 0.00 70.33 69.33 13pk n THR 396 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 13pk s GLY 397 N -1.54 2.21 0.00 3.38 0.00 -1.26 -4.71 107.32 105.41 13pk s GLY 397 Ca 0.34 -0.68 0.00 0.00 0.00 0.00 0.00 44.72 44.38 13pk s GLY 397 CO 0.28 -0.56 0.00 0.61 0.00 0.00 0.00 173.10 173.43 13pk n GLY 398 N 0.82 0.45 0.11 0.20 0.00 -1.26 0.04 105.19 105.55 13pk n GLY 398 Ca -0.09 0.00 0.07 0.00 0.00 0.00 0.00 46.02 45.99 13pk n GLY 398 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 13pk n GLY 399 N 5.00 -0.69 0.04 -0.02 0.00 -1.26 -2.65 105.19 105.61 13pk n GLY 399 Ca 0.00 0.12 -0.01 0.00 0.00 0.00 0.00 46.02 46.13 13pk n GLY 399 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 13pk h ALA 400 N 1.82 -0.65 -0.43 4.61 0.00 -1.85 0.45 119.26 123.21 13pk h ALA 400 Ca 0.00 -0.01 0.12 0.00 0.00 0.00 0.00 54.91 55.02 13pk h ALA 400 Cb 0.12 0.43 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 13pk h ALA 400 CO 0.00 -0.66 0.74 0.77 0.00 0.00 0.00 179.25 180.10 13pk h SER 401 N -0.07 0.00 0.27 0.00 0.02 -1.77 0.98 113.55 112.98 13pk h SER 401 Ca -0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.93 13pk h SER 401 Cb 0.07 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.61 13pk h SER 401 CO -0.02 0.00 -0.13 -0.07 -1.14 0.00 0.00 176.83 175.47 13pk h LEU 402 N 0.00 -0.30 -2.01 5.07 3.38 -0.89 -3.16 115.31 117.40 13pk h LEU 402 Ca 0.20 -0.05 0.13 0.00 0.09 0.00 0.00 57.88 58.25 13pk h LEU 402 Cb 1.68 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 42.49 13pk h LEU 402 CO -0.00 0.17 0.33 -0.08 0.09 0.00 0.00 178.44 178.94 13pk h GLU 403 N -1.07 0.00 -0.15 1.13 4.81 0.51 -0.90 114.58 118.91 13pk h GLU 403 Ca -0.04 0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.24 13pk h GLU 403 Cb 0.33 0.00 -0.05 0.00 0.63 0.00 0.00 28.75 29.67 13pk h GLU 403 CO 0.06 0.00 -0.12 1.25 -0.73 0.00 0.00 179.01 179.47 13pk h LEU 404 N 0.00 -0.40 -1.59 1.64 5.85 -0.44 -1.88 115.31 118.49 13pk h LEU 404 Ca 0.21 0.08 0.06 0.00 0.84 0.00 0.00 57.88 59.08 13pk h LEU 404 Cb 0.86 0.20 -0.01 0.00 0.37 0.00 0.00 40.66 42.08 13pk h LEU 404 CO -0.00 -0.16 0.55 -0.07 -0.34 0.00 0.00 178.44 178.42 13pk h LEU 405 N -0.14 0.00 -0.85 2.25 4.07 -1.12 0.98 115.31 120.50 13pk h LEU 405 Ca 0.10 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.06 13pk h LEU 405 Cb 0.28 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.02 13pk h LEU 405 CO -0.24 0.00 0.00 1.21 -1.08 0.00 0.00 178.44 178.33 13pk n GLU 406 N -3.09 0.09 -0.98 1.13 2.13 -0.70 -4.77 120.64 114.45 13pk n GLU 406 Ca 0.03 0.56 0.00 0.00 0.66 0.00 0.00 57.16 58.41 13pk n GLU 406 Cb 0.65 -1.79 0.00 0.00 0.27 0.00 0.00 31.44 30.58 13pk n GLU 406 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 13pk n GLY 407 N -1.18 0.78 3.82 8.31 0.00 0.34 -5.02 105.19 112.24 13pk n GLY 407 Ca -0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 13pk n GLY 407 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 13pk s LYS 408 N -0.07 2.90 0.04 1.61 0.00 -1.25 -5.03 119.74 117.95 13pk s LYS 408 Ca 0.00 0.91 -0.19 0.00 0.00 0.00 0.00 55.97 56.69 13pk s LYS 408 Cb 0.00 -1.99 -0.06 0.00 0.00 0.00 0.00 37.83 35.78 13pk s LYS 408 CO 0.00 -1.11 0.55 0.95 0.00 0.00 0.00 175.35 175.74 13pk s THR 409 N -3.07 4.82 -0.05 3.79 -4.23 -1.26 -4.94 115.64 110.70 13pk s THR 409 Ca 0.58 1.16 -0.30 0.00 -1.18 0.00 0.00 61.69 61.96 13pk s THR 409 Cb -0.14 -3.88 -0.04 0.00 1.34 0.00 0.00 72.50 69.78 13pk s THR 409 CO 0.55 0.53 1.36 -0.76 -0.54 0.00 0.00 174.62 175.75 13pk s LEU 410 N -0.89 4.28 0.27 4.79 1.43 -1.26 -4.94 118.68 122.36 13pk s LEU 410 Ca 0.29 1.97 -0.03 0.00 -1.03 0.00 0.00 54.13 55.32 13pk s LEU 410 Cb -0.19 -3.55 0.38 0.00 0.03 0.00 0.00 46.19 42.86 13pk s LEU 410 CO 0.18 -0.72 1.92 1.55 0.23 0.00 0.00 176.35 179.50 13pk h PRO 411 N 8.03 1.18 -0.22 1.29 0.13 -1.80 0.43 132.00 141.04 13pk h PRO 411 Ca -0.35 -0.07 -0.06 0.00 -0.87 0.00 0.00 66.00 64.65 13pk h PRO 411 Cb 1.16 -0.27 -0.01 0.00 0.13 0.00 0.00 31.00 32.01 13pk h PRO 411 CO 0.92 0.78 -0.12 0.78 -0.23 0.00 0.00 178.00 180.12 13pk h GLY 412 N 1.22 0.39 0.19 1.56 0.00 -1.57 0.30 103.07 105.16 13pk h GLY 412 Ca 0.39 -0.25 -0.00 0.00 0.00 0.00 0.00 47.33 47.46 13pk h GLY 412 CO -0.12 0.23 -0.01 -2.08 0.00 0.00 0.00 176.54 174.56 13pk h VAL 413 N 0.34 1.43 -0.61 4.60 2.07 -1.46 -3.34 116.25 119.28 13pk h VAL 413 Ca 0.07 -1.77 0.12 0.00 0.82 0.00 0.00 66.70 65.94 13pk h VAL 413 Cb 0.43 2.56 -0.09 0.00 -1.52 0.00 0.00 31.29 32.67 13pk h VAL 413 CO 0.02 0.43 0.11 0.74 0.02 0.00 0.00 177.57 178.89 13pk h THR 414 N -0.85 0.60 0.00 2.57 2.02 0.04 -0.74 112.91 116.55 13pk h THR 414 Ca -0.00 -0.08 0.00 0.00 0.77 0.00 0.00 66.41 67.10 13pk h THR 414 Cb 0.73 0.35 0.00 0.00 -1.74 0.00 0.00 68.15 67.49 13pk h THR 414 CO 0.01 0.04 0.11 1.62 0.37 0.00 0.00 175.52 177.67 13pk h VAL 415 N 0.23 0.00 -4.07 3.16 3.04 -0.51 -3.44 116.25 114.66 13pk h VAL 415 Ca 0.33 0.00 -0.49 0.00 -1.01 0.00 0.00 66.70 65.52 13pk h VAL 415 Cb 0.50 0.88 0.06 0.00 -2.01 0.00 0.00 31.29 30.72 13pk h VAL 415 CO -0.44 0.00 0.43 -0.76 -1.01 0.00 0.00 177.57 175.79 13pk s LEU 416 N -5.99 3.82 -0.40 3.16 1.43 -0.29 -4.85 118.68 115.56 13pk s LEU 416 Ca -0.04 2.13 -0.27 0.00 -1.03 0.00 0.00 54.13 54.92 13pk s LEU 416 Cb 0.11 -4.52 -0.03 0.00 0.03 0.00 0.00 46.19 41.79 13pk s LEU 416 CO 0.36 -1.05 2.00 -1.81 0.23 0.00 0.00 176.35 176.08 13pk s ASP 417 N -1.75 5.40 -1.10 2.29 1.01 -0.34 -4.82 116.67 117.36 13pk s ASP 417 Ca 0.70 1.16 -0.22 0.00 0.71 0.00 0.00 52.55 54.90 13pk s ASP 417 Cb -0.23 -2.52 0.03 0.00 1.01 0.00 0.00 42.92 41.21 13pk s ASP 417 CO 0.26 -2.12 1.64 1.51 0.21 0.00 0.00 175.17 176.68 13pk s ASP 418 N 8.07 6.29 0.00 0.27 -4.77 -1.26 0.13 116.67 125.40 13pk s ASP 418 Ca 0.84 -1.66 0.00 0.00 -3.30 0.00 0.00 52.55 48.43 13pk s ASP 418 Cb -0.21 -2.57 0.00 0.00 -1.09 0.00 0.00 42.92 39.04 13pk s ASP 418 CO 0.30 -1.71 0.44 0.29 0.70 0.00 0.00 175.17 175.19