#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 2.36 0.18 3.49 -0.14 -1.26 -3.92 119.74 120.46 13pk s LYS 6 Ca 0.00 -1.16 -0.31 0.00 -1.36 0.00 0.00 55.97 53.14 13pk s LYS 6 Cb 0.00 -2.32 -0.10 0.00 -1.68 0.00 0.00 37.83 33.74 13pk s LYS 6 CO 0.00 0.44 1.49 0.21 -0.76 0.00 0.00 175.35 176.73 13pk s LYS 7 N -3.02 4.25 0.39 1.68 2.20 -0.59 -4.68 119.74 119.98 13pk s LYS 7 Ca 0.28 2.29 0.02 0.00 -0.36 0.00 0.00 55.97 58.20 13pk s LYS 7 Cb -0.09 -3.16 -0.01 0.00 -1.51 0.00 0.00 37.83 33.06 13pk s LYS 7 CO 0.18 -0.51 0.58 0.45 -0.36 0.00 0.00 175.35 175.69 13pk s SER 8 N 0.86 5.98 0.44 1.43 0.15 -1.26 0.53 113.70 121.83 13pk s SER 8 Ca 0.65 0.18 0.15 0.00 0.70 0.00 0.00 55.95 57.64 13pk s SER 8 Cb -0.42 -1.56 1.06 0.00 -1.71 0.00 0.00 66.02 63.39 13pk s SER 8 CO 0.35 -0.52 1.96 0.16 1.20 0.00 0.00 173.24 176.39 13pk h ILE 9 N 0.64 0.84 -0.90 6.45 3.07 -1.76 -0.46 117.51 125.39 13pk h ILE 9 Ca -0.47 -0.13 0.21 0.00 1.55 0.00 0.00 64.86 66.02 13pk h ILE 9 Cb 1.25 0.43 -0.06 0.00 -0.27 0.00 0.00 36.82 38.16 13pk h ILE 9 CO 0.57 0.07 0.60 0.78 -1.05 0.00 0.00 178.15 179.12 13pk h ASN 10 N 0.38 0.35 -0.02 2.16 -0.26 -1.93 -0.52 115.58 115.75 13pk h ASN 10 Ca 0.31 0.04 0.00 0.00 -0.56 0.00 0.00 56.30 56.09 13pk h ASN 10 Cb 0.70 -0.03 0.00 0.00 -1.06 0.00 0.00 38.32 37.94 13pk h ASN 10 CO -0.09 0.14 0.00 -0.62 -1.06 0.00 0.00 177.43 175.80 13pk n GLU 11 N -4.49 1.47 -3.75 0.81 4.71 -0.18 -4.90 120.64 114.31 13pk n GLU 11 Ca 0.19 -0.68 -0.30 0.00 -0.01 0.00 0.00 57.16 56.36 13pk n GLU 11 Cb 0.74 -1.48 -0.04 0.00 -1.01 0.00 0.00 31.44 29.65 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 -2.66 6.35 -0.02 0.00 2.15 -1.26 -4.91 116.67 116.33 13pk s ASP 13 Ca 0.39 0.10 0.11 0.00 0.43 0.00 0.00 52.55 53.58 13pk s ASP 13 Cb -0.12 -2.28 -0.18 0.00 -0.30 0.00 0.00 42.92 40.04 13pk s ASP 13 CO 0.27 -0.46 0.25 0.18 -0.17 0.00 0.00 175.17 175.23 13pk n LEU 14 N 5.76 0.00 -4.66 -1.34 4.77 -1.26 -4.87 117.00 115.39 13pk n LEU 14 Ca -0.04 0.00 -0.54 0.00 -0.03 0.00 0.00 56.01 55.40 13pk n LEU 14 Cb 0.49 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.52 13pk n LEU 14 CO 0.45 0.00 1.18 1.17 -1.33 0.00 0.00 177.39 178.86 13pk n LYS 15 N -1.90 1.32 -1.48 3.23 3.00 -1.17 -0.80 118.16 120.36 13pk n LYS 15 Ca -0.02 0.48 -0.17 0.00 -0.00 0.00 0.00 58.31 58.60 13pk n LYS 15 Cb 0.30 -2.17 -0.07 0.00 0.00 0.00 0.00 35.03 33.09 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 3.54 1.59 3.68 3.14 0.00 0.12 -4.86 105.19 112.40 13pk n GLY 16 Ca 0.22 0.00 -0.31 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 -3.41 2.66 -0.41 1.61 1.02 0.02 -4.96 119.74 116.27 13pk s LYS 17 Ca 0.00 -0.73 -0.24 0.00 0.02 0.00 0.00 55.97 55.02 13pk s LYS 17 Cb 0.00 -2.60 0.02 0.00 -0.52 0.00 0.00 37.83 34.73 13pk s LYS 17 CO 0.00 0.58 0.86 0.15 -0.92 0.00 0.00 175.35 176.02 13pk s LYS 18 N -1.90 3.63 -0.21 1.68 1.02 -1.26 -1.85 119.74 120.84 13pk s LYS 18 Ca 0.22 0.23 -0.14 0.00 0.02 0.00 0.00 55.97 56.30 13pk s LYS 18 Cb -0.12 -3.87 -0.04 0.00 -0.52 0.00 0.00 37.83 33.28 13pk s LYS 18 CO 0.14 -1.04 0.30 0.08 -0.92 0.00 0.00 175.35 173.90 13pk s VAL 19 N 3.42 5.27 -0.32 3.17 1.01 -0.38 -0.02 120.40 132.56 13pk s VAL 19 Ca 0.34 0.50 -0.21 0.00 0.00 0.00 0.00 61.98 62.61 13pk s VAL 19 Cb -0.12 -3.63 -0.00 0.00 0.00 0.00 0.00 36.38 32.63 13pk s VAL 19 CO 0.21 0.31 0.69 -0.76 0.00 0.00 0.00 175.10 175.55 13pk s LEU 20 N 1.05 4.14 -0.13 3.92 1.02 0.13 -1.56 118.68 127.25 13pk s LEU 20 Ca 0.15 0.45 0.03 0.00 0.02 0.00 0.00 54.13 54.78 13pk s LEU 20 Cb -0.14 -2.90 0.01 0.00 0.02 0.00 0.00 46.19 43.18 13pk s LEU 20 CO 0.06 -0.55 -0.21 -0.63 0.02 0.00 0.00 176.35 175.04 13pk s ILE 21 N 2.76 1.98 -0.39 -0.59 1.01 -0.80 -0.98 121.20 124.18 13pk s ILE 21 Ca 0.28 -0.93 -0.16 0.00 0.00 0.00 0.00 60.65 59.83 13pk s ILE 21 Cb -0.14 -1.75 0.01 0.00 0.01 0.00 0.00 42.46 40.58 13pk s ILE 21 CO 0.13 0.53 0.37 -0.60 0.00 0.00 0.00 174.94 175.37 13pk s ARG 22 N 0.80 3.21 0.38 2.79 3.00 -0.90 -1.22 118.95 127.01 13pk s ARG 22 Ca -0.08 -0.73 0.08 0.00 -1.00 0.00 0.00 55.73 54.00 13pk s ARG 22 Cb -0.16 -3.92 -0.04 0.00 0.00 0.00 0.00 34.95 30.83 13pk s ARG 22 CO -0.01 -0.71 0.20 0.14 0.00 0.00 0.00 175.30 174.92 13pk s VAL 23 N 1.96 2.65 -0.59 7.11 -7.23 -0.79 -0.29 120.40 123.21 13pk s VAL 23 Ca 0.10 -1.63 -0.06 0.00 -1.81 0.00 0.00 61.98 58.57 13pk s VAL 23 Cb -0.17 -2.99 0.15 0.00 0.56 0.00 0.00 36.38 33.93 13pk s VAL 23 CO 0.12 -0.07 0.44 -0.62 -0.31 0.00 0.00 175.10 174.66 13pk s ASP 24 N -3.92 5.61 -0.30 4.85 2.15 -1.26 -4.46 116.67 119.33 13pk s ASP 24 Ca 0.41 -2.49 0.10 0.00 0.43 0.00 0.00 52.55 51.01 13pk s ASP 24 Cb 0.00 -1.95 0.65 0.00 -0.30 0.00 0.00 42.92 41.32 13pk s ASP 24 CO 0.24 -0.51 1.67 0.49 -0.17 0.00 0.00 175.17 176.89 13pk n PHE 25 N 4.07 1.94 -1.79 -5.34 3.72 -1.26 -4.45 117.46 114.35 13pk n PHE 25 Ca 0.04 -1.29 -0.42 0.00 -0.05 0.00 0.00 57.45 55.72 13pk n PHE 25 Cb 0.40 -0.60 -0.01 0.00 -0.94 0.00 0.00 39.48 38.34 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 -0.54 3.86 -4.86 4.37 5.15 -1.23 -4.82 115.26 117.19 13pk n ASN 26 Ca 0.38 -2.83 -0.31 0.00 -0.60 0.00 0.00 54.58 51.21 13pk n ASN 26 Cb 1.25 -1.62 -0.04 0.00 -0.53 0.00 0.00 39.78 38.84 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 3.64 4.72 0.10 3.44 -7.23 -1.26 -4.91 120.40 118.89 13pk s VAL 27 Ca 0.49 0.79 -0.31 0.00 -1.81 0.00 0.00 61.98 61.15 13pk s VAL 27 Cb 0.13 -3.70 -0.08 0.00 0.56 0.00 0.00 36.38 33.29 13pk s VAL 27 CO -0.04 -0.45 1.49 -2.84 -0.31 0.00 0.00 175.10 172.95 13pk s PRO 28 N -3.64 4.26 0.10 4.82 0.02 -1.25 -4.88 135.00 134.42 13pk s PRO 28 Ca 0.53 2.19 0.08 0.00 0.02 0.00 0.00 61.00 63.81 13pk s PRO 28 Cb -0.10 -3.35 -0.03 0.00 0.02 0.00 0.00 34.50 31.03 13pk s PRO 28 CO 0.27 -0.57 -0.20 0.14 -0.33 0.00 0.00 177.00 176.32 13pk s VAL 29 N 1.66 1.64 -0.08 3.83 -7.23 -1.26 -0.52 120.40 118.43 13pk s VAL 29 Ca 0.68 -1.50 -0.03 0.00 -1.81 0.00 0.00 61.98 59.32 13pk s VAL 29 Cb -0.38 -1.49 0.05 0.00 0.56 0.00 0.00 36.38 35.11 13pk s VAL 29 CO 0.30 -0.07 0.16 -0.75 -0.31 0.00 0.00 175.10 174.44 13pk s LYS 30 N -1.85 0.05 -1.38 4.82 2.20 0.83 -4.85 119.74 119.55 13pk s LYS 30 Ca 0.05 0.55 -0.08 0.00 -0.36 0.00 0.00 55.97 56.13 13pk s LYS 30 Cb -0.10 -0.25 0.03 0.00 -1.51 0.00 0.00 37.83 36.01 13pk s LYS 30 CO 0.04 -0.29 1.02 0.09 -0.36 0.00 0.00 175.35 175.85 13pk n ASN 31 N 5.16 -4.44 -0.22 1.43 5.03 -1.26 -1.52 115.26 119.44 13pk n ASN 31 Ca -0.08 -0.67 -0.03 0.00 0.87 0.00 0.00 54.58 54.67 13pk n ASN 31 Cb 0.50 -4.53 -0.01 0.00 -1.02 0.00 0.00 39.78 34.72 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 -1.71 0.52 3.24 7.41 0.00 -1.26 -5.00 105.19 108.39 13pk n GLY 32 Ca -0.07 -0.17 -0.29 0.00 0.00 0.00 0.00 46.02 45.49 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 -1.48 1.90 0.17 1.61 1.02 -0.57 -4.87 119.74 117.51 13pk s LYS 33 Ca 0.00 -0.80 -0.31 0.00 0.02 0.00 0.00 55.97 54.89 13pk s LYS 33 Cb 0.00 -1.79 -0.09 0.00 -0.52 0.00 0.00 37.83 35.43 13pk s LYS 33 CO 0.00 0.45 1.43 0.42 -0.92 0.00 0.00 175.35 176.73 13pk s ILE 34 N -0.43 3.00 -0.55 2.17 1.01 -1.26 -0.12 121.20 125.01 13pk s ILE 34 Ca 0.06 0.76 0.18 0.00 0.00 0.00 0.00 60.65 61.65 13pk s ILE 34 Cb -0.09 -3.49 -0.23 0.00 0.01 0.00 0.00 42.46 38.66 13pk s ILE 34 CO -0.00 0.08 0.64 0.35 0.00 0.00 0.00 174.94 176.01 13pk n THR 35 N 3.39 0.00 -3.65 2.92 -2.24 0.33 -4.88 114.28 110.15 13pk n THR 35 Ca 0.10 -0.20 -0.04 0.00 -2.27 0.00 0.00 64.05 61.63 13pk n THR 35 Cb 0.41 0.66 -0.06 0.00 -2.10 0.00 0.00 70.33 69.24 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 -3.24 -0.93 -0.29 3.42 3.84 -1.25 -5.03 114.94 111.46 13pk s ASN 36 Ca 0.02 1.44 0.10 0.00 0.21 0.00 0.00 52.86 54.63 13pk s ASN 36 Cb 0.13 1.80 0.54 0.00 -0.55 0.00 0.00 41.25 43.17 13pk s ASN 36 CO 0.76 -0.23 1.53 -0.90 -2.79 0.00 0.00 177.10 175.47 13pk n ASP 37 N 5.01 3.04 -0.34 -4.21 5.75 -1.26 -3.91 116.55 120.62 13pk n ASP 37 Ca -0.15 -3.57 0.08 0.00 -0.01 0.00 0.00 54.79 51.14 13pk n ASP 37 Cb 0.53 -0.65 0.25 0.00 -1.03 0.00 0.00 41.12 40.22 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 1.24 1.04 -0.07 2.11 3.20 -1.97 -0.07 116.97 122.45 13pk h TYR 38 Ca 0.23 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 62.07 13pk h TYR 38 Cb 1.80 -0.32 -0.01 0.00 1.54 0.00 0.00 36.73 39.75 13pk h TYR 38 CO 1.01 0.34 -0.24 0.00 -1.64 0.00 0.00 178.16 177.63 13pk h ARG 39 N 0.86 0.11 0.00 1.82 3.08 -1.86 -0.14 114.38 118.26 13pk h ARG 39 Ca 0.50 -0.03 -0.03 0.00 0.07 0.00 0.00 59.98 60.50 13pk h ARG 39 Cb 0.61 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.65 13pk h ARG 39 CO -0.31 0.35 -0.10 0.82 -1.07 0.00 0.00 179.97 179.66 13pk h ILE 40 N 0.10 1.62 -0.88 2.04 2.04 -1.30 -3.03 117.51 118.10 13pk h ILE 40 Ca 0.02 -1.96 0.09 0.00 1.00 0.00 0.00 64.86 64.01 13pk h ILE 40 Cb 0.48 2.92 -0.06 0.00 -0.74 0.00 0.00 36.82 39.42 13pk h ILE 40 CO 0.03 0.52 0.57 0.03 0.00 0.00 0.00 178.15 179.30 13pk h ARG 41 N -0.71 0.86 0.00 2.37 3.08 -0.99 -0.31 114.38 118.68 13pk h ARG 41 Ca -0.01 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 59.95 13pk h ARG 41 Cb 0.91 -0.19 -0.00 0.00 0.08 0.00 0.00 29.97 30.76 13pk h ARG 41 CO 0.02 0.57 -0.14 0.77 -1.07 0.00 0.00 179.97 180.11 13pk h SER 42 N 0.89 0.00 0.79 7.04 0.02 -1.02 -1.94 113.55 119.33 13pk h SER 42 Ca 0.41 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.36 13pk h SER 42 Cb 0.39 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.93 13pk h SER 42 CO -0.17 0.14 -0.38 0.00 -1.14 0.00 0.00 176.83 175.28 13pk n ALA 43 N -2.30 3.00 -0.22 3.77 0.00 -0.15 -4.38 120.51 120.23 13pk n ALA 43 Ca -0.02 -0.24 0.02 0.00 0.00 0.00 0.00 53.44 53.20 13pk n ALA 43 Cb 0.26 -1.24 0.13 0.00 0.00 0.00 0.00 19.45 18.60 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 0.14 -0.28 0.00 3.38 -1.04 -3.03 115.31 114.48 13pk h LEU 44 Ca 0.00 0.10 0.07 0.00 0.09 0.00 0.00 57.88 58.14 13pk h LEU 44 Cb 0.59 0.11 -0.07 0.00 0.09 0.00 0.00 40.66 41.37 13pk h LEU 44 CO 0.00 0.07 -0.23 -0.65 0.09 0.00 0.00 178.44 177.71 13pk h PRO 45 N 0.35 -0.21 -0.55 1.13 0.11 -1.79 0.27 132.00 131.30 13pk h PRO 45 Ca 0.34 0.01 0.02 0.00 0.11 0.00 0.00 66.00 66.48 13pk h PRO 45 Cb 0.49 0.05 -0.03 0.00 0.11 0.00 0.00 31.00 31.62 13pk h PRO 45 CO -0.38 -0.14 0.35 1.15 -0.21 0.00 0.00 178.00 178.77 13pk h THR 46 N -0.22 1.10 -0.49 -1.15 2.02 -1.85 0.15 112.91 112.47 13pk h THR 46 Ca 0.15 -0.24 -0.06 0.00 0.77 0.00 0.00 66.41 67.03 13pk h THR 46 Cb 0.45 0.34 -0.02 0.00 -1.74 0.00 0.00 68.15 67.18 13pk h THR 46 CO -0.41 0.13 0.07 -0.07 0.37 0.00 0.00 175.52 175.61 13pk h LEU 47 N 0.70 0.71 -0.58 2.58 3.38 -1.29 -2.14 115.31 118.67 13pk h LEU 47 Ca 0.21 -0.14 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 13pk h LEU 47 Cb -0.03 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.51 13pk h LEU 47 CO -0.07 0.73 0.21 0.50 0.09 0.00 0.00 178.44 179.91 13pk h LYS 48 N 0.73 0.87 0.53 1.13 3.64 0.42 -1.80 116.57 122.08 13pk h LYS 48 Ca 0.16 -0.17 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 13pk h LYS 48 Cb 0.34 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.00 13pk h LYS 48 CO 0.01 0.76 -0.45 -0.22 -2.27 0.00 0.00 179.45 177.27 13pk h LYS 49 N 0.80 -0.93 -0.87 1.90 3.11 -0.16 0.12 116.57 120.53 13pk h LYS 49 Ca 0.19 0.06 0.04 0.00 -2.81 0.00 0.00 60.65 58.14 13pk h LYS 49 Cb 0.23 0.21 -0.06 0.00 -1.00 0.00 0.00 32.23 31.62 13pk h LYS 49 CO -0.01 -0.62 0.56 -0.24 -2.81 0.00 0.00 179.45 176.32 13pk h VAL 50 N -0.97 1.11 -0.60 2.00 3.04 -1.32 0.79 116.25 120.30 13pk h VAL 50 Ca -0.06 -0.36 -0.05 0.00 -1.01 0.00 0.00 66.70 65.22 13pk h VAL 50 Cb 0.83 -0.04 -0.03 0.00 -2.01 0.00 0.00 31.29 30.04 13pk h VAL 50 CO -0.02 0.19 0.19 -0.07 -1.01 0.00 0.00 177.57 176.85 13pk h LEU 51 N 1.06 0.87 -0.96 3.16 3.38 -1.12 0.41 115.31 122.13 13pk h LEU 51 Ca 0.36 -0.21 -0.07 0.00 0.09 0.00 0.00 57.88 58.05 13pk h LEU 51 Cb 0.06 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 13pk h LEU 51 CO -0.14 0.85 0.03 0.74 0.09 0.00 0.00 178.44 180.01 13pk h THR 52 N 0.85 1.24 0.00 0.22 2.02 -0.13 -2.55 112.91 114.56 13pk h THR 52 Ca 0.19 -0.95 0.00 0.00 0.77 0.00 0.00 66.41 66.42 13pk h THR 52 Cb 0.29 0.84 0.00 0.00 -1.74 0.00 0.00 68.15 67.53 13pk h THR 52 CO -0.01 0.34 0.00 -0.62 0.37 0.00 0.00 175.52 175.60 13pk n GLU 53 N -4.23 0.35 -0.30 6.66 -0.58 0.21 -4.90 120.64 117.85 13pk n GLU 53 Ca 0.03 0.04 0.00 0.00 -0.42 0.00 0.00 57.16 56.80 13pk n GLU 53 Cb 0.28 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.65 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 0.99 0.82 0.00 0.62 0.00 -0.87 -3.02 105.19 103.72 13pk n GLY 54 Ca 0.12 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.30 1.80 3.13 -0.02 0.00 0.08 0.12 105.19 108.00 13pk n GLY 55 Ca 0.00 -2.10 -0.13 0.00 0.00 0.00 0.00 46.02 43.78 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 1.19 -0.09 1.61 1.04 -0.77 -0.29 113.70 115.38 13pk s SER 56 Ca 0.00 -0.74 0.03 0.00 0.48 0.00 0.00 55.95 55.72 13pk s SER 56 Cb 0.00 0.03 -0.01 0.00 0.10 0.00 0.00 66.02 66.14 13pk s SER 56 CO 0.00 -0.27 -0.18 0.00 0.98 0.00 0.00 173.24 173.77 13pk s VAL 58 N -0.01 1.69 0.06 0.00 0.11 -0.60 0.38 120.40 122.04 13pk s VAL 58 Ca -0.06 -1.79 -0.17 0.00 -2.93 0.00 0.00 61.98 57.04 13pk s VAL 58 Cb -0.15 -2.17 -0.06 0.00 -1.53 0.00 0.00 36.38 32.47 13pk s VAL 58 CO 0.05 -0.49 0.51 -0.76 -3.33 0.00 0.00 175.10 171.07 13pk s LEU 59 N 1.23 4.48 -0.04 2.54 1.43 0.55 -1.91 118.68 126.96 13pk s LEU 59 Ca 0.06 1.12 0.05 0.00 -1.03 0.00 0.00 54.13 54.33 13pk s LEU 59 Cb -0.18 -2.84 -0.01 0.00 0.03 0.00 0.00 46.19 43.19 13pk s LEU 59 CO -0.13 0.27 -0.18 -0.04 0.23 0.00 0.00 176.35 176.50 13pk s MET 60 N -1.24 1.75 0.32 1.70 -1.94 -0.36 -1.59 119.30 117.93 13pk s MET 60 Ca 0.28 -0.63 -0.19 0.00 -1.71 0.00 0.00 55.69 53.45 13pk s MET 60 Cb -0.18 -1.55 0.05 0.00 2.01 0.00 0.00 34.83 35.16 13pk s MET 60 CO 0.17 0.29 0.81 0.45 -0.01 0.00 0.00 175.02 176.73 13pk s SER 61 N -0.08 -0.08 0.14 3.03 0.15 -1.26 -1.89 113.70 113.70 13pk s SER 61 Ca -0.01 -0.89 0.05 0.00 0.70 0.00 0.00 55.95 55.79 13pk s SER 61 Cb -0.11 0.75 -0.04 0.00 -1.71 0.00 0.00 66.02 64.91 13pk s SER 61 CO 0.02 -1.46 -0.11 -1.38 1.20 0.00 0.00 173.24 171.51 13pk s HIS 62 N -2.80 1.27 -0.03 3.44 -3.43 -1.26 -0.95 115.29 111.52 13pk s HIS 62 Ca 0.15 -0.71 0.00 0.00 -0.80 0.00 0.00 55.06 53.70 13pk s HIS 62 Cb -0.05 -0.65 0.03 0.00 -1.43 0.00 0.00 32.58 30.48 13pk s HIS 62 CO 0.09 0.09 -0.01 -1.17 -2.00 0.00 0.00 174.74 171.74 13pk s LEU 63 N -2.97 1.14 0.00 5.38 2.96 -1.26 -3.53 118.68 120.40 13pk s LEU 63 Ca 0.14 -0.05 0.00 0.00 -0.22 0.00 0.00 54.13 54.01 13pk s LEU 63 Cb 0.01 -0.27 0.00 0.00 0.50 0.00 0.00 46.19 46.42 13pk s LEU 63 CO 0.01 -0.10 0.00 0.61 -1.32 0.00 0.00 176.35 175.55 13pk n GLY 64 N 4.20 0.84 2.24 7.98 0.00 -1.26 -4.34 105.19 114.84 13pk n GLY 64 Ca -0.25 -0.75 -0.24 0.00 0.00 0.00 0.00 46.02 44.78 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 3.31 0.61 -1.97 1.61 1.74 -1.26 -5.10 116.66 115.59 13pk n ARG 65 Ca 0.00 -3.18 -0.34 0.00 -0.77 0.00 0.00 57.85 53.56 13pk n ARG 65 Cb 0.00 -1.30 0.03 0.00 -1.02 0.00 0.00 32.46 30.16 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 -0.91 3.05 0.32 5.56 0.04 -1.26 -4.93 135.00 136.87 13pk s PRO 66 Ca 0.35 1.46 0.04 0.00 0.04 0.00 0.00 61.00 62.89 13pk s PRO 66 Cb 0.15 -1.98 0.66 0.00 0.04 0.00 0.00 34.50 33.37 13pk s PRO 66 CO -0.13 -1.06 1.88 0.87 0.04 0.00 0.00 177.00 178.60 13pk h LYS 67 N 0.52 0.85 0.00 4.56 6.56 -1.87 -3.47 116.57 123.72 13pk h LYS 67 Ca -0.48 -0.05 0.00 0.00 -1.06 0.00 0.00 60.65 59.06 13pk h LYS 67 Cb 1.25 -0.19 0.00 0.00 -0.57 0.00 0.00 32.23 32.72 13pk h LYS 67 CO 0.55 0.56 0.00 0.41 -2.06 0.00 0.00 179.45 178.92 13pk n GLY 68 N -1.40 -2.20 3.08 3.86 0.00 -1.24 -4.78 105.19 102.51 13pk n GLY 68 Ca 0.16 -1.49 -0.10 0.00 0.00 0.00 0.00 46.02 44.60 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 -2.95 0.12 0.32 -0.61 2.07 -0.33 -4.67 121.20 115.16 13pk s ILE 69 Ca 0.00 -0.99 -0.28 0.00 -1.41 0.00 0.00 60.65 57.97 13pk s ILE 69 Cb 0.00 -0.66 -0.09 0.00 0.13 0.00 0.00 42.46 41.84 13pk s ILE 69 CO 0.00 -0.55 1.16 -2.84 -1.91 0.00 0.00 174.94 170.81 13pk s PRO 70 N -2.09 4.42 0.30 3.50 0.02 -1.26 -0.26 135.00 139.63 13pk s PRO 70 Ca -0.10 1.90 0.05 0.00 0.02 0.00 0.00 61.00 62.87 13pk s PRO 70 Cb -0.04 -3.02 0.73 0.00 0.02 0.00 0.00 34.50 32.19 13pk s PRO 70 CO -0.02 -0.02 1.74 0.52 -0.33 0.00 0.00 177.00 178.89 13pk h MET 71 N 3.39 0.57 -0.33 5.54 2.86 -1.96 -0.26 114.93 124.73 13pk h MET 71 Ca -0.48 -0.03 0.06 0.00 -2.06 0.00 0.00 59.70 57.19 13pk h MET 71 Cb 1.22 -0.13 -0.05 0.00 0.06 0.00 0.00 31.60 32.70 13pk h MET 71 CO 0.65 0.38 -0.01 0.00 1.06 0.00 0.00 176.91 178.99 13pk h ALA 72 N 1.67 0.30 0.00 6.32 0.00 -2.04 -1.62 119.26 123.89 13pk h ALA 72 Ca 0.57 0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.58 13pk h ALA 72 Cb 0.98 0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.94 13pk h ALA 72 CO -0.44 -0.41 0.00 1.96 0.00 0.00 0.00 179.25 180.36 13pk h GLN 73 N 0.09 0.00 -0.11 0.00 4.20 -1.42 -3.03 115.11 114.83 13pk h GLN 73 Ca 0.16 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.86 13pk h GLN 73 Cb 0.22 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.00 13pk h GLN 73 CO -0.28 0.00 0.01 0.00 -0.67 0.00 0.00 178.83 177.89 13pk h ALA 74 N 2.06 0.15 -0.92 3.87 0.00 -1.03 -3.17 119.26 120.23 13pk h ALA 74 Ca 0.00 -0.17 0.24 0.00 0.00 0.00 0.00 54.91 54.98 13pk h ALA 74 Cb 0.25 -0.04 -0.17 0.00 0.00 0.00 0.00 17.79 17.83 13pk h ALA 74 CO 0.00 -0.18 0.03 0.78 0.00 0.00 0.00 179.25 179.88 13pk h GLY 75 N -0.06 1.12 0.97 0.00 0.00 -1.58 0.37 103.07 103.89 13pk h GLY 75 Ca 0.03 0.13 -0.00 0.00 0.00 0.00 0.00 47.33 47.50 13pk h GLY 75 CO 0.00 -0.43 0.06 0.50 0.00 0.00 0.00 176.54 176.67 13pk h LYS 76 N 0.05 0.14 -0.26 4.80 6.56 -1.74 -1.98 116.57 124.14 13pk h LYS 76 Ca 0.54 -0.01 0.04 0.00 -1.06 0.00 0.00 60.65 60.16 13pk h LYS 76 Cb 1.06 -0.03 -0.04 0.00 -0.57 0.00 0.00 32.23 32.65 13pk h LYS 76 CO -0.83 0.13 0.02 0.82 -2.06 0.00 0.00 179.45 177.52 13pk h ILE 77 N 0.11 0.84 0.00 1.86 1.08 -0.37 -1.15 117.51 119.87 13pk h ILE 77 Ca 0.04 -0.03 -0.00 0.00 -0.39 0.00 0.00 64.86 64.47 13pk h ILE 77 Cb 0.02 0.73 -0.00 0.00 -3.07 0.00 0.00 36.82 34.50 13pk h ILE 77 CO -0.01 0.02 -0.00 0.03 -0.69 0.00 0.00 178.15 177.50 13pk h ARG 78 N 0.10 0.00 -0.49 2.37 3.08 -0.74 0.12 114.38 118.82 13pk h ARG 78 Ca 0.12 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 60.06 13pk h ARG 78 Cb 0.15 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.18 13pk h ARG 78 CO -0.19 0.00 -0.12 0.77 -1.07 0.00 0.00 179.97 179.36 13pk h SER 79 N 0.00 0.93 0.34 7.04 0.02 -0.46 -1.85 113.55 119.57 13pk h SER 79 Ca -0.00 -0.30 -0.09 0.00 -0.84 0.00 0.00 61.79 60.55 13pk h SER 79 Cb 0.01 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.28 13pk h SER 79 CO 0.00 1.05 -0.40 0.74 -1.14 0.00 0.00 176.83 177.08 13pk h THR 80 N 0.83 1.30 0.00 -2.27 2.02 -0.40 -3.46 112.91 110.92 13pk h THR 80 Ca 0.13 -1.44 0.00 0.00 0.77 0.00 0.00 66.41 65.87 13pk h THR 80 Cb 0.66 1.72 0.00 0.00 -1.74 0.00 0.00 68.15 68.79 13pk h THR 80 CO 0.05 0.42 0.00 0.61 0.37 0.00 0.00 175.52 176.96 13pk n GLY 81 N -0.31 0.92 3.97 2.16 0.00 0.20 -5.10 105.19 107.04 13pk n GLY 81 Ca -0.02 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.74 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 -1.62 1.78 -0.27 -0.02 0.00 -0.72 -4.95 107.32 101.53 13pk s GLY 82 Ca 0.00 -1.63 -0.06 0.00 0.00 0.00 0.00 44.72 43.03 13pk s GLY 82 CO 0.00 -0.91 0.05 0.14 0.00 0.00 0.00 173.10 172.38 13pk s VAL 83 N -3.55 3.84 -0.27 1.40 1.01 -1.26 -4.15 120.40 117.41 13pk s VAL 83 Ca 0.72 -0.61 -0.38 0.00 0.00 0.00 0.00 61.98 61.71 13pk s VAL 83 Cb -0.03 -2.92 -0.14 0.00 0.00 0.00 0.00 36.38 33.29 13pk s VAL 83 CO 0.49 0.18 1.88 -2.65 0.00 0.00 0.00 175.10 175.00 13pk n PRO 84 N 4.85 1.26 -0.94 2.72 -0.02 -1.26 -1.37 135.00 140.24 13pk n PRO 84 Ca -0.15 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 61.77 13pk n PRO 84 Cb 0.49 -2.25 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 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 4.86 0.41 3.62 -1.23 0.00 -1.25 -4.67 105.19 106.93 13pk n GLY 85 Ca 0.30 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.42 1.73 -3.54 1.61 7.35 -0.47 -4.54 117.46 117.18 13pk n PHE 86 Ca 0.00 0.53 -0.26 0.00 -0.76 0.00 0.00 57.45 56.96 13pk n PHE 86 Cb 0.13 -2.39 -0.15 0.00 0.35 0.00 0.00 39.48 37.42 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 0.28 0.17 0.27 -4.13 -0.21 -1.26 -5.04 119.66 109.75 13pk s GLN 87 Ca 0.78 -0.33 0.12 0.00 0.02 0.00 0.00 55.36 55.96 13pk s GLN 87 Cb -0.83 -1.27 0.92 0.00 1.00 0.00 0.00 33.01 32.83 13pk s GLN 87 CO 0.46 -0.91 1.20 0.94 -2.12 0.00 0.00 175.29 174.86 13pk n GLN 88 N 5.27 -0.05 0.08 2.91 -0.06 -1.26 0.50 117.38 124.78 13pk n GLN 88 Ca -0.06 1.07 0.11 0.00 -2.00 0.00 0.00 57.00 56.12 13pk n GLN 88 Cb 0.45 -1.87 0.45 0.00 -4.06 0.00 0.00 30.24 25.21 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 -4.80 0.15 -0.16 3.69 0.00 -1.26 -3.14 118.16 112.64 13pk n LYS 89 Ca 0.26 0.30 0.09 0.00 -0.00 0.00 0.00 58.31 58.97 13pk n LYS 89 Cb 0.88 -1.74 0.17 0.00 -0.00 0.00 0.00 35.03 34.34 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 -1.69 2.43 -1.77 0.58 0.00 0.18 -4.93 120.51 115.30 13pk n ALA 90 Ca 0.04 -2.51 -0.37 0.00 0.00 0.00 0.00 53.44 50.60 13pk n ALA 90 Cb 0.27 -0.45 -0.02 0.00 0.00 0.00 0.00 19.45 19.25 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 -2.81 3.24 -2.60 0.00 2.01 -1.18 -4.46 115.64 109.85 13pk s THR 91 Ca 0.34 0.94 0.25 0.00 0.31 0.00 0.00 61.69 63.53 13pk s THR 91 Cb 0.29 -3.48 0.43 0.00 0.01 0.00 0.00 72.50 69.74 13pk s THR 91 CO 0.04 -0.00 1.55 0.18 -0.69 0.00 0.00 174.62 175.70 13pk n LEU 92 N -0.37 2.10 -0.04 4.42 4.77 -1.26 -4.40 117.00 122.22 13pk n LEU 92 Ca 0.07 -0.75 -0.08 0.00 -0.03 0.00 0.00 56.01 55.22 13pk n LEU 92 Cb 0.48 -0.04 -0.02 0.00 -2.33 0.00 0.00 43.42 41.52 13pk n LEU 92 CO 0.47 0.37 0.73 0.50 -1.33 0.00 0.00 177.39 178.13 13pk h LYS 93 N 3.15 -0.19 -0.21 3.23 3.64 -1.95 0.18 116.57 124.43 13pk h LYS 93 Ca 0.00 0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.44 13pk h LYS 93 Cb 0.67 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.53 13pk h LYS 93 CO 0.00 -0.13 0.15 -1.00 -2.27 0.00 0.00 179.45 176.20 13pk h PRO 94 N -0.20 0.08 -0.47 1.90 0.13 -1.90 0.62 132.00 132.17 13pk h PRO 94 Ca 0.13 -0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.15 13pk h PRO 94 Cb 0.40 -0.02 -0.02 0.00 0.13 0.00 0.00 31.00 31.49 13pk h PRO 94 CO -0.34 0.05 -0.15 0.28 -0.23 0.00 0.00 178.00 177.61 13pk h VAL 95 N 0.08 1.27 -0.63 1.56 2.07 -1.00 -1.23 116.25 118.36 13pk h VAL 95 Ca 0.10 -1.27 -0.00 0.00 0.82 0.00 0.00 66.70 66.34 13pk h VAL 95 Cb 0.29 1.06 -0.03 0.00 -1.52 0.00 0.00 31.29 31.09 13pk h VAL 95 CO -0.01 0.44 0.38 0.00 0.02 0.00 0.00 177.57 178.40 13pk h ALA 96 N 1.03 0.80 -0.23 1.67 0.00 0.75 0.19 119.26 123.47 13pk h ALA 96 Ca 0.12 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 13pk h ALA 96 Cb 0.68 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 13pk h ALA 96 CO 0.05 0.27 0.07 -0.22 0.00 0.00 0.00 179.25 179.43 13pk h LYS 97 N 0.85 0.35 0.20 0.00 3.11 -1.00 -1.36 116.57 118.72 13pk h LYS 97 Ca 0.23 -0.07 -0.01 0.00 -2.81 0.00 0.00 60.65 57.98 13pk h LYS 97 Cb -0.03 -0.05 0.00 0.00 -1.00 0.00 0.00 32.23 31.15 13pk h LYS 97 CO -0.04 0.43 -0.09 -0.09 -2.81 0.00 0.00 179.45 176.84 13pk h ARG 98 N 0.20 -0.25 -0.78 1.90 9.65 -0.77 -2.15 114.38 122.18 13pk h ARG 98 Ca 0.07 0.02 0.14 0.00 -1.10 0.00 0.00 59.98 59.12 13pk h ARG 98 Cb 0.22 0.06 -0.10 0.00 -1.39 0.00 0.00 29.97 28.77 13pk h ARG 98 CO -0.00 -0.10 0.33 1.25 2.80 0.00 0.00 179.97 184.25 13pk h LEU 99 N -0.36 0.33 -1.05 3.80 5.85 -0.57 0.28 115.31 123.59 13pk h LEU 99 Ca -0.03 0.11 0.05 0.00 0.84 0.00 0.00 57.88 58.85 13pk h LEU 99 Cb 0.28 0.07 -0.06 0.00 0.37 0.00 0.00 40.66 41.32 13pk h LEU 99 CO 0.04 0.12 0.63 -1.28 -0.34 0.00 0.00 178.44 177.62 13pk h SER 100 N 0.48 1.03 -0.41 1.25 0.87 -0.83 -0.58 113.55 115.36 13pk h SER 100 Ca 0.43 -0.00 -0.15 0.00 -1.23 0.00 0.00 61.79 60.83 13pk h SER 100 Cb 0.64 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.37 13pk h SER 100 CO -0.40 0.68 -0.33 -0.33 -0.53 0.00 0.00 176.83 175.92 13pk h GLU 101 N 1.18 0.95 -0.16 2.24 5.08 0.14 -1.47 114.58 122.54 13pk h GLU 101 Ca 0.40 -0.48 -0.07 0.00 -1.00 0.00 0.00 59.36 58.22 13pk h GLU 101 Cb 0.09 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.34 13pk h GLU 101 CO -0.14 1.14 -0.18 -0.07 -1.00 0.00 0.00 179.01 178.76 13pk h LEU 102 N 0.78 0.44 -1.32 1.33 3.38 -0.76 -3.13 115.31 116.02 13pk h LEU 102 Ca 0.07 -0.49 0.00 0.00 0.09 0.00 0.00 57.88 57.55 13pk h LEU 102 Cb 0.93 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.55 13pk h LEU 102 CO 0.09 0.84 0.00 -0.07 0.09 0.00 0.00 178.44 179.39 13pk h LEU 103 N 0.04 0.00 1.61 1.67 4.07 -1.15 -3.47 115.31 118.08 13pk h LEU 103 Ca 0.02 0.00 -0.31 0.00 0.08 0.00 0.00 57.88 57.68 13pk h LEU 103 Cb 0.72 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.47 13pk h LEU 103 CO 0.04 0.00 -0.42 0.18 -1.08 0.00 0.00 178.44 177.17 13pk n LEU 104 N -2.94 -1.96 -3.61 1.67 4.77 -0.57 -4.99 117.00 109.36 13pk n LEU 104 Ca 0.01 -0.09 -0.12 0.00 -0.03 0.00 0.00 56.01 55.79 13pk n LEU 104 Cb 0.29 -2.32 -0.05 0.00 -2.33 0.00 0.00 43.42 39.02 13pk n LEU 104 CO 0.26 -0.04 0.20 0.00 -1.33 0.00 0.00 177.39 176.48 13pk s ARG 105 N -5.00 1.06 0.75 3.23 1.70 -1.10 -5.06 118.95 114.52 13pk s ARG 105 Ca 0.08 -0.55 -0.15 0.00 -0.47 0.00 0.00 55.73 54.64 13pk s ARG 105 Cb -0.04 0.47 0.05 0.00 -0.57 0.00 0.00 34.95 34.86 13pk s ARG 105 CO 0.10 -0.41 1.22 -2.14 -1.08 0.00 0.00 175.30 173.00 13pk s PRO 106 N -3.35 1.98 -0.13 3.89 0.02 -1.26 -4.44 135.00 131.70 13pk s PRO 106 Ca 0.00 1.82 -0.03 0.00 0.02 0.00 0.00 61.00 62.81 13pk s PRO 106 Cb 0.01 -1.81 0.05 0.00 0.02 0.00 0.00 34.50 32.77 13pk s PRO 106 CO -0.09 -1.97 0.05 0.08 -0.33 0.00 0.00 177.00 174.74 13pk s VAL 107 N -1.95 0.20 -0.16 3.83 1.01 -1.26 -4.37 120.40 117.70 13pk s VAL 107 Ca 0.75 -0.09 -0.20 0.00 0.00 0.00 0.00 61.98 62.44 13pk s VAL 107 Cb -0.31 -0.61 -0.03 0.00 0.00 0.00 0.00 36.38 35.43 13pk s VAL 107 CO 0.47 -0.04 0.56 0.28 0.00 0.00 0.00 175.10 176.37 13pk s THR 108 N 2.02 5.10 -0.35 3.92 -1.32 -0.30 -4.86 115.64 119.85 13pk s THR 108 Ca 0.02 1.07 -0.19 0.00 -1.21 0.00 0.00 61.69 61.38 13pk s THR 108 Cb -0.15 -3.89 -0.00 0.00 -1.51 0.00 0.00 72.50 66.96 13pk s THR 108 CO -0.07 0.20 0.58 0.12 -2.21 0.00 0.00 174.62 173.25 13pk s PHE 109 N 1.36 3.17 -0.48 9.09 5.36 -1.26 -0.61 117.98 134.61 13pk s PHE 109 Ca 0.27 0.29 -0.21 0.00 -0.96 0.00 0.00 56.93 56.32 13pk s PHE 109 Cb -0.16 -3.04 0.04 0.00 -0.34 0.00 0.00 43.02 39.52 13pk s PHE 109 CO 0.11 -0.58 0.72 0.00 -1.46 0.00 0.00 175.22 174.01 13pk s ALA 110 N 2.56 3.31 -0.99 11.12 0.00 0.37 -4.94 121.76 133.19 13pk s ALA 110 Ca 0.22 -1.32 0.00 0.00 0.00 0.00 0.00 51.96 50.86 13pk s ALA 110 Cb -0.15 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.54 13pk s ALA 110 CO 0.14 -1.99 0.84 -0.35 0.00 0.00 0.00 175.76 174.40 13pk n PRO 111 N 6.55 0.00 -3.50 0.00 -0.04 -1.26 0.34 135.00 137.09 13pk n PRO 111 Ca -0.02 0.36 -0.11 0.00 -0.04 0.00 0.00 63.50 63.68 13pk n PRO 111 Cb 0.47 -1.56 -0.10 0.00 -0.04 0.00 0.00 33.50 32.27 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 -2.69 0.36 0.53 3.54 -1.08 -1.26 -4.62 116.67 111.45 13pk s ASP 112 Ca 0.00 0.38 0.27 0.00 -0.52 0.00 0.00 52.55 52.69 13pk s ASP 112 Cb 0.00 0.95 1.47 0.00 -1.46 0.00 0.00 42.92 43.88 13pk s ASP 112 CO 0.00 -0.28 2.08 0.00 0.52 0.00 0.00 175.17 177.50 13pk n LEU 114 N -3.66 4.15 -2.69 0.00 4.77 -1.26 -4.29 117.00 114.03 13pk n LEU 114 Ca -0.02 -2.09 -0.07 0.00 -0.03 0.00 0.00 56.01 53.79 13pk n LEU 114 Cb 0.23 -0.54 0.07 0.00 -2.33 0.00 0.00 43.42 40.85 13pk n LEU 114 CO 0.30 0.70 0.14 -3.20 -1.33 0.00 0.00 177.39 173.99 13pk n ASN 115 N 0.93 0.18 -0.06 -1.43 5.15 -0.72 -4.90 115.26 114.41 13pk n ASN 115 Ca 0.22 -2.55 0.04 0.00 -0.60 0.00 0.00 54.58 51.69 13pk n ASN 115 Cb 0.78 0.05 0.06 0.00 -0.53 0.00 0.00 39.78 40.15 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 -0.35 2.12 -0.19 5.20 0.00 -1.22 -4.73 120.51 121.33 13pk n ALA 116 Ca 0.04 -1.63 -0.00 0.00 0.00 0.00 0.00 53.44 51.84 13pk n ALA 116 Cb 0.83 -0.17 0.08 0.00 0.00 0.00 0.00 19.45 20.19 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 0.09 0.50 -0.19 0.00 0.00 -1.91 -0.06 119.26 117.69 13pk h ALA 117 Ca 0.00 0.20 0.05 0.00 0.00 0.00 0.00 54.91 55.17 13pk h ALA 117 Cb 0.71 0.37 -0.07 0.00 0.00 0.00 0.00 17.79 18.81 13pk h ALA 117 CO 0.00 -0.41 -0.33 0.38 0.00 0.00 0.00 179.25 178.89 13pk h ASP 118 N 0.06 -1.03 -0.49 0.00 2.03 -2.00 0.28 116.42 115.27 13pk h ASP 118 Ca 0.30 0.16 -0.04 0.00 -0.73 0.00 0.00 57.03 56.71 13pk h ASP 118 Cb 0.47 0.45 -0.02 0.00 -0.83 0.00 0.00 39.33 39.40 13pk h ASP 118 CO -0.55 -0.35 0.14 0.58 -1.03 0.00 0.00 179.24 178.03 13pk h VAL 119 N -0.37 1.23 -0.24 4.15 2.07 -1.72 -2.77 116.25 118.61 13pk h VAL 119 Ca 0.11 -0.79 -0.01 0.00 0.82 0.00 0.00 66.70 66.83 13pk h VAL 119 Cb 0.55 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 13pk h VAL 119 CO -0.40 0.29 0.11 0.58 0.02 0.00 0.00 177.57 178.17 13pk h VAL 120 N 0.66 1.15 -0.91 2.57 2.07 -0.39 -2.80 116.25 118.60 13pk h VAL 120 Ca 0.16 -0.44 0.11 0.00 0.82 0.00 0.00 66.70 67.35 13pk h VAL 120 Cb 0.29 1.00 -0.07 0.00 -1.52 0.00 0.00 31.29 30.99 13pk h VAL 120 CO -0.00 0.15 0.58 0.77 0.02 0.00 0.00 177.57 179.09 13pk h SER 121 N 0.25 0.78 0.18 0.57 4.64 -0.31 -0.35 113.55 119.31 13pk h SER 121 Ca 0.08 0.03 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 13pk h SER 121 Cb 0.14 -0.13 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 13pk h SER 121 CO -0.01 0.43 0.00 0.29 -0.87 0.00 0.00 176.83 176.68 13pk n LYS 122 N -4.55 0.63 -2.00 4.77 5.02 -1.06 -4.87 118.16 116.10 13pk n LYS 122 Ca 0.16 0.02 -0.34 0.00 -2.02 0.00 0.00 58.31 56.13 13pk n LYS 122 Cb 0.36 -1.50 0.03 0.00 -0.02 0.00 0.00 35.03 33.90 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 -2.22 3.05 0.09 1.97 -1.94 -0.14 -5.06 119.30 115.05 13pk s MET 123 Ca 0.33 1.54 -0.01 0.00 -1.71 0.00 0.00 55.69 55.84 13pk s MET 123 Cb 0.17 -1.97 -0.04 0.00 2.01 0.00 0.00 34.83 35.00 13pk s MET 123 CO 0.33 -1.08 0.01 -1.12 -0.01 0.00 0.00 175.02 173.14 13pk s SER 124 N -2.10 0.46 0.25 3.03 0.01 -1.26 -5.06 113.70 109.03 13pk s SER 124 Ca 0.71 -1.10 -0.30 0.00 1.31 0.00 0.00 55.95 56.57 13pk s SER 124 Cb -0.23 0.24 -0.14 0.00 0.21 0.00 0.00 66.02 66.09 13pk s SER 124 CO 0.34 -0.65 1.19 -2.65 0.41 0.00 0.00 173.24 171.88 13pk n PRO 125 N 0.00 1.58 0.00 12.44 -0.02 -1.26 -1.17 135.00 146.57 13pk n PRO 125 Ca -0.10 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 61.94 13pk n PRO 125 Cb 0.62 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 32.03 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 1.62 1.64 3.82 -1.23 0.00 0.60 -4.93 105.19 106.70 13pk n GLY 126 Ca 0.11 0.00 -0.33 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 -1.65 6.97 -0.05 1.61 1.11 -0.32 -4.91 116.67 119.43 13pk s ASP 127 Ca 0.00 1.66 0.01 0.00 0.18 0.00 0.00 52.55 54.40 13pk s ASP 127 Cb 0.00 -2.53 0.02 0.00 1.07 0.00 0.00 42.92 41.49 13pk s ASP 127 CO 0.00 -0.31 -0.04 -0.69 1.18 0.00 0.00 175.17 175.31 13pk s VAL 128 N -2.09 0.56 -0.04 -1.27 1.01 -1.26 0.32 120.40 117.63 13pk s VAL 128 Ca 0.60 -0.11 0.04 0.00 0.00 0.00 0.00 61.98 62.50 13pk s VAL 128 Cb -0.10 -0.60 -0.00 0.00 0.00 0.00 0.00 36.38 35.68 13pk s VAL 128 CO 0.15 0.24 -0.15 -0.69 0.00 0.00 0.00 175.10 174.65 13pk s VAL 129 N 1.07 1.27 -0.16 2.92 1.01 0.16 -1.15 120.40 125.53 13pk s VAL 129 Ca -0.09 -0.63 0.00 0.00 0.00 0.00 0.00 61.98 61.27 13pk s VAL 129 Cb -0.14 -1.10 -0.00 0.00 0.00 0.00 0.00 36.38 35.14 13pk s VAL 129 CO -0.01 0.37 -0.16 -0.22 0.00 0.00 0.00 175.10 175.09 13pk s LEU 130 N 0.09 2.44 0.38 3.92 2.96 0.22 -0.33 118.68 128.36 13pk s LEU 130 Ca -0.04 -0.48 -0.12 0.00 -0.22 0.00 0.00 54.13 53.27 13pk s LEU 130 Cb -0.11 -1.55 -0.07 0.00 0.50 0.00 0.00 46.19 44.96 13pk s LEU 130 CO 0.02 0.08 0.76 -0.76 -1.32 0.00 0.00 176.35 175.13 13pk s LEU 131 N 0.84 3.90 1.02 -0.68 1.43 -0.62 -0.48 118.68 124.09 13pk s LEU 131 Ca -0.05 1.18 -0.11 0.00 -1.03 0.00 0.00 54.13 54.12 13pk s LEU 131 Cb -0.15 -4.04 0.21 0.00 0.03 0.00 0.00 46.19 42.24 13pk s LEU 131 CO -0.01 -0.34 1.09 1.21 0.23 0.00 0.00 176.35 178.53 13pk n GLU 132 N -1.03 -1.28 -1.54 1.70 4.07 0.15 -4.61 120.64 118.11 13pk n GLU 132 Ca 0.03 -0.32 -0.63 0.00 -0.06 0.00 0.00 57.16 56.18 13pk n GLU 132 Cb 0.54 -2.29 -0.10 0.00 -0.06 0.00 0.00 31.44 29.52 13pk n GLU 132 CO 0.00 0.00 0.00 -1.71 -0.06 0.00 0.00 177.13 175.36 13pk n ASN 133 N -4.54 1.21 0.27 4.31 2.85 -1.26 -4.42 115.26 113.68 13pk n ASN 133 Ca 0.08 0.94 0.15 0.00 -0.11 0.00 0.00 54.58 55.64 13pk n ASN 133 Cb 0.53 -0.94 0.77 0.00 1.24 0.00 0.00 39.78 41.38 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 5.91 0.32 0.00 3.44 -1.51 -1.34 -1.94 116.25 121.13 13pk h VAL 134 Ca -0.30 -0.52 0.00 0.00 -1.23 0.00 0.00 66.70 64.65 13pk h VAL 134 Cb 1.38 1.39 0.00 0.00 -2.13 0.00 0.00 31.29 31.93 13pk h VAL 134 CO 1.02 0.08 0.00 0.54 -1.23 0.00 0.00 177.57 177.98 13pk n ARG 135 N -3.37 0.91 0.04 5.19 1.74 -1.26 -2.73 116.66 117.18 13pk n ARG 135 Ca -0.01 0.00 0.10 0.00 -0.77 0.00 0.00 57.85 57.16 13pk n ARG 135 Cb 0.25 -1.27 0.40 0.00 -1.02 0.00 0.00 32.46 30.83 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 -0.77 0.29 -4.69 -1.55 3.01 -0.73 -3.62 117.46 109.40 13pk n PHE 136 Ca 0.12 0.11 -0.33 0.00 1.01 0.00 0.00 57.45 58.35 13pk n PHE 136 Cb 0.05 -0.67 -0.15 0.00 -0.01 0.00 0.00 39.48 38.70 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 -3.10 2.81 0.48 1.38 2.02 -1.11 -1.18 117.35 118.65 13pk s TYR 137 Ca 0.07 -0.73 0.18 0.00 -0.37 0.00 0.00 57.07 56.22 13pk s TYR 137 Cb 0.11 -1.87 1.20 0.00 -0.40 0.00 0.00 41.96 41.00 13pk s TYR 137 CO 0.35 -0.28 2.07 0.87 -1.57 0.00 0.00 175.55 176.99 13pk h LYS 138 N 6.89 0.00 0.00 -0.62 1.57 -0.87 -2.68 116.57 120.86 13pk h LYS 138 Ca -0.28 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.47 13pk h LYS 138 Cb 1.21 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.51 13pk h LYS 138 CO 0.56 0.11 -0.14 1.05 -0.57 0.00 0.00 179.45 180.46 13pk h GLU 139 N 0.00 0.00 -0.48 3.15 9.09 -1.89 -2.32 114.58 122.13 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 0.22 0.00 -0.09 0.00 -1.65 0.00 0.00 28.75 27.23 13pk h GLU 139 CO 0.01 0.14 -0.07 1.49 0.05 0.00 0.00 179.01 180.64 13pk h GLU 140 N 0.00 0.04 -0.57 1.06 4.22 -1.73 -2.18 114.58 115.43 13pk h GLU 140 Ca -0.00 -0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 13pk h GLU 140 Cb 0.37 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.61 13pk h GLU 140 CO 0.02 0.03 0.00 0.41 -2.18 0.00 0.00 179.01 177.29 13pk n GLY 141 N -1.33 2.76 3.65 1.92 0.00 -1.04 -0.87 105.19 110.28 13pk n GLY 141 Ca 0.05 -0.71 -0.38 0.00 0.00 0.00 0.00 46.02 44.97 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 1.04 1.32 0.15 1.61 2.88 -0.82 -4.88 113.62 114.92 13pk n SER 142 Ca 0.21 0.88 0.12 0.00 -1.33 0.00 0.00 58.87 58.75 13pk n SER 142 Cb 0.67 -1.43 0.15 0.00 -0.75 0.00 0.00 64.21 62.85 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 0.88 0.00 -6.14 -1.46 6.56 -1.91 -3.43 116.57 111.07 13pk h LYS 143 Ca -0.48 0.00 -0.58 0.00 -1.06 0.00 0.00 60.65 58.53 13pk h LYS 143 Cb 1.35 0.00 -0.10 0.00 -0.57 0.00 0.00 32.23 32.91 13pk h LYS 143 CO 0.53 0.00 0.81 0.15 -2.06 0.00 0.00 179.45 178.88 13pk s LYS 144 N -3.24 3.32 0.40 3.15 1.02 -1.26 -4.89 119.74 118.24 13pk s LYS 144 Ca 0.05 -0.18 0.19 0.00 0.02 0.00 0.00 55.97 56.05 13pk s LYS 144 Cb 0.08 -4.10 1.13 0.00 -0.52 0.00 0.00 37.83 34.42 13pk s LYS 144 CO 0.70 -1.76 1.75 0.00 -0.92 0.00 0.00 175.35 175.13 13pk h ALA 145 N 9.59 2.26 -0.40 5.17 0.00 -1.99 0.38 119.26 134.27 13pk h ALA 145 Ca -0.27 0.07 0.05 0.00 0.00 0.00 0.00 54.91 54.77 13pk h ALA 145 Cb 1.06 0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.85 13pk h ALA 145 CO 1.18 -0.69 0.13 1.57 0.00 0.00 0.00 179.25 181.43 13pk h LYS 146 N 0.37 0.27 -0.30 0.00 2.10 -1.96 0.43 116.57 117.47 13pk h LYS 146 Ca 0.62 -0.02 -0.02 0.00 -2.00 0.00 0.00 60.65 59.24 13pk h LYS 146 Cb 1.60 -0.06 -0.01 0.00 -0.90 0.00 0.00 32.23 32.86 13pk h LYS 146 CO -0.32 0.18 0.12 -0.44 -2.00 0.00 0.00 179.45 176.99 13pk h ASP 147 N 0.28 0.41 -0.32 7.07 3.32 -0.64 -1.48 116.42 125.07 13pk h ASP 147 Ca 0.19 -0.16 0.02 0.00 0.02 0.00 0.00 57.03 57.09 13pk h ASP 147 Cb 0.18 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.60 13pk h ASP 147 CO -0.20 0.46 0.17 0.03 -1.72 0.00 0.00 179.24 177.97 13pk h ARG 148 N 0.34 0.34 -0.31 3.56 3.08 -0.91 -2.52 114.38 117.96 13pk h ARG 148 Ca 0.10 -0.02 -0.04 0.00 0.07 0.00 0.00 59.98 60.09 13pk h ARG 148 Cb 0.18 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.13 13pk h ARG 148 CO -0.01 0.22 0.03 0.93 -1.07 0.00 0.00 179.97 180.08 13pk h GLU 149 N 0.35 0.45 0.20 0.04 5.08 -0.74 0.61 114.58 120.56 13pk h GLU 149 Ca 0.13 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 13pk h GLU 149 Cb 0.03 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 13pk h GLU 149 CO -0.08 0.46 -0.19 0.00 -1.00 0.00 0.00 179.01 178.20 13pk h ALA 150 N 1.60 -0.39 0.01 3.43 0.00 -0.84 0.24 119.26 123.32 13pk h ALA 150 Ca 0.10 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 13pk h ALA 150 Cb 0.24 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.29 13pk h ALA 150 CO 0.00 -0.74 -0.01 1.98 0.00 0.00 0.00 179.25 180.49 13pk h MET 151 N -0.41 -0.02 -0.73 0.00 1.85 -1.28 -2.91 114.93 111.43 13pk h MET 151 Ca -0.00 0.00 0.17 0.00 -0.61 0.00 0.00 59.70 59.25 13pk h MET 151 Cb 0.38 0.00 -0.04 0.00 0.43 0.00 0.00 31.60 32.37 13pk h MET 151 CO -0.04 0.20 0.50 0.00 -0.40 0.00 0.00 176.91 177.17 13pk h ALA 152 N 0.75 2.28 -0.85 0.39 0.00 -0.63 -1.04 119.26 120.16 13pk h ALA 152 Ca -0.00 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.93 13pk h ALA 152 Cb 0.22 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 13pk h ALA 152 CO 0.00 -0.48 0.55 0.87 0.00 0.00 0.00 179.25 180.19 13pk h LYS 153 N 0.28 1.06 -0.01 0.00 1.57 -0.32 0.18 116.57 119.33 13pk h LYS 153 Ca 0.36 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 59.07 13pk h LYS 153 Cb 1.00 -0.24 -0.00 0.00 0.08 0.00 0.00 32.23 33.07 13pk h LYS 153 CO -0.09 0.70 -0.01 0.82 -0.57 0.00 0.00 179.45 180.30 13pk h ILE 154 N 1.09 1.43 -0.55 1.86 2.04 -1.25 -2.97 117.51 119.16 13pk h ILE 154 Ca 0.33 -1.27 0.02 0.00 1.00 0.00 0.00 64.86 64.95 13pk h ILE 154 Cb -0.04 2.27 -0.04 0.00 -0.74 0.00 0.00 36.82 38.27 13pk h ILE 154 CO -0.10 0.33 0.33 -0.07 0.00 0.00 0.00 178.15 178.64 13pk h LEU 155 N -0.51 0.54 -2.21 1.44 4.07 -1.28 -0.71 115.31 116.63 13pk h LEU 155 Ca 0.00 0.00 0.05 0.00 0.08 0.00 0.00 57.88 58.02 13pk h LEU 155 Cb 0.55 -0.11 -0.01 0.00 1.08 0.00 0.00 40.66 42.17 13pk h LEU 155 CO 0.00 0.38 0.20 0.00 -1.08 0.00 0.00 178.44 177.95 13pk h ALA 156 N 1.24 1.83 0.00 1.53 0.00 -0.67 0.41 119.26 123.60 13pk h ALA 156 Ca 0.22 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.12 13pk h ALA 156 Cb 0.02 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.82 13pk h ALA 156 CO -0.09 -0.30 0.00 -1.13 0.00 0.00 0.00 179.25 177.72 13pk n SER 157 N -3.83 0.65 0.11 0.00 3.41 -0.28 -3.19 113.62 110.49 13pk n SER 157 Ca 0.02 0.64 -0.04 0.00 -0.26 0.00 0.00 58.87 59.23 13pk n SER 157 Cb 0.33 -0.79 0.11 0.00 -0.26 0.00 0.00 64.21 63.60 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 0.12 -4.89 7.33 0.05 -0.20 -3.48 116.97 115.91 13pk h TYR 158 Ca 0.00 -0.05 -0.48 0.00 0.05 0.00 0.00 58.73 58.25 13pk h TYR 158 Cb 0.42 -0.02 -0.13 0.00 1.01 0.00 0.00 36.73 38.01 13pk h TYR 158 CO 0.00 0.74 -0.47 0.20 -1.05 0.00 0.00 178.16 177.58 13pk s GLY 159 N -4.45 2.36 -0.10 3.88 0.00 -1.19 -4.95 107.32 102.86 13pk s GLY 159 Ca -0.02 -2.08 -0.09 0.00 0.00 0.00 0.00 44.72 42.53 13pk s GLY 159 CO 0.79 -1.46 -0.17 1.22 0.00 0.00 0.00 173.10 173.48 13pk n ASP 160 N -1.63 1.22 -4.91 1.64 8.00 0.97 -4.96 116.55 116.88 13pk n ASP 160 Ca 0.08 0.36 -0.30 0.00 0.71 0.00 0.00 54.79 55.63 13pk n ASP 160 Cb 0.62 -0.70 -0.04 0.00 -0.02 0.00 0.00 41.12 40.98 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 -2.03 5.27 -0.09 2.53 0.11 -1.02 -4.96 120.40 120.21 13pk s VAL 161 Ca -0.14 -0.23 0.01 0.00 -2.93 0.00 0.00 61.98 58.69 13pk s VAL 161 Cb 0.02 -3.65 0.02 0.00 -1.53 0.00 0.00 36.38 31.24 13pk s VAL 161 CO 0.21 0.04 -0.10 -0.47 -3.33 0.00 0.00 175.10 171.44 13pk s TYR 162 N -1.64 1.50 -0.02 1.54 6.14 -1.26 0.17 117.35 123.77 13pk s TYR 162 Ca 0.38 -0.65 0.04 0.00 0.64 0.00 0.00 57.07 57.48 13pk s TYR 162 Cb -0.12 -1.15 -0.01 0.00 0.42 0.00 0.00 41.96 41.10 13pk s TYR 162 CO 0.27 -0.39 -0.14 0.96 0.64 0.00 0.00 175.55 176.89 13pk s ILE 163 N 1.11 1.18 -0.11 3.14 -5.25 -0.15 -1.55 121.20 119.57 13pk s ILE 163 Ca -0.06 -0.61 -0.02 0.00 -0.99 0.00 0.00 60.65 58.97 13pk s ILE 163 Cb -0.14 -1.00 -0.03 0.00 2.95 0.00 0.00 42.46 44.23 13pk s ILE 163 CO -0.02 0.34 -0.02 -0.55 -1.79 0.00 0.00 174.94 172.90 13pk s SER 164 N -0.12 5.00 0.00 4.36 0.15 -0.49 -2.12 113.70 120.48 13pk s SER 164 Ca 0.01 0.01 0.00 0.00 0.70 0.00 0.00 55.95 56.67 13pk s SER 164 Cb -0.08 -1.56 0.00 0.00 -1.71 0.00 0.00 66.02 62.67 13pk s SER 164 CO 0.00 0.29 0.32 -0.67 1.20 0.00 0.00 173.24 174.38 13pk n ASP 165 N 2.74 0.53 -2.74 5.45 2.03 0.60 -0.77 116.55 124.39 13pk n ASP 165 Ca -0.18 -1.09 -0.28 0.00 0.52 0.00 0.00 54.79 53.77 13pk n ASP 165 Cb 0.53 0.00 -0.07 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 -0.04 6.77 -1.80 -1.67 0.00 -0.68 -3.96 120.51 119.12 13pk n ALA 166 Ca 0.00 -3.01 -0.42 0.00 0.00 0.00 0.00 53.44 50.02 13pk n ALA 166 Cb 0.19 -2.62 -0.02 0.00 0.00 0.00 0.00 19.45 17.00 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 0.13 2.86 0.00 0.00 2.19 -1.26 -0.69 117.98 121.21 13pk s PHE 167 Ca 0.63 0.79 0.00 0.00 0.33 0.00 0.00 56.93 58.68 13pk s PHE 167 Cb 0.28 -4.00 0.00 0.00 -1.31 0.00 0.00 43.02 37.99 13pk s PHE 167 CO -0.09 -3.41 0.00 0.41 1.83 0.00 0.00 175.22 173.96 13pk n GLY 168 N 2.49 1.81 0.00 13.12 0.00 -1.26 -4.58 105.19 116.77 13pk n GLY 168 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 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 -0.19 0.00 0.29 2.61 -1.04 0.13 -4.69 114.28 111.39 13pk n THR 169 Ca 0.00 -0.24 0.18 0.00 -2.04 0.00 0.00 64.05 61.95 13pk n THR 169 Cb 0.00 0.95 0.98 0.00 -1.82 0.00 0.00 70.33 70.44 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 1.44 0.00 2.41 0.00 -1.74 -0.90 119.26 120.47 13pk h ALA 170 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 13pk h ALA 170 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 13pk h ALA 170 CO 0.00 -0.08 0.00 1.12 0.00 0.00 0.00 179.25 180.29 13pk h HIS 171 N 0.00 0.00 -3.46 0.00 2.07 -1.89 0.47 115.15 112.34 13pk h HIS 171 Ca 0.02 0.00 -0.63 0.00 -2.85 0.00 0.00 60.37 56.91 13pk h HIS 171 Cb 0.14 0.00 -0.20 0.00 2.57 0.00 0.00 27.41 29.93 13pk h HIS 171 CO 0.00 0.00 -0.60 1.03 -3.07 0.00 0.00 177.93 175.29 13pk s ARG 172 N -3.47 3.79 0.19 5.12 0.52 -0.34 -4.51 118.95 120.25 13pk s ARG 172 Ca 0.04 -0.43 -0.30 0.00 -0.52 0.00 0.00 55.73 54.52 13pk s ARG 172 Cb 0.08 -3.22 -0.08 0.00 0.52 0.00 0.00 34.95 32.24 13pk s ARG 172 CO 0.59 0.07 1.15 0.34 0.02 0.00 0.00 175.30 177.46 13pk s ASP 173 N 0.92 7.17 0.24 0.23 -1.08 -1.26 -4.59 116.67 118.29 13pk s ASP 173 Ca 0.03 2.18 -0.21 0.00 -0.52 0.00 0.00 52.55 54.04 13pk s ASP 173 Cb -0.14 -2.61 0.07 0.00 -1.46 0.00 0.00 42.92 38.78 13pk s ASP 173 CO 0.03 -0.29 0.94 -0.94 0.52 0.00 0.00 175.17 175.43 13pk s SER 174 N -0.07 -0.05 0.03 -0.34 1.04 -1.26 -4.92 113.70 108.13 13pk s SER 174 Ca 0.50 -0.74 -0.14 0.00 0.48 0.00 0.00 55.95 56.05 13pk s SER 174 Cb -0.31 0.60 -0.07 0.00 0.10 0.00 0.00 66.02 66.34 13pk s SER 174 CO 0.37 -1.17 1.22 0.00 0.98 0.00 0.00 173.24 174.63 13pk h ALA 175 N 2.00 -0.96 0.00 5.32 0.00 -1.24 0.21 119.26 124.59 13pk h ALA 175 Ca -0.28 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.48 13pk h ALA 175 Cb 1.23 0.40 -0.01 0.00 0.00 0.00 0.00 17.79 19.41 13pk h ALA 175 CO 0.34 -0.96 -0.34 1.79 0.00 0.00 0.00 179.25 180.08 13pk h THR 176 N -0.43 1.24 0.00 0.00 1.35 -1.91 -0.82 112.91 112.34 13pk h THR 176 Ca -0.03 -1.18 -0.00 0.00 -0.55 0.00 0.00 66.41 64.65 13pk h THR 176 Cb 0.36 1.64 0.00 0.00 -1.73 0.00 0.00 68.15 68.42 13pk h THR 176 CO -0.00 0.34 -0.00 0.24 -0.25 0.00 0.00 175.52 175.84 13pk h MET 177 N 0.00 0.00 0.00 4.72 2.07 -1.87 -3.41 114.93 116.44 13pk h MET 177 Ca -0.00 -0.00 -0.15 0.00 -2.07 0.00 0.00 59.70 57.48 13pk h MET 177 Cb 0.61 0.00 -0.03 0.00 -1.87 0.00 0.00 31.60 30.31 13pk h MET 177 CO 0.04 0.98 -1.56 0.25 1.07 0.00 0.00 176.91 177.70 13pk n THR 178 N -4.62 0.56 0.53 2.22 -2.24 0.58 -4.71 114.28 106.60 13pk n THR 178 Ca -0.10 -0.29 -0.21 0.00 -2.27 0.00 0.00 64.05 61.18 13pk n THR 178 Cb 0.47 -0.82 -0.10 0.00 -2.10 0.00 0.00 70.33 67.79 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 1.25 -1.41 -0.22 3.38 0.00 0.23 -2.92 103.07 103.39 13pk h GLY 179 Ca -0.22 0.52 0.08 0.00 0.00 0.00 0.00 47.33 47.72 13pk h GLY 179 CO -0.01 -0.51 -0.33 -2.22 0.00 0.00 0.00 176.54 173.47 13pk h ILE 180 N -1.36 0.22 -0.93 2.60 2.04 -1.54 0.87 117.51 119.42 13pk h ILE 180 Ca -0.14 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.73 13pk h ILE 180 Cb 1.03 0.22 -0.05 0.00 -0.74 0.00 0.00 36.82 37.29 13pk h ILE 180 CO 0.23 0.00 0.60 1.55 0.00 0.00 0.00 178.15 180.52 13pk h PRO 181 N -0.23 1.23 0.15 2.37 0.13 -1.76 0.57 132.00 134.46 13pk h PRO 181 Ca 0.18 -0.09 0.01 0.00 -0.87 0.00 0.00 66.00 65.24 13pk h PRO 181 Cb 0.54 -0.27 -0.02 0.00 0.13 0.00 0.00 31.00 31.37 13pk h PRO 181 CO -0.56 0.83 -0.21 -0.22 -0.23 0.00 0.00 178.00 177.61 13pk h LYS 182 N 1.26 -0.40 -0.09 0.86 3.64 -0.95 0.35 116.57 121.24 13pk h LYS 182 Ca 0.34 0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 59.64 13pk h LYS 182 Cb -0.12 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.78 13pk h LYS 182 CO -0.07 -0.27 -0.40 0.82 -2.27 0.00 0.00 179.45 177.26 13pk h ILE 183 N -0.42 1.30 0.00 2.00 2.04 -0.48 -3.16 117.51 118.80 13pk h ILE 183 Ca 0.01 -1.47 -0.09 0.00 1.00 0.00 0.00 64.86 64.31 13pk h ILE 183 Cb 0.42 1.68 -0.01 0.00 -0.74 0.00 0.00 36.82 38.17 13pk h ILE 183 CO -0.09 0.44 -0.45 0.25 0.00 0.00 0.00 178.15 178.30 13pk h LEU 184 N 0.16 0.00 0.00 1.44 5.85 0.74 -3.47 115.31 120.03 13pk h LEU 184 Ca 0.02 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.74 13pk h LEU 184 Cb 0.78 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.81 13pk h LEU 184 CO 0.06 0.45 0.00 0.61 -0.34 0.00 0.00 178.44 179.22 13pk n GLY 185 N 0.99 0.61 3.20 3.75 0.00 0.12 -4.99 105.19 108.87 13pk n GLY 185 Ca 0.02 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.34 -0.06 0.00 1.61 2.20 -1.13 -5.05 114.94 110.17 13pk s ASN 186 Ca 0.00 -0.18 0.00 0.00 -0.94 0.00 0.00 52.86 51.74 13pk s ASN 186 Cb 0.00 0.29 0.00 0.00 -2.00 0.00 0.00 41.25 39.54 13pk s ASN 186 CO 0.00 -0.50 0.00 0.61 -2.94 0.00 0.00 177.10 174.27 13pk n GLY 187 N 0.96 1.38 3.09 0.45 0.00 -1.24 -4.34 105.19 105.49 13pk n GLY 187 Ca -0.20 0.28 -0.12 0.00 0.00 0.00 0.00 46.02 45.98 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 -0.10 0.67 0.03 4.61 0.00 -0.60 -0.38 121.76 125.99 13pk s ALA 188 Ca 0.00 -0.96 -0.30 0.00 0.00 0.00 0.00 51.96 50.69 13pk s ALA 188 Cb 0.00 0.10 -0.05 0.00 0.00 0.00 0.00 23.12 23.17 13pk s ALA 188 CO 0.00 -0.12 1.14 0.00 0.00 0.00 0.00 175.76 176.79 13pk s ALA 189 N -2.23 3.34 0.89 0.00 0.00 0.19 -1.40 121.76 122.55 13pk s ALA 189 Ca -0.03 0.74 -0.13 0.00 0.00 0.00 0.00 51.96 52.54 13pk s ALA 189 Cb -0.04 -3.43 0.13 0.00 0.00 0.00 0.00 23.12 19.78 13pk s ALA 189 CO -0.02 -0.42 1.18 0.20 0.00 0.00 0.00 175.76 176.70 13pk s GLY 190 N 1.09 1.61 0.28 0.00 0.00 0.05 -2.29 107.32 108.06 13pk s GLY 190 Ca 0.57 -0.70 0.00 0.00 0.00 0.00 0.00 44.72 44.59 13pk s GLY 190 CO 0.28 -0.13 1.83 -0.97 0.00 0.00 0.00 173.10 174.11 13pk h TYR 191 N -1.38 1.08 -0.15 1.90 0.05 -1.95 -0.95 116.97 115.57 13pk h TYR 191 Ca -0.47 0.03 -0.05 0.00 0.05 0.00 0.00 58.73 58.28 13pk h TYR 191 Cb 1.31 -0.34 -0.00 0.00 1.01 0.00 0.00 36.73 38.71 13pk h TYR 191 CO -0.03 0.42 -0.12 1.25 -1.05 0.00 0.00 178.16 178.63 13pk h LEU 192 N 0.94 0.36 -0.50 3.88 5.85 -1.87 0.95 115.31 124.92 13pk h LEU 192 Ca 0.48 -0.46 0.09 0.00 0.84 0.00 0.00 57.88 58.84 13pk h LEU 192 Cb 0.49 -0.10 -0.08 0.00 0.37 0.00 0.00 40.66 41.34 13pk h LEU 192 CO -0.27 0.74 0.02 -0.03 -0.34 0.00 0.00 178.44 178.56 13pk h MET 193 N -0.01 0.13 0.71 1.25 4.05 -1.57 0.17 114.93 119.66 13pk h MET 193 Ca 0.03 -0.01 -0.03 0.00 -0.28 0.00 0.00 59.70 59.41 13pk h MET 193 Cb 0.63 -0.03 -0.00 0.00 -0.80 0.00 0.00 31.60 31.40 13pk h MET 193 CO 0.03 0.09 -0.41 0.93 0.23 0.00 0.00 176.91 177.78 13pk h GLU 194 N 0.14 -1.00 -0.93 0.39 5.08 -1.03 0.46 114.58 117.68 13pk h GLU 194 Ca 0.25 0.07 0.28 0.00 -1.00 0.00 0.00 59.36 58.96 13pk h GLU 194 Cb 0.37 0.23 -0.16 0.00 0.50 0.00 0.00 28.75 29.70 13pk h GLU 194 CO -0.40 -0.67 0.27 -0.22 -1.00 0.00 0.00 179.01 176.99 13pk h LYS 195 N -1.04 0.15 0.23 2.33 3.64 -0.12 0.83 116.57 122.59 13pk h LYS 195 Ca -0.10 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.26 13pk h LYS 195 Cb 0.82 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.61 13pk h LYS 195 CO 0.11 0.10 -0.11 0.93 -2.27 0.00 0.00 179.45 178.21 13pk h GLU 196 N 0.16 -0.30 0.14 1.90 4.39 -0.43 -1.14 114.58 119.29 13pk h GLU 196 Ca 0.62 0.02 0.02 0.00 0.34 0.00 0.00 59.36 60.36 13pk h GLU 196 Cb 1.35 0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 30.02 13pk h GLU 196 CO -0.72 0.03 -0.43 0.82 -1.16 0.00 0.00 179.01 177.56 13pk h ILE 197 N -0.95 0.14 -0.66 3.13 2.04 0.86 -2.01 117.51 120.05 13pk h ILE 197 Ca -0.03 0.00 0.14 0.00 1.00 0.00 0.00 64.86 65.97 13pk h ILE 197 Cb 0.47 0.14 -0.10 0.00 -0.74 0.00 0.00 36.82 36.59 13pk h ILE 197 CO 0.05 0.00 0.09 0.28 0.00 0.00 0.00 178.15 178.57 13pk h SER 198 N -0.67 -0.12 0.04 1.72 0.02 0.56 0.29 113.55 115.39 13pk h SER 198 Ca 0.02 0.14 -0.00 0.00 -0.84 0.00 0.00 61.79 61.11 13pk h SER 198 Cb 0.69 0.22 0.00 0.00 0.14 0.00 0.00 62.40 63.46 13pk h SER 198 CO -0.24 -0.07 -0.02 0.22 -1.14 0.00 0.00 176.83 175.59 13pk h TYR 199 N 0.20 -0.05 -1.02 3.45 3.20 -0.96 -2.54 116.97 119.25 13pk h TYR 199 Ca 0.36 -0.00 0.30 0.00 3.14 0.00 0.00 58.73 62.52 13pk h TYR 199 Cb 0.59 0.02 -0.04 0.00 1.54 0.00 0.00 36.73 38.83 13pk h TYR 199 CO -0.31 -0.03 0.80 0.74 -1.64 0.00 0.00 178.16 177.72 13pk h PHE 200 N -0.06 0.00 0.00 -3.82 0.04 -1.25 0.27 116.94 112.12 13pk h PHE 200 Ca -0.01 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.76 13pk h PHE 200 Cb 0.04 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.19 13pk h PHE 200 CO 0.17 0.00 0.00 0.00 -0.60 0.00 0.00 178.31 177.88 13pk n ALA 201 N -2.66 0.00 0.13 2.45 0.00 0.10 -0.09 120.51 120.45 13pk n ALA 201 Ca 0.22 0.00 0.19 0.00 0.00 0.00 0.00 53.44 53.85 13pk n ALA 201 Cb 1.14 0.00 0.71 0.00 0.00 0.00 0.00 19.45 21.30 13pk n ALA 201 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 13pk h LYS 202 N 0.00 0.00 0.01 0.00 5.09 -1.39 -0.32 116.57 119.97 13pk h LYS 202 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 60.65 60.74 13pk h LYS 202 Cb 0.00 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.33 13pk h LYS 202 CO 0.00 0.00 -0.01 0.28 -2.09 0.00 0.00 179.45 177.63 13pk h VAL 203 N 0.00 1.49 -1.02 0.07 2.07 -0.55 -3.33 116.25 114.98 13pk h VAL 203 Ca 0.17 -1.95 -0.53 0.00 0.82 0.00 0.00 66.70 65.21 13pk h VAL 203 Cb 1.18 2.74 -0.20 0.00 -1.52 0.00 0.00 31.29 33.49 13pk h VAL 203 CO -0.00 0.48 0.61 0.18 0.02 0.00 0.00 177.57 178.86 13pk n LEU 204 N -4.69 6.91 0.00 2.57 4.32 0.88 -3.71 117.00 123.28 13pk n LEU 204 Ca -0.09 -4.00 0.00 0.00 -0.02 0.00 0.00 56.01 51.90 13pk n LEU 204 Cb 0.38 -1.10 0.00 0.00 -1.62 0.00 0.00 43.42 41.09 13pk n LEU 204 CO 0.30 1.52 0.00 0.61 -1.22 0.00 0.00 177.39 178.60 13pk n GLY 205 N 0.10 -0.15 2.81 -0.72 0.00 -0.95 -4.88 105.19 101.39 13pk n GLY 205 Ca 0.47 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.20 13pk n GLY 205 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 13pk s ASN 206 N -1.00 3.97 0.55 1.61 2.47 -1.26 -5.11 114.94 116.17 13pk s ASN 206 Ca 0.00 -3.07 -0.12 0.00 0.42 0.00 0.00 52.86 50.09 13pk s ASN 206 Cb 0.00 -1.33 -0.05 0.00 -1.45 0.00 0.00 41.25 38.42 13pk s ASN 206 CO 0.00 -0.21 0.96 -2.16 -3.72 0.00 0.00 177.10 171.97 13pk s PRO 207 N -0.30 3.71 -0.04 0.43 0.04 -1.24 -5.01 135.00 132.59 13pk s PRO 207 Ca 0.20 0.71 -0.30 0.00 0.04 0.00 0.00 61.00 61.65 13pk s PRO 207 Cb -0.18 -2.16 -0.06 0.00 0.04 0.00 0.00 34.50 32.14 13pk s PRO 207 CO -0.05 -0.39 1.58 -2.14 0.04 0.00 0.00 177.00 176.04 13pk s PRO 208 N -4.68 4.20 0.32 0.56 0.02 -1.26 -5.01 135.00 129.16 13pk s PRO 208 Ca 0.55 2.13 0.07 0.00 0.02 0.00 0.00 61.00 63.77 13pk s PRO 208 Cb -0.11 -3.85 -0.02 0.00 0.02 0.00 0.00 34.50 30.54 13pk s PRO 208 CO 0.44 -0.78 0.34 1.03 -0.33 0.00 0.00 177.00 177.71 13pk s ARG 209 N 3.56 2.90 0.57 5.54 0.52 -1.26 -2.78 118.95 127.99 13pk s ARG 209 Ca 0.70 -1.16 -0.21 0.00 -0.52 0.00 0.00 55.73 54.54 13pk s ARG 209 Cb -0.33 -2.61 -0.04 0.00 0.52 0.00 0.00 34.95 32.49 13pk s ARG 209 CO 0.28 0.13 1.30 -2.30 0.02 0.00 0.00 175.30 174.72 13pk n PRO 210 N -1.44 1.48 -4.00 3.54 -0.02 -1.26 -4.28 135.00 129.02 13pk n PRO 210 Ca -0.02 0.55 -0.34 0.00 -2.02 0.00 0.00 63.50 61.67 13pk n PRO 210 Cb 0.59 -2.51 -0.15 0.00 -0.02 0.00 0.00 33.50 31.41 13pk n PRO 210 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 13pk s LEU 211 N -3.41 2.70 -0.14 2.45 2.96 -1.26 -1.11 118.68 120.88 13pk s LEU 211 Ca 0.74 -0.64 -0.03 0.00 -0.22 0.00 0.00 54.13 53.98 13pk s LEU 211 Cb -0.41 -1.62 -0.03 0.00 0.50 0.00 0.00 46.19 44.63 13pk s LEU 211 CO 0.47 -0.05 -0.03 0.54 -1.32 0.00 0.00 176.35 175.97 13pk s VAL 212 N 1.36 4.02 -0.22 1.68 0.11 -0.47 -0.29 120.40 126.58 13pk s VAL 212 Ca 0.04 -0.32 -0.06 0.00 -2.93 0.00 0.00 61.98 58.71 13pk s VAL 212 Cb -0.15 -2.74 -0.02 0.00 -1.53 0.00 0.00 36.38 31.94 13pk s VAL 212 CO -0.07 0.52 0.02 0.00 -3.33 0.00 0.00 175.10 172.23 13pk s ALA 213 N 0.09 3.05 -0.29 1.54 0.00 -0.14 -1.35 121.76 124.67 13pk s ALA 213 Ca 0.00 -1.06 -0.08 0.00 0.00 0.00 0.00 51.96 50.82 13pk s ALA 213 Cb -0.13 -1.88 -0.01 0.00 0.00 0.00 0.00 23.12 21.10 13pk s ALA 213 CO 0.02 -0.31 0.10 0.42 0.00 0.00 0.00 175.76 176.00 13pk s ILE 214 N 1.29 4.27 -0.05 0.00 1.09 0.38 -0.62 121.20 127.56 13pk s ILE 214 Ca 0.04 -0.47 0.04 0.00 -1.10 0.00 0.00 60.65 59.16 13pk s ILE 214 Cb -0.15 -3.14 -0.00 0.00 -1.06 0.00 0.00 42.46 38.11 13pk s ILE 214 CO 0.02 0.14 -0.18 0.54 -0.10 0.00 0.00 174.94 175.35 13pk s VAL 215 N 1.57 1.51 0.00 2.92 0.11 -0.18 -1.03 120.40 125.30 13pk s VAL 215 Ca 0.04 -0.75 0.00 0.00 -2.93 0.00 0.00 61.98 58.34 13pk s VAL 215 Cb -0.17 -1.30 0.00 0.00 -1.53 0.00 0.00 36.38 33.38 13pk s VAL 215 CO 0.04 0.43 0.00 0.61 -3.33 0.00 0.00 175.10 172.85 13pk n GLY 216 N 3.19 4.44 7.00 6.54 0.00 0.50 -1.10 105.19 125.77 13pk n GLY 216 Ca -0.18 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.31 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 0.13 0.00 -0.02 0.00 0.03 -4.39 105.19 100.94 13pk n GLY 217 Ca 0.00 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 45.03 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 -3.29 4.61 0.00 -1.26 -0.52 120.51 126.79 13pk n ALA 218 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 53.44 53.20 13pk n ALA 218 Cb 0.00 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.47 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 -4.41 -0.11 0.00 5.02 -1.26 -4.79 118.16 112.62 13pk n LYS 219 Ca 0.00 0.68 -0.08 0.00 -2.02 0.00 0.00 58.31 56.89 13pk n LYS 219 Cb 0.00 -5.48 -0.02 0.00 -0.02 0.00 0.00 35.03 29.51 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 -1.33 0.24 -1.01 -0.18 2.07 -1.95 0.39 116.25 114.48 13pk h VAL 220 Ca -0.49 0.00 0.24 0.00 0.82 0.00 0.00 66.70 67.27 13pk h VAL 220 Cb 1.33 0.24 -0.11 0.00 -1.52 0.00 0.00 31.29 31.23 13pk h VAL 220 CO 0.56 0.00 0.63 0.77 0.02 0.00 0.00 177.57 179.55 13pk h SER 221 N -0.26 0.60 0.00 0.57 4.64 -1.99 0.69 113.55 117.79 13pk h SER 221 Ca 0.16 0.10 -0.11 0.00 -0.47 0.00 0.00 61.79 61.48 13pk h SER 221 Cb 0.54 0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.62 13pk h SER 221 CO -0.52 0.14 -0.61 0.44 -0.87 0.00 0.00 176.83 175.41 13pk h ASP 222 N 0.54 0.00 -0.77 4.97 3.32 -1.80 -3.33 116.42 119.35 13pk h ASP 222 Ca 0.60 -0.70 0.01 0.00 0.02 0.00 0.00 57.03 56.97 13pk h ASP 222 Cb 1.26 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.77 13pk h ASP 222 CO -0.37 1.20 0.51 0.50 -1.72 0.00 0.00 179.24 179.36 13pk h LYS 223 N -1.00 1.00 -0.27 3.56 3.64 -0.42 -1.92 116.57 121.16 13pk h LYS 223 Ca -0.16 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.14 13pk h LYS 223 Cb 1.09 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.67 13pk h LYS 223 CO -0.10 0.66 0.11 0.97 -2.27 0.00 0.00 179.45 178.82 13pk h ILE 224 N 1.03 1.11 0.00 2.00 2.10 0.23 0.08 117.51 124.06 13pk h ILE 224 Ca 0.29 -0.33 0.00 0.00 1.08 0.00 0.00 64.86 65.90 13pk h ILE 224 Cb -0.08 0.78 0.00 0.00 -1.09 0.00 0.00 36.82 36.43 13pk h ILE 224 CO -0.07 0.13 0.00 0.00 -1.08 0.00 0.00 178.15 177.13 13pk n GLN 225 N -4.43 0.05 0.05 2.19 6.02 -0.72 -2.40 117.38 118.15 13pk n GLN 225 Ca 0.01 0.21 0.11 0.00 -0.01 0.00 0.00 57.00 57.33 13pk n GLN 225 Cb 0.12 -1.59 0.04 0.00 1.02 0.00 0.00 30.24 29.83 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 -1.68 0.66 -0.09 1.08 4.77 0.01 -4.19 117.00 117.55 13pk n LEU 226 Ca 0.04 0.14 -0.10 0.00 -0.03 0.00 0.00 56.01 56.07 13pk n LEU 226 Cb 0.24 -0.10 -0.03 0.00 -2.33 0.00 0.00 43.42 41.21 13pk n LEU 226 CO 0.19 -0.05 0.89 -0.07 -1.33 0.00 0.00 177.39 177.03 13pk h LEU 227 N 0.00 0.39 -0.44 2.23 3.38 -1.46 -3.13 115.31 116.28 13pk h LEU 227 Ca 0.00 -0.15 0.09 0.00 0.09 0.00 0.00 57.88 57.90 13pk h LEU 227 Cb 0.83 -0.10 -0.08 0.00 0.09 0.00 0.00 40.66 41.40 13pk h LEU 227 CO 0.00 0.44 -0.09 0.44 0.09 0.00 0.00 178.44 179.31 13pk h ASP 228 N 0.32 -0.38 0.00 -0.43 3.32 -1.73 -1.19 116.42 116.33 13pk h ASP 228 Ca 0.10 0.13 0.00 0.00 0.02 0.00 0.00 57.03 57.28 13pk h ASP 228 Cb 0.16 0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.97 13pk h ASP 228 CO -0.01 -0.13 0.00 -0.46 -1.72 0.00 0.00 179.24 176.92 13pk n ASN 229 N -5.31 0.14 0.00 6.45 6.94 -1.18 -2.88 115.26 119.41 13pk n ASN 229 Ca 0.03 -1.51 0.00 0.00 -0.02 0.00 0.00 54.58 53.08 13pk n ASN 229 Cb 0.24 -0.07 0.00 0.00 -2.36 0.00 0.00 39.78 37.59 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 -0.39 -0.62 0.20 -3.83 0.00 -0.46 -3.65 117.12 108.38 13pk n MET 230 Ca 0.00 -0.37 0.04 0.00 0.00 0.00 0.00 57.70 57.37 13pk n MET 230 Cb 0.03 -0.87 0.45 0.00 0.00 0.00 0.00 33.22 32.83 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 0.03 -0.97 3.17 3.38 -1.45 -2.06 115.31 117.42 13pk h LEU 231 Ca 0.00 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 13pk h LEU 231 Cb 0.12 -0.01 -0.01 0.00 0.09 0.00 0.00 40.66 40.85 13pk h LEU 231 CO 0.00 0.26 -0.48 1.56 0.09 0.00 0.00 178.44 179.87 13pk h GLN 232 N 0.03 0.08 0.19 1.13 7.50 -1.85 -3.22 115.11 118.98 13pk h GLN 232 Ca 0.00 -0.04 -0.35 0.00 0.50 0.00 0.00 58.65 58.76 13pk h GLN 232 Cb 0.42 0.00 0.01 0.00 0.05 0.00 0.00 27.48 27.96 13pk h GLN 232 CO 0.03 0.54 -1.74 0.00 -1.50 0.00 0.00 178.83 176.17 13pk h ARG 233 N 0.07 0.40 -6.85 1.46 2.47 -1.72 -3.48 114.38 106.72 13pk h ARG 233 Ca 0.00 -0.68 -0.48 0.00 -1.26 0.00 0.00 59.98 57.56 13pk h ARG 233 Cb 0.87 0.25 0.03 0.00 -1.65 0.00 0.00 29.97 29.48 13pk h ARG 233 CO 0.07 1.32 0.03 0.96 0.56 0.00 0.00 179.97 182.91 13pk s ILE 234 N -2.58 4.55 -0.09 2.04 -4.36 -0.83 -4.86 121.20 115.05 13pk s ILE 234 Ca -0.15 -0.08 0.07 0.00 -0.26 0.00 0.00 60.65 60.22 13pk s ILE 234 Cb 0.05 -3.72 -0.11 0.00 1.25 0.00 0.00 42.46 39.94 13pk s ILE 234 CO 0.86 -0.63 0.01 0.47 0.24 0.00 0.00 174.94 175.89 13pk n ASP 235 N -2.20 2.82 -4.11 4.36 8.00 0.60 -4.65 116.55 121.36 13pk n ASP 235 Ca 0.00 -0.01 -0.18 0.00 0.71 0.00 0.00 54.79 55.31 13pk n ASP 235 Cb 0.56 0.59 -0.13 0.00 -0.02 0.00 0.00 41.12 42.12 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 -2.22 1.05 -0.30 1.24 1.51 -0.81 -0.97 117.35 116.86 13pk s TYR 236 Ca -0.06 -0.36 -0.02 0.00 -1.01 0.00 0.00 57.07 55.61 13pk s TYR 236 Cb 0.03 -0.62 0.10 0.00 -0.11 0.00 0.00 41.96 41.35 13pk s TYR 236 CO 0.35 0.01 0.11 -1.17 -1.11 0.00 0.00 175.55 173.74 13pk s LEU 237 N -1.18 1.58 -0.09 -1.29 2.96 -0.30 -0.96 118.68 119.39 13pk s LEU 237 Ca -0.01 -1.47 -0.20 0.00 -0.22 0.00 0.00 54.13 52.23 13pk s LEU 237 Cb -0.08 -0.67 -0.04 0.00 0.50 0.00 0.00 46.19 45.90 13pk s LEU 237 CO 0.01 -0.42 0.55 -0.76 -1.32 0.00 0.00 176.35 174.41 13pk s LEU 238 N 1.80 4.30 -0.15 -0.68 1.43 0.21 -0.37 118.68 125.24 13pk s LEU 238 Ca 0.09 0.96 0.02 0.00 -1.03 0.00 0.00 54.13 54.17 13pk s LEU 238 Cb -0.17 -2.83 0.01 0.00 0.03 0.00 0.00 46.19 43.24 13pk s LEU 238 CO -0.28 -0.02 -0.21 -0.63 0.23 0.00 0.00 176.35 175.44 13pk s ILE 239 N 0.58 2.01 0.00 -0.59 1.01 -0.58 -1.01 121.20 122.62 13pk s ILE 239 Ca 0.30 -0.94 0.00 0.00 0.00 0.00 0.00 60.65 60.01 13pk s ILE 239 Cb -0.16 -1.79 0.00 0.00 0.01 0.00 0.00 42.46 40.52 13pk s ILE 239 CO 0.13 0.54 0.00 0.61 0.00 0.00 0.00 174.94 176.22 13pk n GLY 240 N 4.21 5.41 7.00 6.18 0.00 -0.26 -4.01 105.19 123.73 13pk n GLY 240 Ca -0.20 -1.59 0.00 0.00 0.00 0.00 0.00 46.02 44.22 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 1.06 0.79 0.21 -0.02 0.00 -0.06 -3.22 105.19 103.95 13pk n GLY 241 Ca 0.00 -0.77 -0.02 0.00 0.00 0.00 0.00 46.02 45.23 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 -0.90 1.12 -1.00 4.61 0.00 -1.10 -3.19 119.26 118.80 13pk h ALA 242 Ca 0.00 -0.38 0.32 0.00 0.00 0.00 0.00 54.91 54.85 13pk h ALA 242 Cb 0.00 -0.10 -0.15 0.00 0.00 0.00 0.00 17.79 17.54 13pk h ALA 242 CO 0.00 0.57 0.56 1.98 0.00 0.00 0.00 179.25 182.36 13pk h MET 243 N 0.27 0.32 -0.81 0.00 1.85 -1.63 -1.69 114.93 113.22 13pk h MET 243 Ca 0.03 -0.02 0.01 0.00 -0.61 0.00 0.00 59.70 59.11 13pk h MET 243 Cb 0.76 -0.07 -0.04 0.00 0.43 0.00 0.00 31.60 32.68 13pk h MET 243 CO 0.06 0.21 0.54 0.00 -0.40 0.00 0.00 176.91 177.32 13pk h ALA 244 N 1.85 1.03 -0.89 0.39 0.00 -1.53 -3.17 119.26 116.94 13pk h ALA 244 Ca 0.73 -0.06 0.08 0.00 0.00 0.00 0.00 54.91 55.66 13pk h ALA 244 Cb 1.66 -0.33 -0.06 0.00 0.00 0.00 0.00 17.79 19.06 13pk h ALA 244 CO -0.61 0.44 0.58 1.88 0.00 0.00 0.00 179.25 181.54 13pk h TYR 245 N 1.10 0.99 -0.33 0.00 0.05 -1.52 0.64 116.97 117.90 13pk h TYR 245 Ca 0.30 0.03 -0.02 0.00 0.05 0.00 0.00 58.73 59.08 13pk h TYR 245 Cb -0.13 -0.32 -0.01 0.00 1.01 0.00 0.00 36.73 37.28 13pk h TYR 245 CO -0.02 0.49 0.11 1.15 -1.05 0.00 0.00 178.16 178.85 13pk h THR 246 N 0.95 1.20 -0.21 -2.88 2.02 -1.69 -1.18 112.91 111.13 13pk h THR 246 Ca 0.40 -0.64 -0.01 0.00 0.77 0.00 0.00 66.41 66.92 13pk h THR 246 Cb 0.29 1.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.69 13pk h THR 246 CO -0.16 0.22 0.09 -0.26 0.37 0.00 0.00 175.52 175.78 13pk h PHE 247 N 0.39 0.31 -0.75 3.16 0.04 -1.41 -1.37 116.94 117.32 13pk h PHE 247 Ca 0.11 -0.02 0.03 0.00 2.80 0.00 0.00 57.97 60.88 13pk h PHE 247 Cb 0.23 -0.09 -0.04 0.00 2.20 0.00 0.00 35.95 38.24 13pk h PHE 247 CO 0.00 0.35 0.48 -0.07 -0.60 0.00 0.00 178.31 178.47 13pk h LEU 248 N 0.19 0.80 -0.59 1.54 3.38 -0.79 -1.02 115.31 118.82 13pk h LEU 248 Ca 0.07 -0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.92 13pk h LEU 248 Cb 0.16 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 13pk h LEU 248 CO -0.01 0.56 -0.14 0.50 0.09 0.00 0.00 178.44 179.44 13pk h LYS 249 N 0.95 0.97 -0.19 1.13 3.64 -1.08 -1.37 116.57 120.62 13pk h LYS 249 Ca 0.30 -0.37 0.01 0.00 -1.27 0.00 0.00 60.65 59.32 13pk h LYS 249 Cb -0.01 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.74 13pk h LYS 249 CO -0.10 1.04 0.13 0.00 -2.27 0.00 0.00 179.45 178.25 13pk h ALA 250 N 0.97 1.92 0.00 5.00 0.00 -0.70 0.13 119.26 126.59 13pk h ALA 250 Ca 0.13 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.03 13pk h ALA 250 Cb 0.70 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.43 13pk h ALA 250 CO 0.05 0.06 0.00 1.04 0.00 0.00 0.00 179.25 180.40 13pk n GLN 251 N -4.51 0.25 0.00 0.00 6.02 -0.44 -4.90 117.38 113.81 13pk n GLN 251 Ca 0.00 0.23 0.00 0.00 -0.01 0.00 0.00 57.00 57.22 13pk n GLN 251 Cb 0.12 -1.81 0.00 0.00 1.02 0.00 0.00 30.24 29.57 13pk n GLN 251 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 13pk n GLY 252 N 1.18 1.16 3.97 1.08 0.00 0.47 -5.08 105.19 107.98 13pk n GLY 252 Ca 0.05 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.86 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 3.17 -0.09 1.61 2.02 -0.72 -5.00 117.35 116.34 13pk s TYR 253 Ca 0.00 -0.01 -0.27 0.00 -0.37 0.00 0.00 57.07 56.42 13pk s TYR 253 Cb 0.00 -2.14 -0.02 0.00 -0.40 0.00 0.00 41.96 39.39 13pk s TYR 253 CO 0.00 -0.18 0.90 -1.12 -1.57 0.00 0.00 175.55 173.58 13pk s SER 254 N -4.19 7.15 0.00 2.29 0.01 -1.26 -4.35 113.70 113.35 13pk s SER 254 Ca 0.46 1.41 0.17 0.00 1.31 0.00 0.00 55.95 59.31 13pk s SER 254 Cb -0.10 -2.51 -0.10 0.00 0.21 0.00 0.00 66.02 63.52 13pk s SER 254 CO 0.34 -0.33 0.82 -0.38 0.41 0.00 0.00 173.24 174.10 13pk n ILE 255 N 4.29 0.00 -3.53 1.44 -0.00 -1.26 0.83 119.36 121.14 13pk n ILE 255 Ca 0.05 -0.20 0.00 0.00 -0.00 0.00 0.00 62.75 62.60 13pk n ILE 255 Cb 0.50 1.10 0.00 0.00 -0.00 0.00 0.00 39.64 41.24 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 1.32 2.35 1.35 7.39 0.00 -1.19 -1.65 105.19 114.77 13pk n GLY 256 Ca 0.05 -0.36 -0.03 0.00 0.00 0.00 0.00 46.02 45.68 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 12.76 2.40 -2.19 1.61 5.02 0.37 -4.95 118.16 133.17 13pk n LYS 257 Ca 0.00 -1.51 -0.33 0.00 -2.02 0.00 0.00 58.31 54.45 13pk n LYS 257 Cb 0.00 -1.76 -0.01 0.00 -0.02 0.00 0.00 35.03 33.25 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 -0.28 6.06 0.18 4.39 0.01 -0.66 -4.67 113.70 118.74 13pk s SER 258 Ca 0.27 1.77 -0.33 0.00 1.31 0.00 0.00 55.95 58.97 13pk s SER 258 Cb 0.22 -2.53 -0.13 0.00 0.21 0.00 0.00 66.02 63.79 13pk s SER 258 CO 0.07 -0.98 1.66 1.17 0.41 0.00 0.00 173.24 175.57 13pk n LYS 259 N -1.79 2.47 -3.72 12.44 0.00 -1.26 -4.99 118.16 121.32 13pk n LYS 259 Ca 0.08 0.89 -0.13 0.00 0.00 0.00 0.00 58.31 59.15 13pk n LYS 259 Cb 0.53 -2.70 -0.09 0.00 0.00 0.00 0.00 35.03 32.76 13pk n LYS 259 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 13pk n GLU 261 N 2.61 3.48 -0.25 0.00 -0.58 -1.26 -4.85 120.64 119.79 13pk n GLU 261 Ca -0.14 -4.18 0.33 0.00 -0.42 0.00 0.00 57.16 52.74 13pk n GLU 261 Cb 0.57 -2.77 0.72 0.00 -0.57 0.00 0.00 31.44 29.39 13pk n GLU 261 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 13pk h GLU 262 N 6.83 0.00 -0.73 3.49 4.39 -1.97 0.48 114.58 127.07 13pk h GLU 262 Ca 0.24 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.94 13pk h GLU 262 Cb 0.86 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.51 13pk h GLU 262 CO 1.13 0.00 0.00 -1.13 -1.16 0.00 0.00 179.01 177.85 13pk n SER 263 N -4.00 3.06 0.00 1.42 3.41 -1.26 -3.76 113.62 112.48 13pk n SER 263 Ca 0.23 -2.38 0.00 0.00 -0.26 0.00 0.00 58.87 56.46 13pk n SER 263 Cb 1.19 -0.53 0.00 0.00 -0.26 0.00 0.00 64.21 64.61 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 0.34 0.45 -0.21 4.33 4.01 0.17 -4.88 118.16 122.36 13pk n LYS 264 Ca 0.13 -0.22 0.02 0.00 -0.51 0.00 0.00 58.31 57.74 13pk n LYS 264 Cb 0.64 -0.67 0.13 0.00 -0.51 0.00 0.00 35.03 34.62 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 -0.10 -0.75 -0.35 3.38 -1.64 0.41 115.31 116.25 13pk h LEU 265 Ca 0.00 0.14 -0.11 0.00 0.09 0.00 0.00 57.88 58.00 13pk h LEU 265 Cb 0.17 0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 13pk h LEU 265 CO 0.00 -0.05 -0.19 -0.33 0.09 0.00 0.00 178.44 177.95 13pk h GLU 266 N 0.21 0.74 -0.43 1.13 5.08 -1.89 -1.70 114.58 117.72 13pk h GLU 266 Ca 0.35 -0.28 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 13pk h GLU 266 Cb 0.56 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.74 13pk h GLU 266 CO -0.48 0.88 0.28 0.35 -1.00 0.00 0.00 179.01 179.04 13pk h PHE 267 N 0.65 0.54 -0.21 4.33 3.57 -1.21 -0.09 116.94 124.54 13pk h PHE 267 Ca 0.10 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.64 13pk h PHE 267 Cb 0.69 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 39.22 13pk h PHE 267 CO 0.03 0.35 0.03 0.00 -2.23 0.00 0.00 178.31 176.50 13pk h ALA 268 N 1.15 0.20 -0.60 2.41 0.00 -0.02 -0.19 119.26 122.20 13pk h ALA 268 Ca 0.16 0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.13 13pk h ALA 268 Cb -0.05 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 13pk h ALA 268 CO -0.03 -0.40 0.37 0.00 0.00 0.00 0.00 179.25 179.19 13pk h ARG 269 N 0.11 0.71 -0.47 0.00 3.08 -0.67 -1.27 114.38 115.87 13pk h ARG 269 Ca 0.09 -0.04 -0.10 0.00 0.07 0.00 0.00 59.98 60.00 13pk h ARG 269 Cb 0.10 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 13pk h ARG 269 CO -0.13 0.47 -0.10 1.03 -1.07 0.00 0.00 179.97 180.16 13pk h SER 270 N 0.73 0.85 -0.58 7.04 0.87 -0.67 -1.86 113.55 119.93 13pk h SER 270 Ca 0.24 -0.26 -0.05 0.00 -1.23 0.00 0.00 61.79 60.49 13pk h SER 270 Cb 0.02 -0.23 -0.03 0.00 -0.44 0.00 0.00 62.40 61.72 13pk h SER 270 CO -0.10 0.97 0.18 0.25 -0.53 0.00 0.00 176.83 177.61 13pk h LEU 271 N 0.78 0.87 -0.80 2.23 6.46 -0.44 -0.63 115.31 123.77 13pk h LEU 271 Ca 0.13 -0.15 -0.10 0.00 -0.12 0.00 0.00 57.88 57.64 13pk h LEU 271 Cb 0.61 -0.23 -0.02 0.00 -0.73 0.00 0.00 40.66 40.30 13pk h LEU 271 CO 0.04 0.82 -0.18 -0.07 -0.62 0.00 0.00 178.44 178.43 13pk h LEU 272 N 0.90 0.71 0.52 2.25 3.38 -0.83 0.16 115.31 122.40 13pk h LEU 272 Ca 0.20 -0.23 -0.03 0.00 0.09 0.00 0.00 57.88 57.91 13pk h LEU 272 Cb 0.27 -0.19 0.01 0.00 0.09 0.00 0.00 40.66 40.83 13pk h LEU 272 CO -0.01 0.89 -0.25 0.11 0.09 0.00 0.00 178.44 179.28 13pk h LYS 273 N 0.64 -0.67 -0.85 1.13 6.56 -0.53 -2.18 116.57 120.67 13pk h LYS 273 Ca 0.10 0.05 0.08 0.00 -1.06 0.00 0.00 60.65 59.81 13pk h LYS 273 Cb 0.65 0.15 -0.07 0.00 -0.57 0.00 0.00 32.23 32.40 13pk h LYS 273 CO 0.05 -0.43 0.51 0.87 -2.06 0.00 0.00 179.45 178.39 13pk h LYS 274 N -0.74 0.86 -0.34 3.15 1.57 -0.95 -0.86 116.57 119.25 13pk h LYS 274 Ca -0.07 -0.05 0.07 0.00 -1.87 0.00 0.00 60.65 58.72 13pk h LYS 274 Cb 0.55 -0.19 -0.06 0.00 0.08 0.00 0.00 32.23 32.61 13pk h LYS 274 CO 0.12 0.57 -0.05 0.00 -0.57 0.00 0.00 179.45 179.52 13pk h ALA 275 N 1.43 0.27 0.02 3.86 0.00 -0.43 0.53 119.26 124.93 13pk h ALA 275 Ca 0.39 0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.43 13pk h ALA 275 Cb 0.28 0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 13pk h ALA 275 CO -0.21 -0.44 -0.07 0.93 0.00 0.00 0.00 179.25 179.47 13pk h GLU 276 N 0.04 -0.12 -0.83 0.00 5.08 -0.61 -0.51 114.58 117.64 13pk h GLU 276 Ca 0.17 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.61 13pk h GLU 276 Cb 0.25 0.03 -0.05 0.00 0.50 0.00 0.00 28.75 29.47 13pk h GLU 276 CO -0.32 -0.08 0.54 -0.44 -1.00 0.00 0.00 179.01 177.71 13pk h ASP 277 N -0.12 0.78 -0.22 1.42 3.32 -0.32 -1.38 116.42 119.90 13pk h ASP 277 Ca 0.02 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.08 13pk h ASP 277 Cb 0.15 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.54 13pk h ASP 277 CO -0.06 0.49 0.00 0.54 -1.72 0.00 0.00 179.24 178.49 13pk n ARG 278 N -4.49 1.53 -3.38 3.56 5.12 0.18 -4.91 116.66 114.27 13pk n ARG 278 Ca 0.13 -0.82 -0.16 0.00 -1.93 0.00 0.00 57.85 55.06 13pk n ARG 278 Cb 0.24 -1.21 0.09 0.00 -1.16 0.00 0.00 32.46 30.42 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 0.15 -6.15 -4.12 5.56 5.02 -0.52 -4.81 118.16 113.29 13pk n LYS 279 Ca 0.09 0.83 -0.32 0.00 -2.02 0.00 0.00 58.31 56.88 13pk n LYS 279 Cb 0.20 -5.77 -0.16 0.00 -0.02 0.00 0.00 35.03 29.28 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 -3.35 1.96 -0.66 -0.18 1.01 -0.26 -4.71 120.40 114.21 13pk s VAL 280 Ca 0.03 -0.88 -0.24 0.00 0.00 0.00 0.00 61.98 60.89 13pk s VAL 280 Cb -0.00 -1.78 0.05 0.00 0.00 0.00 0.00 36.38 34.65 13pk s VAL 280 CO 0.71 0.52 1.07 -1.58 0.00 0.00 0.00 175.10 175.82 13pk s GLN 281 N 1.31 3.20 0.06 2.72 0.74 -0.15 -4.18 119.66 123.36 13pk s GLN 281 Ca 0.05 -0.49 -0.23 0.00 0.05 0.00 0.00 55.36 54.74 13pk s GLN 281 Cb -0.13 -4.17 -0.06 0.00 1.10 0.00 0.00 33.01 29.75 13pk s GLN 281 CO -0.12 -1.84 0.70 0.08 -0.55 0.00 0.00 175.29 173.56 13pk s VAL 282 N 4.59 4.71 -0.04 1.34 1.01 -1.26 -1.15 120.40 129.58 13pk s VAL 282 Ca 0.29 1.50 0.03 0.00 0.00 0.00 0.00 61.98 63.80 13pk s VAL 282 Cb -0.13 -4.05 0.00 0.00 0.00 0.00 0.00 36.38 32.20 13pk s VAL 282 CO 0.14 0.43 -0.13 -0.63 0.00 0.00 0.00 175.10 174.91 13pk s ILE 283 N -0.41 1.13 0.43 2.22 1.01 0.51 -4.92 121.20 121.17 13pk s ILE 283 Ca 0.35 -0.53 0.06 0.00 0.00 0.00 0.00 60.65 60.53 13pk s ILE 283 Cb -0.20 -1.00 -0.05 0.00 0.01 0.00 0.00 42.46 41.22 13pk s ILE 283 CO 0.22 0.34 0.08 -0.76 0.00 0.00 0.00 174.94 174.82 13pk s LEU 284 N 0.26 2.84 0.32 2.97 1.43 -1.26 -1.53 118.68 123.72 13pk s LEU 284 Ca -0.06 -1.33 -0.29 0.00 -1.03 0.00 0.00 54.13 51.42 13pk s LEU 284 Cb -0.12 -1.05 -0.12 0.00 0.03 0.00 0.00 46.19 44.93 13pk s LEU 284 CO 0.02 -0.58 1.38 -2.65 0.23 0.00 0.00 176.35 174.75 13pk n PRO 285 N -1.14 2.26 -0.04 1.29 -0.02 -1.26 -4.91 135.00 131.19 13pk n PRO 285 Ca -0.06 0.80 -0.20 0.00 -2.02 0.00 0.00 63.50 62.02 13pk n PRO 285 Cb 0.66 -2.44 -0.13 0.00 -0.02 0.00 0.00 33.50 31.56 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 0.91 1.69 -4.23 4.25 5.41 -1.26 -4.75 119.36 121.38 13pk n ILE 286 Ca 0.06 -0.64 -0.13 0.00 1.00 0.00 0.00 62.75 63.04 13pk n ILE 286 Cb 0.36 -1.60 -0.10 0.00 -0.71 0.00 0.00 39.64 37.59 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 -6.83 0.47 0.17 4.38 -4.77 -1.26 -2.69 116.67 106.15 13pk s ASP 287 Ca -0.25 -1.42 -0.00 0.00 -3.30 0.00 0.00 52.55 47.57 13pk s ASP 287 Cb 0.07 0.36 -0.04 0.00 -1.09 0.00 0.00 42.92 42.22 13pk s ASP 287 CO 0.72 -0.84 0.07 -1.00 0.70 0.00 0.00 175.17 174.82 13pk s HIS 288 N -4.03 1.09 -0.18 2.11 3.76 -1.26 -1.74 115.29 115.04 13pk s HIS 288 Ca 0.39 -1.22 -0.02 0.00 -0.15 0.00 0.00 55.06 54.06 13pk s HIS 288 Cb 0.07 -0.60 -0.00 0.00 1.11 0.00 0.00 32.58 33.16 13pk s HIS 288 CO 0.13 -0.46 -0.10 0.08 -0.85 0.00 0.00 174.74 173.54 13pk s VAL 289 N -3.96 2.99 0.32 -0.90 1.01 -0.21 -1.59 120.40 118.06 13pk s VAL 289 Ca 0.29 -0.64 0.03 0.00 0.00 0.00 0.00 61.98 61.66 13pk s VAL 289 Cb 0.07 -2.31 -0.04 0.00 0.00 0.00 0.00 36.38 34.10 13pk s VAL 289 CO 0.06 0.48 0.12 0.00 0.00 0.00 0.00 175.10 175.76 13pk s HIS 291 N -3.49 -0.48 -0.20 0.00 2.46 -0.73 -0.89 115.29 111.96 13pk s HIS 291 Ca 0.34 0.40 0.29 0.00 0.47 0.00 0.00 55.06 56.56 13pk s HIS 291 Cb 0.06 0.53 1.10 0.00 -0.13 0.00 0.00 32.58 34.14 13pk s HIS 291 CO 0.15 -0.69 1.85 1.79 -2.47 0.00 0.00 174.74 175.38 13pk h THR 292 N 2.15 0.00 -3.55 0.89 1.35 -1.87 0.00 112.91 111.88 13pk h THR 292 Ca -0.28 -0.48 -0.09 0.00 -0.55 0.00 0.00 66.41 65.01 13pk h THR 292 Cb 1.26 1.39 -0.15 0.00 -1.73 0.00 0.00 68.15 68.92 13pk h THR 292 CO 0.35 0.00 -0.30 -1.83 -0.25 0.00 0.00 175.52 173.49 13pk s GLU 293 N -3.47 0.83 -0.99 4.72 -1.05 -1.26 -4.81 118.70 112.67 13pk s GLU 293 Ca 0.03 -0.72 -0.14 0.00 -0.15 0.00 0.00 54.97 53.99 13pk s GLU 293 Cb 0.09 0.35 -0.09 0.00 -0.44 0.00 0.00 34.13 34.04 13pk s GLU 293 CO 0.51 -0.27 2.12 0.34 0.95 0.00 0.00 175.26 178.91 13pk n PHE 294 N 0.26 2.00 -3.85 4.83 -0.00 -1.26 -4.76 117.46 114.68 13pk n PHE 294 Ca -0.17 -2.14 -0.12 0.00 -0.00 0.00 0.00 57.45 55.02 13pk n PHE 294 Cb 0.61 -1.89 -0.12 0.00 -0.00 0.00 0.00 39.48 38.08 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 3.98 0.22 0.51 -4.13 1.02 -1.26 -5.14 119.74 114.93 13pk s LYS 295 Ca 0.51 0.01 -0.20 0.00 0.02 0.00 0.00 55.97 56.30 13pk s LYS 295 Cb 0.13 0.10 -0.07 0.00 -0.52 0.00 0.00 37.83 37.47 13pk s LYS 295 CO 0.02 -0.04 1.12 0.00 -0.92 0.00 0.00 175.35 175.53 13pk s ALA 296 N -0.31 2.80 -0.23 5.17 0.00 -1.26 -4.99 121.76 122.93 13pk s ALA 296 Ca -0.04 0.81 -0.13 0.00 0.00 0.00 0.00 51.96 52.60 13pk s ALA 296 Cb -0.03 -3.34 0.07 0.00 0.00 0.00 0.00 23.12 19.82 13pk s ALA 296 CO 0.00 -0.65 0.57 0.54 0.00 0.00 0.00 175.76 176.23 13pk s VAL 297 N -1.75 -0.01 0.25 0.00 0.11 -1.26 -5.09 120.40 112.65 13pk s VAL 297 Ca 0.69 0.04 -0.31 0.00 -2.93 0.00 0.00 61.98 59.48 13pk s VAL 297 Cb -0.24 -0.84 -0.11 0.00 -1.53 0.00 0.00 36.38 33.67 13pk s VAL 297 CO 0.27 0.02 1.59 -1.81 -3.33 0.00 0.00 175.10 171.84 13pk s ASP 298 N 1.52 6.45 -0.75 3.54 1.11 -1.26 -3.46 116.67 123.82 13pk s ASP 298 Ca -0.10 2.84 -0.00 0.00 0.18 0.00 0.00 52.55 55.48 13pk s ASP 298 Cb -0.06 -2.62 -0.00 0.00 1.07 0.00 0.00 42.92 41.30 13pk s ASP 298 CO -0.17 -0.88 0.70 -1.20 1.18 0.00 0.00 175.17 174.81 13pk n SER 299 N 2.77 -7.70 -3.98 0.27 7.64 -1.26 -5.02 113.62 106.34 13pk n SER 299 Ca 0.10 -0.11 -0.25 0.00 1.01 0.00 0.00 58.87 59.62 13pk n SER 299 Cb 0.38 -5.21 0.16 0.00 -1.01 0.00 0.00 64.21 58.52 13pk n SER 299 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 13pk n PRO 300 N -1.83 -0.78 -2.44 1.43 -0.04 -1.22 -5.01 135.00 125.11 13pk n PRO 300 Ca -0.01 -2.13 -0.42 0.00 -0.04 0.00 0.00 63.50 60.90 13pk n PRO 300 Cb 0.51 -1.03 -0.03 0.00 -0.04 0.00 0.00 33.50 32.92 13pk n PRO 300 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 13pk s LEU 301 N 0.00 4.30 -0.27 1.53 2.96 -0.07 -4.83 118.68 122.30 13pk s LEU 301 Ca 0.67 1.86 -0.02 0.00 -0.22 0.00 0.00 54.13 56.42 13pk s LEU 301 Cb -0.02 -3.56 0.03 0.00 0.50 0.00 0.00 46.19 43.14 13pk s LEU 301 CO 0.46 -0.57 -0.03 -0.51 -1.32 0.00 0.00 176.35 174.38 13pk s ILE 302 N 2.02 3.02 0.94 6.68 1.10 -1.26 0.13 121.20 133.83 13pk s ILE 302 Ca 0.57 -1.10 -0.12 0.00 -0.51 0.00 0.00 60.65 59.49 13pk s ILE 302 Cb -0.26 -2.60 0.15 0.00 0.15 0.00 0.00 42.46 39.91 13pk s ILE 302 CO 0.23 0.09 1.11 0.42 -2.11 0.00 0.00 174.94 174.69 13pk s THR 303 N 1.32 2.20 -0.13 4.00 -4.23 -0.62 -4.95 115.64 113.23 13pk s THR 303 Ca -0.01 0.07 0.11 0.00 -1.18 0.00 0.00 61.69 60.68 13pk s THR 303 Cb -0.18 -2.67 -0.16 0.00 1.34 0.00 0.00 72.50 70.83 13pk s THR 303 CO -0.03 -0.09 0.04 -0.62 -0.54 0.00 0.00 174.62 173.38 13pk n GLU 304 N -3.94 1.78 -2.78 3.99 -0.58 -1.26 -4.29 120.64 113.56 13pk n GLU 304 Ca 0.06 -0.00 -0.17 0.00 -0.42 0.00 0.00 57.16 56.63 13pk n GLU 304 Cb 0.58 -1.34 0.05 0.00 -0.57 0.00 0.00 31.44 30.16 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 -2.51 1.88 0.05 1.62 8.00 -1.26 -4.66 116.55 119.67 13pk n ASP 305 Ca -0.22 -2.35 0.13 0.00 0.71 0.00 0.00 54.79 53.06 13pk n ASP 305 Cb 0.92 -0.33 0.34 0.00 -0.02 0.00 0.00 41.12 42.03 13pk n ASP 305 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 13pk n GLN 306 N -2.03 0.19 -2.65 -1.24 3.00 -1.09 -4.06 117.38 109.49 13pk n GLN 306 Ca 0.12 0.10 -0.41 0.00 -0.01 0.00 0.00 57.00 56.81 13pk n GLN 306 Cb 0.52 -1.66 -0.05 0.00 0.00 0.00 0.00 30.24 29.04 13pk n GLN 306 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.06 176.26 13pk s ASN 307 N -3.92 7.47 -0.12 1.08 0.01 -1.26 -4.66 114.94 113.54 13pk s ASN 307 Ca 0.10 2.00 0.01 0.00 -0.71 0.00 0.00 52.86 54.25 13pk s ASN 307 Cb 0.15 -2.61 -0.01 0.00 0.41 0.00 0.00 41.25 39.19 13pk s ASN 307 CO 0.64 -0.03 -0.15 -0.63 -1.51 0.00 0.00 177.10 175.43 13pk s ILE 308 N -0.70 2.87 0.30 0.60 1.01 0.24 -4.83 121.20 120.69 13pk s ILE 308 Ca 0.45 -0.73 -0.30 0.00 0.00 0.00 0.00 60.65 60.08 13pk s ILE 308 Cb -0.27 -2.19 -0.13 0.00 0.01 0.00 0.00 42.46 39.88 13pk s ILE 308 CO 0.34 0.53 1.39 -2.65 0.00 0.00 0.00 174.94 174.55 13pk n PRO 309 N 3.51 2.21 -0.33 2.79 -0.02 -1.26 -3.18 135.00 138.73 13pk n PRO 309 Ca -0.18 0.78 0.25 0.00 -2.02 0.00 0.00 63.50 62.33 13pk n PRO 309 Cb 0.53 -2.43 0.48 0.00 -0.02 0.00 0.00 33.50 32.05 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 3.57 0.10 -0.01 -0.52 3.07 -1.94 0.21 114.58 119.06 13pk h GLU 310 Ca -0.46 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.39 13pk h GLU 310 Cb 1.27 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 29.16 13pk h GLU 310 CO 0.70 0.07 -0.06 0.41 -1.40 0.00 0.00 179.01 178.74 13pk n GLY 311 N -1.32 -0.70 3.79 -3.84 0.00 -1.26 -3.59 105.19 98.28 13pk n GLY 311 Ca 0.32 -0.30 -0.22 0.00 0.00 0.00 0.00 46.02 45.82 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 -2.22 2.85 -0.05 1.61 3.76 0.72 -4.36 115.29 117.60 13pk s HIS 312 Ca 0.36 -0.29 0.01 0.00 -0.15 0.00 0.00 55.06 54.99 13pk s HIS 312 Cb 0.21 -1.64 0.02 0.00 1.11 0.00 0.00 32.58 32.27 13pk s HIS 312 CO 0.41 0.32 -0.08 0.00 -0.85 0.00 0.00 174.74 174.54 13pk s MET 313 N -3.90 1.19 -0.03 1.40 0.23 -0.01 0.14 119.30 118.31 13pk s MET 313 Ca 0.38 -0.23 -0.30 0.00 -1.03 0.00 0.00 55.69 54.51 13pk s MET 313 Cb -0.05 -1.08 -0.04 0.00 -1.53 0.00 0.00 34.83 32.14 13pk s MET 313 CO 0.25 -0.04 1.17 0.00 -2.03 0.00 0.00 175.02 174.36 13pk s ALA 314 N 0.84 3.44 -0.95 3.16 0.00 -1.26 -1.77 121.76 125.22 13pk s ALA 314 Ca -0.12 0.64 0.09 0.00 0.00 0.00 0.00 51.96 52.57 13pk s ALA 314 Cb -0.15 -3.48 0.02 0.00 0.00 0.00 0.00 23.12 19.51 13pk s ALA 314 CO 0.01 -0.64 0.67 1.28 0.00 0.00 0.00 175.76 177.07 13pk n LEU 315 N 4.83 1.37 -3.51 0.00 4.77 0.15 -4.82 117.00 119.78 13pk n LEU 315 Ca 0.10 -0.85 -0.08 0.00 -0.03 0.00 0.00 56.01 55.15 13pk n LEU 315 Cb 0.47 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.54 13pk n LEU 315 CO 0.55 0.27 0.71 -0.62 -1.33 0.00 0.00 177.39 176.97 13pk s ASP 316 N -1.10 -0.35 0.50 -1.43 2.15 -1.12 -0.67 116.67 114.65 13pk s ASP 316 Ca 0.09 -0.01 -0.20 0.00 0.43 0.00 0.00 52.55 52.86 13pk s ASP 316 Cb 0.07 0.37 -0.08 0.00 -0.30 0.00 0.00 42.92 42.99 13pk s ASP 316 CO 0.19 -0.60 1.06 0.27 -0.17 0.00 0.00 175.17 175.91 13pk s ILE 317 N -3.09 3.66 0.79 4.11 -4.36 -1.24 -1.05 121.20 120.02 13pk s ILE 317 Ca 0.05 1.02 -0.09 0.00 -0.26 0.00 0.00 60.65 61.38 13pk s ILE 317 Cb -0.01 -3.41 0.11 0.00 1.25 0.00 0.00 42.46 40.40 13pk s ILE 317 CO -0.09 -0.23 1.12 -0.83 0.24 0.00 0.00 174.94 175.15 13pk s GLY 318 N -1.97 1.72 0.22 6.27 0.00 -0.71 -4.37 107.32 108.48 13pk s GLY 318 Ca 0.68 -1.12 -0.08 0.00 0.00 0.00 0.00 44.72 44.20 13pk s GLY 318 CO 0.22 -0.58 1.76 -0.56 0.00 0.00 0.00 173.10 173.95 13pk h PRO 319 N -0.93 0.49 -0.29 2.90 0.13 -1.90 -0.30 132.00 132.11 13pk h PRO 319 Ca -0.43 -0.03 -0.06 0.00 -0.87 0.00 0.00 66.00 64.61 13pk h PRO 319 Cb 1.29 -0.11 -0.02 0.00 0.13 0.00 0.00 31.00 32.29 13pk h PRO 319 CO 0.51 0.32 -0.09 0.87 -0.23 0.00 0.00 178.00 179.38 13pk h LYS 320 N 0.51 0.47 -0.27 0.86 1.57 -1.94 -0.60 116.57 117.16 13pk h LYS 320 Ca 0.33 -0.12 -0.12 0.00 -1.87 0.00 0.00 60.65 58.87 13pk h LYS 320 Cb 0.38 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.63 13pk h LYS 320 CO -0.29 0.57 -0.31 1.15 -0.57 0.00 0.00 179.45 180.00 13pk h THR 321 N 0.44 1.31 -0.86 -0.16 2.02 -1.54 -2.04 112.91 112.08 13pk h THR 321 Ca 0.09 -1.49 0.03 0.00 0.77 0.00 0.00 66.41 65.80 13pk h THR 321 Cb 0.43 1.64 -0.05 0.00 -1.74 0.00 0.00 68.15 68.43 13pk h THR 321 CO 0.02 0.47 0.56 0.40 0.37 0.00 0.00 175.52 177.34 13pk h ILE 322 N 0.41 1.16 -0.17 3.11 2.04 -0.67 -0.06 117.51 123.35 13pk h ILE 322 Ca 0.04 -0.38 -0.00 0.00 1.00 0.00 0.00 64.86 65.52 13pk h ILE 322 Cb 0.88 -0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.92 13pk h ILE 322 CO 0.07 0.20 0.09 -0.33 0.00 0.00 0.00 178.15 178.18 13pk h GLU 323 N 1.10 0.23 -0.02 2.37 5.08 -0.92 0.79 114.58 123.23 13pk h GLU 323 Ca 0.33 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.66 13pk h GLU 323 Cb -0.04 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.17 13pk h GLU 323 CO -0.10 0.25 0.01 -0.22 -1.00 0.00 0.00 179.01 177.94 13pk h LYS 324 N 0.16 0.02 -0.35 2.33 1.63 -0.93 -0.00 116.57 119.43 13pk h LYS 324 Ca 0.06 -0.00 0.02 0.00 -0.85 0.00 0.00 60.65 59.88 13pk h LYS 324 Cb 0.09 -0.00 -0.03 0.00 -0.60 0.00 0.00 32.23 31.68 13pk h LYS 324 CO -0.01 0.16 0.17 1.88 -3.45 0.00 0.00 179.45 178.20 13pk h TYR 325 N -0.12 0.32 -0.65 1.91 -1.99 -0.92 0.31 116.97 115.84 13pk h TYR 325 Ca 0.01 0.01 -0.02 0.00 2.00 0.00 0.00 58.73 60.73 13pk h TYR 325 Cb 0.14 -0.09 -0.03 0.00 2.00 0.00 0.00 36.73 38.75 13pk h TYR 325 CO -0.03 0.17 0.32 0.28 -0.00 0.00 0.00 178.16 178.90 13pk h VAL 326 N 0.36 1.22 0.14 -2.88 2.07 -0.79 -1.07 116.25 115.30 13pk h VAL 326 Ca 0.15 -0.60 -0.01 0.00 0.82 0.00 0.00 66.70 67.06 13pk h VAL 326 Cb 0.06 0.42 0.00 0.00 -1.52 0.00 0.00 31.29 30.25 13pk h VAL 326 CO -0.10 0.25 -0.07 -0.61 0.02 0.00 0.00 177.57 177.06 13pk h GLN 327 N 0.89 -0.19 -0.53 1.57 4.15 -0.22 -1.74 115.11 119.05 13pk h GLN 327 Ca 0.22 0.01 -0.05 0.00 0.77 0.00 0.00 58.65 59.61 13pk h GLN 327 Cb 0.10 0.04 -0.02 0.00 0.21 0.00 0.00 27.48 27.81 13pk h GLN 327 CO -0.03 -0.09 0.14 0.00 -1.93 0.00 0.00 178.83 176.91 13pk h THR 328 N -0.23 1.22 -0.12 2.39 1.03 -0.30 -1.15 112.91 115.75 13pk h THR 328 Ca -0.02 -0.78 -0.01 0.00 -0.01 0.00 0.00 66.41 65.59 13pk h THR 328 Cb 0.18 0.67 -0.01 0.00 -1.07 0.00 0.00 68.15 67.92 13pk h THR 328 CO 0.03 0.29 0.01 0.40 -0.01 0.00 0.00 175.52 176.24 13pk h ILE 329 N 0.78 1.08 0.00 0.00 2.04 -0.94 0.31 117.51 120.78 13pk h ILE 329 Ca 0.17 -0.29 -0.03 0.00 1.00 0.00 0.00 64.86 65.72 13pk h ILE 329 Cb 0.27 0.98 -0.00 0.00 -0.74 0.00 0.00 36.82 37.33 13pk h ILE 329 CO -0.00 0.10 -0.13 1.23 0.00 0.00 0.00 178.15 179.35 13pk h GLY 330 N 0.35 0.00 0.92 5.37 0.00 -0.30 -2.57 103.07 106.84 13pk h GLY 330 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.37 13pk h GLY 330 CO 0.00 0.00 -0.07 0.28 0.00 0.00 0.00 176.54 176.75 13pk n LYS 331 N -3.36 0.75 -3.50 4.80 5.02 0.11 -4.92 118.16 117.05 13pk n LYS 331 Ca -0.00 -0.22 -0.20 0.00 -2.02 0.00 0.00 58.31 55.87 13pk n LYS 331 Cb 0.33 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 33.82 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 -1.58 5.62 -3.84 0.00 5.02 -0.26 -4.87 118.16 118.24 13pk n LYS 333 Ca 0.03 -0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.20 13pk n LYS 333 Cb 0.61 -0.67 -0.14 0.00 -0.02 0.00 0.00 35.03 34.81 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 -1.36 -0.06 -0.05 4.39 0.01 -0.95 -1.34 113.70 114.34 13pk s SER 334 Ca 0.01 0.13 -0.02 0.00 1.31 0.00 0.00 55.95 57.38 13pk s SER 334 Cb 0.02 0.12 0.04 0.00 0.21 0.00 0.00 66.02 66.41 13pk s SER 334 CO 0.13 -0.03 0.10 0.00 0.41 0.00 0.00 173.24 173.85 13pk s ALA 335 N 0.11 -0.09 -0.16 1.44 0.00 -0.30 -1.36 121.76 121.40 13pk s ALA 335 Ca -0.01 0.50 0.01 0.00 0.00 0.00 0.00 51.96 52.46 13pk s ALA 335 Cb -0.01 -0.44 0.02 0.00 0.00 0.00 0.00 23.12 22.69 13pk s ALA 335 CO -0.00 -0.21 -0.16 0.42 0.00 0.00 0.00 175.76 175.80 13pk s ILE 336 N 1.35 1.71 -0.07 0.00 1.01 -0.45 -0.64 121.20 124.12 13pk s ILE 336 Ca -0.07 -0.72 0.05 0.00 0.00 0.00 0.00 60.65 59.91 13pk s ILE 336 Cb -0.12 -1.59 -0.01 0.00 0.01 0.00 0.00 42.46 40.76 13pk s ILE 336 CO -0.05 0.48 -0.24 0.86 0.00 0.00 0.00 174.94 176.00 13pk s TRP 337 N 1.42 2.41 -0.12 3.97 -0.00 -0.07 -0.47 118.94 126.08 13pk s TRP 337 Ca 0.05 -0.81 -0.04 0.00 -0.00 0.00 0.00 56.10 55.30 13pk s TRP 337 Cb -0.13 -1.60 0.06 0.00 -0.00 0.00 0.00 33.47 31.81 13pk s TRP 337 CO -0.11 -0.28 0.19 1.21 -0.00 0.00 0.00 176.95 177.96 13pk s ASN 338 N 0.03 0.86 0.00 5.86 3.04 -0.19 -1.50 114.94 123.03 13pk s ASN 338 Ca -0.09 0.24 0.00 0.00 0.04 0.00 0.00 52.86 53.05 13pk s ASN 338 Cb -0.15 0.38 0.00 0.00 -1.54 0.00 0.00 41.25 39.94 13pk s ASN 338 CO 0.05 -0.27 0.00 0.61 -3.04 0.00 0.00 177.10 174.46 13pk n GLY 339 N 5.33 1.93 3.74 1.21 0.00 -1.26 -0.37 105.19 115.77 13pk n GLY 339 Ca -0.05 -1.29 -0.38 0.00 0.00 0.00 0.00 46.02 44.30 13pk n GLY 339 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 13pk s PRO 340 N -4.36 2.97 0.20 1.61 0.02 -1.26 -3.72 135.00 130.46 13pk s PRO 340 Ca 0.00 2.22 0.25 0.00 0.02 0.00 0.00 61.00 63.48 13pk s PRO 340 Cb 0.00 -2.15 0.90 0.00 0.02 0.00 0.00 34.50 33.27 13pk s PRO 340 CO 0.00 -1.32 1.74 -1.33 -0.33 0.00 0.00 177.00 175.77 13pk n MET 341 N -1.26 0.19 -1.11 5.54 2.81 -1.26 -0.79 117.12 121.25 13pk n MET 341 Ca 0.12 0.29 -0.00 0.00 -1.81 0.00 0.00 57.70 56.29 13pk n MET 341 Cb 0.46 -1.79 0.00 0.00 -0.71 0.00 0.00 33.22 31.18 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 0.69 1.88 2.87 3.03 0.00 -1.26 -0.88 105.19 111.51 13pk n GLY 342 Ca 0.04 -1.00 -0.42 0.00 0.00 0.00 0.00 46.02 44.64 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 3.57 0.28 1.61 0.31 0.15 -4.74 118.33 119.50 13pk n VAL 343 Ca -0.00 -3.24 0.14 0.00 -0.01 0.00 0.00 64.34 61.23 13pk n VAL 343 Cb 0.01 -2.56 0.77 0.00 -0.91 0.00 0.00 33.84 31.15 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 6.24 0.00 0.00 3.52 -0.00 -1.86 -0.42 116.94 124.42 13pk h PHE 344 Ca 0.54 0.00 -0.02 0.00 -0.00 0.00 0.00 57.97 58.49 13pk h PHE 344 Cb 0.68 0.00 -0.00 0.00 -0.00 0.00 0.00 35.95 36.62 13pk h PHE 344 CO 1.44 0.00 -0.09 0.93 -0.00 0.00 0.00 178.31 180.59 13pk h GLU 345 N 0.00 0.00 -5.17 6.09 3.07 -1.87 -3.40 114.58 113.29 13pk h GLU 345 Ca 0.00 0.00 -0.63 0.00 -0.50 0.00 0.00 59.36 58.23 13pk h GLU 345 Cb 0.45 0.00 -0.20 0.00 -0.84 0.00 0.00 28.75 28.16 13pk h GLU 345 CO 0.00 0.09 -0.62 -1.64 -1.40 0.00 0.00 179.01 175.44 13pk s MET 346 N -4.21 3.76 0.23 2.33 -1.94 -0.17 -5.03 119.30 114.28 13pk s MET 346 Ca -0.03 -0.45 -0.14 0.00 -1.71 0.00 0.00 55.69 53.36 13pk s MET 346 Cb 0.13 -3.15 0.27 0.00 2.01 0.00 0.00 34.83 34.09 13pk s MET 346 CO 0.57 0.10 1.59 0.28 -0.01 0.00 0.00 175.02 177.54 13pk h VAL 347 N 5.20 0.16 0.00 -6.03 2.07 -1.85 0.04 116.25 115.84 13pk h VAL 347 Ca -0.36 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.16 13pk h VAL 347 Cb 1.18 0.16 -0.00 0.00 -1.52 0.00 0.00 31.29 31.10 13pk h VAL 347 CO 0.64 0.00 -0.00 1.55 0.02 0.00 0.00 177.57 179.77 13pk h PRO 348 N -0.04 0.00 -0.32 1.57 0.13 -1.92 -2.45 132.00 128.97 13pk h PRO 348 Ca 0.34 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.41 13pk h PRO 348 Cb 0.58 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.67 13pk h PRO 348 CO -0.82 0.00 0.01 0.66 -0.23 0.00 0.00 178.00 177.62 13pk n TYR 349 N -3.10 1.10 0.36 1.56 4.01 -0.03 -4.54 117.16 116.52 13pk n TYR 349 Ca -0.02 -1.08 0.09 0.00 -0.16 0.00 0.00 57.90 56.72 13pk n TYR 349 Cb 0.15 -0.39 -0.12 0.00 -0.31 0.00 0.00 39.34 38.67 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 -0.66 0.88 -0.23 7.72 3.41 -0.92 -3.16 113.62 120.67 13pk n SER 350 Ca 0.26 -0.41 0.04 0.00 -0.26 0.00 0.00 58.87 58.50 13pk n SER 350 Cb 0.97 1.45 0.15 0.00 -0.26 0.00 0.00 64.21 66.51 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 0.19 -0.37 4.33 1.57 -1.80 -2.26 116.57 118.23 13pk h LYS 351 Ca 0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 13pk h LYS 351 Cb 0.63 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.88 13pk h LYS 351 CO 0.00 0.13 0.24 0.78 -0.57 0.00 0.00 179.45 180.03 13pk h GLY 352 N 0.20 0.53 0.94 3.86 0.00 -1.82 -0.77 103.07 106.01 13pk h GLY 352 Ca 0.38 -0.21 -0.02 0.00 0.00 0.00 0.00 47.33 47.48 13pk h GLY 352 CO -0.52 0.20 0.15 -0.84 0.00 0.00 0.00 176.54 175.53 13pk h THR 353 N 0.50 1.19 0.00 4.70 2.02 -1.73 -1.89 112.91 117.69 13pk h THR 353 Ca 0.14 -0.58 -0.09 0.00 0.77 0.00 0.00 66.41 66.64 13pk h THR 353 Cb -0.03 0.87 -0.01 0.00 -1.74 0.00 0.00 68.15 67.23 13pk h THR 353 CO -0.03 0.21 -0.45 -0.26 0.37 0.00 0.00 175.52 175.36 13pk h PHE 354 N 0.47 0.00 -0.19 3.16 0.04 -1.37 -1.67 116.94 117.39 13pk h PHE 354 Ca 0.13 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.87 13pk h PHE 354 Cb 0.18 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.33 13pk h PHE 354 CO -0.00 0.45 0.02 0.00 -0.60 0.00 0.00 178.31 178.17 13pk h ALA 355 N 1.55 0.25 -0.52 2.45 0.00 -0.70 0.25 119.26 122.54 13pk h ALA 355 Ca -0.00 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 13pk h ALA 355 Cb 0.83 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 13pk h ALA 355 CO 0.06 -0.06 0.19 0.82 0.00 0.00 0.00 179.25 180.26 13pk h ILE 356 N 0.09 1.22 -0.25 0.00 1.08 -1.25 -1.26 117.51 117.14 13pk h ILE 356 Ca 0.05 -0.71 0.03 0.00 -0.39 0.00 0.00 64.86 63.84 13pk h ILE 356 Cb 0.35 0.71 -0.03 0.00 -3.07 0.00 0.00 36.82 34.78 13pk h ILE 356 CO 0.01 0.27 0.07 0.00 -0.69 0.00 0.00 178.15 177.81 13pk h ALA 357 N 1.04 0.27 -0.68 1.87 0.00 -0.91 -0.99 119.26 119.87 13pk h ALA 357 Ca 0.17 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.13 13pk h ALA 357 Cb 0.23 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.00 13pk h ALA 357 CO -0.01 -0.34 0.44 -0.22 0.00 0.00 0.00 179.25 179.12 13pk h LYS 358 N 0.18 0.85 -0.53 0.00 3.64 -0.25 -0.94 116.57 119.51 13pk h LYS 358 Ca 0.11 -0.05 -0.11 0.00 -1.27 0.00 0.00 60.65 59.33 13pk h LYS 358 Cb 0.09 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 31.70 13pk h LYS 358 CO -0.12 0.56 -0.09 0.00 -2.27 0.00 0.00 179.45 177.53 13pk h ALA 359 N 1.27 0.73 -0.31 5.00 0.00 -0.87 0.11 119.26 125.19 13pk h ALA 359 Ca 0.26 -0.34 -0.10 0.00 0.00 0.00 0.00 54.91 54.73 13pk h ALA 359 Cb -0.04 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.54 13pk h ALA 359 CO -0.08 0.63 -0.21 0.52 0.00 0.00 0.00 179.25 180.11 13pk h MET 360 N 0.87 0.59 0.21 0.00 2.86 -0.85 0.68 114.93 119.29 13pk h MET 360 Ca 0.14 -0.21 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 13pk h MET 360 Cb 0.65 -0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.27 13pk h MET 360 CO 0.04 0.76 -0.10 0.78 1.06 0.00 0.00 176.91 179.45 13pk h GLY 361 N 0.99 -0.29 0.02 8.32 0.00 -0.97 -2.67 103.07 108.47 13pk h GLY 361 Ca 0.08 0.11 0.14 0.00 0.00 0.00 0.00 47.33 47.66 13pk h GLY 361 CO 0.05 -0.11 0.14 -0.09 0.00 0.00 0.00 176.54 176.54 13pk h ARG 362 N -0.88 0.25 -0.12 4.80 2.43 -0.75 0.29 114.38 120.40 13pk h ARG 362 Ca -0.03 -0.01 0.04 0.00 -0.81 0.00 0.00 59.98 59.16 13pk h ARG 362 Cb 0.51 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 29.96 13pk h ARG 362 CO 0.05 0.16 -0.10 0.78 -1.51 0.00 0.00 179.97 179.35 13pk h GLY 363 N 0.26 -0.01 0.85 2.80 0.00 -0.86 1.31 103.07 107.42 13pk h GLY 363 Ca 0.37 0.12 -0.01 0.00 0.00 0.00 0.00 47.33 47.82 13pk h GLY 363 CO -0.47 -0.11 0.05 -0.84 0.00 0.00 0.00 176.54 175.16 13pk h THR 364 N -0.12 1.18 0.38 4.70 2.02 -1.09 0.32 112.91 120.30 13pk h THR 364 Ca 0.08 -0.54 -0.02 0.00 0.77 0.00 0.00 66.41 66.70 13pk h THR 364 Cb 0.23 1.27 -0.00 0.00 -1.74 0.00 0.00 68.15 67.91 13pk h THR 364 CO -0.19 0.16 -0.23 -0.74 0.37 0.00 0.00 175.52 174.89 13pk h HIS 365 N 0.05 -0.61 0.00 3.16 6.17 -0.35 -1.19 115.15 122.38 13pk h HIS 365 Ca 0.05 -0.01 -0.00 0.00 0.71 0.00 0.00 60.37 61.12 13pk h HIS 365 Cb 0.21 0.22 0.00 0.00 2.52 0.00 0.00 27.41 30.36 13pk h HIS 365 CO -0.00 -0.34 -0.00 0.93 0.71 0.00 0.00 177.93 179.22 13pk h GLU 366 N -0.57 -0.00 -0.18 5.26 4.39 0.16 -3.38 114.58 120.26 13pk h GLU 366 Ca -0.05 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.65 13pk h GLU 366 Cb 0.45 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.10 13pk h GLU 366 CO 0.05 0.34 0.00 0.72 -1.16 0.00 0.00 179.01 178.96 13pk n HIS 367 N -4.93 0.47 -0.91 4.33 8.25 0.10 -5.01 115.22 117.52 13pk n HIS 367 Ca -0.08 -0.75 0.00 0.00 -0.26 0.00 0.00 57.72 56.63 13pk n HIS 367 Cb 0.18 -0.16 0.00 0.00 1.12 0.00 0.00 29.99 31.13 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 -0.46 0.52 3.55 -1.41 0.00 -0.45 -4.89 105.19 102.05 13pk n GLY 368 Ca 0.14 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.72 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 0.00 1.19 -4.43 0.99 7.94 -0.98 -4.82 117.00 116.89 13pk n LEU 369 Ca 0.00 1.13 -0.44 0.00 -1.11 0.00 0.00 56.01 55.59 13pk n LEU 369 Cb 0.08 -1.22 -0.03 0.00 0.53 0.00 0.00 43.42 42.77 13pk n LEU 369 CO 0.00 -1.83 0.75 -0.32 -1.11 0.00 0.00 177.39 174.88 13pk s MET 370 N -1.52 3.29 -0.11 1.96 -2.45 -0.45 -4.06 119.30 115.96 13pk s MET 370 Ca 0.60 -1.34 -0.12 0.00 -1.25 0.00 0.00 55.69 53.58 13pk s MET 370 Cb -0.71 -4.49 -0.05 0.00 1.25 0.00 0.00 34.83 30.83 13pk s MET 370 CO 0.59 -1.72 0.28 -1.54 1.05 0.00 0.00 175.02 173.68 13pk s SER 371 N 3.60 6.51 -0.04 1.11 1.04 -1.26 -1.15 113.70 123.51 13pk s SER 371 Ca 0.23 0.60 0.01 0.00 0.48 0.00 0.00 55.95 57.28 13pk s SER 371 Cb -0.14 -2.17 0.02 0.00 0.10 0.00 0.00 66.02 63.83 13pk s SER 371 CO 0.01 0.23 -0.04 -0.63 0.98 0.00 0.00 173.24 173.80 13pk s ILE 372 N -0.28 0.49 0.10 -1.02 1.01 0.19 -0.86 121.20 120.82 13pk s ILE 372 Ca 0.18 -0.10 0.09 0.00 0.00 0.00 0.00 60.65 60.82 13pk s ILE 372 Cb -0.14 -0.51 -0.03 0.00 0.01 0.00 0.00 42.46 41.78 13pk s ILE 372 CO 0.06 0.21 -0.24 -0.63 0.00 0.00 0.00 174.94 174.34 13pk s ILE 373 N 0.87 2.01 0.06 2.92 1.01 -0.60 -0.89 121.20 126.59 13pk s ILE 373 Ca -0.11 -1.56 -0.12 0.00 0.00 0.00 0.00 60.65 58.85 13pk s ILE 373 Cb -0.14 -1.78 0.02 0.00 0.01 0.00 0.00 42.46 40.57 13pk s ILE 373 CO 0.00 0.12 0.28 -0.83 0.00 0.00 0.00 174.94 174.50 13pk s GLY 374 N -1.75 -0.08 0.00 6.18 0.00 -0.56 0.68 107.32 111.79 13pk s GLY 374 Ca 0.11 -0.18 0.00 0.00 0.00 0.00 0.00 44.72 44.65 13pk s GLY 374 CO 0.04 -0.39 0.00 0.61 0.00 0.00 0.00 173.10 173.36 13pk n GLY 375 N 0.33 2.49 0.16 0.20 0.00 -0.81 -4.13 105.19 103.44 13pk n GLY 375 Ca -0.17 -1.35 -0.05 0.00 0.00 0.00 0.00 46.02 44.45 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 0.37 1.71 -0.02 0.00 -1.90 0.26 103.07 103.49 13pk h GLY 376 Ca 0.00 0.06 -0.14 0.00 0.00 0.00 0.00 47.33 47.25 13pk h GLY 376 CO 0.00 -0.10 -0.53 -0.55 0.00 0.00 0.00 176.54 175.36 13pk h ASP 377 N 0.09 0.34 -0.40 0.19 3.32 -1.98 -1.48 116.42 116.50 13pk h ASP 377 Ca 0.19 -0.18 -0.08 0.00 0.02 0.00 0.00 57.03 56.99 13pk h ASP 377 Cb 0.27 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 13pk h ASP 377 CO -0.33 0.81 -0.05 0.28 -1.72 0.00 0.00 179.24 178.23 13pk h SER 378 N 0.24 0.73 -0.63 6.45 0.02 -1.63 -0.17 113.55 118.58 13pk h SER 378 Ca 0.01 -0.34 -0.04 0.00 -0.84 0.00 0.00 61.79 60.57 13pk h SER 378 Cb 1.01 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 63.32 13pk h SER 378 CO 0.09 0.90 0.23 0.00 -1.14 0.00 0.00 176.83 176.91 13pk h ALA 379 N 0.86 1.17 -0.54 3.77 0.00 -0.39 0.09 119.26 124.22 13pk h ALA 379 Ca 0.11 -0.19 0.04 0.00 0.00 0.00 0.00 54.91 54.86 13pk h ALA 379 Cb 0.55 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.04 13pk h ALA 379 CO 0.03 0.59 0.30 0.77 0.00 0.00 0.00 179.25 180.94 13pk h SER 380 N 0.96 0.45 -0.48 0.00 0.02 -0.45 -0.70 113.55 113.35 13pk h SER 380 Ca 0.22 0.02 -0.12 0.00 -0.84 0.00 0.00 61.79 61.07 13pk h SER 380 Cb 0.23 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 62.69 13pk h SER 380 CO -0.01 0.31 -0.15 0.00 -1.14 0.00 0.00 176.83 175.84 13pk h ALA 381 N 1.27 0.67 -0.57 3.77 0.00 -0.48 -1.68 119.26 122.23 13pk h ALA 381 Ca 0.23 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 13pk h ALA 381 Cb 0.09 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 13pk h ALA 381 CO -0.13 0.61 0.30 0.00 0.00 0.00 0.00 179.25 180.02 13pk h ALA 382 N 0.88 0.74 -0.25 0.00 0.00 -0.32 -2.38 119.26 117.92 13pk h ALA 382 Ca 0.12 -0.11 -0.16 0.00 0.00 0.00 0.00 54.91 54.75 13pk h ALA 382 Cb 0.71 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 13pk h ALA 382 CO 0.05 0.28 -0.50 0.93 0.00 0.00 0.00 179.25 180.01 13pk h GLU 383 N 0.78 0.69 -0.70 0.00 5.08 -1.13 0.13 114.58 119.43 13pk h GLU 383 Ca 0.20 -0.41 0.02 0.00 -1.00 0.00 0.00 59.36 58.17 13pk h GLU 383 Cb 0.08 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.33 13pk h GLU 383 CO -0.03 1.03 0.46 -0.07 -1.00 0.00 0.00 179.01 179.40 13pk h LEU 384 N 0.54 0.77 -2.11 1.33 4.07 -1.11 -2.71 115.31 116.10 13pk h LEU 384 Ca 0.02 -0.02 0.00 0.00 0.08 0.00 0.00 57.88 57.97 13pk h LEU 384 Cb 1.06 -0.19 0.00 0.00 1.08 0.00 0.00 40.66 42.61 13pk h LEU 384 CO 0.10 0.55 0.00 -1.54 -1.08 0.00 0.00 178.44 176.47 13pk n SER 385 N -4.44 3.16 -0.30 -0.43 3.41 -0.91 -4.95 113.62 109.15 13pk n SER 385 Ca 0.08 -1.95 -0.04 0.00 -0.26 0.00 0.00 58.87 56.70 13pk n SER 385 Cb 0.07 -0.23 -0.02 0.00 -0.26 0.00 0.00 64.21 63.78 13pk n SER 385 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 13pk n GLY 386 N 1.44 0.64 0.10 5.00 0.00 -0.79 -4.90 105.19 106.67 13pk n GLY 386 Ca 0.19 -0.30 0.11 0.00 0.00 0.00 0.00 46.02 46.02 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 -1.99 0.62 -0.15 1.61 -0.58 0.40 -4.30 120.64 116.25 13pk n GLU 387 Ca -0.04 0.08 -0.03 0.00 -0.42 0.00 0.00 57.16 56.74 13pk n GLU 387 Cb 0.24 -1.77 0.04 0.00 -0.57 0.00 0.00 31.44 29.38 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 1.96 0.36 0.00 0.62 0.00 -1.79 0.13 119.26 120.55 13pk h ALA 388 Ca -0.01 0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 13pk h ALA 388 Cb 1.04 0.31 -0.00 0.00 0.00 0.00 0.00 17.79 19.15 13pk h ALA 388 CO 0.00 -0.43 -0.02 1.57 0.00 0.00 0.00 179.25 180.38 13pk h LYS 389 N 0.04 0.00 0.00 0.00 2.10 -1.88 -0.51 116.57 116.32 13pk h LYS 389 Ca 0.23 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.88 13pk h LYS 389 Cb 0.35 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.68 13pk h LYS 389 CO -0.45 0.02 -0.55 0.54 -2.00 0.00 0.00 179.45 177.01 13pk n ARG 390 N -3.28 0.04 -2.55 0.07 1.74 0.40 -4.91 116.66 108.17 13pk n ARG 390 Ca -0.02 0.01 -0.35 0.00 -0.77 0.00 0.00 57.85 56.71 13pk n ARG 390 Cb 0.15 -1.52 -0.04 0.00 -1.02 0.00 0.00 32.46 30.03 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 -3.02 4.01 0.31 5.56 -1.94 -0.20 -4.49 119.30 119.52 13pk s MET 391 Ca 0.10 1.44 -0.00 0.00 -1.71 0.00 0.00 55.69 55.52 13pk s MET 391 Cb 0.17 -2.34 0.51 0.00 2.01 0.00 0.00 34.83 35.18 13pk s MET 391 CO 0.71 -0.26 1.96 0.77 -0.01 0.00 0.00 175.02 178.19 13pk h SER 392 N 2.08 0.89 -3.09 3.03 0.02 -1.30 -3.43 113.55 111.75 13pk h SER 392 Ca -0.49 -0.01 0.07 0.00 -0.84 0.00 0.00 61.79 60.52 13pk h SER 392 Cb 1.22 -0.21 -0.26 0.00 0.14 0.00 0.00 62.40 63.28 13pk h SER 392 CO 0.61 0.62 0.44 -2.28 -1.14 0.00 0.00 176.83 175.08 13pk s HIS 393 N -5.88 -0.50 -0.29 3.45 2.46 -0.80 -4.99 115.29 108.74 13pk s HIS 393 Ca -0.11 1.17 0.01 0.00 0.47 0.00 0.00 55.06 56.60 13pk s HIS 393 Cb 0.18 0.37 0.07 0.00 -0.13 0.00 0.00 32.58 33.07 13pk s HIS 393 CO 0.79 -0.24 -0.03 0.14 -2.47 0.00 0.00 174.74 172.92 13pk s VAL 394 N 0.42 2.52 0.73 0.89 -7.23 -1.26 -1.55 120.40 114.92 13pk s VAL 394 Ca 0.01 -1.68 -0.14 0.00 -1.81 0.00 0.00 61.98 58.37 13pk s VAL 394 Cb -0.05 -2.54 0.04 0.00 0.56 0.00 0.00 36.38 34.39 13pk s VAL 394 CO -0.08 -0.17 1.15 -0.55 -0.31 0.00 0.00 175.10 175.14 13pk s SER 395 N 1.17 4.44 0.00 4.85 0.15 0.21 -4.93 113.70 119.59 13pk s SER 395 Ca -0.04 2.12 0.21 0.00 0.70 0.00 0.00 55.95 58.94 13pk s SER 395 Cb -0.20 -2.56 0.54 0.00 -1.71 0.00 0.00 66.02 62.09 13pk s SER 395 CO -0.04 -2.09 1.46 0.35 1.20 0.00 0.00 173.24 174.12 13pk n THR 396 N -2.90 0.70 -4.05 6.45 -2.24 -1.26 -4.34 114.28 106.65 13pk n THR 396 Ca 0.11 -0.78 -0.36 0.00 -2.27 0.00 0.00 64.05 60.75 13pk n THR 396 Cb 0.51 0.58 -0.07 0.00 -2.10 0.00 0.00 70.33 69.25 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 -1.18 2.04 0.00 3.38 0.00 -1.26 -4.79 107.32 105.51 13pk s GLY 397 Ca 0.41 -0.70 0.00 0.00 0.00 0.00 0.00 44.72 44.43 13pk s GLY 397 CO 0.30 -0.40 0.00 0.61 0.00 0.00 0.00 173.10 173.61 13pk n GLY 398 N 2.17 0.86 1.00 0.20 0.00 -1.26 -1.93 105.19 106.23 13pk n GLY 398 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.83 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 4.80 0.99 0.01 -0.02 0.00 -1.26 -2.92 105.19 106.79 13pk n GLY 399 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 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 2.00 0.00 -1.29 4.61 0.00 -1.84 -3.14 119.26 119.60 13pk h ALA 400 Ca 0.00 -0.24 0.37 0.00 0.00 0.00 0.00 54.91 55.04 13pk h ALA 400 Cb 0.49 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 13pk h ALA 400 CO 0.00 0.07 0.94 0.77 0.00 0.00 0.00 179.25 181.03 13pk h SER 401 N -0.17 0.00 0.11 0.00 0.02 -1.79 1.29 113.55 113.02 13pk h SER 401 Ca 0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 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 0.00 0.00 -0.05 -0.07 -1.14 0.00 0.00 176.83 175.57 13pk h LEU 402 N 0.00 -0.12 -0.93 5.07 3.38 -1.69 -1.59 115.31 119.42 13pk h LEU 402 Ca 0.61 -0.33 -0.11 0.00 0.09 0.00 0.00 57.88 58.14 13pk h LEU 402 Cb 2.48 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 43.25 13pk h LEU 402 CO -0.01 0.28 -0.50 -0.08 0.09 0.00 0.00 178.44 178.23 13pk h GLU 403 N -0.56 0.08 -0.71 1.13 4.81 0.15 -2.53 114.58 116.96 13pk h GLU 403 Ca -0.01 -0.05 0.03 0.00 -0.13 0.00 0.00 59.36 59.20 13pk h GLU 403 Cb 0.45 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.79 13pk h GLU 403 CO 0.02 0.57 0.45 1.25 -0.73 0.00 0.00 179.01 180.57 13pk h LEU 404 N 0.07 0.75 -1.08 1.64 5.85 -0.53 -1.75 115.31 120.25 13pk h LEU 404 Ca -0.00 -0.00 0.13 0.00 0.84 0.00 0.00 57.88 58.85 13pk h LEU 404 Cb 0.91 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.75 13pk h LEU 404 CO 0.07 0.53 0.87 -0.07 -0.34 0.00 0.00 178.44 179.49 13pk h LEU 405 N 0.89 0.00 -0.35 2.25 4.07 -0.82 0.34 115.31 121.69 13pk h LEU 405 Ca 0.28 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.24 13pk h LEU 405 Cb -0.01 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 41.72 13pk h LEU 405 CO -0.10 0.00 0.22 -0.08 -1.08 0.00 0.00 178.44 177.40 13pk h GLU 406 N 0.00 0.46 0.00 1.13 4.81 -1.38 -3.45 114.58 116.16 13pk h GLU 406 Ca 0.22 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.41 13pk h GLU 406 Cb 1.95 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 31.23 13pk h GLU 406 CO -0.00 0.33 0.00 0.41 -0.73 0.00 0.00 179.01 179.02 13pk n GLY 407 N -1.12 1.49 3.66 1.92 0.00 0.12 -4.96 105.19 106.30 13pk n GLY 407 Ca -0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 13pk n GLY 407 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 13pk n LYS 408 N 0.00 0.89 -2.93 1.61 -0.00 -1.26 -4.98 118.16 111.49 13pk n LYS 408 Ca 0.00 0.35 -0.35 0.00 -0.00 0.00 0.00 58.31 58.32 13pk n LYS 408 Cb 0.00 -2.32 -0.06 0.00 -0.00 0.00 0.00 35.03 32.65 13pk n LYS 408 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 13pk s THR 409 N -1.52 4.44 -0.31 0.58 -4.23 -1.26 -4.90 115.64 108.43 13pk s THR 409 Ca 0.78 1.43 -0.29 0.00 -1.18 0.00 0.00 61.69 62.43 13pk s THR 409 Cb -0.39 -3.77 0.01 0.00 1.34 0.00 0.00 72.50 69.69 13pk s THR 409 CO 0.45 -0.05 1.19 -0.76 -0.54 0.00 0.00 174.62 174.91 13pk s LEU 410 N -2.57 3.91 0.31 4.79 1.43 -1.26 -4.94 118.68 120.35 13pk s LEU 410 Ca 0.53 1.14 0.05 0.00 -1.03 0.00 0.00 54.13 54.82 13pk s LEU 410 Cb -0.14 -3.54 0.69 0.00 0.03 0.00 0.00 46.19 43.23 13pk s LEU 410 CO 0.19 -0.98 1.83 1.55 0.23 0.00 0.00 176.35 179.16 13pk h PRO 411 N 8.69 0.81 -0.16 1.29 0.13 -1.64 0.66 132.00 141.77 13pk h PRO 411 Ca -0.23 -0.05 -0.05 0.00 -0.87 0.00 0.00 66.00 64.80 13pk h PRO 411 Cb 1.08 -0.18 -0.01 0.00 0.13 0.00 0.00 31.00 32.01 13pk h PRO 411 CO 1.03 0.54 -0.11 0.78 -0.23 0.00 0.00 178.00 180.01 13pk h GLY 412 N 0.84 0.28 0.04 1.56 0.00 -0.33 0.94 103.07 106.40 13pk h GLY 412 Ca 0.51 -0.16 -0.00 0.00 0.00 0.00 0.00 47.33 47.68 13pk h GLY 412 CO -0.28 0.15 -0.00 -2.08 0.00 0.00 0.00 176.54 174.33 13pk h VAL 413 N 0.24 1.53 -0.68 4.60 2.07 -0.56 -3.35 116.25 120.10 13pk h VAL 413 Ca 0.05 -2.08 0.15 0.00 0.82 0.00 0.00 66.70 65.63 13pk h VAL 413 Cb 0.35 2.86 -0.12 0.00 -1.52 0.00 0.00 31.29 32.86 13pk h VAL 413 CO 0.02 0.51 -0.03 0.74 0.02 0.00 0.00 177.57 178.83 13pk h THR 414 N -0.97 0.40 -0.00 2.57 2.02 0.47 0.42 112.91 117.82 13pk h THR 414 Ca -0.00 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.15 13pk h THR 414 Cb 0.84 0.30 -0.00 0.00 -1.74 0.00 0.00 68.15 67.55 13pk h THR 414 CO 0.00 0.02 0.13 1.62 0.37 0.00 0.00 175.52 177.66 13pk h VAL 415 N 0.09 0.00 -3.98 3.16 3.04 -0.95 -3.43 116.25 114.18 13pk h VAL 415 Ca 0.36 0.00 -0.50 0.00 -1.01 0.00 0.00 66.70 65.55 13pk h VAL 415 Cb 0.60 0.87 0.05 0.00 -2.01 0.00 0.00 31.29 30.80 13pk h VAL 415 CO -0.61 0.00 0.46 -0.76 -1.01 0.00 0.00 177.57 175.65 13pk s LEU 416 N -6.00 4.07 -0.40 3.16 1.43 0.14 -4.83 118.68 116.26 13pk s LEU 416 Ca -0.04 2.22 -0.27 0.00 -1.03 0.00 0.00 54.13 55.00 13pk s LEU 416 Cb 0.11 -4.20 -0.05 0.00 0.03 0.00 0.00 46.19 42.08 13pk s LEU 416 CO 0.36 -0.75 2.18 -1.81 0.23 0.00 0.00 176.35 176.55 13pk s ASP 417 N -1.41 5.10 -1.03 2.29 1.01 0.49 -4.88 116.67 118.24 13pk s ASP 417 Ca 0.61 1.27 -0.23 0.00 0.71 0.00 0.00 52.55 54.91 13pk s ASP 417 Cb -0.26 -2.51 0.03 0.00 1.01 0.00 0.00 42.92 41.19 13pk s ASP 417 CO 0.33 -2.33 1.57 1.51 0.21 0.00 0.00 175.17 176.45 13pk s ASP 418 N 9.42 6.28 0.00 0.27 -4.77 -1.26 -1.54 116.67 125.07 13pk s ASP 418 Ca 0.91 -1.43 0.00 0.00 -3.30 0.00 0.00 52.55 48.73 13pk s ASP 418 Cb -0.22 -2.57 0.00 0.00 -1.09 0.00 0.00 42.92 39.04 13pk s ASP 418 CO 0.29 -1.72 0.41 0.29 0.70 0.00 0.00 175.17 175.15