#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fie h ARG 11 N 0.00 0.23 -3.28 1.61 9.65 -2.09 -3.47 114.38 117.03 1fie h ARG 11 Ca 0.00 -0.22 -0.15 0.00 -1.10 0.00 0.00 59.98 58.51 1fie h ARG 11 Cb 0.00 0.05 -0.23 0.00 -1.39 0.00 0.00 29.97 28.40 1fie h ARG 11 CO 0.00 0.90 -0.44 -0.98 2.80 0.00 0.00 179.97 182.25 1fie s ARG 12 N -3.37 0.41 0.34 0.20 1.70 -1.26 -5.05 118.95 111.93 1fie s ARG 12 Ca -0.15 -0.04 0.04 0.00 -0.47 0.00 0.00 55.73 55.11 1fie s ARG 12 Cb 0.02 0.18 0.62 0.00 -0.57 0.00 0.00 34.95 35.21 1fie s ARG 12 CO 0.75 -0.09 1.90 0.00 -1.08 0.00 0.00 175.30 176.78 1fie h ALA 13 N 4.90 1.41 -3.62 7.88 0.00 -2.09 -3.42 119.26 124.31 1fie h ALA 13 Ca -0.28 -0.18 -0.55 0.00 0.00 0.00 0.00 54.91 53.90 1fie h ALA 13 Cb 1.19 -0.16 -0.32 0.00 0.00 0.00 0.00 17.79 18.50 1fie h ALA 13 CO 0.39 0.42 -0.83 0.08 0.00 0.00 0.00 179.25 179.31 1fie s VAL 14 N -5.06 1.35 0.94 0.00 1.01 -1.26 -5.12 120.40 112.25 1fie s VAL 14 Ca -0.08 -0.64 -0.11 0.00 0.00 0.00 0.00 61.98 61.16 1fie s VAL 14 Cb 0.16 -1.19 0.16 0.00 0.00 0.00 0.00 36.38 35.50 1fie s VAL 14 CO 0.76 0.40 1.11 -2.16 0.00 0.00 0.00 175.10 175.21 1fie s PRO 15 N 0.35 0.88 0.08 2.72 0.04 -1.26 -4.90 135.00 132.91 1fie s PRO 15 Ca -0.10 1.29 -0.31 0.00 0.04 0.00 0.00 61.00 61.93 1fie s PRO 15 Cb -0.14 -1.73 -0.09 0.00 0.04 0.00 0.00 34.50 32.58 1fie s PRO 15 CO 0.04 -2.64 1.68 -1.25 0.04 0.00 0.00 177.00 174.86 1fie s PRO 16 N -4.68 4.19 -1.06 0.56 0.04 -1.26 -4.92 135.00 127.87 1fie s PRO 16 Ca 0.66 2.38 -0.21 0.00 0.04 0.00 0.00 61.00 63.86 1fie s PRO 16 Cb -0.22 -3.57 0.07 0.00 0.04 0.00 0.00 34.50 30.82 1fie s PRO 16 CO 0.59 -0.75 1.45 1.21 0.04 0.00 0.00 177.00 179.55 1fie s ASN 17 N 2.39 6.59 -0.22 6.66 2.47 -1.26 -4.72 114.94 126.84 1fie s ASN 17 Ca 0.75 -1.73 0.08 0.00 0.42 0.00 0.00 52.86 52.38 1fie s ASN 17 Cb -0.41 -2.54 -0.21 0.00 -1.45 0.00 0.00 41.25 36.64 1fie s ASN 17 CO 0.33 -1.38 -0.05 0.59 -3.72 0.00 0.00 177.10 172.87 1fie n ASN 18 N 8.42 1.17 -4.93 -4.21 5.03 -1.26 -2.30 115.26 117.18 1fie n ASN 18 Ca 0.35 -0.05 -0.25 0.00 0.87 0.00 0.00 54.58 55.49 1fie n ASN 18 Cb 0.50 0.13 0.02 0.00 -1.02 0.00 0.00 39.78 39.40 1fie n ASN 18 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 1fie s SER 19 N -6.13 5.84 -0.01 6.41 0.15 -1.26 -4.01 113.70 114.69 1fie s SER 19 Ca -0.24 0.57 0.02 0.00 0.70 0.00 0.00 55.95 57.01 1fie s SER 19 Cb 0.08 -1.75 -0.03 0.00 -1.71 0.00 0.00 66.02 62.61 1fie s SER 19 CO 0.71 -0.80 0.03 -3.20 1.20 0.00 0.00 173.24 171.18 1fie n ASN 20 N -2.29 4.51 0.08 5.45 4.05 -1.26 -4.23 115.26 121.56 1fie n ASN 20 Ca 0.02 0.00 -0.06 0.00 0.45 0.00 0.00 54.58 54.99 1fie n ASN 20 Cb 0.57 0.90 -0.04 0.00 1.23 0.00 0.00 39.78 42.44 1fie n ASN 20 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1fie h ALA 21 N 0.16 0.50 -2.35 5.20 0.00 -1.95 -3.41 119.26 117.40 1fie h ALA 21 Ca -0.02 -0.81 -0.51 0.00 0.00 0.00 0.00 54.91 53.57 1fie h ALA 21 Cb 0.47 -0.13 0.11 0.00 0.00 0.00 0.00 17.79 18.24 1fie h ALA 21 CO 0.00 1.09 0.35 0.00 0.00 0.00 0.00 179.25 180.69 1fie s ALA 22 N -2.97 2.49 -0.27 0.00 0.00 -1.26 -5.03 121.76 114.70 1fie s ALA 22 Ca -0.00 0.29 -0.25 0.00 0.00 0.00 0.00 51.96 52.00 1fie s ALA 22 Cb 0.10 -3.25 0.09 0.00 0.00 0.00 0.00 23.12 20.06 1fie s ALA 22 CO 0.81 -1.38 0.82 -1.83 0.00 0.00 0.00 175.76 174.18 1fie s GLU 23 N -4.66 0.73 0.54 0.00 -1.05 -1.26 -3.74 118.70 109.26 1fie s GLU 23 Ca 0.62 0.87 -0.03 0.00 -0.15 0.00 0.00 54.97 56.28 1fie s GLU 23 Cb -0.17 0.35 0.01 0.00 -0.44 0.00 0.00 34.13 33.88 1fie s GLU 23 CO 0.50 -0.09 0.80 0.16 0.95 0.00 0.00 175.26 177.59 1fie s ASP 24 N 0.35 5.62 -0.26 0.83 -4.77 -1.24 -4.71 116.67 112.50 1fie s ASP 24 Ca 0.01 0.47 -0.06 0.00 -3.30 0.00 0.00 52.55 49.67 1fie s ASP 24 Cb -0.05 -1.54 -0.01 0.00 -1.09 0.00 0.00 42.92 40.24 1fie s ASP 24 CO -0.02 -0.95 0.04 -0.62 0.70 0.00 0.00 175.17 174.32 1fie s ASP 25 N -4.29 4.87 0.18 2.11 2.15 -1.26 -5.03 116.67 115.40 1fie s ASP 25 Ca 0.52 -0.47 -0.20 0.00 0.43 0.00 0.00 52.55 52.83 1fie s ASP 25 Cb -0.10 -1.85 -0.08 0.00 -0.30 0.00 0.00 42.92 40.59 1fie s ASP 25 CO 0.42 -0.09 0.70 -0.76 -0.17 0.00 0.00 175.17 175.26 1fie s LEU 26 N 1.52 4.42 0.23 -1.34 1.43 -1.26 -5.04 118.68 118.64 1fie s LEU 26 Ca 0.05 1.41 -0.30 0.00 -1.03 0.00 0.00 54.13 54.26 1fie s LEU 26 Cb -0.16 -3.41 -0.09 0.00 0.03 0.00 0.00 46.19 42.57 1fie s LEU 26 CO 0.01 0.11 1.17 -2.16 0.23 0.00 0.00 176.35 175.71 1fie s PRO 27 N -1.69 4.53 0.55 1.29 0.04 -1.26 -4.90 135.00 133.56 1fie s PRO 27 Ca 0.39 1.88 0.33 0.00 0.04 0.00 0.00 61.00 63.64 1fie s PRO 27 Cb -0.18 -3.21 1.36 0.00 0.04 0.00 0.00 34.50 32.51 1fie s PRO 27 CO 0.22 0.01 1.98 1.79 0.04 0.00 0.00 177.00 181.04 1fie h THR 28 N 3.47 0.01 -2.13 1.26 1.35 -1.84 -3.41 112.91 111.62 1fie h THR 28 Ca -0.46 -0.53 -0.05 0.00 -0.55 0.00 0.00 66.41 64.82 1fie h THR 28 Cb 1.21 1.52 -0.26 0.00 -1.73 0.00 0.00 68.15 68.89 1fie h THR 28 CO 0.71 0.00 -0.34 0.54 -0.25 0.00 0.00 175.52 176.19 1fie s VAL 29 N -3.67 -0.74 -0.42 6.82 0.11 -1.26 -0.01 120.40 121.23 1fie s VAL 29 Ca 0.01 0.07 0.03 0.00 -2.93 0.00 0.00 61.98 59.16 1fie s VAL 29 Cb 0.09 -0.79 0.12 0.00 -1.53 0.00 0.00 36.38 34.26 1fie s VAL 29 CO 0.55 0.01 0.17 -0.70 -3.33 0.00 0.00 175.10 171.79 1fie s GLU 30 N 2.68 1.53 0.17 1.54 2.56 0.16 -5.00 118.70 122.35 1fie s GLU 30 Ca 0.03 -2.08 0.08 0.00 0.00 0.00 0.00 54.97 53.00 1fie s GLU 30 Cb -0.13 -2.93 -0.04 0.00 2.00 0.00 0.00 34.13 33.03 1fie s GLU 30 CO -0.15 -1.05 -0.03 -0.51 -0.56 0.00 0.00 175.26 172.95 1fie s LEU 31 N 0.45 3.20 -0.28 2.70 1.43 -1.26 -0.83 118.68 124.09 1fie s LEU 31 Ca 0.14 -0.45 -0.16 0.00 -1.03 0.00 0.00 54.13 52.63 1fie s LEU 31 Cb -0.22 -1.87 0.09 0.00 0.03 0.00 0.00 46.19 44.22 1fie s LEU 31 CO -0.06 0.10 0.74 -1.58 0.23 0.00 0.00 176.35 175.78 1fie s GLN 32 N -2.87 0.66 0.00 1.70 0.74 0.65 -4.98 119.66 115.56 1fie s GLN 32 Ca 0.26 1.12 0.00 0.00 0.05 0.00 0.00 55.36 56.80 1fie s GLN 32 Cb -0.09 0.14 0.00 0.00 1.10 0.00 0.00 33.01 34.16 1fie s GLN 32 CO 0.17 -0.14 0.00 0.41 -0.55 0.00 0.00 175.29 175.19 1fie n GLY 33 N 4.15 3.40 3.49 2.59 0.00 -1.26 -4.67 105.19 112.89 1fie n GLY 33 Ca -0.20 -0.16 -0.33 0.00 0.00 0.00 0.00 46.02 45.34 1fie n GLY 33 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1fie n VAL 34 N 0.00 0.35 -0.02 1.61 0.24 -1.26 -4.84 118.33 114.40 1fie n VAL 34 Ca 0.00 -0.18 -0.00 0.00 -2.04 0.00 0.00 64.34 62.12 1fie n VAL 34 Cb 0.00 -0.75 -0.00 0.00 -1.47 0.00 0.00 33.84 31.61 1fie n VAL 34 CO 0.00 0.00 0.00 1.33 -2.14 0.00 0.00 176.83 176.02 1fie n VAL 35 N -3.58 -0.03 -1.54 3.34 0.24 -1.26 -5.19 118.33 110.31 1fie n VAL 35 Ca 0.09 0.30 -0.37 0.00 -2.04 0.00 0.00 64.34 62.32 1fie n VAL 35 Cb 0.53 -0.40 -0.05 0.00 -1.47 0.00 0.00 33.84 32.45 1fie n VAL 35 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 1fie n PRO 36 N -2.62 0.83 -0.66 7.34 -0.04 -1.26 -5.21 135.00 133.37 1fie n PRO 36 Ca 0.00 -0.01 0.00 0.00 -0.04 0.00 0.00 63.50 63.45 1fie n PRO 36 Cb 0.01 -3.07 0.00 0.00 -0.04 0.00 0.00 33.50 30.40 1fie n PRO 36 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1fie n ASN 40 N 14.90 0.00 -0.49 3.54 0.23 -1.26 -5.71 115.26 126.47 1fie n ASN 40 Ca 0.43 0.32 0.08 0.00 -0.53 0.00 0.00 54.58 54.88 1fie n ASN 40 Cb 0.45 -0.75 0.19 0.00 -2.08 0.00 0.00 39.78 37.58 1fie n ASN 40 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1fie n LEU 41 N -0.02 3.08 -1.71 -4.53 -0.00 0.00 -4.89 117.00 108.93 1fie n LEU 41 Ca 0.00 -2.88 -0.12 0.00 -0.00 0.00 0.00 56.01 53.02 1fie n LEU 41 Cb 0.00 -0.43 0.14 0.00 -0.00 0.00 0.00 43.42 43.13 1fie n LEU 41 CO 0.00 0.68 0.94 0.00 -0.00 0.00 0.00 177.39 179.01 1fie n GLN 42 N -0.77 2.11 -2.80 1.47 6.02 -1.26 -4.78 117.38 117.37 1fie n GLN 42 Ca 0.17 -1.93 -0.43 0.00 -0.01 0.00 0.00 57.00 54.80 1fie n GLN 42 Cb 0.71 -1.80 -0.04 0.00 1.02 0.00 0.00 30.24 30.13 1fie n GLN 42 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1fie s GLU 43 N -2.11 3.18 0.08 -1.09 -6.30 -1.26 -4.93 118.70 106.28 1fie s GLU 43 Ca 0.36 -0.59 0.01 0.00 -2.50 0.00 0.00 54.97 52.25 1fie s GLU 43 Cb 0.30 -4.17 -0.00 0.00 0.00 0.00 0.00 34.13 30.25 1fie s GLU 43 CO 0.08 -1.78 0.02 1.19 0.02 0.00 0.00 175.26 174.78 1fie n PHE 44 N 7.91 0.08 -0.69 5.30 3.01 -1.26 -5.02 117.46 126.78 1fie n PHE 44 Ca -0.01 -0.49 -0.31 0.00 1.01 0.00 0.00 57.45 57.64 1fie n PHE 44 Cb 0.46 -0.02 0.16 0.00 -0.01 0.00 0.00 39.48 40.08 1fie n PHE 44 CO 0.00 0.00 0.00 -0.11 1.01 0.00 0.00 176.76 177.66 1fie n LEU 45 N 0.00 2.24 -3.67 4.37 7.94 -1.26 -4.99 117.00 121.62 1fie n LEU 45 Ca -0.02 0.36 -0.11 0.00 -1.11 0.00 0.00 56.01 55.13 1fie n LEU 45 Cb 0.12 -1.40 -0.09 0.00 0.53 0.00 0.00 43.42 42.58 1fie n LEU 45 CO 0.06 -2.56 0.23 0.21 -1.11 0.00 0.00 177.39 174.22 1fie s ASN 46 N -2.48 -0.66 -0.18 1.96 2.47 -1.26 -4.96 114.94 109.83 1fie s ASN 46 Ca 0.65 1.17 -0.22 0.00 0.42 0.00 0.00 52.86 54.88 1fie s ASN 46 Cb -0.23 1.12 -0.03 0.00 -1.45 0.00 0.00 41.25 40.67 1fie s ASN 46 CO 0.61 -0.21 0.66 0.68 -3.72 0.00 0.00 177.10 175.12 1fie s VAL 47 N 0.91 5.01 -0.06 -5.21 -7.23 -1.26 0.68 120.40 113.24 1fie s VAL 47 Ca -0.05 1.26 -0.13 0.00 -1.81 0.00 0.00 61.98 61.26 1fie s VAL 47 Cb -0.05 -3.98 -0.30 0.00 0.56 0.00 0.00 36.38 32.61 1fie s VAL 47 CO -0.08 0.12 0.64 0.74 -0.31 0.00 0.00 175.10 176.21 1fie h THR 48 N 5.13 0.97 -2.92 5.32 2.02 0.20 -3.46 112.91 120.16 1fie h THR 48 Ca -0.32 -2.48 0.02 0.00 0.77 0.00 0.00 66.41 64.39 1fie h THR 48 Cb 1.15 2.76 -0.10 0.00 -1.74 0.00 0.00 68.15 70.21 1fie h THR 48 CO 0.78 0.82 0.24 -0.55 0.37 0.00 0.00 175.52 177.18 1fie s SER 49 N -7.23 -0.47 -0.00 4.18 0.15 -0.57 -4.98 113.70 104.78 1fie s SER 49 Ca -0.17 -0.16 0.05 0.00 0.70 0.00 0.00 55.95 56.37 1fie s SER 49 Cb 0.05 0.61 -0.01 0.00 -1.71 0.00 0.00 66.02 64.96 1fie s SER 49 CO 0.83 -1.03 -0.16 -0.69 1.20 0.00 0.00 173.24 173.39 1fie s VAL 50 N -3.73 1.25 -0.15 4.45 1.01 -1.26 0.43 120.40 122.40 1fie s VAL 50 Ca 0.04 -0.73 -0.01 0.00 0.00 0.00 0.00 61.98 61.28 1fie s VAL 50 Cb -0.02 -1.05 0.04 0.00 0.00 0.00 0.00 36.38 35.35 1fie s VAL 50 CO -0.08 0.31 -0.04 -1.00 0.00 0.00 0.00 175.10 174.29 1fie s HIS 51 N -0.43 1.45 -0.20 5.22 3.76 0.19 -4.98 115.29 120.29 1fie s HIS 51 Ca 0.06 -0.87 -0.05 0.00 -0.15 0.00 0.00 55.06 54.05 1fie s HIS 51 Cb -0.06 -1.20 -0.02 0.00 1.11 0.00 0.00 32.58 32.41 1fie s HIS 51 CO -0.00 -0.56 -0.00 -0.51 -0.85 0.00 0.00 174.74 172.82 1fie s LEU 52 N 1.72 3.22 -1.43 0.89 1.43 -1.26 0.68 118.68 123.93 1fie s LEU 52 Ca 0.02 -0.22 -0.12 0.00 -1.03 0.00 0.00 54.13 52.77 1fie s LEU 52 Cb -0.15 -1.82 0.06 0.00 0.03 0.00 0.00 46.19 44.32 1fie s LEU 52 CO -0.07 0.05 2.20 0.49 0.23 0.00 0.00 176.35 179.25 1fie n PHE 53 N 4.31 3.30 1.81 0.29 3.72 -1.24 -4.64 117.46 125.02 1fie n PHE 53 Ca -0.17 -2.94 0.15 0.00 -0.05 0.00 0.00 57.45 54.44 1fie n PHE 53 Cb 0.52 -2.39 0.79 0.00 -0.94 0.00 0.00 39.48 37.45 1fie n PHE 53 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 176.76 177.07 1fie n LYS 54 N 5.31 1.25 -2.14 -1.08 2.85 -1.26 -4.03 118.16 119.06 1fie n LYS 54 Ca 0.51 -0.36 -0.36 0.00 -1.05 0.00 0.00 58.31 57.05 1fie n LYS 54 Cb 0.37 -1.49 0.02 0.00 -0.65 0.00 0.00 35.03 33.28 1fie n LYS 54 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 1fie s GLU 55 N -2.00 3.20 0.46 -1.58 0.41 -1.26 -4.71 118.70 113.22 1fie s GLU 55 Ca 0.44 1.72 0.17 0.00 -0.41 0.00 0.00 54.97 56.89 1fie s GLU 55 Cb 0.21 -1.99 1.09 0.00 -1.78 0.00 0.00 34.13 31.67 1fie s GLU 55 CO 0.35 -1.00 2.01 0.00 -0.49 0.00 0.00 175.26 176.13 1fie h ARG 56 N 1.10 0.00 0.00 1.61 3.08 -1.93 -1.86 114.38 116.38 1fie h ARG 56 Ca -0.50 0.00 -0.12 0.00 0.07 0.00 0.00 59.98 59.43 1fie h ARG 56 Cb 1.28 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.31 1fie h ARG 56 CO 0.56 0.17 -0.57 0.11 -1.07 0.00 0.00 179.97 179.18 1fie h TRP 57 N 0.00 0.00 -3.50 3.04 0.09 -1.96 -3.41 115.95 110.21 1fie h TRP 57 Ca -0.00 0.00 -0.47 0.00 0.09 0.00 0.00 58.89 58.51 1fie h TRP 57 Cb 0.33 0.00 0.21 0.00 0.08 0.00 0.00 29.16 29.78 1fie h TRP 57 CO 0.00 0.57 -0.06 -0.25 0.09 0.00 0.00 178.44 178.79 1fie n ASP 58 N -3.27 -1.14 0.20 0.11 8.00 -0.70 -4.89 116.55 114.87 1fie n ASP 58 Ca 0.01 0.06 -0.15 0.00 0.71 0.00 0.00 54.79 55.42 1fie n ASP 58 Cb 0.75 -1.30 -0.07 0.00 -0.02 0.00 0.00 41.12 40.47 1fie n ASP 58 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 1fie h THR 59 N -2.33 0.27 -0.18 -3.53 2.02 -1.83 -3.14 112.91 104.19 1fie h THR 59 Ca -0.54 0.00 0.02 0.00 0.77 0.00 0.00 66.41 66.66 1fie h THR 59 Cb 1.31 0.27 -0.03 0.00 -1.74 0.00 0.00 68.15 67.96 1fie h THR 59 CO 0.45 0.00 -0.14 0.78 0.37 0.00 0.00 175.52 176.97 1fie h ASN 60 N -0.71 -0.50 -0.67 4.18 2.35 -1.88 0.13 115.58 118.48 1fie h ASN 60 Ca -0.01 0.07 0.03 0.00 -0.55 0.00 0.00 56.30 55.84 1fie h ASN 60 Cb 0.65 0.21 -0.04 0.00 0.05 0.00 0.00 38.32 39.20 1fie h ASN 60 CO -0.09 -0.08 0.44 0.11 -1.65 0.00 0.00 177.43 176.16 1fie h LYS 61 N -0.05 0.78 0.31 0.81 1.57 -1.79 -1.08 116.57 117.13 1fie h LYS 61 Ca 0.03 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 1fie h LYS 61 Cb 0.12 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.26 1fie h LYS 61 CO -0.19 0.52 -0.15 0.28 -0.57 0.00 0.00 179.45 179.34 1fie h VAL 62 N 0.81 0.49 0.00 0.50 2.07 -1.36 0.92 116.25 119.69 1fie h VAL 62 Ca 0.27 -0.79 -0.00 0.00 0.82 0.00 0.00 66.70 67.00 1fie h VAL 62 Cb 0.06 0.79 -0.00 0.00 -1.52 0.00 0.00 31.29 30.62 1fie h VAL 62 CO -0.07 0.11 -0.00 0.44 0.02 0.00 0.00 177.57 178.07 1fie h ASP 63 N -0.95 0.00 0.22 0.57 5.19 -0.67 -1.37 116.42 119.41 1fie h ASP 63 Ca -0.04 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.37 1fie h ASP 63 Cb 0.50 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.01 1fie h ASP 63 CO 0.07 0.00 -0.58 1.41 -3.12 0.00 0.00 179.24 177.01 1fie n HIS 64 N -3.13 0.00 -2.01 4.55 8.25 -0.42 -4.94 115.22 117.52 1fie n HIS 64 Ca -0.03 0.00 -0.08 0.00 -0.26 0.00 0.00 57.72 57.35 1fie n HIS 64 Cb 0.07 -0.11 -0.01 0.00 1.12 0.00 0.00 29.99 31.06 1fie n HIS 64 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1fie n HIS 65 N -1.09 -0.34 -1.19 4.41 8.25 -0.52 -4.71 115.22 120.04 1fie n HIS 65 Ca 0.07 0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.59 1fie n HIS 65 Cb 0.36 -2.12 0.20 0.00 1.12 0.00 0.00 29.99 29.55 1fie n HIS 65 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1fie n THR 66 N -3.81 2.22 1.46 1.59 -2.24 0.25 -4.66 114.28 109.09 1fie n THR 66 Ca -0.10 -2.34 0.14 0.00 -2.27 0.00 0.00 64.05 59.48 1fie n THR 66 Cb 0.53 -0.26 0.64 0.00 -2.10 0.00 0.00 70.33 69.13 1fie n THR 66 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1fie n ASP 67 N -1.00 0.47 0.07 3.42 5.75 -1.04 -3.82 116.55 120.40 1fie n ASP 67 Ca 0.22 -0.64 0.12 0.00 -0.01 0.00 0.00 54.79 54.48 1fie n ASP 67 Cb 0.83 -0.07 0.05 0.00 -1.03 0.00 0.00 41.12 40.90 1fie n ASP 67 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1fie n LYS 68 N -0.91 0.45 -2.20 0.11 5.02 -1.26 -4.90 118.16 114.46 1fie n LYS 68 Ca 0.15 0.08 -0.42 0.00 -2.02 0.00 0.00 58.31 56.10 1fie n LYS 68 Cb 0.27 -1.73 -0.03 0.00 -0.02 0.00 0.00 35.03 33.52 1fie n LYS 68 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1fie s TYR 69 N -3.28 2.98 -0.77 2.13 1.51 -1.25 -4.80 117.35 113.87 1fie s TYR 69 Ca 0.02 0.86 -0.21 0.00 -1.01 0.00 0.00 57.07 56.73 1fie s TYR 69 Cb 0.12 -3.67 -0.15 0.00 -0.11 0.00 0.00 41.96 38.15 1fie s TYR 69 CO 0.77 -2.43 1.93 0.39 -1.11 0.00 0.00 175.55 175.10 1fie n GLU 70 N 4.88 1.52 -3.68 -0.62 -0.58 -0.70 -4.76 120.64 116.70 1fie n GLU 70 Ca 0.13 -1.81 -0.16 0.00 -0.42 0.00 0.00 57.16 54.89 1fie n GLU 70 Cb 0.43 -2.88 -0.15 0.00 -0.57 0.00 0.00 31.44 28.27 1fie n GLU 70 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 1fie s ASN 71 N 4.92 0.59 0.47 1.62 3.84 -1.26 -4.53 114.94 120.58 1fie s ASN 71 Ca 0.56 0.31 0.31 0.00 0.21 0.00 0.00 52.86 54.25 1fie s ASN 71 Cb 0.14 0.24 1.26 0.00 -0.55 0.00 0.00 41.25 42.34 1fie s ASN 71 CO 0.11 -0.22 1.91 -0.55 -2.79 0.00 0.00 177.10 175.55 1fie h ASN 72 N 8.13 0.00 -3.60 -4.21 -1.07 -1.95 -3.45 115.58 109.43 1fie h ASN 72 Ca -0.19 0.00 -0.46 0.00 0.07 0.00 0.00 56.30 55.71 1fie h ASN 72 Cb 1.12 0.00 0.07 0.00 -2.07 0.00 0.00 38.32 37.44 1fie h ASN 72 CO 0.20 0.00 0.18 -0.54 0.07 0.00 0.00 177.43 177.35 1fie s LYS 73 N -3.57 2.47 -0.14 4.14 -0.14 -1.26 -4.92 119.74 116.33 1fie s LYS 73 Ca 0.02 -0.22 -0.29 0.00 -1.36 0.00 0.00 55.97 54.11 1fie s LYS 73 Cb 0.09 -2.24 -0.02 0.00 -1.68 0.00 0.00 37.83 33.99 1fie s LYS 73 CO 0.50 -1.00 1.24 -1.17 -0.76 0.00 0.00 175.35 174.16 1fie s LEU 74 N -5.11 4.21 -0.06 3.17 2.96 -1.26 -4.97 118.68 117.61 1fie s LEU 74 Ca 0.58 1.72 0.02 0.00 -0.22 0.00 0.00 54.13 56.23 1fie s LEU 74 Cb -0.11 -3.54 -0.03 0.00 0.50 0.00 0.00 46.19 43.01 1fie s LEU 74 CO 0.44 -0.71 -0.10 -0.63 -1.32 0.00 0.00 176.35 174.03 1fie s ILE 75 N 3.13 3.40 0.20 6.68 1.01 -1.26 -1.07 121.20 133.30 1fie s ILE 75 Ca 0.55 -0.59 -0.05 0.00 0.00 0.00 0.00 60.65 60.55 1fie s ILE 75 Cb -0.22 -2.37 -0.03 0.00 0.01 0.00 0.00 42.46 39.85 1fie s ILE 75 CO 0.16 0.59 0.25 -0.69 0.00 0.00 0.00 174.94 175.25 1fie s VAL 76 N -0.69 0.02 -0.04 2.92 1.01 0.48 -4.62 120.40 119.47 1fie s VAL 76 Ca 0.10 -1.75 0.05 0.00 0.00 0.00 0.00 61.98 60.39 1fie s VAL 76 Cb -0.11 -2.30 -0.01 0.00 0.00 0.00 0.00 36.38 33.96 1fie s VAL 76 CO 0.01 -0.07 -0.19 -0.13 0.00 0.00 0.00 175.10 174.72 1fie s ARG 77 N -4.09 1.93 0.65 2.72 0.52 -1.26 -0.47 118.95 118.95 1fie s ARG 77 Ca 0.30 -0.70 -0.18 0.00 -0.52 0.00 0.00 55.73 54.64 1fie s ARG 77 Cb 0.04 -1.70 -0.02 0.00 0.52 0.00 0.00 34.95 33.80 1fie s ARG 77 CO 0.09 0.31 1.14 2.89 0.02 0.00 0.00 175.30 179.75 1fie n ARG 78 N 3.00 0.91 -0.98 3.54 1.85 -0.48 -3.48 116.66 121.02 1fie n ARG 78 Ca -0.17 0.36 0.00 0.00 -1.00 0.00 0.00 57.85 57.04 1fie n ARG 78 Cb 0.53 -2.37 0.00 0.00 -1.05 0.00 0.00 32.46 29.57 1fie n ARG 78 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1fie n GLY 79 N 1.05 0.59 3.00 2.89 0.00 -1.11 -4.62 105.19 106.99 1fie n GLY 79 Ca 0.15 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.97 1fie n GLY 79 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1fie s GLN 80 N -0.20 0.88 0.45 1.61 0.74 -1.23 -4.78 119.66 117.14 1fie s GLN 80 Ca 0.00 -0.29 -0.24 0.00 0.05 0.00 0.00 55.36 54.88 1fie s GLN 80 Cb 0.00 -0.83 -0.07 0.00 1.10 0.00 0.00 33.01 33.21 1fie s GLN 80 CO 0.00 0.12 1.26 -1.54 -0.55 0.00 0.00 175.29 174.58 1fie s SER 81 N 0.12 6.05 0.07 6.67 1.04 -1.25 -4.19 113.70 122.20 1fie s SER 81 Ca -0.02 2.53 0.01 0.00 0.48 0.00 0.00 55.95 58.95 1fie s SER 81 Cb -0.07 -2.62 -0.04 0.00 0.10 0.00 0.00 66.02 63.38 1fie s SER 81 CO 0.00 -1.02 -0.05 0.72 0.98 0.00 0.00 173.24 173.87 1fie s PHE 82 N -1.38 0.73 -0.01 5.02 -0.71 -0.23 -4.94 117.98 116.44 1fie s PHE 82 Ca 0.62 -0.92 -0.01 0.00 -1.04 0.00 0.00 56.93 55.59 1fie s PHE 82 Cb -0.35 -0.45 -0.04 0.00 -1.21 0.00 0.00 43.02 40.97 1fie s PHE 82 CO 0.43 -0.22 0.08 0.71 -1.34 0.00 0.00 175.22 174.88 1fie s TYR 83 N -3.46 3.31 0.05 3.49 2.02 -1.26 -1.26 117.35 120.22 1fie s TYR 83 Ca 0.07 0.23 -0.09 0.00 -0.37 0.00 0.00 57.07 56.91 1fie s TYR 83 Cb 0.04 -1.75 0.00 0.00 -0.40 0.00 0.00 41.96 39.85 1fie s TYR 83 CO -0.06 0.56 0.18 0.14 -1.57 0.00 0.00 175.55 174.80 1fie s VAL 84 N -1.18 0.12 -0.05 0.71 -7.23 -1.08 -3.62 120.40 108.06 1fie s VAL 84 Ca 0.22 -0.96 -0.00 0.00 -1.81 0.00 0.00 61.98 59.43 1fie s VAL 84 Cb -0.12 -0.96 0.03 0.00 0.56 0.00 0.00 36.38 35.88 1fie s VAL 84 CO 0.13 -0.53 -0.02 -1.58 -0.31 0.00 0.00 175.10 172.79 1fie s GLN 85 N -2.73 0.65 -0.18 4.82 0.74 0.21 -0.43 119.66 122.74 1fie s GLN 85 Ca -0.04 0.02 -0.08 0.00 0.05 0.00 0.00 55.36 55.31 1fie s GLN 85 Cb -0.00 -0.85 -0.04 0.00 1.10 0.00 0.00 33.01 33.22 1fie s GLN 85 CO -0.05 -0.19 0.09 0.42 -0.55 0.00 0.00 175.29 175.01 1fie s ILE 86 N 1.40 5.01 -0.36 -2.34 1.01 -0.33 0.57 121.20 126.17 1fie s ILE 86 Ca -0.04 0.05 -0.12 0.00 0.00 0.00 0.00 60.65 60.54 1fie s ILE 86 Cb -0.13 -3.26 0.01 0.00 0.01 0.00 0.00 42.46 39.08 1fie s ILE 86 CO -0.03 0.46 0.22 -1.81 0.00 0.00 0.00 174.94 173.79 1fie s ASP 87 N 0.28 5.84 0.58 3.58 1.01 0.17 -1.83 116.67 126.30 1fie s ASP 87 Ca 0.05 -0.76 -0.01 0.00 0.71 0.00 0.00 52.55 52.55 1fie s ASP 87 Cb -0.12 -2.07 0.04 0.00 1.01 0.00 0.00 42.92 41.78 1fie s ASP 87 CO -0.00 -0.33 0.83 -0.36 0.21 0.00 0.00 175.17 175.51 1fie s PHE 88 N 1.63 2.91 -0.93 4.23 0.08 -0.63 0.20 117.98 125.47 1fie s PHE 88 Ca 0.04 0.13 0.21 0.00 0.12 0.00 0.00 56.93 57.44 1fie s PHE 88 Cb -0.18 -2.82 0.89 0.00 -0.57 0.00 0.00 43.02 40.33 1fie s PHE 88 CO 0.08 -0.96 1.68 -1.13 -0.10 0.00 0.00 175.22 174.79 1fie n SER 89 N -2.46 0.12 -3.60 1.36 3.41 0.21 -4.56 113.62 108.11 1fie n SER 89 Ca 0.07 0.52 -0.05 0.00 -0.26 0.00 0.00 58.87 59.16 1fie n SER 89 Cb 0.60 -0.55 -0.03 0.00 -0.26 0.00 0.00 64.21 63.97 1fie n SER 89 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1fie s ARG 90 N -3.04 0.30 0.37 4.33 1.04 -1.26 -4.97 118.95 115.71 1fie s ARG 90 Ca 0.09 -0.06 -0.18 0.00 -1.04 0.00 0.00 55.73 54.55 1fie s ARG 90 Cb 0.13 0.14 -0.13 0.00 -2.04 0.00 0.00 34.95 33.04 1fie s ARG 90 CO 0.39 -0.12 0.04 -2.30 -0.04 0.00 0.00 175.30 173.27 1fie n PRO 91 N 0.13 0.00 -2.89 3.89 -0.02 -1.26 -4.82 135.00 130.03 1fie n PRO 91 Ca -0.01 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.04 1fie n PRO 91 Cb 0.58 -0.87 -0.04 0.00 -0.02 0.00 0.00 33.50 33.15 1fie n PRO 91 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 1fie s TYR 92 N -1.51 2.83 -0.44 6.00 5.04 -1.26 -5.00 117.35 123.00 1fie s TYR 92 Ca 0.51 -0.12 -0.21 0.00 -2.44 0.00 0.00 57.07 54.82 1fie s TYR 92 Cb -0.53 -4.00 0.02 0.00 0.35 0.00 0.00 41.96 37.80 1fie s TYR 92 CO 0.55 -1.32 0.64 0.34 -1.34 0.00 0.00 175.55 174.42 1fie s ASP 93 N 2.86 6.32 0.00 4.32 -1.08 -1.26 -4.92 116.67 122.91 1fie s ASP 93 Ca 0.28 -0.36 0.00 0.00 -0.52 0.00 0.00 52.55 51.95 1fie s ASP 93 Cb -0.14 -2.32 0.00 0.00 -1.46 0.00 0.00 42.92 39.01 1fie s ASP 93 CO 0.18 -0.78 0.22 -2.65 0.52 0.00 0.00 175.17 172.66 1fie n PRO 94 N 6.24 0.00 0.00 4.34 -0.02 -1.26 -1.47 135.00 142.84 1fie n PRO 94 Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.46 1fie n PRO 94 Cb 0.48 -1.27 0.00 0.00 -0.02 0.00 0.00 33.50 32.69 1fie n PRO 94 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 1fie n ARG 95 N -0.67 0.00 0.22 -0.52 0.63 -1.26 -4.78 116.66 110.28 1fie n ARG 95 Ca 0.00 0.00 0.15 0.00 -0.92 0.00 0.00 57.85 57.08 1fie n ARG 95 Cb 0.00 -0.08 0.80 0.00 0.45 0.00 0.00 32.46 33.63 1fie n ARG 95 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1fie h ARG 96 N 0.00 0.00 -6.33 -0.14 2.47 -1.99 -3.43 114.38 104.96 1fie h ARG 96 Ca 0.00 0.00 -0.56 0.00 -1.26 0.00 0.00 59.98 58.16 1fie h ARG 96 Cb 0.00 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 28.28 1fie h ARG 96 CO 0.00 0.00 -0.05 -0.51 0.56 0.00 0.00 179.97 179.97 1fie s ASP 97 N -6.19 6.90 -0.19 7.04 1.01 -0.54 -5.00 116.67 119.71 1fie s ASP 97 Ca -0.05 1.15 -0.08 0.00 0.71 0.00 0.00 52.55 54.29 1fie s ASP 97 Cb 0.16 -2.32 0.08 0.00 1.01 0.00 0.00 42.92 41.85 1fie s ASP 97 CO 0.59 0.13 0.42 -0.22 0.21 0.00 0.00 175.17 176.30 1fie s LEU 98 N -1.77 -0.50 0.29 1.23 1.98 -1.26 -4.80 118.68 113.86 1fie s LEU 98 Ca 0.36 0.96 -0.20 0.00 -2.89 0.00 0.00 54.13 52.36 1fie s LEU 98 Cb -0.16 1.35 0.03 0.00 0.66 0.00 0.00 46.19 48.06 1fie s LEU 98 CO 0.19 -0.22 0.74 0.72 -1.89 0.00 0.00 176.35 175.88 1fie s PHE 99 N 2.28 -0.14 -0.08 5.38 -0.71 -1.26 -2.12 117.98 121.33 1fie s PHE 99 Ca -0.04 -0.35 -0.30 0.00 -1.04 0.00 0.00 56.93 55.21 1fie s PHE 99 Cb -0.11 0.73 0.10 0.00 -1.21 0.00 0.00 43.02 42.53 1fie s PHE 99 CO -0.13 -1.28 0.86 -0.98 -1.34 0.00 0.00 175.22 172.35 1fie s ARG 100 N -3.66 0.82 0.39 1.99 1.70 -0.75 -4.44 118.95 115.00 1fie s ARG 100 Ca 0.12 0.06 -0.09 0.00 -0.47 0.00 0.00 55.73 55.34 1fie s ARG 100 Cb -0.06 0.38 -0.06 0.00 -0.57 0.00 0.00 34.95 34.65 1fie s ARG 100 CO 0.08 -0.28 0.74 0.08 -1.08 0.00 0.00 175.30 174.83 1fie s VAL 101 N -1.67 4.83 -0.00 4.99 1.01 -1.19 -1.44 120.40 126.93 1fie s VAL 101 Ca -0.03 0.50 0.02 0.00 0.00 0.00 0.00 61.98 62.47 1fie s VAL 101 Cb -0.00 -3.74 -0.01 0.00 0.00 0.00 0.00 36.38 32.63 1fie s VAL 101 CO 0.01 -0.52 -0.05 -1.61 0.00 0.00 0.00 175.10 172.93 1fie s GLU 102 N -3.88 0.42 -0.08 2.72 2.02 -0.37 0.55 118.70 120.10 1fie s GLU 102 Ca 0.50 -0.22 0.04 0.00 0.02 0.00 0.00 54.97 55.31 1fie s GLU 102 Cb -0.10 -0.39 0.00 0.00 0.10 0.00 0.00 34.13 33.74 1fie s GLU 102 CO 0.32 0.11 -0.19 0.71 0.02 0.00 0.00 175.26 176.23 1fie s TYR 103 N -0.19 2.03 0.00 1.61 2.02 -0.19 -2.40 117.35 120.23 1fie s TYR 103 Ca 0.01 -0.77 -0.01 0.00 -0.37 0.00 0.00 57.07 55.94 1fie s TYR 103 Cb -0.02 -1.39 -0.01 0.00 -0.40 0.00 0.00 41.96 40.14 1fie s TYR 103 CO -0.00 -0.32 0.00 0.14 -1.57 0.00 0.00 175.55 173.80 1fie s VAL 104 N 0.39 0.04 -0.01 0.71 -7.23 -1.05 0.08 120.40 113.35 1fie s VAL 104 Ca -0.15 -0.37 0.01 0.00 -1.81 0.00 0.00 61.98 59.67 1fie s VAL 104 Cb -0.16 -0.13 0.00 0.00 0.56 0.00 0.00 36.38 36.65 1fie s VAL 104 CO 0.06 -0.20 -0.04 -0.63 -0.31 0.00 0.00 175.10 173.98 1fie s ILE 105 N -0.60 0.35 0.00 -0.62 1.09 -0.51 -2.19 121.20 118.73 1fie s ILE 105 Ca -0.07 -0.14 0.00 0.00 -1.10 0.00 0.00 60.65 59.34 1fie s ILE 105 Cb -0.04 -0.33 0.00 0.00 -1.06 0.00 0.00 42.46 41.03 1fie s ILE 105 CO -0.00 0.12 0.00 0.61 -0.10 0.00 0.00 174.94 175.57 1fie n GLY 106 N 3.28 -2.27 0.27 6.18 0.00 -1.24 -4.26 105.19 107.15 1fie n GLY 106 Ca -0.17 -1.47 0.12 0.00 0.00 0.00 0.00 46.02 44.50 1fie n GLY 106 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1fie h ARG 107 N -0.01 0.00 -2.19 1.61 2.43 -1.83 -3.30 114.38 111.09 1fie h ARG 107 Ca -0.00 0.00 -0.56 0.00 -0.81 0.00 0.00 59.98 58.61 1fie h ARG 107 Cb 0.01 0.00 -0.41 0.00 -0.42 0.00 0.00 29.97 29.15 1fie h ARG 107 CO 0.00 0.05 -0.82 0.66 -1.51 0.00 0.00 179.97 178.35 1fie n TYR 108 N -3.99 2.75 -1.72 2.20 4.01 -1.26 -4.24 117.16 114.92 1fie n TYR 108 Ca -0.03 -3.94 -0.40 0.00 -0.16 0.00 0.00 57.90 53.37 1fie n TYR 108 Cb 0.14 -0.47 0.02 0.00 -0.31 0.00 0.00 39.34 38.72 1fie n TYR 108 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1fie n PRO 109 N -0.02 1.89 -3.74 -0.72 -0.02 -1.25 -4.83 135.00 126.31 1fie n PRO 109 Ca 0.29 0.68 -0.12 0.00 -2.02 0.00 0.00 63.50 62.33 1fie n PRO 109 Cb 0.48 -2.46 -0.11 0.00 -0.02 0.00 0.00 33.50 31.39 1fie n PRO 109 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1fie s GLN 110 N -2.42 0.34 0.42 -0.52 -0.21 -1.26 -4.86 119.66 111.15 1fie s GLN 110 Ca 0.64 0.54 0.08 0.00 0.02 0.00 0.00 55.36 56.64 1fie s GLN 110 Cb -0.47 0.07 0.90 0.00 1.00 0.00 0.00 33.01 34.50 1fie s GLN 110 CO 0.56 -0.10 2.06 1.49 -2.12 0.00 0.00 175.29 177.18 1fie h GLU 111 N 6.32 0.47 -0.98 2.91 4.81 -1.93 -2.60 114.58 123.58 1fie h GLU 111 Ca -0.32 -0.03 0.18 0.00 -0.13 0.00 0.00 59.36 59.06 1fie h GLU 111 Cb 1.18 -0.11 -0.10 0.00 0.63 0.00 0.00 28.75 30.35 1fie h GLU 111 CO 0.32 0.32 0.58 -0.91 -0.73 0.00 0.00 179.01 178.60 1fie h ASN 112 N 0.49 0.75 -0.53 1.04 -0.26 -1.96 -2.40 115.58 112.70 1fie h ASN 112 Ca 0.13 0.10 0.00 0.00 -0.56 0.00 0.00 56.30 55.97 1fie h ASN 112 Cb -0.04 -0.04 0.00 0.00 -1.06 0.00 0.00 38.32 37.19 1fie h ASN 112 CO -0.03 0.27 0.00 0.29 -1.06 0.00 0.00 177.43 176.91 1fie n LYS 113 N -4.78 3.18 -1.23 0.81 4.76 -1.00 -4.96 118.16 114.94 1fie n LYS 113 Ca 0.22 -2.60 -0.08 0.00 -2.87 0.00 0.00 58.31 52.99 1fie n LYS 113 Cb 0.55 -1.64 -0.03 0.00 -1.84 0.00 0.00 35.03 32.07 1fie n LYS 113 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1fie n GLY 114 N 0.87 0.96 0.54 0.72 0.00 -0.90 -4.64 105.19 102.73 1fie n GLY 114 Ca 0.21 -0.45 0.13 0.00 0.00 0.00 0.00 46.02 45.90 1fie n GLY 114 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1fie n THR 115 N -2.67 0.00 -3.43 2.61 -2.24 -1.08 -4.64 114.28 102.82 1fie n THR 115 Ca -0.08 -0.28 -0.14 0.00 -2.27 0.00 0.00 64.05 61.27 1fie n THR 115 Cb 0.31 0.82 -0.11 0.00 -2.10 0.00 0.00 70.33 69.25 1fie n THR 115 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1fie s TYR 116 N -2.18 -0.51 -0.24 4.78 5.04 -1.23 -1.42 117.35 121.59 1fie s TYR 116 Ca 0.30 0.46 0.02 0.00 -2.44 0.00 0.00 57.07 55.41 1fie s TYR 116 Cb 0.20 -0.21 0.05 0.00 0.35 0.00 0.00 41.96 42.35 1fie s TYR 116 CO 0.40 -0.66 -0.13 0.42 -1.34 0.00 0.00 175.55 174.24 1fie s ILE 117 N 2.42 2.19 -0.42 3.14 1.01 0.11 -4.06 121.20 125.58 1fie s ILE 117 Ca 0.09 -1.42 -0.20 0.00 0.00 0.00 0.00 60.65 59.13 1fie s ILE 117 Cb -0.16 -2.18 0.02 0.00 0.01 0.00 0.00 42.46 40.15 1fie s ILE 117 CO -0.14 0.13 0.59 -2.16 0.00 0.00 0.00 174.94 173.37 1fie s PRO 118 N 1.17 3.29 -0.78 2.79 0.04 -1.26 -1.02 135.00 139.22 1fie s PRO 118 Ca -0.05 -0.41 -0.25 0.00 0.04 0.00 0.00 61.00 60.34 1fie s PRO 118 Cb -0.18 -3.93 0.05 0.00 0.04 0.00 0.00 34.50 30.47 1fie s PRO 118 CO -0.07 -0.94 1.22 0.08 0.04 0.00 0.00 177.00 177.34 1fie s VAL 119 N 2.65 3.96 0.11 -0.36 1.01 0.19 -4.97 120.40 122.99 1fie s VAL 119 Ca 0.20 -0.09 -0.31 0.00 0.00 0.00 0.00 61.98 61.78 1fie s VAL 119 Cb -0.15 -4.88 -0.08 0.00 0.00 0.00 0.00 36.38 31.27 1fie s VAL 119 CO 0.17 -1.76 1.39 -2.16 0.00 0.00 0.00 175.10 172.74 1fie s PRO 120 N 5.03 4.32 -0.01 2.72 0.04 -1.26 -3.15 135.00 142.68 1fie s PRO 120 Ca 0.34 2.07 -0.30 0.00 0.04 0.00 0.00 61.00 63.14 1fie s PRO 120 Cb -0.09 -3.26 -0.06 0.00 0.04 0.00 0.00 34.50 31.14 1fie s PRO 120 CO 0.08 -0.44 1.47 0.96 0.04 0.00 0.00 177.00 179.11 1fie s ILE 121 N 1.13 3.64 0.21 0.56 -5.25 -1.26 -1.92 121.20 118.32 1fie s ILE 121 Ca 0.64 0.98 0.07 0.00 -0.99 0.00 0.00 60.65 61.35 1fie s ILE 121 Cb -0.37 -3.63 -0.04 0.00 2.95 0.00 0.00 42.46 41.38 1fie s ILE 121 CO 0.30 -0.02 0.10 -0.69 -1.79 0.00 0.00 174.94 172.84 1fie s VAL 122 N 2.79 4.12 -0.07 8.37 1.01 0.36 -4.81 120.40 132.17 1fie s VAL 122 Ca 0.66 -1.40 -0.17 0.00 0.00 0.00 0.00 61.98 61.07 1fie s VAL 122 Cb -0.32 -3.15 -0.13 0.00 0.00 0.00 0.00 36.38 32.78 1fie s VAL 122 CO 0.27 -0.23 0.63 0.77 0.00 0.00 0.00 175.10 176.54 1fie h SER 123 N 2.10 -0.15 -3.27 3.32 4.64 -1.93 -3.32 113.55 114.94 1fie h SER 123 Ca -0.47 -0.34 -0.67 0.00 -0.47 0.00 0.00 61.79 59.84 1fie h SER 123 Cb 1.22 0.04 -0.34 0.00 -0.31 0.00 0.00 62.40 63.01 1fie h SER 123 CO 0.61 0.45 -0.87 -0.70 -0.87 0.00 0.00 176.83 175.45 1fie s GLU 124 N -2.80 2.96 -0.41 4.77 2.56 -1.26 -4.77 118.70 119.75 1fie s GLU 124 Ca -0.10 -0.84 -0.28 0.00 0.00 0.00 0.00 54.97 53.75 1fie s GLU 124 Cb -0.00 -2.33 -0.02 0.00 2.00 0.00 0.00 34.13 33.78 1fie s GLU 124 CO 0.38 0.06 1.81 -0.51 -0.56 0.00 0.00 175.26 176.44 1fie s LEU 125 N 0.62 3.45 0.51 2.70 1.43 -1.26 -5.00 118.68 121.13 1fie s LEU 125 Ca -0.12 1.01 -0.17 0.00 -1.03 0.00 0.00 54.13 53.82 1fie s LEU 125 Cb -0.17 -3.21 -0.08 0.00 0.03 0.00 0.00 46.19 42.76 1fie s LEU 125 CO 0.03 -1.91 0.99 0.00 0.23 0.00 0.00 176.35 175.68 1fie s GLN 126 N 6.08 3.93 0.34 1.70 0.00 -1.26 -5.02 119.66 125.42 1fie s GLN 126 Ca 0.76 1.01 -0.27 0.00 -0.00 0.00 0.00 55.36 56.86 1fie s GLN 126 Cb -0.19 -2.13 -0.09 0.00 0.00 0.00 0.00 33.01 30.59 1fie s GLN 126 CO 0.30 -0.29 1.15 -1.12 0.00 0.00 0.00 175.29 175.33 1fie s SER 127 N -2.89 6.90 0.00 12.60 0.01 -1.26 -3.61 113.70 125.45 1fie s SER 127 Ca 0.60 2.33 0.00 0.00 1.31 0.00 0.00 55.95 60.19 1fie s SER 127 Cb -0.10 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.50 1fie s SER 127 CO 0.29 -0.41 0.00 0.61 0.41 0.00 0.00 173.24 174.14 1fie n GLY 128 N 0.86 2.77 3.66 3.44 0.00 -1.26 -5.00 105.19 109.66 1fie n GLY 128 Ca 0.01 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.77 1fie n GLY 128 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fie s LYS 129 N 0.00 2.41 0.25 1.61 1.02 -1.24 -4.35 119.74 119.44 1fie s LYS 129 Ca 0.00 -1.09 -0.30 0.00 0.02 0.00 0.00 55.97 54.61 1fie s LYS 129 Cb 0.00 -2.37 -0.09 0.00 -0.52 0.00 0.00 37.83 34.85 1fie s LYS 129 CO 0.00 0.46 1.00 -1.58 -0.92 0.00 0.00 175.35 174.32 1fie s TRP 130 N -1.69 3.82 -0.16 3.18 0.52 -1.26 -4.44 118.94 118.92 1fie s TRP 130 Ca 0.27 1.82 -0.32 0.00 0.02 0.00 0.00 56.10 57.90 1fie s TRP 130 Cb -0.09 -3.10 0.14 0.00 -1.15 0.00 0.00 33.47 29.26 1fie s TRP 130 CO 0.18 0.05 1.11 0.20 0.02 0.00 0.00 176.95 178.51 1fie s GLY 131 N -0.97 -0.26 -0.09 0.98 0.00 -1.04 -4.66 107.32 101.28 1fie s GLY 131 Ca 0.43 1.78 -0.01 0.00 0.00 0.00 0.00 44.72 46.92 1fie s GLY 131 CO 0.35 0.71 -0.02 0.00 0.00 0.00 0.00 173.10 174.14 1fie s ALA 132 N -2.01 0.93 -0.13 3.20 0.00 -0.81 -0.94 121.76 122.02 1fie s ALA 132 Ca 0.06 -0.30 -0.13 0.00 0.00 0.00 0.00 51.96 51.58 1fie s ALA 132 Cb -0.01 -0.83 -0.05 0.00 0.00 0.00 0.00 23.12 22.24 1fie s ALA 132 CO -0.04 -0.48 0.28 0.21 0.00 0.00 0.00 175.76 175.73 1fie s LYS 133 N 1.87 4.09 -0.67 0.00 2.20 -0.23 0.14 119.74 127.14 1fie s LYS 133 Ca 0.05 0.10 -0.27 0.00 -0.36 0.00 0.00 55.97 55.49 1fie s LYS 133 Cb -0.13 -3.36 0.03 0.00 -1.51 0.00 0.00 37.83 32.87 1fie s LYS 133 CO -0.06 0.39 1.20 0.42 -0.36 0.00 0.00 175.35 176.94 1fie s ILE 134 N 0.01 3.90 -0.11 5.43 1.01 -1.26 -1.05 121.20 129.13 1fie s ILE 134 Ca 0.17 0.47 0.14 0.00 0.00 0.00 0.00 60.65 61.43 1fie s ILE 134 Cb -0.13 -4.82 -0.00 0.00 0.01 0.00 0.00 42.46 37.52 1fie s ILE 134 CO 0.05 -1.63 1.35 1.62 0.00 0.00 0.00 174.94 176.33 1fie h VAL 135 N 6.06 0.95 -1.29 2.92 3.04 -1.52 -3.48 116.25 122.94 1fie h VAL 135 Ca -0.27 -2.38 0.16 0.00 -1.01 0.00 0.00 66.70 63.19 1fie h VAL 135 Cb 1.06 2.45 -0.30 0.00 -2.01 0.00 0.00 31.29 32.48 1fie h VAL 135 CO 1.23 0.54 0.60 -0.32 -1.01 0.00 0.00 177.57 178.61 1fie s MET 136 N -2.92 0.21 -0.20 4.17 -2.45 -1.15 -5.02 119.30 111.94 1fie s MET 136 Ca 0.03 0.34 0.01 0.00 -1.25 0.00 0.00 55.69 54.82 1fie s MET 136 Cb 0.08 0.05 0.04 0.00 1.25 0.00 0.00 34.83 36.25 1fie s MET 136 CO 0.76 -0.04 -0.13 -0.98 1.05 0.00 0.00 175.02 175.68 1fie s ARG 137 N 1.00 2.31 0.52 4.11 1.70 -1.26 -0.92 118.95 126.42 1fie s ARG 137 Ca -0.06 -0.92 0.06 0.00 -0.47 0.00 0.00 55.73 54.34 1fie s ARG 137 Cb -0.03 -2.52 0.05 0.00 -0.57 0.00 0.00 34.95 31.88 1fie s ARG 137 CO -0.12 -0.39 0.72 -1.83 -1.08 0.00 0.00 175.30 172.60 1fie s GLU 138 N 1.32 2.50 -0.44 3.89 -1.05 -1.08 -4.97 118.70 118.87 1fie s GLU 138 Ca -0.01 -1.23 -0.42 0.00 -0.15 0.00 0.00 54.97 53.16 1fie s GLU 138 Cb -0.16 -2.62 -0.17 0.00 -0.44 0.00 0.00 34.13 30.74 1fie s GLU 138 CO -0.09 -0.65 2.08 -0.40 0.95 0.00 0.00 175.26 177.15 1fie n ASP 139 N -2.17 1.27 0.00 0.83 5.75 -1.26 -0.93 116.55 120.03 1fie n ASP 139 Ca 0.11 0.68 0.00 0.00 -0.01 0.00 0.00 54.79 55.56 1fie n ASP 139 Cb 0.60 -1.01 0.00 0.00 -1.03 0.00 0.00 41.12 39.68 1fie n ASP 139 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1fie n ARG 140 N 7.26 0.00 -4.21 0.11 1.74 -1.26 -4.96 116.66 115.34 1fie n ARG 140 Ca 0.47 0.00 -0.26 0.00 -0.77 0.00 0.00 57.85 57.29 1fie n ARG 140 Cb 0.04 -2.60 -0.08 0.00 -1.02 0.00 0.00 32.46 28.81 1fie n ARG 140 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1fie s SER 141 N -2.92 4.79 -0.01 0.55 0.01 -0.11 -1.61 113.70 114.40 1fie s SER 141 Ca 0.00 -0.40 0.01 0.00 1.31 0.00 0.00 55.95 56.87 1fie s SER 141 Cb 0.00 -1.03 0.00 0.00 0.21 0.00 0.00 66.02 65.21 1fie s SER 141 CO 0.00 0.08 -0.05 -0.69 0.41 0.00 0.00 173.24 172.99 1fie s VAL 142 N -1.78 0.43 -0.17 3.43 1.01 -0.76 -2.64 120.40 119.93 1fie s VAL 142 Ca 0.28 -0.19 -0.03 0.00 0.00 0.00 0.00 61.98 62.04 1fie s VAL 142 Cb -0.09 -0.39 -0.02 0.00 0.00 0.00 0.00 36.38 35.88 1fie s VAL 142 CO 0.19 0.14 -0.06 -0.60 0.00 0.00 0.00 175.10 174.77 1fie s ARG 143 N 0.15 3.52 0.25 2.72 6.06 -0.09 -1.19 118.95 130.38 1fie s ARG 143 Ca -0.01 -0.59 0.11 0.00 -2.50 0.00 0.00 55.73 52.73 1fie s ARG 143 Cb -0.05 -2.87 -0.05 0.00 0.06 0.00 0.00 34.95 32.04 1fie s ARG 143 CO -0.00 0.12 -0.14 -0.51 -2.50 0.00 0.00 175.30 172.26 1fie s LEU 144 N 0.66 2.77 -0.28 -0.88 1.43 0.42 -1.28 118.68 121.52 1fie s LEU 144 Ca -0.04 -0.86 0.02 0.00 -1.03 0.00 0.00 54.13 52.23 1fie s LEU 144 Cb -0.15 -1.33 0.08 0.00 0.03 0.00 0.00 46.19 44.82 1fie s LEU 144 CO 0.02 0.05 -0.02 -0.55 0.23 0.00 0.00 176.35 176.09 1fie s SER 145 N -3.36 4.30 -0.15 2.29 0.15 -0.22 -2.64 113.70 114.07 1fie s SER 145 Ca 0.28 -1.59 -0.08 0.00 0.70 0.00 0.00 55.95 55.27 1fie s SER 145 Cb -0.06 -1.37 -0.04 0.00 -1.71 0.00 0.00 66.02 62.84 1fie s SER 145 CO 0.16 -0.29 0.13 -0.63 1.20 0.00 0.00 173.24 173.80 1fie s ILE 146 N 1.20 5.39 -0.09 6.45 1.01 -0.39 -1.06 121.20 133.70 1fie s ILE 146 Ca 0.00 0.17 0.03 0.00 0.00 0.00 0.00 60.65 60.86 1fie s ILE 146 Cb -0.19 -3.39 0.00 0.00 0.01 0.00 0.00 42.46 38.90 1fie s ILE 146 CO -0.09 0.55 -0.21 -1.58 0.00 0.00 0.00 174.94 173.62 1fie s GLN 147 N -0.50 2.72 0.38 2.79 0.74 -0.11 -1.07 119.66 124.62 1fie s GLN 147 Ca 0.12 -0.77 -0.07 0.00 0.05 0.00 0.00 55.36 54.69 1fie s GLN 147 Cb -0.12 -2.10 -0.05 0.00 1.10 0.00 0.00 33.01 31.84 1fie s GLN 147 CO 0.02 0.13 0.70 -1.54 -0.55 0.00 0.00 175.29 174.05 1fie s SER 148 N 0.46 6.44 0.19 6.67 1.04 -1.26 -2.48 113.70 124.75 1fie s SER 148 Ca -0.17 0.94 -0.30 0.00 0.48 0.00 0.00 55.95 56.90 1fie s SER 148 Cb -0.17 -2.24 -0.08 0.00 0.10 0.00 0.00 66.02 63.63 1fie s SER 148 CO 0.07 -0.37 1.02 -0.55 0.98 0.00 0.00 173.24 174.39 1fie s SER 149 N -3.39 7.42 0.64 7.02 0.15 -1.26 -2.74 113.70 121.54 1fie s SER 149 Ca 0.48 2.00 0.32 0.00 0.70 0.00 0.00 55.95 59.45 1fie s SER 149 Cb -0.10 -2.60 1.73 0.00 -1.71 0.00 0.00 66.02 63.33 1fie s SER 149 CO 0.34 -0.07 2.01 1.55 1.20 0.00 0.00 173.24 178.27 1fie h PRO 150 N 4.81 0.00 -0.65 5.44 0.13 -1.87 -0.21 132.00 139.65 1fie h PRO 150 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1fie h PRO 150 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1fie h PRO 150 CO 0.70 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 180.10 1fie n LYS 151 N -3.22 2.69 -0.69 0.86 5.02 -1.26 -4.64 118.16 116.92 1fie n LYS 151 Ca 0.00 -2.38 -0.32 0.00 -2.02 0.00 0.00 58.31 53.59 1fie n LYS 151 Cb 0.37 -1.57 0.17 0.00 -0.02 0.00 0.00 35.03 33.98 1fie n LYS 151 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1fie s ILE 153 N -2.34 4.79 -0.05 0.00 1.01 -1.26 -4.53 121.20 118.83 1fie s ILE 153 Ca 0.59 0.88 -0.18 0.00 0.00 0.00 0.00 60.65 61.94 1fie s ILE 153 Cb -0.18 -3.73 -0.05 0.00 0.01 0.00 0.00 42.46 38.51 1fie s ILE 153 CO 0.66 0.15 0.48 -0.69 0.00 0.00 0.00 174.94 175.55 1fie s VAL 154 N -1.57 5.05 -5.00 2.92 1.01 -1.03 -4.83 120.40 116.95 1fie s VAL 154 Ca 0.42 0.99 0.00 0.00 0.00 0.00 0.00 61.98 63.39 1fie s VAL 154 Cb -0.14 -3.81 0.00 0.00 0.00 0.00 0.00 36.38 32.42 1fie s VAL 154 CO 0.20 0.44 0.00 0.61 0.00 0.00 0.00 175.10 176.34 1fie n GLY 155 N 2.56 -1.55 3.50 4.51 0.00 -1.00 -4.83 105.19 108.38 1fie n GLY 155 Ca -0.09 -1.49 -0.43 0.00 0.00 0.00 0.00 46.02 44.01 1fie n GLY 155 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1fie s LYS 156 N -1.78 3.26 0.56 1.61 2.20 -1.26 -2.05 119.74 122.28 1fie s LYS 156 Ca 0.00 -0.46 -0.05 0.00 -0.36 0.00 0.00 55.97 55.11 1fie s LYS 156 Cb 0.00 -4.01 0.00 0.00 -1.51 0.00 0.00 37.83 32.31 1fie s LYS 156 CO 0.00 -1.19 0.85 -0.06 -0.36 0.00 0.00 175.35 174.59 1fie s PHE 157 N 3.08 3.26 -0.14 4.03 0.40 0.12 -4.88 117.98 123.85 1fie s PHE 157 Ca 0.23 0.57 -0.00 0.00 -0.60 0.00 0.00 56.93 57.13 1fie s PHE 157 Cb -0.15 -2.65 -0.01 0.00 0.51 0.00 0.00 43.02 40.72 1fie s PHE 157 CO 0.18 -0.72 -0.13 1.03 0.70 0.00 0.00 175.22 176.27 1fie s ARG 158 N -4.90 3.36 -0.04 0.44 0.52 -0.93 -1.66 118.95 115.74 1fie s ARG 158 Ca 0.53 -0.69 -0.06 0.00 -0.52 0.00 0.00 55.73 54.98 1fie s ARG 158 Cb -0.10 -2.64 -0.04 0.00 0.52 0.00 0.00 34.95 32.68 1fie s ARG 158 CO 0.44 0.17 0.22 1.41 0.02 0.00 0.00 175.30 177.55 1fie s MET 159 N 0.47 3.53 -0.07 3.54 -2.45 -1.26 -2.51 119.30 120.55 1fie s MET 159 Ca -0.10 -0.11 -0.12 0.00 -1.25 0.00 0.00 55.69 54.12 1fie s MET 159 Cb -0.16 -3.13 0.03 0.00 1.25 0.00 0.00 34.83 32.82 1fie s MET 159 CO 0.05 0.70 0.30 0.71 1.05 0.00 0.00 175.02 177.82 1fie s TYR 160 N -1.20 -0.25 -0.11 4.11 2.02 -1.01 -4.72 117.35 116.18 1fie s TYR 160 Ca 0.23 0.55 -0.01 0.00 -0.37 0.00 0.00 57.07 57.47 1fie s TYR 160 Cb -0.13 0.10 -0.03 0.00 -0.40 0.00 0.00 41.96 41.50 1fie s TYR 160 CO 0.13 -0.26 -0.05 0.08 -1.57 0.00 0.00 175.55 173.87 1fie s VAL 161 N -0.52 3.80 -0.02 0.71 1.01 -1.26 -1.23 120.40 122.89 1fie s VAL 161 Ca -0.06 -0.42 0.06 0.00 0.00 0.00 0.00 61.98 61.56 1fie s VAL 161 Cb -0.04 -2.60 -0.01 0.00 0.00 0.00 0.00 36.38 33.73 1fie s VAL 161 CO 0.02 0.56 -0.20 0.00 0.00 0.00 0.00 175.10 175.48 1fie s ALA 162 N -0.33 1.67 -0.19 5.51 0.00 -0.52 -2.10 121.76 125.80 1fie s ALA 162 Ca 0.05 -0.85 0.00 0.00 0.00 0.00 0.00 51.96 51.16 1fie s ALA 162 Cb -0.12 -0.45 0.01 0.00 0.00 0.00 0.00 23.12 22.56 1fie s ALA 162 CO 0.02 0.39 -0.17 0.08 0.00 0.00 0.00 175.76 176.09 1fie s VAL 163 N -0.38 2.33 -0.28 0.00 1.01 0.87 -1.81 120.40 122.14 1fie s VAL 163 Ca 0.05 -0.86 -0.28 0.00 0.00 0.00 0.00 61.98 60.90 1fie s VAL 163 Cb -0.09 -2.00 0.01 0.00 0.00 0.00 0.00 36.38 34.30 1fie s VAL 163 CO -0.00 0.51 1.00 0.26 0.00 0.00 0.00 175.10 176.86 1fie s TRP 164 N 1.33 3.23 0.28 5.22 0.52 -0.90 -1.44 118.94 127.17 1fie s TRP 164 Ca 0.05 1.21 0.07 0.00 0.02 0.00 0.00 56.10 57.45 1fie s TRP 164 Cb -0.13 -3.43 -0.03 0.00 -1.15 0.00 0.00 33.47 28.72 1fie s TRP 164 CO -0.11 -0.62 0.29 0.95 0.02 0.00 0.00 176.95 177.48 1fie s THR 165 N 3.33 4.32 -0.70 2.01 -4.23 0.25 -4.64 115.64 115.99 1fie s THR 165 Ca 0.42 -1.27 0.17 0.00 -1.18 0.00 0.00 61.69 59.83 1fie s THR 165 Cb -0.14 -3.43 0.16 0.00 1.34 0.00 0.00 72.50 70.43 1fie s THR 165 CO 0.11 -0.28 1.52 -0.81 -0.54 0.00 0.00 174.62 174.62 1fie n PRO 166 N -1.33 0.09 -0.12 3.99 -0.04 -1.26 -2.47 135.00 133.86 1fie n PRO 166 Ca -0.06 0.40 0.06 0.00 -0.04 0.00 0.00 63.50 63.87 1fie n PRO 166 Cb 0.58 -1.70 0.13 0.00 -0.04 0.00 0.00 33.50 32.47 1fie n PRO 166 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1fie n TYR 167 N -1.88 0.33 0.00 0.54 4.01 -1.26 -5.04 117.16 113.86 1fie n TYR 167 Ca 0.02 -0.30 0.00 0.00 -0.16 0.00 0.00 57.90 57.45 1fie n TYR 167 Cb 0.15 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.17 1fie n TYR 167 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1fie n GLY 168 N 0.70 -0.07 2.98 2.72 0.00 -1.03 -0.25 105.19 110.23 1fie n GLY 168 Ca 0.11 -0.96 -0.21 0.00 0.00 0.00 0.00 46.02 44.96 1fie n GLY 168 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fie s VAL 169 N -4.00 0.79 -0.10 1.61 1.01 -0.01 -0.58 120.40 119.12 1fie s VAL 169 Ca 0.00 -0.33 -0.01 0.00 0.00 0.00 0.00 61.98 61.64 1fie s VAL 169 Cb 0.00 -0.72 -0.03 0.00 0.00 0.00 0.00 36.38 35.63 1fie s VAL 169 CO 0.00 0.26 -0.07 -0.76 0.00 0.00 0.00 175.10 174.53 1fie s LEU 170 N 0.39 3.15 0.09 3.92 1.43 -0.52 -0.66 118.68 126.47 1fie s LEU 170 Ca -0.06 -0.09 -0.13 0.00 -1.03 0.00 0.00 54.13 52.82 1fie s LEU 170 Cb -0.11 -1.71 0.02 0.00 0.03 0.00 0.00 46.19 44.42 1fie s LEU 170 CO 0.01 0.28 0.31 0.00 0.23 0.00 0.00 176.35 177.18 1fie s ARG 171 N -0.34 0.92 0.99 1.70 1.70 0.99 -0.09 118.95 124.83 1fie s ARG 171 Ca 0.05 -0.71 -0.12 0.00 -0.47 0.00 0.00 55.73 54.48 1fie s ARG 171 Cb -0.12 0.39 0.19 0.00 -0.57 0.00 0.00 34.95 34.84 1fie s ARG 171 CO 0.02 -0.32 1.08 0.95 -1.08 0.00 0.00 175.30 175.95 1fie s THR 172 N -3.41 2.30 0.20 4.99 -4.23 -0.89 -4.42 115.64 110.18 1fie s THR 172 Ca 0.01 0.10 0.05 0.00 -1.18 0.00 0.00 61.69 60.67 1fie s THR 172 Cb 0.02 -2.35 -0.04 0.00 1.34 0.00 0.00 72.50 71.47 1fie s THR 172 CO -0.09 -0.13 0.23 -0.94 -0.54 0.00 0.00 174.62 173.15 1fie s SER 173 N -2.98 5.84 -0.58 3.99 1.04 -1.26 -4.69 113.70 115.06 1fie s SER 173 Ca 0.66 -0.07 -0.38 0.00 0.48 0.00 0.00 55.95 56.64 1fie s SER 173 Cb -0.21 -1.61 -0.18 0.00 0.10 0.00 0.00 66.02 64.13 1fie s SER 173 CO 0.60 0.00 2.29 -1.14 0.98 0.00 0.00 173.24 175.97 1fie n ARG 174 N -0.86 0.27 -3.93 4.02 3.00 -1.26 -4.87 116.66 113.03 1fie n ARG 174 Ca -0.08 0.06 -0.30 0.00 -0.00 0.00 0.00 57.85 57.53 1fie n ARG 174 Cb 0.56 -1.79 -0.15 0.00 0.00 0.00 0.00 32.46 31.08 1fie n ARG 174 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.63 178.84 1fie s ASN 175 N 7.23 4.45 0.62 6.15 2.47 -1.26 -4.97 114.94 129.62 1fie s ASN 175 Ca 1.20 -2.31 0.30 0.00 0.42 0.00 0.00 52.86 52.48 1fie s ASN 175 Cb -1.25 -1.45 1.66 0.00 -1.45 0.00 0.00 41.25 38.75 1fie s ASN 175 CO 0.57 -0.34 2.02 -0.65 -3.72 0.00 0.00 177.10 174.97 1fie h PRO 176 N 7.36 0.00 0.00 0.43 0.11 -1.96 -2.03 132.00 135.92 1fie h PRO 176 Ca -0.06 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.97 1fie h PRO 176 Cb 0.98 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.08 1fie h PRO 176 CO 0.55 0.00 -0.36 0.93 -0.21 0.00 0.00 178.00 178.90 1fie h GLU 177 N 0.00 0.00 -0.24 1.05 4.39 -2.00 -3.07 114.58 114.71 1fie h GLU 177 Ca 0.09 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.79 1fie h GLU 177 Cb 0.69 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.34 1fie h GLU 177 CO -0.00 0.36 0.00 0.25 -1.16 0.00 0.00 179.01 178.46 1fie n THR 178 N -3.84 0.31 -1.71 1.13 -2.24 -0.76 -4.80 114.28 102.36 1fie n THR 178 Ca -0.01 -0.46 -0.42 0.00 -2.27 0.00 0.00 64.05 60.88 1fie n THR 178 Cb 0.43 0.52 -0.03 0.00 -2.10 0.00 0.00 70.33 69.15 1fie n THR 178 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1fie n ASP 179 N 0.64 4.02 -4.38 3.42 8.00 -1.16 -4.31 116.55 122.78 1fie n ASP 179 Ca 0.17 1.04 -0.33 0.00 0.71 0.00 0.00 54.79 56.37 1fie n ASP 179 Cb 0.40 -1.57 -0.14 0.00 -0.02 0.00 0.00 41.12 39.79 1fie n ASP 179 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1fie s THR 180 N 1.67 3.28 -0.16 -3.53 2.01 -0.66 -3.99 115.64 114.24 1fie s THR 180 Ca 0.77 -0.57 -0.20 0.00 0.31 0.00 0.00 61.69 62.00 1fie s THR 180 Cb -0.50 -2.41 -0.03 0.00 0.01 0.00 0.00 72.50 69.57 1fie s THR 180 CO 0.34 0.50 0.58 -0.31 -0.69 0.00 0.00 174.62 175.04 1fie s TYR 181 N 0.61 3.43 -0.27 4.92 1.51 -0.23 0.11 117.35 127.42 1fie s TYR 181 Ca -0.06 0.93 -0.03 0.00 -1.01 0.00 0.00 57.07 56.90 1fie s TYR 181 Cb -0.15 -2.72 0.02 0.00 -0.11 0.00 0.00 41.96 39.01 1fie s TYR 181 CO 0.03 -0.04 -0.01 0.42 -1.11 0.00 0.00 175.55 174.83 1fie s ILE 182 N 1.40 3.22 0.50 2.71 1.01 -0.87 -0.39 121.20 128.78 1fie s ILE 182 Ca 0.28 -0.98 0.08 0.00 0.00 0.00 0.00 60.65 60.04 1fie s ILE 182 Cb -0.16 -2.67 0.03 0.00 0.01 0.00 0.00 42.46 39.68 1fie s ILE 182 CO 0.11 0.12 0.55 -0.76 0.00 0.00 0.00 174.94 174.96 1fie s LEU 183 N 1.37 3.14 0.75 2.97 1.43 0.37 -2.39 118.68 126.32 1fie s LEU 183 Ca 0.00 -0.87 -0.11 0.00 -1.03 0.00 0.00 54.13 52.12 1fie s LEU 183 Cb -0.17 -1.76 0.04 0.00 0.03 0.00 0.00 46.19 44.33 1fie s LEU 183 CO -0.02 -1.02 1.08 -0.36 0.23 0.00 0.00 176.35 176.27 1fie s PHE 184 N -2.60 2.71 -0.42 0.29 0.08 -0.49 -1.39 117.98 116.16 1fie s PHE 184 Ca 0.50 1.52 0.02 0.00 0.12 0.00 0.00 56.93 59.09 1fie s PHE 184 Cb -0.05 -3.01 0.15 0.00 -0.57 0.00 0.00 43.02 39.54 1fie s PHE 184 CO 0.30 -1.66 0.27 1.21 -0.10 0.00 0.00 175.22 175.24 1fie s ASN 185 N -3.45 2.98 0.01 1.36 2.47 -1.26 -4.67 114.94 112.38 1fie s ASN 185 Ca 0.61 -2.63 0.01 0.00 0.42 0.00 0.00 52.86 51.26 1fie s ASN 185 Cb -0.17 -0.70 0.03 0.00 -1.45 0.00 0.00 41.25 38.97 1fie s ASN 185 CO 0.55 -0.25 1.01 -2.65 -3.72 0.00 0.00 177.10 172.04 1fie n PRO 186 N 3.48 0.00 -0.10 0.43 -0.02 -1.26 -0.75 135.00 136.79 1fie n PRO 186 Ca 0.15 0.49 0.11 0.00 -2.02 0.00 0.00 63.50 62.23 1fie n PRO 186 Cb 0.38 -1.53 0.34 0.00 -0.02 0.00 0.00 33.50 32.68 1fie n PRO 186 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1fie n TRP 187 N -1.51 0.25 -3.86 6.00 8.01 -1.26 -0.98 117.44 124.09 1fie n TRP 187 Ca -0.00 -0.13 -0.36 0.00 -1.31 0.00 0.00 57.50 55.71 1fie n TRP 187 Cb 0.01 0.00 -0.14 0.00 -2.01 0.00 0.00 31.31 29.18 1fie n TRP 187 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1fie n GLU 189 N 4.79 -0.02 -0.01 0.00 1.02 -1.26 -0.38 120.64 124.78 1fie n GLU 189 Ca -0.16 1.10 0.11 0.00 -0.02 0.00 0.00 57.16 58.18 1fie n GLU 189 Cb 0.49 -2.34 -0.15 0.00 -0.02 0.00 0.00 31.44 29.41 1fie n GLU 189 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1fie n ASP 190 N -4.20 0.34 -4.74 1.62 8.00 -1.26 -4.92 116.55 111.39 1fie n ASP 190 Ca 0.40 -0.31 -0.41 0.00 0.71 0.00 0.00 54.79 55.18 1fie n ASP 190 Cb 1.69 1.68 -0.03 0.00 -0.02 0.00 0.00 41.12 44.45 1fie n ASP 190 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1fie s ASP 191 N -4.02 6.69 0.35 -2.24 -1.08 0.49 -4.83 116.67 112.02 1fie s ASP 191 Ca -0.03 2.60 0.21 0.00 -0.52 0.00 0.00 52.55 54.81 1fie s ASP 191 Cb 0.14 -2.61 1.16 0.00 -1.46 0.00 0.00 42.92 40.15 1fie s ASP 191 CO 0.89 -0.69 1.63 0.00 0.52 0.00 0.00 175.17 177.52 1fie h ALA 192 N 5.47 1.04 -0.41 3.66 0.00 -1.86 -1.51 119.26 125.65 1fie h ALA 192 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1fie h ALA 192 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1fie h ALA 192 CO 0.80 -0.04 0.00 1.55 0.00 0.00 0.00 179.25 181.56 1fie n VAL 193 N -2.27 2.32 -1.87 0.00 3.14 -1.26 -1.26 118.33 117.13 1fie n VAL 193 Ca -0.01 -1.59 -0.41 0.00 -2.96 0.00 0.00 64.34 59.36 1fie n VAL 193 Cb 0.10 -0.17 -0.01 0.00 -1.06 0.00 0.00 33.84 32.70 1fie n VAL 193 CO 0.00 0.00 0.00 -0.47 -6.46 0.00 0.00 176.83 169.90 1fie s TYR 194 N -2.58 2.71 -0.09 1.45 5.04 -0.57 -4.28 117.35 119.03 1fie s TYR 194 Ca 0.46 1.17 0.04 0.00 -2.44 0.00 0.00 57.07 56.30 1fie s TYR 194 Cb 0.35 -3.95 -0.00 0.00 0.35 0.00 0.00 41.96 38.71 1fie s TYR 194 CO 0.13 -2.82 -0.23 -0.51 -1.34 0.00 0.00 175.55 170.78 1fie s LEU 195 N -1.78 2.06 0.51 6.97 1.43 -0.16 -4.96 118.68 122.75 1fie s LEU 195 Ca 0.53 -0.53 0.18 0.00 -1.03 0.00 0.00 54.13 53.28 1fie s LEU 195 Cb -0.45 -1.36 1.29 0.00 0.03 0.00 0.00 46.19 45.69 1fie s LEU 195 CO 0.59 0.16 2.12 0.44 0.23 0.00 0.00 176.35 179.89 1fie h ASP 196 N 6.63 0.00 -5.29 2.29 5.19 -1.97 -3.44 116.42 119.83 1fie h ASP 196 Ca -0.22 0.00 -0.15 0.00 -0.62 0.00 0.00 57.03 56.05 1fie h ASP 196 Cb 1.23 0.00 -0.15 0.00 0.18 0.00 0.00 39.33 40.59 1fie h ASP 196 CO 0.47 0.06 -0.67 0.54 -3.12 0.00 0.00 179.24 176.52 1fie s ASN 197 N -6.86 0.44 0.11 6.45 2.20 -1.26 -5.06 114.94 110.96 1fie s ASN 197 Ca -0.05 -1.07 -0.14 0.00 -0.94 0.00 0.00 52.86 50.66 1fie s ASN 197 Cb 0.16 0.23 -0.07 0.00 -2.00 0.00 0.00 41.25 39.57 1fie s ASN 197 CO 0.65 -0.64 1.45 -0.08 -2.94 0.00 0.00 177.10 175.54 1fie h GLU 198 N 3.04 0.73 -0.85 3.55 4.57 -1.99 -2.47 114.58 121.16 1fie h GLU 198 Ca -0.34 -0.36 0.21 0.00 -1.18 0.00 0.00 59.36 57.69 1fie h GLU 198 Cb 1.16 0.00 -0.13 0.00 -0.16 0.00 0.00 28.75 29.63 1fie h GLU 198 CO 0.64 0.98 0.29 0.87 -1.18 0.00 0.00 179.01 180.60 1fie h LYS 199 N 0.50 0.29 0.10 1.92 1.79 -1.99 0.19 116.57 119.37 1fie h LYS 199 Ca 0.06 -0.02 -0.00 0.00 -2.18 0.00 0.00 60.65 58.51 1fie h LYS 199 Cb 0.81 -0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.40 1fie h LYS 199 CO 0.07 0.20 -0.05 0.93 -1.08 0.00 0.00 179.45 179.51 1fie h GLU 200 N 0.30 -0.12 -0.56 3.15 5.08 -1.94 -2.80 114.58 117.68 1fie h GLU 200 Ca 0.53 0.01 0.11 0.00 -1.00 0.00 0.00 59.36 59.00 1fie h GLU 200 Cb 1.00 0.03 -0.09 0.00 0.50 0.00 0.00 28.75 30.19 1fie h GLU 200 CO -0.57 0.37 0.06 0.00 -1.00 0.00 0.00 179.01 177.87 1fie h ARG 201 N -0.71 0.17 -0.86 2.33 3.08 -0.71 0.42 114.38 118.09 1fie h ARG 201 Ca -0.01 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 60.00 1fie h ARG 201 Cb 0.55 -0.04 -0.04 0.00 0.08 0.00 0.00 29.97 30.52 1fie h ARG 201 CO 0.02 0.11 0.44 0.93 -1.07 0.00 0.00 179.97 180.40 1fie h GLU 202 N 0.18 1.23 0.13 0.04 5.08 -0.76 -0.36 114.58 120.11 1fie h GLU 202 Ca 0.29 -0.16 -0.01 0.00 -1.00 0.00 0.00 59.36 58.48 1fie h GLU 202 Cb 0.44 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 29.47 1fie h GLU 202 CO -0.43 0.92 -0.06 1.49 -1.00 0.00 0.00 179.01 179.93 1fie h GLU 203 N 1.22 -0.17 -0.00 2.33 4.57 -0.88 0.41 114.58 122.07 1fie h GLU 203 Ca 0.30 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.49 1fie h GLU 203 Cb 0.08 0.04 0.00 0.00 -0.16 0.00 0.00 28.75 28.71 1fie h GLU 203 CO -0.04 0.29 -0.27 0.66 -1.18 0.00 0.00 179.01 178.47 1fie n TYR 204 N -4.91 0.00 0.03 0.92 4.01 0.13 -3.60 117.16 113.74 1fie n TYR 204 Ca -0.08 0.00 -0.01 0.00 -0.16 0.00 0.00 57.90 57.65 1fie n TYR 204 Cb 0.27 -0.34 -0.00 0.00 -0.31 0.00 0.00 39.34 38.96 1fie n TYR 204 CO 0.00 0.00 0.00 0.28 -0.46 0.00 0.00 176.86 176.68 1fie n VAL 205 N -1.43 1.24 0.17 -0.72 0.31 -0.17 -2.76 118.33 114.97 1fie n VAL 205 Ca 0.07 0.37 0.05 0.00 -0.01 0.00 0.00 64.34 64.82 1fie n VAL 205 Cb 0.33 -1.66 0.22 0.00 -0.91 0.00 0.00 33.84 31.82 1fie n VAL 205 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1fie h LEU 206 N -0.10 0.00 -8.98 7.52 -0.00 -1.26 -3.44 115.31 109.05 1fie h LEU 206 Ca -0.00 0.00 -0.57 0.00 -0.00 0.00 0.00 57.88 57.31 1fie h LEU 206 Cb 0.13 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 40.75 1fie h LEU 206 CO -0.00 0.41 1.10 0.21 -0.00 0.00 0.00 178.44 180.15 1fie s ASN 207 N -6.40 6.40 -0.06 -0.43 3.84 0.14 -4.86 114.94 113.57 1fie s ASN 207 Ca 0.02 1.41 0.11 0.00 0.21 0.00 0.00 52.86 54.61 1fie s ASN 207 Cb 0.09 -2.53 0.43 0.00 -0.55 0.00 0.00 41.25 38.68 1fie s ASN 207 CO 0.70 -1.27 1.28 -0.90 -2.79 0.00 0.00 177.10 174.12 1fie n ASP 208 N 8.45 2.96 -4.00 -4.21 5.75 -1.26 -4.87 116.55 119.36 1fie n ASP 208 Ca 0.18 -2.24 -0.15 0.00 -0.01 0.00 0.00 54.79 52.57 1fie n ASP 208 Cb 0.46 -0.43 -0.13 0.00 -1.03 0.00 0.00 41.12 39.99 1fie n ASP 208 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1fie s ILE 209 N -1.69 0.47 0.31 2.12 1.01 -1.26 -0.66 121.20 121.50 1fie s ILE 209 Ca 0.30 -0.59 -0.02 0.00 0.00 0.00 0.00 60.65 60.34 1fie s ILE 209 Cb 0.19 -0.47 -0.01 0.00 0.01 0.00 0.00 42.46 42.19 1fie s ILE 209 CO 0.15 -0.09 0.40 -0.83 0.00 0.00 0.00 174.94 174.57 1fie s GLY 210 N -0.74 1.50 -0.03 6.18 0.00 -0.53 -4.92 107.32 108.77 1fie s GLY 210 Ca -0.03 -1.55 0.04 0.00 0.00 0.00 0.00 44.72 43.18 1fie s GLY 210 CO 0.00 -1.08 -0.14 -1.34 0.00 0.00 0.00 173.10 170.54 1fie s VAL 211 N -3.38 1.19 -0.21 1.40 -7.23 -1.26 -0.38 120.40 110.52 1fie s VAL 211 Ca 0.32 -0.59 -0.09 0.00 -1.81 0.00 0.00 61.98 59.81 1fie s VAL 211 Cb 0.01 -1.02 -0.04 0.00 0.56 0.00 0.00 36.38 35.88 1fie s VAL 211 CO 0.19 0.35 0.11 -0.63 -0.31 0.00 0.00 175.10 174.80 1fie s ILE 212 N 0.03 5.04 -0.26 -0.62 1.09 0.19 -4.62 121.20 122.06 1fie s ILE 212 Ca -0.02 0.06 -0.15 0.00 -1.10 0.00 0.00 60.65 59.44 1fie s ILE 212 Cb -0.10 -3.31 -0.04 0.00 -1.06 0.00 0.00 42.46 37.95 1fie s ILE 212 CO 0.01 0.41 0.38 -0.36 -0.10 0.00 0.00 174.94 175.28 1fie s PHE 213 N 0.73 3.26 0.00 3.97 0.08 -1.26 -2.95 117.98 121.80 1fie s PHE 213 Ca 0.06 0.44 0.00 0.00 0.12 0.00 0.00 56.93 57.55 1fie s PHE 213 Cb -0.13 -2.57 0.00 0.00 -0.57 0.00 0.00 43.02 39.75 1fie s PHE 213 CO 0.02 -0.20 0.00 2.48 -0.10 0.00 0.00 175.22 177.41 1fie n TYR 214 N 5.23 0.00 0.00 0.36 4.11 -0.22 -4.76 117.16 121.88 1fie n TYR 214 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.82 1fie n TYR 214 Cb 0.51 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.85 1fie n TYR 214 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1fie n GLY 215 N 1.64 2.02 3.33 -7.48 0.00 -1.26 -1.77 105.19 101.66 1fie n GLY 215 Ca 0.00 -0.56 -0.11 0.00 0.00 0.00 0.00 46.02 45.35 1fie n GLY 215 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1fie s GLU 216 N 0.00 1.04 0.37 1.61 4.04 -1.10 -4.66 118.70 119.99 1fie s GLU 216 Ca 0.00 -0.58 0.17 0.00 0.04 0.00 0.00 54.97 54.60 1fie s GLU 216 Cb 0.00 0.46 1.11 0.00 0.02 0.00 0.00 34.13 35.72 1fie s GLU 216 CO 0.00 -0.39 1.70 0.28 -1.84 0.00 0.00 175.26 175.00 1fie h VAL 217 N 2.54 0.38 -0.53 1.83 2.07 -1.89 0.31 116.25 120.96 1fie h VAL 217 Ca -0.33 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.07 1fie h VAL 217 Cb 1.24 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 31.00 1fie h VAL 217 CO 0.45 0.07 0.00 0.59 0.02 0.00 0.00 177.57 178.70 1fie n ASN 218 N -4.85 4.42 -2.70 0.57 3.02 -1.26 -4.30 115.26 110.15 1fie n ASN 218 Ca 0.30 -2.52 -0.07 0.00 -0.03 0.00 0.00 54.58 52.26 1fie n ASN 218 Cb 0.98 -0.58 0.09 0.00 -0.61 0.00 0.00 39.78 39.67 1fie n ASN 218 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1fie n ASP 219 N 0.79 -1.91 -4.61 6.41 2.03 0.10 -5.09 116.55 114.29 1fie n ASP 219 Ca 0.22 -2.80 -0.43 0.00 0.52 0.00 0.00 54.79 52.30 1fie n ASP 219 Cb 0.87 1.42 -0.03 0.00 -0.72 0.00 0.00 41.12 42.66 1fie n ASP 219 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1fie s ILE 220 N 0.19 3.07 0.18 5.18 1.01 -0.58 -2.73 121.20 127.52 1fie s ILE 220 Ca 0.20 0.07 0.03 0.00 0.00 0.00 0.00 60.65 60.95 1fie s ILE 220 Cb 0.30 -3.09 -0.03 0.00 0.01 0.00 0.00 42.46 39.65 1fie s ILE 220 CO -0.08 -0.05 0.31 -0.54 0.00 0.00 0.00 174.94 174.58 1fie s LYS 221 N 6.13 3.44 0.09 2.79 1.02 -0.73 -4.95 119.74 127.53 1fie s LYS 221 Ca 0.97 -0.65 0.04 0.00 0.02 0.00 0.00 55.97 56.36 1fie s LYS 221 Cb -0.32 -2.94 -0.03 0.00 -0.52 0.00 0.00 37.83 34.02 1fie s LYS 221 CO 0.35 0.48 -0.11 0.99 -0.92 0.00 0.00 175.35 176.15 1fie s THR 222 N -1.83 0.98 -0.09 2.17 2.01 -1.26 -1.06 115.64 116.56 1fie s THR 222 Ca 0.34 -1.53 -0.24 0.00 0.31 0.00 0.00 61.69 60.58 1fie s THR 222 Cb -0.10 -1.25 0.05 0.00 0.01 0.00 0.00 72.50 71.22 1fie s THR 222 CO 0.29 -0.46 0.56 0.00 -0.69 0.00 0.00 174.62 174.33 1fie s ARG 223 N -2.44 0.85 0.17 4.92 1.70 -1.15 -5.01 118.95 117.98 1fie s ARG 223 Ca 0.03 0.33 -0.05 0.00 -0.47 0.00 0.00 55.73 55.57 1fie s ARG 223 Cb -0.05 0.40 -0.06 0.00 -0.57 0.00 0.00 34.95 34.67 1fie s ARG 223 CO 0.01 -0.22 0.40 -1.12 -1.08 0.00 0.00 175.30 173.29 1fie s SER 224 N -0.75 6.49 -0.01 -2.89 0.01 -1.26 -0.63 113.70 114.65 1fie s SER 224 Ca -0.08 0.60 0.01 0.00 1.31 0.00 0.00 55.95 57.79 1fie s SER 224 Cb -0.03 -2.10 0.01 0.00 0.21 0.00 0.00 66.02 64.12 1fie s SER 224 CO 0.06 0.02 -0.02 0.86 0.41 0.00 0.00 173.24 174.56 1fie s TRP 225 N -1.72 0.30 -0.41 2.43 -0.11 0.49 -4.93 118.94 114.99 1fie s TRP 225 Ca 0.41 -0.04 -0.19 0.00 1.22 0.00 0.00 56.10 57.50 1fie s TRP 225 Cb -0.12 -0.27 0.02 0.00 -1.50 0.00 0.00 33.47 31.60 1fie s TRP 225 CO 0.25 -0.05 0.57 -1.54 -4.62 0.00 0.00 176.95 171.56 1fie s SER 226 N 0.30 6.30 0.25 5.86 1.04 -1.16 -1.45 113.70 124.84 1fie s SER 226 Ca -0.03 -0.32 0.00 0.00 0.48 0.00 0.00 55.95 56.08 1fie s SER 226 Cb -0.06 -2.29 0.31 0.00 0.10 0.00 0.00 66.02 64.09 1fie s SER 226 CO -0.01 -0.66 1.67 1.88 0.98 0.00 0.00 173.24 177.10 1fie h TYR 227 N 8.73 0.63 -5.90 5.02 0.05 -1.24 -2.89 116.97 121.36 1fie h TYR 227 Ca -0.26 -0.15 -0.41 0.00 0.05 0.00 0.00 58.73 57.96 1fie h TYR 227 Cb 1.11 -0.15 -0.14 0.00 1.01 0.00 0.00 36.73 38.56 1fie h TYR 227 CO 0.70 0.79 -0.60 0.41 -1.05 0.00 0.00 178.16 178.40 1fie n GLY 228 N -0.24 -0.47 0.18 3.88 0.00 -0.96 -4.48 105.19 103.10 1fie n GLY 228 Ca -0.01 0.09 0.12 0.00 0.00 0.00 0.00 46.02 46.22 1fie n GLY 228 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 1fie h GLN 229 N -0.97 0.00 -0.22 1.61 -0.00 -1.85 -2.13 115.11 111.55 1fie h GLN 229 Ca -0.44 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.21 1fie h GLN 229 Cb 1.29 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.77 1fie h GLN 229 CO 0.58 0.00 0.00 1.19 -0.00 0.00 0.00 178.83 180.60 1fie n PHE 230 N -2.35 0.27 -1.23 0.06 3.72 -1.26 -4.52 117.46 112.15 1fie n PHE 230 Ca -0.01 -0.16 -0.29 0.00 -0.05 0.00 0.00 57.45 56.93 1fie n PHE 230 Cb 0.07 -0.00 0.14 0.00 -0.94 0.00 0.00 39.48 38.75 1fie n PHE 230 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 1fie s GLU 231 N -1.43 1.13 -0.07 -1.08 0.41 -0.80 -1.73 118.70 115.12 1fie s GLU 231 Ca 0.29 0.73 -0.29 0.00 -0.41 0.00 0.00 54.97 55.29 1fie s GLU 231 Cb 0.18 -1.80 -0.06 0.00 -1.78 0.00 0.00 34.13 30.67 1fie s GLU 231 CO 0.26 -2.30 1.75 0.34 -0.49 0.00 0.00 175.26 174.81 1fie s ASP 232 N -3.47 6.49 0.00 -0.19 2.15 -1.26 -3.04 116.67 117.35 1fie s ASP 232 Ca 0.64 2.20 0.00 0.00 0.43 0.00 0.00 52.55 55.81 1fie s ASP 232 Cb -0.18 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 39.91 1fie s ASP 232 CO 0.57 -1.08 0.00 0.61 -0.17 0.00 0.00 175.17 175.10 1fie n GLY 233 N 4.42 1.47 0.13 2.66 0.00 -1.26 -4.96 105.19 107.64 1fie n GLY 233 Ca 0.19 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.09 1fie n GLY 233 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1fie h ILE 234 N 0.00 1.25 -0.39 -0.61 1.08 -1.85 -1.99 117.51 115.00 1fie h ILE 234 Ca 0.00 -0.85 0.08 0.00 -0.39 0.00 0.00 64.86 63.70 1fie h ILE 234 Cb 0.00 1.42 -0.09 0.00 -3.07 0.00 0.00 36.82 35.08 1fie h ILE 234 CO 0.00 0.26 -0.24 0.25 -0.69 0.00 0.00 178.15 177.73 1fie h LEU 235 N 0.11 -0.81 -0.90 1.44 6.46 -1.80 0.11 115.31 119.92 1fie h LEU 235 Ca 0.06 0.17 0.03 0.00 -0.12 0.00 0.00 57.88 58.02 1fie h LEU 235 Cb 0.38 0.41 -0.05 0.00 -0.73 0.00 0.00 40.66 40.67 1fie h LEU 235 CO 0.01 -0.26 0.58 0.44 -0.62 0.00 0.00 178.44 178.59 1fie h ASP 236 N -0.17 0.97 -0.80 1.25 3.32 -1.93 -1.85 116.42 117.21 1fie h ASP 236 Ca 0.19 -0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.20 1fie h ASP 236 Cb 0.47 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 39.76 1fie h ASP 236 CO -0.50 0.67 0.39 0.74 -1.72 0.00 0.00 179.24 178.83 1fie h THR 237 N 1.13 1.25 -0.53 0.35 2.02 -0.23 0.52 112.91 117.42 1fie h THR 237 Ca 0.36 -0.68 0.05 0.00 0.77 0.00 0.00 66.41 66.90 1fie h THR 237 Cb -0.00 0.23 -0.05 0.00 -1.74 0.00 0.00 68.15 66.59 1fie h THR 237 CO -0.12 0.29 0.27 0.00 0.37 0.00 0.00 175.52 176.33 1fie h LEU 239 N 0.51 0.89 -1.52 0.00 3.38 -0.73 -2.02 115.31 115.83 1fie h LEU 239 Ca 0.24 -0.25 0.02 0.00 0.09 0.00 0.00 57.88 57.98 1fie h LEU 239 Cb 0.16 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 1fie h LEU 239 CO -0.17 0.97 0.34 0.22 0.09 0.00 0.00 178.44 179.89 1fie h TYR 240 N 0.84 0.61 -0.67 1.13 3.20 0.18 -2.21 116.97 120.05 1fie h TYR 240 Ca 0.15 0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.96 1fie h TYR 240 Cb 0.53 -0.21 -0.03 0.00 1.54 0.00 0.00 36.73 38.57 1fie h TYR 240 CO 0.03 0.37 0.11 0.28 -1.64 0.00 0.00 178.16 177.32 1fie h VAL 241 N 0.65 1.26 0.00 1.81 2.07 0.05 -0.25 116.25 121.84 1fie h VAL 241 Ca 0.20 -1.03 -0.05 0.00 0.82 0.00 0.00 66.70 66.64 1fie h VAL 241 Cb -0.01 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1fie h VAL 241 CO -0.05 0.39 -0.23 0.24 0.02 0.00 0.00 177.57 177.94 1fie h MET 242 N 1.03 0.00 -0.07 1.57 2.86 -1.34 -2.67 114.93 116.31 1fie h MET 242 Ca 0.20 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.75 1fie h MET 242 Cb 0.43 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.09 1fie h MET 242 CO 0.01 0.23 -0.33 -0.44 1.06 0.00 0.00 176.91 177.44 1fie h ASP 243 N 0.00 0.42 0.08 1.22 3.32 -0.84 -2.11 116.42 118.52 1fie h ASP 243 Ca -0.00 -0.64 -0.00 0.00 0.02 0.00 0.00 57.03 56.40 1fie h ASP 243 Cb 0.88 -0.12 -0.00 0.00 0.22 0.00 0.00 39.33 40.30 1fie h ASP 243 CO 0.03 0.99 -0.00 0.03 -1.72 0.00 0.00 179.24 178.57 1fie h ARG 244 N -0.13 0.00 -0.46 3.56 2.47 -0.93 -0.53 114.38 118.36 1fie h ARG 244 Ca -0.02 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.70 1fie h ARG 244 Cb 0.98 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.30 1fie h ARG 244 CO 0.07 0.00 0.00 0.00 0.56 0.00 0.00 179.97 180.60 1fie n ALA 245 N -2.12 2.43 -4.02 0.04 0.00 -1.02 -4.94 120.51 110.88 1fie n ALA 245 Ca -0.03 -0.89 -0.32 0.00 0.00 0.00 0.00 53.44 52.21 1fie n ALA 245 Cb 0.09 -0.96 0.01 0.00 0.00 0.00 0.00 19.45 18.59 1fie n ALA 245 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1fie n GLN 246 N 1.02 -4.68 -2.42 0.00 1.13 -0.21 -4.86 117.38 107.37 1fie n GLN 246 Ca 0.18 0.52 -0.43 0.00 -1.94 0.00 0.00 57.00 55.33 1fie n GLN 246 Cb 0.46 -5.34 -0.02 0.00 0.11 0.00 0.00 30.24 25.45 1fie n GLN 246 CO 0.00 0.00 0.00 1.41 -1.44 0.00 0.00 177.06 177.03 1fie s MET 247 N -6.72 3.51 -0.39 -1.09 1.75 -0.81 -4.86 119.30 110.68 1fie s MET 247 Ca 0.67 0.69 -0.45 0.00 -1.25 0.00 0.00 55.69 55.35 1fie s MET 247 Cb -0.35 -4.03 -0.19 0.00 2.84 0.00 0.00 34.83 33.09 1fie s MET 247 CO 0.87 -1.66 1.56 -3.47 -0.65 0.00 0.00 175.02 171.67 1fie n ASP 248 N 8.87 1.29 0.21 1.11 2.03 -1.26 -4.70 116.55 124.11 1fie n ASP 248 Ca 0.14 1.17 0.17 0.00 0.52 0.00 0.00 54.79 56.78 1fie n ASP 248 Cb 0.49 -0.94 0.83 0.00 -0.72 0.00 0.00 41.12 40.78 1fie n ASP 248 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1fie h LEU 249 N 5.15 0.00 0.00 -2.67 3.38 -1.68 0.70 115.31 120.19 1fie h LEU 249 Ca -0.45 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.52 1fie h LEU 249 Cb 1.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.12 1fie h LEU 249 CO 0.94 0.00 0.00 -1.20 0.09 0.00 0.00 178.44 178.27 1fie n SER 250 N -3.87 0.00 -0.04 -0.43 7.64 -1.26 -3.05 113.62 112.61 1fie n SER 250 Ca 0.01 0.49 -0.08 0.00 1.01 0.00 0.00 58.87 60.30 1fie n SER 250 Cb 0.29 -0.50 -0.14 0.00 -1.01 0.00 0.00 64.21 62.85 1fie n SER 250 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1fie n GLY 251 N 0.42 -1.02 0.00 0.23 0.00 0.23 -4.27 105.19 100.78 1fie n GLY 251 Ca 0.05 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1fie n GLY 251 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fie n ARG 252 N -2.95 0.00 0.00 1.61 1.74 -1.17 -0.25 116.66 115.64 1fie n ARG 252 Ca -0.20 0.00 0.09 0.00 -0.77 0.00 0.00 57.85 56.97 1fie n ARG 252 Cb 1.05 -1.30 -0.05 0.00 -1.02 0.00 0.00 32.46 31.14 1fie n ARG 252 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1fie n GLY 253 N -0.76 -0.37 3.52 -0.13 0.00 -1.26 -2.46 105.19 103.73 1fie n GLY 253 Ca 0.00 -0.55 -0.42 0.00 0.00 0.00 0.00 46.02 45.06 1fie n GLY 253 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1fie s ASN 254 N -2.48 6.19 0.52 1.61 3.84 0.65 -4.92 114.94 120.35 1fie s ASN 254 Ca 0.12 -0.39 0.22 0.00 0.21 0.00 0.00 52.86 53.02 1fie s ASN 254 Cb 0.15 -2.21 1.39 0.00 -0.55 0.00 0.00 41.25 40.03 1fie s ASN 254 CO 0.63 -0.44 2.11 -0.65 -2.79 0.00 0.00 177.10 175.96 1fie h PRO 255 N 8.57 0.00 0.28 0.43 0.11 -1.90 0.36 132.00 139.84 1fie h PRO 255 Ca -0.28 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.81 1fie h PRO 255 Cb 1.13 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1fie h PRO 255 CO 0.74 0.09 -0.13 0.82 -0.21 0.00 0.00 178.00 179.30 1fie h ILE 256 N 0.00 0.00 -0.84 4.15 2.04 -1.92 -2.51 117.51 118.42 1fie h ILE 256 Ca -0.00 -0.16 0.13 0.00 1.00 0.00 0.00 64.86 65.83 1fie h ILE 256 Cb 0.19 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.18 1fie h ILE 256 CO 0.01 0.00 0.45 0.50 0.00 0.00 0.00 178.15 179.11 1fie h LYS 257 N -0.54 0.66 -0.28 2.37 3.64 -1.83 0.42 116.57 121.00 1fie h LYS 257 Ca -0.04 -0.04 0.04 0.00 -1.27 0.00 0.00 60.65 59.34 1fie h LYS 257 Cb 0.29 -0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 31.92 1fie h LYS 257 CO 0.06 0.43 0.07 0.28 -2.27 0.00 0.00 179.45 178.02 1fie h VAL 258 N 0.68 0.88 0.00 2.00 2.07 -0.96 0.35 116.25 121.26 1fie h VAL 258 Ca 0.44 -0.06 -0.11 0.00 0.82 0.00 0.00 66.70 67.79 1fie h VAL 258 Cb 0.57 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 1fie h VAL 258 CO -0.33 0.03 -0.54 0.77 0.02 0.00 0.00 177.57 177.53 1fie h SER 259 N 0.18 0.00 0.57 0.57 4.64 -0.84 0.59 113.55 119.26 1fie h SER 259 Ca 0.13 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.42 1fie h SER 259 Cb 0.13 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.22 1fie h SER 259 CO -0.16 0.54 -0.27 -0.09 -0.87 0.00 0.00 176.83 175.97 1fie h ARG 260 N 0.00 -0.74 -0.06 4.77 9.65 0.46 -1.65 114.38 126.81 1fie h ARG 260 Ca -0.01 0.05 -0.11 0.00 -1.10 0.00 0.00 59.98 58.81 1fie h ARG 260 Cb 1.10 0.17 -0.01 0.00 -1.39 0.00 0.00 29.97 29.84 1fie h ARG 260 CO 0.07 -0.48 -0.46 0.28 2.80 0.00 0.00 179.97 182.18 1fie h VAL 261 N -1.19 1.33 -0.50 0.20 2.07 -0.37 -3.09 116.25 114.70 1fie h VAL 261 Ca -0.08 -1.64 -0.09 0.00 0.82 0.00 0.00 66.70 65.71 1fie h VAL 261 Cb 0.60 1.81 -0.02 0.00 -1.52 0.00 0.00 31.29 32.16 1fie h VAL 261 CO 0.13 0.48 -0.06 1.23 0.02 0.00 0.00 177.57 179.37 1fie h GLY 262 N 1.34 1.00 1.70 2.17 0.00 0.14 -3.11 103.07 106.32 1fie h GLY 262 Ca 0.01 -0.78 -0.11 0.00 0.00 0.00 0.00 47.33 46.44 1fie h GLY 262 CO 0.07 0.72 -0.40 1.48 0.00 0.00 0.00 176.54 178.40 1fie h SER 263 N 0.79 0.35 0.73 0.19 4.64 -1.26 -2.69 113.55 116.30 1fie h SER 263 Ca 0.14 -0.15 -0.01 0.00 -0.47 0.00 0.00 61.79 61.30 1fie h SER 263 Cb 0.60 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 62.59 1fie h SER 263 CO 0.04 0.72 -0.04 0.00 -0.87 0.00 0.00 176.83 176.68 1fie h ALA 264 N 1.30 1.04 0.00 5.18 0.00 -1.52 -2.66 119.26 122.60 1fie h ALA 264 Ca 0.03 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1fie h ALA 264 Cb 0.83 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.61 1fie h ALA 264 CO 0.07 0.05 0.00 0.52 0.00 0.00 0.00 179.25 179.89 1fie h MET 265 N 0.00 0.00 0.14 0.00 2.86 -1.40 -3.38 114.93 113.14 1fie h MET 265 Ca -0.00 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 1fie h MET 265 Cb 0.42 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.08 1fie h MET 265 CO 0.01 0.00 -0.07 0.28 1.06 0.00 0.00 176.91 178.19 1fie h VAL 266 N 0.00 0.90 -3.64 -2.22 2.07 -1.53 0.19 116.25 112.02 1fie h VAL 266 Ca 0.00 -0.16 -0.61 0.00 0.82 0.00 0.00 66.70 66.75 1fie h VAL 266 Cb 0.95 1.01 -0.11 0.00 -1.52 0.00 0.00 31.29 31.62 1fie h VAL 266 CO 0.00 0.04 0.50 0.21 0.02 0.00 0.00 177.57 178.34 1fie s ASN 267 N -5.10 6.47 -0.35 0.57 2.47 -1.26 -0.04 114.94 117.71 1fie s ASN 267 Ca -0.14 0.06 -0.28 0.00 0.42 0.00 0.00 52.86 52.92 1fie s ASN 267 Cb 0.05 -2.43 -0.04 0.00 -1.45 0.00 0.00 41.25 37.38 1fie s ASN 267 CO 0.65 -1.00 2.06 0.00 -3.72 0.00 0.00 177.10 175.09 1fie s ALA 268 N 3.58 2.52 -1.27 1.71 0.00 0.30 -4.45 121.76 124.15 1fie s ALA 268 Ca 0.35 0.31 -0.05 0.00 0.00 0.00 0.00 51.96 52.56 1fie s ALA 268 Cb -0.11 -4.13 0.12 0.00 0.00 0.00 0.00 23.12 19.00 1fie s ALA 268 CO 0.25 -3.15 2.41 1.17 0.00 0.00 0.00 175.76 176.44 1fie n LYS 269 N 8.74 4.48 -1.55 0.00 4.81 -1.26 -4.77 118.16 128.60 1fie n LYS 269 Ca 0.27 -3.40 0.00 0.00 -0.87 0.00 0.00 58.31 54.31 1fie n LYS 269 Cb 0.48 -2.60 0.00 0.00 0.02 0.00 0.00 35.03 32.93 1fie n LYS 269 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 1fie n ASP 270 N 1.66 -7.78 0.00 3.14 5.68 -1.26 -4.43 116.55 113.56 1fie n ASP 270 Ca 0.62 1.07 0.00 0.00 -0.50 0.00 0.00 54.79 55.98 1fie n ASP 270 Cb 0.26 -3.90 0.00 0.00 -1.14 0.00 0.00 41.12 36.34 1fie n ASP 270 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 1fie n ASP 271 N 0.66 0.00 0.00 -1.12 2.03 -1.26 -4.61 116.55 112.25 1fie n ASP 271 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1fie n ASP 271 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 1fie n ASP 271 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1fie n GLU 272 N 0.00 0.00 -0.65 -0.67 -0.58 -1.26 -4.51 120.64 112.97 1fie n GLU 272 Ca 0.00 0.00 -0.25 0.00 -0.42 0.00 0.00 57.16 56.49 1fie n GLU 272 Cb 0.00 0.00 0.02 0.00 -0.57 0.00 0.00 31.44 30.89 1fie n GLU 272 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1fie n GLY 273 N 3.12 -2.37 0.23 0.62 0.00 -1.26 -4.55 105.19 100.99 1fie n GLY 273 Ca 0.00 -0.24 -0.16 0.00 0.00 0.00 0.00 46.02 45.62 1fie n GLY 273 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1fie h VAL 274 N -0.65 1.28 -4.03 1.61 2.07 -0.82 -3.32 116.25 112.39 1fie h VAL 274 Ca -0.27 -1.92 -0.43 0.00 0.82 0.00 0.00 66.70 64.90 1fie h VAL 274 Cb 0.89 1.90 -0.25 0.00 -1.52 0.00 0.00 31.29 32.31 1fie h VAL 274 CO 0.14 0.61 -0.79 -0.76 0.02 0.00 0.00 177.57 176.80 1fie s LEU 275 N -8.44 2.17 -0.46 2.57 1.43 0.94 -0.07 118.68 116.82 1fie s LEU 275 Ca -0.10 -0.45 -0.19 0.00 -1.03 0.00 0.00 54.13 52.36 1fie s LEU 275 Cb 0.09 -0.56 0.04 0.00 0.03 0.00 0.00 46.19 45.78 1fie s LEU 275 CO 0.90 0.02 0.55 -0.69 0.23 0.00 0.00 176.35 177.36 1fie s VAL 276 N -0.86 4.95 0.24 -1.59 1.01 -0.58 0.11 120.40 123.67 1fie s VAL 276 Ca 0.01 -0.29 -0.30 0.00 0.00 0.00 0.00 61.98 61.40 1fie s VAL 276 Cb -0.08 -4.17 -0.09 0.00 0.00 0.00 0.00 36.38 32.04 1fie s VAL 276 CO 0.01 -0.60 1.31 -0.83 0.00 0.00 0.00 175.10 174.99 1fie s GLY 277 N 2.17 2.58 -0.15 4.51 0.00 -1.26 -1.45 107.32 113.72 1fie s GLY 277 Ca 0.16 1.15 -0.10 0.00 0.00 0.00 0.00 44.72 45.93 1fie s GLY 277 CO 0.14 2.03 0.38 -0.45 0.00 0.00 0.00 173.10 175.20 1fie s SER 278 N 0.10 -0.45 -0.11 1.64 0.15 -0.84 -4.84 113.70 109.35 1fie s SER 278 Ca 0.55 0.81 0.14 0.00 0.70 0.00 0.00 55.95 58.15 1fie s SER 278 Cb -0.37 0.72 0.27 0.00 -1.71 0.00 0.00 66.02 64.93 1fie s SER 278 CO 0.42 -0.18 1.14 0.79 1.20 0.00 0.00 173.24 176.61 1fie n TRP 279 N 3.96 0.00 -1.51 3.44 8.01 -1.26 -4.71 117.44 125.37 1fie n TRP 279 Ca -0.21 -0.87 -0.17 0.00 -1.31 0.00 0.00 57.50 54.93 1fie n TRP 279 Cb 0.55 -0.15 0.12 0.00 -2.01 0.00 0.00 31.31 29.82 1fie n TRP 279 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.69 176.28 1fie n ASP 280 N -0.94 -0.01 -0.54 -0.99 5.68 -1.26 -4.99 116.55 113.48 1fie n ASP 280 Ca 0.13 -1.26 0.07 0.00 -0.50 0.00 0.00 54.79 53.22 1fie n ASP 280 Cb 0.70 -0.59 0.05 0.00 -1.14 0.00 0.00 41.12 40.14 1fie n ASP 280 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 1fie n ASN 281 N -3.53 2.12 -0.02 -1.12 5.15 -1.26 -4.73 115.26 111.87 1fie n ASN 281 Ca 0.10 -1.56 -0.01 0.00 -0.60 0.00 0.00 54.58 52.51 1fie n ASN 281 Cb 0.34 0.04 -0.00 0.00 -0.53 0.00 0.00 39.78 39.63 1fie n ASN 281 CO 0.00 0.00 0.00 0.40 1.40 0.00 0.00 177.26 179.06 1fie h ILE 282 N 2.67 0.00 -4.00 -1.44 5.03 -2.00 -3.49 117.51 114.28 1fie h ILE 282 Ca 0.00 -0.35 -0.04 0.00 -0.12 0.00 0.00 64.86 64.35 1fie h ILE 282 Cb 0.58 0.00 0.03 0.00 -3.03 0.00 0.00 36.82 34.40 1fie h ILE 282 CO 0.00 0.00 -0.13 -1.22 -0.68 0.00 0.00 178.15 176.12 1fie n TYR 283 N -3.04 -1.16 0.29 1.37 4.01 -1.26 -4.92 117.16 112.45 1fie n TYR 283 Ca -0.02 0.43 -0.15 0.00 -0.16 0.00 0.00 57.90 58.01 1fie n TYR 283 Cb 0.06 -2.81 -0.08 0.00 -0.31 0.00 0.00 39.34 36.20 1fie n TYR 283 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1fie h ALA 284 N 0.11 -1.14 -1.24 -0.72 0.00 -1.99 -3.29 119.26 110.99 1fie h ALA 284 Ca -0.10 -0.18 -0.70 0.00 0.00 0.00 0.00 54.91 53.94 1fie h ALA 284 Cb 1.05 0.55 -0.33 0.00 0.00 0.00 0.00 17.79 19.06 1fie h ALA 284 CO 0.15 -1.13 0.31 0.66 0.00 0.00 0.00 179.25 179.24 1fie n TYR 285 N -4.80 3.17 -3.53 0.00 4.01 -1.26 -4.98 117.16 109.76 1fie n TYR 285 Ca -0.11 -2.68 -0.01 0.00 -0.16 0.00 0.00 57.90 54.95 1fie n TYR 285 Cb 0.38 -0.73 0.01 0.00 -0.31 0.00 0.00 39.34 38.68 1fie n TYR 285 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1fie n GLY 286 N -0.50 1.15 3.68 2.72 0.00 -1.24 -4.88 105.19 106.12 1fie n GLY 286 Ca 0.47 -0.98 -0.37 0.00 0.00 0.00 0.00 46.02 45.14 1fie n GLY 286 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fie s VAL 287 N -2.46 5.28 0.26 1.61 1.01 -1.21 -4.97 120.40 119.92 1fie s VAL 287 Ca 0.06 0.50 -0.31 0.00 0.00 0.00 0.00 61.98 62.23 1fie s VAL 287 Cb -0.01 -3.63 -0.13 0.00 0.00 0.00 0.00 36.38 32.62 1fie s VAL 287 CO 0.01 0.31 1.52 -2.65 0.00 0.00 0.00 175.10 174.29 1fie n PRO 288 N 4.23 2.38 0.27 2.72 -0.02 -1.26 -4.46 135.00 138.86 1fie n PRO 288 Ca -0.11 0.85 0.10 0.00 -2.02 0.00 0.00 63.50 62.32 1fie n PRO 288 Cb 0.52 -2.58 0.55 0.00 -0.02 0.00 0.00 33.50 31.97 1fie n PRO 288 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1fie h PRO 289 N 4.68 0.00 0.00 0.52 0.11 -1.90 0.56 132.00 135.97 1fie h PRO 289 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1fie h PRO 289 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1fie h PRO 289 CO 0.79 0.00 -0.26 0.43 -0.21 0.00 0.00 178.00 178.75 1fie n SER 290 N -2.51 0.33 0.04 -2.05 7.64 -1.26 -3.83 113.62 111.99 1fie n SER 290 Ca -0.01 0.17 -0.04 0.00 1.01 0.00 0.00 58.87 60.00 1fie n SER 290 Cb 0.42 -0.16 -0.09 0.00 -1.01 0.00 0.00 64.21 63.38 1fie n SER 290 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1fie h ALA 291 N 2.91 0.61 -2.18 -0.43 0.00 -1.19 -3.42 119.26 115.57 1fie h ALA 291 Ca 0.00 -0.96 -0.60 0.00 0.00 0.00 0.00 54.91 53.35 1fie h ALA 291 Cb 0.54 0.16 0.05 0.00 0.00 0.00 0.00 17.79 18.54 1fie h ALA 291 CO 0.00 1.13 0.86 0.91 0.00 0.00 0.00 179.25 182.16 1fie n TRP 292 N -3.11 2.25 0.05 0.00 5.03 -1.25 -4.85 117.44 115.56 1fie n TRP 292 Ca -0.07 0.22 0.10 0.00 3.03 0.00 0.00 57.50 60.77 1fie n TRP 292 Cb 0.90 -2.56 -0.07 0.00 -1.03 0.00 0.00 31.31 28.55 1fie n TRP 292 CO 0.00 0.00 0.00 0.25 -0.03 0.00 0.00 177.69 177.91 1fie n THR 293 N 3.83 0.49 -3.97 -0.99 -2.24 -1.26 -5.05 114.28 105.09 1fie n THR 293 Ca 0.19 -0.56 0.02 0.00 -2.27 0.00 0.00 64.05 61.43 1fie n THR 293 Cb 0.28 -0.26 0.01 0.00 -2.10 0.00 0.00 70.33 68.26 1fie n THR 293 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fie n GLY 294 N 1.25 0.32 0.16 3.38 0.00 -1.26 -2.98 105.19 106.06 1fie n GLY 294 Ca -0.03 -1.01 -0.23 0.00 0.00 0.00 0.00 46.02 44.75 1fie n GLY 294 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1fie h SER 295 N 1.60 0.84 -0.93 1.61 0.02 -1.77 -3.36 113.55 111.56 1fie h SER 295 Ca -0.17 -0.82 0.08 0.00 -0.84 0.00 0.00 61.79 60.04 1fie h SER 295 Cb 0.95 -0.27 -0.11 0.00 0.14 0.00 0.00 62.40 63.11 1fie h SER 295 CO 0.25 1.63 -0.55 0.52 -1.14 0.00 0.00 176.83 177.54 1fie n VAL 296 N -3.75 -0.63 -0.31 2.27 0.31 -1.26 -0.17 118.33 114.79 1fie n VAL 296 Ca -0.14 2.25 -0.08 0.00 -0.01 0.00 0.00 64.34 66.37 1fie n VAL 296 Cb 1.03 -2.79 -0.07 0.00 -0.91 0.00 0.00 33.84 31.11 1fie n VAL 296 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1fie n ASP 297 N -5.16 -0.75 -0.06 4.52 -0.08 -1.26 -2.05 116.55 111.70 1fie n ASP 297 Ca 0.02 1.30 -0.14 0.00 -1.51 0.00 0.00 54.79 54.45 1fie n ASP 297 Cb 0.24 -0.18 -0.06 0.00 2.34 0.00 0.00 41.12 43.46 1fie n ASP 297 CO 0.00 0.00 0.00 0.40 0.12 0.00 0.00 177.20 177.72 1fie h ILE 298 N 0.00 1.33 -0.22 5.18 2.04 -0.72 -3.08 117.51 122.04 1fie h ILE 298 Ca 0.13 -1.59 -0.02 0.00 1.00 0.00 0.00 64.86 64.37 1fie h ILE 298 Cb 0.31 1.85 -0.01 0.00 -0.74 0.00 0.00 36.82 38.23 1fie h ILE 298 CO -0.69 0.49 0.04 -0.07 0.00 0.00 0.00 178.15 177.92 1fie h LEU 299 N 0.28 0.35 -0.74 1.44 3.38 -0.50 0.18 115.31 119.70 1fie h LEU 299 Ca 0.01 -0.25 0.01 0.00 0.09 0.00 0.00 57.88 57.74 1fie h LEU 299 Cb 0.96 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.58 1fie h LEU 299 CO 0.08 0.51 0.48 -0.07 0.09 0.00 0.00 178.44 179.53 1fie h LEU 300 N 0.17 0.82 -0.92 1.67 3.38 -1.55 -0.08 115.31 118.81 1fie h LEU 300 Ca 0.07 -0.02 0.03 0.00 0.09 0.00 0.00 57.88 58.05 1fie h LEU 300 Cb 0.31 -0.20 -0.05 0.00 0.09 0.00 0.00 40.66 40.81 1fie h LEU 300 CO 0.00 0.59 0.60 -0.08 0.09 0.00 0.00 178.44 179.64 1fie h GLU 301 N 0.97 1.15 0.89 1.13 4.22 -1.40 0.11 114.58 121.65 1fie h GLU 301 Ca 0.28 -0.07 -0.04 0.00 0.08 0.00 0.00 59.36 59.61 1fie h GLU 301 Cb -0.08 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 28.92 1fie h GLU 301 CO -0.07 0.76 -0.49 -0.92 -2.18 0.00 0.00 179.01 176.11 1fie h TYR 302 N 1.18 -1.29 -0.60 0.92 3.20 0.85 -2.61 116.97 118.63 1fie h TYR 302 Ca 0.36 -0.02 0.12 0.00 3.14 0.00 0.00 58.73 62.32 1fie h TYR 302 Cb -0.04 0.44 -0.12 0.00 1.54 0.00 0.00 36.73 38.56 1fie h TYR 302 CO -0.01 -0.76 -0.24 -0.09 -1.64 0.00 0.00 178.16 175.43 1fie h ARG 303 N -1.27 -0.08 -0.62 1.82 9.65 -0.28 0.82 114.38 124.41 1fie h ARG 303 Ca -0.12 0.01 -0.10 0.00 -1.10 0.00 0.00 59.98 58.67 1fie h ARG 303 Cb 1.00 0.02 -0.02 0.00 -1.39 0.00 0.00 29.97 29.58 1fie h ARG 303 CO 0.16 -0.05 0.01 0.77 2.80 0.00 0.00 179.97 183.66 1fie h SER 304 N -0.08 1.07 0.98 -3.80 0.02 -0.83 -3.24 113.55 107.67 1fie h SER 304 Ca 0.27 -0.30 -0.15 0.00 -0.84 0.00 0.00 61.79 60.77 1fie h SER 304 Cb 0.51 -0.29 -0.03 0.00 0.14 0.00 0.00 62.40 62.74 1fie h SER 304 CO -0.66 1.11 -1.08 0.77 -1.14 0.00 0.00 176.83 175.82 1fie h SER 305 N 1.00 0.00 -0.97 3.07 4.64 -1.02 -3.48 113.55 116.80 1fie h SER 305 Ca 0.18 0.00 -0.39 0.00 -0.47 0.00 0.00 61.79 61.10 1fie h SER 305 Cb 0.55 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 62.49 1fie h SER 305 CO 0.03 0.60 -0.36 -0.62 -0.87 0.00 0.00 176.83 175.60 1fie n GLU 306 N -3.04 -1.34 -4.26 4.77 1.02 0.28 -4.95 120.64 113.11 1fie n GLU 306 Ca -0.05 1.17 -0.15 0.00 -0.02 0.00 0.00 57.16 58.11 1fie n GLU 306 Cb 0.82 -5.50 -0.10 0.00 -0.02 0.00 0.00 31.44 26.64 1fie n GLU 306 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 1fie s ASN 307 N -2.78 1.65 0.40 1.62 0.02 -1.24 -5.01 114.94 109.60 1fie s ASN 307 Ca 0.00 -1.10 -0.26 0.00 -1.02 0.00 0.00 52.86 50.48 1fie s ASN 307 Cb 0.00 0.03 -0.10 0.00 0.02 0.00 0.00 41.25 41.19 1fie s ASN 307 CO 0.00 -0.44 1.26 -2.65 0.02 0.00 0.00 177.10 175.30 1fie n PRO 308 N -0.26 1.95 -3.09 -0.60 -0.02 -1.25 -4.63 135.00 127.10 1fie n PRO 308 Ca -0.08 0.69 -0.39 0.00 -2.02 0.00 0.00 63.50 61.70 1fie n PRO 308 Cb 0.62 -2.36 -0.05 0.00 -0.02 0.00 0.00 33.50 31.69 1fie n PRO 308 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1fie s VAL 309 N -1.18 5.07 -0.26 -1.45 1.01 0.90 -4.87 120.40 119.62 1fie s VAL 309 Ca 0.60 1.36 -0.29 0.00 0.00 0.00 0.00 61.98 63.64 1fie s VAL 309 Cb -0.52 -4.00 0.00 0.00 0.00 0.00 0.00 36.38 31.86 1fie s VAL 309 CO 0.59 0.26 1.16 -0.13 0.00 0.00 0.00 175.10 176.98 1fie s ARG 310 N 0.79 4.12 0.00 2.72 0.52 -1.26 -1.53 118.95 124.31 1fie s ARG 310 Ca 0.35 1.32 0.00 0.00 -0.52 0.00 0.00 55.73 56.88 1fie s ARG 310 Cb -0.17 -3.75 0.00 0.00 0.52 0.00 0.00 34.95 31.55 1fie s ARG 310 CO 0.17 -0.84 0.00 0.66 0.02 0.00 0.00 175.30 175.31 1fie n TYR 311 N 6.84 0.00 -3.73 -0.53 4.01 -0.53 -3.31 117.16 119.91 1fie n TYR 311 Ca 0.13 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.75 1fie n TYR 311 Cb 0.46 -1.82 -0.07 0.00 -0.31 0.00 0.00 39.34 37.60 1fie n TYR 311 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1fie s GLY 312 N 0.00 -0.17 0.00 2.72 0.00 -0.97 -4.28 107.32 104.62 1fie s GLY 312 Ca 0.00 0.18 0.00 0.00 0.00 0.00 0.00 44.72 44.90 1fie s GLY 312 CO 0.00 -0.05 0.00 -1.06 0.00 0.00 0.00 173.10 171.99 1fie n GLN 313 N 0.75 1.67 0.12 2.90 6.02 -1.26 -1.98 117.38 125.59 1fie n GLN 313 Ca -0.19 0.00 0.09 0.00 -0.01 0.00 0.00 57.00 56.89 1fie n GLN 313 Cb 0.59 0.00 0.58 0.00 1.02 0.00 0.00 30.24 32.43 1fie n GLN 313 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1fie h TRP 315 N 0.18 0.34 0.05 0.00 0.09 -1.97 -3.07 115.95 111.57 1fie h TRP 315 Ca 0.11 -0.19 -0.00 0.00 0.09 0.00 0.00 58.89 58.90 1fie h TRP 315 Cb 0.21 -0.04 0.00 0.00 0.08 0.00 0.00 29.16 29.41 1fie h TRP 315 CO -0.00 1.00 -0.03 0.28 0.09 0.00 0.00 178.44 179.78 1fie h VAL 316 N 0.13 1.17 -0.89 0.12 2.07 -1.80 0.24 116.25 117.29 1fie h VAL 316 Ca -0.05 -0.76 0.14 0.00 0.82 0.00 0.00 66.70 66.85 1fie h VAL 316 Cb 1.51 1.67 -0.07 0.00 -1.52 0.00 0.00 31.29 32.88 1fie h VAL 316 CO 0.14 0.19 0.57 -0.26 0.02 0.00 0.00 177.57 178.23 1fie h PHE 317 N -0.41 0.83 0.01 1.57 0.04 -1.53 -0.07 116.94 117.37 1fie h PHE 317 Ca -0.01 0.02 -0.21 0.00 2.80 0.00 0.00 57.97 60.58 1fie h PHE 317 Cb 0.37 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 38.23 1fie h PHE 317 CO 0.04 0.31 -0.97 0.00 -0.60 0.00 0.00 178.31 177.09 1fie h ALA 318 N 1.60 0.42 -0.32 2.45 0.00 -1.43 -1.09 119.26 120.89 1fie h ALA 318 Ca 0.45 -0.85 -0.14 0.00 0.00 0.00 0.00 54.91 54.37 1fie h ALA 318 Cb 0.70 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1fie h ALA 318 CO -0.21 1.13 -0.37 0.78 0.00 0.00 0.00 179.25 180.58 1fie h GLY 319 N 2.62 0.80 0.22 0.00 0.00 0.55 -1.65 103.07 105.61 1fie h GLY 319 Ca -0.02 -0.79 -0.00 0.00 0.00 0.00 0.00 47.33 46.51 1fie h GLY 319 CO 0.13 0.72 -0.03 -2.08 0.00 0.00 0.00 176.54 175.27 1fie h VAL 320 N 0.61 1.13 -0.21 4.60 2.07 -1.08 -2.60 116.25 120.77 1fie h VAL 320 Ca 0.06 -1.51 0.06 0.00 0.82 0.00 0.00 66.70 66.12 1fie h VAL 320 Cb 0.91 2.00 -0.01 0.00 -1.52 0.00 0.00 31.29 32.68 1fie h VAL 320 CO 0.08 0.33 0.17 0.15 0.02 0.00 0.00 177.57 178.32 1fie h PHE 321 N -0.87 0.00 -0.11 1.57 3.57 -1.29 -1.32 116.94 118.49 1fie h PHE 321 Ca -0.01 0.00 -0.22 0.00 3.53 0.00 0.00 57.97 61.28 1fie h PHE 321 Cb 0.61 0.00 0.01 0.00 2.79 0.00 0.00 35.95 39.37 1fie h PHE 321 CO 0.14 0.00 -0.77 -0.97 -2.23 0.00 0.00 178.31 174.48 1fie h ASN 322 N 0.00 0.87 -0.88 0.41 -1.24 -1.31 -1.68 115.58 111.74 1fie h ASN 322 Ca 0.10 -0.66 -0.01 0.00 0.71 0.00 0.00 56.30 56.44 1fie h ASN 322 Cb 0.44 -0.26 -0.04 0.00 0.73 0.00 0.00 38.32 39.19 1fie h ASN 322 CO -0.00 1.39 0.51 0.74 -1.29 0.00 0.00 177.43 178.78 1fie h THR 323 N 0.41 1.25 0.07 -3.57 2.02 -0.86 -1.89 112.91 110.33 1fie h THR 323 Ca -0.07 -0.57 -0.00 0.00 0.77 0.00 0.00 66.41 66.54 1fie h THR 323 Cb 1.42 0.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.86 1fie h THR 323 CO 0.16 0.27 -0.03 0.15 0.37 0.00 0.00 175.52 176.43 1fie h PHE 324 N 1.22 -0.09 -0.07 3.16 3.04 -1.29 -0.26 116.94 122.66 1fie h PHE 324 Ca 0.31 -0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.27 1fie h PHE 324 Cb -0.02 0.03 -0.01 0.00 2.56 0.00 0.00 35.95 38.51 1fie h PHE 324 CO 0.00 0.10 0.03 -0.07 -2.02 0.00 0.00 178.31 176.35 1fie h LEU 325 N -0.26 0.03 -0.56 0.59 3.38 -1.10 -2.85 115.31 114.56 1fie h LEU 325 Ca -0.01 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 1fie h LEU 325 Cb 0.22 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 1fie h LEU 325 CO 0.02 0.03 0.22 0.03 0.09 0.00 0.00 178.44 178.83 1fie h ARG 326 N 0.06 0.83 -0.97 1.13 3.08 -1.38 0.11 114.38 117.24 1fie h ARG 326 Ca 0.03 -0.15 0.16 0.00 0.07 0.00 0.00 59.98 60.09 1fie h ARG 326 Cb 0.01 -0.14 -0.10 0.00 0.08 0.00 0.00 29.97 29.83 1fie h ARG 326 CO -0.02 0.72 0.58 0.00 -1.07 0.00 0.00 179.97 180.18 1fie n LEU 328 N -4.74 0.38 0.00 0.00 4.77 -1.13 -4.97 117.00 111.30 1fie n LEU 328 Ca 0.21 0.21 0.00 0.00 -0.03 0.00 0.00 56.01 56.40 1fie n LEU 328 Cb 0.48 -0.33 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 1fie n LEU 328 CO 0.23 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 176.95 1fie n GLY 329 N 1.47 1.25 3.45 -0.72 0.00 0.31 -1.40 105.19 109.55 1fie n GLY 329 Ca 0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 1fie n GLY 329 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fie s ILE 330 N -2.00 4.60 0.05 -0.61 1.01 0.33 -4.40 121.20 120.18 1fie s ILE 330 Ca 0.00 -0.34 -0.36 0.00 0.00 0.00 0.00 60.65 59.94 1fie s ILE 330 Cb 0.00 -3.31 -0.16 0.00 0.01 0.00 0.00 42.46 39.01 1fie s ILE 330 CO 0.00 0.12 1.46 -2.65 0.00 0.00 0.00 174.94 173.87 1fie n PRO 331 N 4.98 1.42 -3.78 2.79 -0.02 -1.26 -3.68 135.00 135.44 1fie n PRO 331 Ca -0.14 0.51 -0.10 0.00 -2.02 0.00 0.00 63.50 61.75 1fie n PRO 331 Cb 0.50 -2.20 -0.06 0.00 -0.02 0.00 0.00 33.50 31.72 1fie n PRO 331 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1fie s ALA 332 N 1.10 -0.55 -0.23 3.55 0.00 -1.11 -0.43 121.76 124.10 1fie s ALA 332 Ca 0.85 -0.40 -0.26 0.00 0.00 0.00 0.00 51.96 52.15 1fie s ALA 332 Cb -0.90 0.69 0.09 0.00 0.00 0.00 0.00 23.12 23.00 1fie s ALA 332 CO 0.47 -0.63 0.81 -0.98 0.00 0.00 0.00 175.76 175.43 1fie s ARG 333 N -3.86 0.78 0.36 0.00 1.70 -0.40 -4.71 118.95 112.82 1fie s ARG 333 Ca 0.07 0.71 -0.25 0.00 -0.47 0.00 0.00 55.73 55.79 1fie s ARG 333 Cb 0.03 0.38 -0.10 0.00 -0.57 0.00 0.00 34.95 34.69 1fie s ARG 333 CO -0.08 -0.14 1.00 0.42 -1.08 0.00 0.00 175.30 175.42 1fie s ILE 334 N -0.05 3.99 -0.04 4.99 1.01 -1.26 -0.46 121.20 129.38 1fie s ILE 334 Ca -0.01 1.57 0.00 0.00 0.00 0.00 0.00 60.65 62.21 1fie s ILE 334 Cb -0.04 -3.84 0.03 0.00 0.01 0.00 0.00 42.46 38.62 1fie s ILE 334 CO 0.01 0.06 -0.00 -0.69 0.00 0.00 0.00 174.94 174.31 1fie s VAL 335 N -1.66 0.23 -0.15 2.92 1.01 -0.91 -4.42 120.40 117.42 1fie s VAL 335 Ca 0.54 0.08 -0.04 0.00 0.00 0.00 0.00 61.98 62.56 1fie s VAL 335 Cb -0.20 -0.33 -0.03 0.00 0.00 0.00 0.00 36.38 35.82 1fie s VAL 335 CO 0.25 0.17 -0.03 -0.89 0.00 0.00 0.00 175.10 174.60 1fie s THR 336 N 1.14 3.98 -0.15 3.92 2.01 -0.28 -1.02 115.64 125.24 1fie s THR 336 Ca -0.08 -0.33 -0.04 0.00 0.31 0.00 0.00 61.69 61.55 1fie s THR 336 Cb -0.13 -2.73 -0.03 0.00 0.01 0.00 0.00 72.50 69.61 1fie s THR 336 CO -0.02 0.51 -0.04 0.21 -0.69 0.00 0.00 174.62 174.59 1fie s ASN 337 N 0.18 4.79 -0.20 3.53 3.04 -0.80 -0.33 114.94 125.15 1fie s ASN 337 Ca -0.01 -0.13 -0.16 0.00 0.04 0.00 0.00 52.86 52.60 1fie s ASN 337 Cb -0.14 -1.77 -0.04 0.00 -1.54 0.00 0.00 41.25 37.76 1fie s ASN 337 CO 0.03 0.17 0.41 -0.31 -3.04 0.00 0.00 177.10 174.36 1fie s TYR 338 N 0.34 3.38 -0.22 0.43 2.02 0.68 -1.81 117.35 122.16 1fie s TYR 338 Ca -0.04 0.63 -0.04 0.00 -0.37 0.00 0.00 57.07 57.25 1fie s TYR 338 Cb -0.14 -2.54 0.01 0.00 -0.40 0.00 0.00 41.96 38.88 1fie s TYR 338 CO 0.03 -0.01 0.15 1.19 -1.57 0.00 0.00 175.55 175.34 1fie n PHE 339 N 4.48 -2.32 -4.39 2.71 3.72 -0.50 -3.08 117.46 118.09 1fie n PHE 339 Ca -0.08 0.99 -0.35 0.00 -0.05 0.00 0.00 57.45 57.96 1fie n PHE 339 Cb 0.51 -3.06 -0.10 0.00 -0.94 0.00 0.00 39.48 35.89 1fie n PHE 339 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 1fie s SER 340 N -1.40 5.15 -1.07 4.37 0.01 -0.41 -4.23 113.70 116.12 1fie s SER 340 Ca 0.06 0.10 -0.06 0.00 1.31 0.00 0.00 55.95 57.37 1fie s SER 340 Cb -0.02 -1.49 0.29 0.00 0.21 0.00 0.00 66.02 65.01 1fie s SER 340 CO 0.47 0.35 1.28 0.00 0.41 0.00 0.00 173.24 175.76 1fie n ALA 341 N 2.33 4.70 -1.77 1.44 0.00 -1.17 -0.56 120.51 125.48 1fie n ALA 341 Ca -0.18 -4.74 -0.29 0.00 0.00 0.00 0.00 53.44 48.22 1fie n ALA 341 Cb 0.53 -2.31 0.10 0.00 0.00 0.00 0.00 19.45 17.77 1fie n ALA 341 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1fie s HIS 342 N -2.12 2.86 -1.45 0.00 2.46 -1.26 -3.85 115.29 111.93 1fie s HIS 342 Ca 0.31 0.84 -0.08 0.00 0.47 0.00 0.00 55.06 56.60 1fie s HIS 342 Cb -0.01 -3.39 0.04 0.00 -0.13 0.00 0.00 32.58 29.09 1fie s HIS 342 CO 0.02 -1.88 0.71 -0.25 -2.47 0.00 0.00 174.74 170.87 1fie n ASP 343 N -3.42 -5.16 0.04 9.88 8.00 -1.26 -4.87 116.55 119.75 1fie n ASP 343 Ca 0.07 -0.45 0.13 0.00 0.71 0.00 0.00 54.79 55.26 1fie n ASP 343 Cb 0.60 -4.17 0.49 0.00 -0.02 0.00 0.00 41.12 38.01 1fie n ASP 343 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 1fie n ASN 344 N -2.57 0.37 -3.16 -2.24 0.23 -1.25 -4.93 115.26 101.71 1fie n ASN 344 Ca -0.04 0.44 -0.19 0.00 -0.53 0.00 0.00 54.58 54.26 1fie n ASN 344 Cb 0.57 -0.49 -0.01 0.00 -2.08 0.00 0.00 39.78 37.76 1fie n ASN 344 CO 0.00 0.00 0.00 -0.67 -0.93 0.00 0.00 177.26 175.66 1fie n ASP 345 N -1.80 -2.97 -0.93 0.53 2.03 -1.26 -0.13 116.55 112.02 1fie n ASP 345 Ca 0.06 -0.20 -0.12 0.00 0.52 0.00 0.00 54.79 55.05 1fie n ASP 345 Cb 0.38 -2.52 -0.05 0.00 -0.72 0.00 0.00 41.12 38.21 1fie n ASP 345 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1fie n ALA 346 N -3.14 -0.18 -2.52 -1.67 0.00 -1.26 -4.97 120.51 106.76 1fie n ALA 346 Ca -0.02 0.20 -0.39 0.00 0.00 0.00 0.00 53.44 53.22 1fie n ALA 346 Cb 0.53 -1.78 -0.05 0.00 0.00 0.00 0.00 19.45 18.15 1fie n ALA 346 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1fie s ASN 347 N -2.47 7.03 -0.35 0.00 0.01 0.82 -2.15 114.94 117.82 1fie s ASN 347 Ca 0.00 1.23 0.03 0.00 -0.71 0.00 0.00 52.86 53.41 1fie s ASN 347 Cb 0.00 -2.40 0.53 0.00 0.41 0.00 0.00 41.25 39.79 1fie s ASN 347 CO 0.00 0.03 1.72 0.18 -1.51 0.00 0.00 177.10 177.52 1fie n LEU 348 N 3.01 5.93 -3.75 0.60 4.77 -0.06 -4.86 117.00 122.64 1fie n LEU 348 Ca -0.04 -3.15 -0.12 0.00 -0.03 0.00 0.00 56.01 52.67 1fie n LEU 348 Cb 0.51 -0.77 -0.12 0.00 -2.33 0.00 0.00 43.42 40.71 1fie n LEU 348 CO 0.45 0.93 -0.08 -1.10 -1.33 0.00 0.00 177.39 176.26 1fie s GLN 349 N -2.58 0.27 0.01 3.23 -0.21 -1.26 -2.54 119.66 116.57 1fie s GLN 349 Ca 0.45 0.49 0.04 0.00 0.02 0.00 0.00 55.36 56.36 1fie s GLN 349 Cb 0.38 0.00 -0.03 0.00 1.00 0.00 0.00 33.01 34.35 1fie s GLN 349 CO 0.09 -0.11 -0.11 1.41 -2.12 0.00 0.00 175.29 174.45 1fie s MET 350 N 0.81 2.40 -0.12 2.91 -2.45 0.20 -4.91 119.30 118.14 1fie s MET 350 Ca -0.05 -0.80 -0.00 0.00 -1.25 0.00 0.00 55.69 53.58 1fie s MET 350 Cb -0.07 -2.39 -0.02 0.00 1.25 0.00 0.00 34.83 33.60 1fie s MET 350 CO -0.05 0.58 -0.11 -0.51 1.05 0.00 0.00 175.02 175.98 1fie s ASP 351 N -1.37 4.18 -0.12 1.11 1.01 -1.26 -0.22 116.67 119.99 1fie s ASP 351 Ca 0.16 -0.25 0.02 0.00 0.71 0.00 0.00 52.55 53.19 1fie s ASP 351 Cb -0.11 -1.49 -0.00 0.00 1.01 0.00 0.00 42.92 42.33 1fie s ASP 351 CO 0.06 0.21 -0.20 -0.63 0.21 0.00 0.00 175.17 174.83 1fie s ILE 352 N 0.10 2.39 -0.11 0.77 1.09 0.15 -4.68 121.20 120.92 1fie s ILE 352 Ca -0.05 -0.89 -0.05 0.00 -1.10 0.00 0.00 60.65 58.56 1fie s ILE 352 Cb -0.14 -1.96 -0.04 0.00 -1.06 0.00 0.00 42.46 39.26 1fie s ILE 352 CO 0.04 0.54 0.09 -0.36 -0.10 0.00 0.00 174.94 175.15 1fie s PHE 353 N 0.52 3.43 -0.02 3.97 0.08 -1.26 -0.75 117.98 123.95 1fie s PHE 353 Ca -0.12 0.39 0.05 0.00 0.12 0.00 0.00 56.93 57.37 1fie s PHE 353 Cb -0.17 -1.89 -0.03 0.00 -0.57 0.00 0.00 43.02 40.37 1fie s PHE 353 CO 0.05 0.62 -0.17 -0.51 -0.10 0.00 0.00 175.22 175.10 1fie s LEU 354 N -0.92 2.60 0.78 -0.37 1.02 0.99 0.30 118.68 123.08 1fie s LEU 354 Ca 0.14 -0.29 -0.11 0.00 0.02 0.00 0.00 54.13 53.88 1fie s LEU 354 Cb -0.12 -1.52 0.06 0.00 0.02 0.00 0.00 46.19 44.63 1fie s LEU 354 CO 0.03 0.32 1.09 -1.61 0.02 0.00 0.00 176.35 176.20 1fie s GLU 355 N -0.89 2.25 0.28 1.70 2.02 0.23 -1.16 118.70 123.13 1fie s GLU 355 Ca 0.12 0.76 0.02 0.00 0.02 0.00 0.00 54.97 55.89 1fie s GLU 355 Cb -0.10 -1.93 0.66 0.00 0.10 0.00 0.00 34.13 32.85 1fie s GLU 355 CO 0.02 -1.54 1.73 0.93 0.02 0.00 0.00 175.26 176.42 1fie h GLU 356 N -1.03 0.51 -0.11 1.61 5.08 -1.87 0.03 114.58 118.80 1fie h GLU 356 Ca -0.46 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 57.87 1fie h GLU 356 Cb 1.25 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.39 1fie h GLU 356 CO 0.58 0.34 0.00 -0.40 -1.00 0.00 0.00 179.01 178.53 1fie n ASP 357 N -4.95 0.11 0.00 1.42 5.75 -1.26 -4.75 116.55 112.87 1fie n ASP 357 Ca 0.20 -0.68 0.00 0.00 -0.01 0.00 0.00 54.79 54.31 1fie n ASP 357 Cb 0.56 -0.06 0.00 0.00 -1.03 0.00 0.00 41.12 40.60 1fie n ASP 357 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1fie n GLY 358 N 0.00 2.49 3.82 6.12 0.00 -0.00 -4.96 105.19 112.66 1fie n GLY 358 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 1fie n GLY 358 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1fie s ASN 359 N -3.71 6.24 0.10 1.61 3.84 -1.25 -4.68 114.94 117.09 1fie s ASN 359 Ca 0.00 1.73 -0.31 0.00 0.21 0.00 0.00 52.86 54.49 1fie s ASN 359 Cb 0.00 -2.53 -0.07 0.00 -0.55 0.00 0.00 41.25 38.10 1fie s ASN 359 CO 0.00 -0.85 1.33 -0.69 -2.79 0.00 0.00 177.10 174.10 1fie s VAL 360 N -2.44 3.50 -1.02 -5.21 1.01 -1.26 0.78 120.40 115.76 1fie s VAL 360 Ca 0.62 1.08 -0.19 0.00 0.00 0.00 0.00 61.98 63.49 1fie s VAL 360 Cb -0.13 -3.69 0.11 0.00 0.00 0.00 0.00 36.38 32.67 1fie s VAL 360 CO 0.31 0.09 1.29 0.21 0.00 0.00 0.00 175.10 177.00 1fie s ASN 361 N 1.06 6.67 0.64 3.32 3.84 0.15 -4.67 114.94 125.96 1fie s ASN 361 Ca 0.63 -2.05 0.39 0.00 0.21 0.00 0.00 52.86 52.03 1fie s ASN 361 Cb -0.35 -2.46 2.19 0.00 -0.55 0.00 0.00 41.25 40.09 1fie s ASN 361 CO 0.30 -1.14 2.31 0.28 -2.79 0.00 0.00 177.10 176.06 1fie h SER 362 N 8.76 0.00 0.87 -4.21 0.02 -1.90 -2.18 113.55 114.91 1fie h SER 362 Ca 0.21 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 61.02 1fie h SER 362 Cb 0.99 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.51 1fie h SER 362 CO 1.23 0.00 -0.69 0.11 -1.14 0.00 0.00 176.83 176.35 1fie h LYS 363 N 0.00 0.00 0.00 3.45 1.57 -1.96 -3.35 116.57 116.28 1fie h LYS 363 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1fie h LYS 363 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1fie h LYS 363 CO -0.00 0.69 -1.70 1.28 -0.57 0.00 0.00 179.45 179.14 1fie n LEU 364 N -3.55 0.04 -4.51 2.94 4.77 -0.87 -4.82 117.00 111.00 1fie n LEU 364 Ca -0.00 -0.03 -0.42 0.00 -0.03 0.00 0.00 56.01 55.53 1fie n LEU 364 Cb 0.71 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.77 1fie n LEU 364 CO 0.43 0.01 0.90 -0.89 -1.33 0.00 0.00 177.39 176.50 1fie s THR 365 N -3.12 4.14 -0.22 -5.08 2.01 -0.89 -4.77 115.64 107.71 1fie s THR 365 Ca -0.05 0.10 0.08 0.00 0.31 0.00 0.00 61.69 62.13 1fie s THR 365 Cb 0.11 -4.72 -0.10 0.00 0.01 0.00 0.00 72.50 67.79 1fie s THR 365 CO 0.69 -1.49 0.26 0.29 -0.69 0.00 0.00 174.62 173.68 1fie n LYS 366 N 8.20 2.74 -2.05 4.92 4.76 -1.26 -4.89 118.16 130.57 1fie n LYS 366 Ca 0.00 -0.03 -0.28 0.00 -2.87 0.00 0.00 58.31 55.13 1fie n LYS 366 Cb 0.47 -1.00 0.14 0.00 -1.84 0.00 0.00 35.03 32.81 1fie n LYS 366 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1fie s ASP 367 N -2.21 3.79 -0.02 4.39 1.01 -1.26 -5.08 116.67 117.29 1fie s ASP 367 Ca 0.01 0.31 -0.28 0.00 0.71 0.00 0.00 52.55 53.29 1fie s ASP 367 Cb 0.06 -0.57 0.07 0.00 1.01 0.00 0.00 42.92 43.48 1fie s ASP 367 CO 0.32 -2.29 0.64 -0.44 0.21 0.00 0.00 175.17 173.60 1fie s SER 368 N -4.76 -0.60 -0.18 0.27 0.01 -1.26 -4.96 113.70 102.22 1fie s SER 368 Ca 0.69 0.56 -0.04 0.00 1.31 0.00 0.00 55.95 58.47 1fie s SER 368 Cb -0.06 0.53 -0.02 0.00 0.21 0.00 0.00 66.02 66.68 1fie s SER 368 CO 0.50 -0.65 -0.04 -0.69 0.41 0.00 0.00 173.24 172.76 1fie s VAL 369 N -1.59 3.65 0.35 3.43 1.01 -1.26 -4.62 120.40 121.37 1fie s VAL 369 Ca -0.09 -0.43 -0.27 0.00 0.00 0.00 0.00 61.98 61.19 1fie s VAL 369 Cb -0.00 -2.62 -0.09 0.00 0.00 0.00 0.00 36.38 33.66 1fie s VAL 369 CO 0.06 0.46 1.17 0.26 0.00 0.00 0.00 175.10 177.06 1fie s TRP 370 N 0.79 3.23 0.31 5.22 0.52 0.28 -4.00 118.94 125.29 1fie s TRP 370 Ca -0.02 1.57 0.02 0.00 0.02 0.00 0.00 56.10 57.69 1fie s TRP 370 Cb -0.15 -3.42 0.57 0.00 -1.15 0.00 0.00 33.47 29.33 1fie s TRP 370 CO 0.02 -1.18 1.93 -0.91 0.02 0.00 0.00 176.95 176.83 1fie h ASN 371 N 3.16 0.86 -5.06 2.95 -0.26 -1.44 -1.05 115.58 114.73 1fie h ASN 371 Ca -0.48 0.00 -0.02 0.00 -0.56 0.00 0.00 56.30 55.24 1fie h ASN 371 Cb 1.22 -0.18 -0.10 0.00 -1.06 0.00 0.00 38.32 38.20 1fie h ASN 371 CO 0.64 0.56 0.06 -0.72 -1.06 0.00 0.00 177.43 176.92 1fie s TYR 372 N -5.86 -0.21 -0.28 1.19 1.13 -1.26 -1.41 117.35 110.65 1fie s TYR 372 Ca -0.11 -0.11 -0.11 0.00 -1.41 0.00 0.00 57.07 55.32 1fie s TYR 372 Cb 0.20 0.42 0.11 0.00 -1.10 0.00 0.00 41.96 41.59 1fie s TYR 372 CO 0.79 -0.90 0.63 -1.58 -2.51 0.00 0.00 175.55 171.99 1fie s HIS 373 N -3.85 -1.22 -0.16 -3.49 2.46 -0.75 -4.81 115.29 103.47 1fie s HIS 373 Ca 0.07 2.20 -0.06 0.00 0.47 0.00 0.00 55.06 57.74 1fie s HIS 373 Cb -0.01 0.72 -0.04 0.00 -0.13 0.00 0.00 32.58 33.12 1fie s HIS 373 CO -0.05 -0.61 0.04 0.00 -2.47 0.00 0.00 174.74 171.64 1fie n TRP 375 N 3.24 0.00 -4.20 0.00 2.14 -0.19 -4.65 117.44 113.79 1fie n TRP 375 Ca -0.17 0.00 -0.17 0.00 2.07 0.00 0.00 57.50 59.22 1fie n TRP 375 Cb 0.53 0.00 -0.11 0.00 -0.81 0.00 0.00 31.31 30.91 1fie n TRP 375 CO 0.00 0.00 0.00 -0.80 2.07 0.00 0.00 177.69 178.96 1fie s ASN 376 N 0.45 1.74 -0.05 -0.67 -0.87 -0.37 -2.15 114.94 113.02 1fie s ASN 376 Ca 0.00 -0.72 0.06 0.00 -1.57 0.00 0.00 52.86 50.63 1fie s ASN 376 Cb 0.00 -0.04 -0.01 0.00 -0.02 0.00 0.00 41.25 41.18 1fie s ASN 376 CO 0.00 -0.14 -0.23 -1.61 -2.57 0.00 0.00 177.10 172.55 1fie s GLU 377 N -2.26 2.33 -0.03 -0.60 2.02 0.39 -1.22 118.70 119.32 1fie s GLU 377 Ca 0.03 -0.84 0.05 0.00 0.02 0.00 0.00 54.97 54.23 1fie s GLU 377 Cb -0.07 -2.00 -0.01 0.00 0.10 0.00 0.00 34.13 32.15 1fie s GLU 377 CO 0.02 0.36 -0.18 0.00 0.02 0.00 0.00 175.26 175.48 1fie s ALA 378 N -0.16 1.56 -0.22 5.21 0.00 0.68 -1.28 121.76 127.56 1fie s ALA 378 Ca -0.02 -0.74 -0.10 0.00 0.00 0.00 0.00 51.96 51.09 1fie s ALA 378 Cb -0.13 -0.48 -0.05 0.00 0.00 0.00 0.00 23.12 22.46 1fie s ALA 378 CO 0.03 0.32 0.14 -0.46 0.00 0.00 0.00 175.76 175.78 1fie s TRP 379 N -0.12 3.32 -0.13 0.00 -0.11 0.43 0.00 118.94 122.34 1fie s TRP 379 Ca -0.00 0.21 -0.33 0.00 1.22 0.00 0.00 56.10 57.19 1fie s TRP 379 Cb -0.10 -2.21 0.13 0.00 -1.50 0.00 0.00 33.47 29.78 1fie s TRP 379 CO 0.01 0.12 1.19 0.00 -4.62 0.00 0.00 176.95 173.65 1fie s MET 380 N 0.80 0.40 1.03 5.86 0.23 -0.94 -4.34 119.30 122.34 1fie s MET 380 Ca 0.07 -0.17 -0.16 0.00 -1.03 0.00 0.00 55.69 54.40 1fie s MET 380 Cb -0.13 0.17 0.21 0.00 -1.53 0.00 0.00 34.83 33.55 1fie s MET 380 CO 0.02 -0.18 1.21 0.95 -2.03 0.00 0.00 175.02 174.99 1fie s THR 381 N -2.51 1.86 -0.42 3.16 -4.23 -0.39 -0.98 115.64 112.14 1fie s THR 381 Ca 0.10 0.00 0.05 0.00 -1.18 0.00 0.00 61.69 60.66 1fie s THR 381 Cb 0.00 -2.77 0.19 0.00 1.34 0.00 0.00 72.50 71.26 1fie s THR 381 CO -0.05 0.00 0.39 0.54 -0.54 0.00 0.00 174.62 174.96 1fie n ARG 382 N -4.10 0.39 0.00 3.99 5.12 -1.26 -4.77 116.66 116.03 1fie n ARG 382 Ca 0.13 -3.25 0.05 0.00 -1.93 0.00 0.00 57.85 52.84 1fie n ARG 382 Cb 0.59 -1.60 0.25 0.00 -1.16 0.00 0.00 32.46 30.54 1fie n ARG 382 CO 0.00 0.00 0.00 -0.35 -1.93 0.00 0.00 177.63 175.35 1fie n PRO 383 N 2.48 0.18 0.00 5.56 -0.04 -1.26 -2.34 135.00 139.57 1fie n PRO 383 Ca 0.28 0.15 0.12 0.00 -0.04 0.00 0.00 63.50 64.00 1fie n PRO 383 Cb 0.48 -1.50 0.13 0.00 -0.04 0.00 0.00 33.50 32.58 1fie n PRO 383 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1fie n ASP 384 N -1.22 1.21 -4.38 3.54 5.75 -1.26 -4.94 116.55 115.24 1fie n ASP 384 Ca 0.05 -0.97 -0.21 0.00 -0.01 0.00 0.00 54.79 53.65 1fie n ASP 384 Cb 0.07 0.45 -0.10 0.00 -1.03 0.00 0.00 41.12 40.50 1fie n ASP 384 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1fie s LEU 385 N -2.70 2.54 0.87 -2.12 1.43 -0.99 -5.06 118.68 112.65 1fie s LEU 385 Ca 0.16 -0.99 -0.14 0.00 -1.03 0.00 0.00 54.13 52.14 1fie s LEU 385 Cb 0.18 -0.84 0.00 0.00 0.03 0.00 0.00 46.19 45.57 1fie s LEU 385 CO 0.65 -0.08 0.42 -2.65 0.23 0.00 0.00 176.35 174.92 1fie n PRO 386 N -0.29 -0.06 -1.89 1.29 -0.02 -1.26 -4.86 135.00 127.90 1fie n PRO 386 Ca -0.08 0.03 -0.41 0.00 -2.02 0.00 0.00 63.50 61.01 1fie n PRO 386 Cb 0.59 -1.83 -0.02 0.00 -0.02 0.00 0.00 33.50 32.23 1fie n PRO 386 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1fie s VAL 387 N -2.21 2.36 0.00 -1.45 0.11 -1.26 -3.27 120.40 114.68 1fie s VAL 387 Ca 0.59 0.30 0.00 0.00 -2.93 0.00 0.00 61.98 59.95 1fie s VAL 387 Cb -0.26 -3.19 0.00 0.00 -1.53 0.00 0.00 36.38 31.40 1fie s VAL 387 CO 0.64 0.05 0.00 0.61 -3.33 0.00 0.00 175.10 173.07 1fie n GLY 388 N 2.33 1.21 1.36 6.54 0.00 -1.26 -4.95 105.19 110.42 1fie n GLY 388 Ca 0.08 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.19 1fie n GLY 388 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1fie n PHE 389 N -0.42 1.25 -1.94 1.61 3.72 -1.20 -4.94 117.46 115.54 1fie n PHE 389 Ca 0.00 -0.62 -0.28 0.00 -0.05 0.00 0.00 57.45 56.50 1fie n PHE 389 Cb 0.00 -0.21 0.19 0.00 -0.94 0.00 0.00 39.48 38.52 1fie n PHE 389 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1fie n GLY 390 N 0.88 -1.33 0.00 1.37 0.00 -1.26 -4.69 105.19 100.16 1fie n GLY 390 Ca 0.23 -1.73 0.00 0.00 0.00 0.00 0.00 46.02 44.52 1fie n GLY 390 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fie n GLY 391 N -3.26 0.21 3.76 -0.02 0.00 -0.15 -4.88 105.19 100.85 1fie n GLY 391 Ca 0.16 -1.85 -0.41 0.00 0.00 0.00 0.00 46.02 43.92 1fie n GLY 391 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1fie s TRP 392 N 0.00 2.72 -0.06 1.61 0.52 -1.26 -2.22 118.94 120.25 1fie s TRP 392 Ca 0.00 1.03 0.02 0.00 0.02 0.00 0.00 56.10 57.17 1fie s TRP 392 Cb 0.00 -4.00 0.01 0.00 -1.15 0.00 0.00 33.47 28.33 1fie s TRP 392 CO 0.00 -3.11 -0.13 -0.65 0.02 0.00 0.00 176.95 173.08 1fie s GLN 393 N -1.31 1.70 0.15 4.98 -1.52 0.10 -2.96 119.66 120.80 1fie s GLN 393 Ca 0.57 -0.42 -0.30 0.00 -1.95 0.00 0.00 55.36 53.26 1fie s GLN 393 Cb -0.46 -1.41 -0.07 0.00 -0.22 0.00 0.00 33.01 30.85 1fie s GLN 393 CO 0.55 0.04 1.04 0.00 -0.25 0.00 0.00 175.29 176.67 1fie s ALA 394 N 0.61 3.32 -0.05 6.09 0.00 0.17 -0.23 121.76 131.67 1fie s ALA 394 Ca -0.14 0.71 -0.02 0.00 0.00 0.00 0.00 51.96 52.51 1fie s ALA 394 Cb -0.15 -3.32 0.03 0.00 0.00 0.00 0.00 23.12 19.68 1fie s ALA 394 CO 0.04 -0.12 0.10 0.08 0.00 0.00 0.00 175.76 175.86 1fie s VAL 395 N -0.15 -0.05 -0.15 0.00 1.01 -0.36 0.07 120.40 120.78 1fie s VAL 395 Ca 0.48 0.18 -0.00 0.00 0.00 0.00 0.00 61.98 62.64 1fie s VAL 395 Cb -0.27 -0.18 0.03 0.00 0.00 0.00 0.00 36.38 35.97 1fie s VAL 395 CO 0.32 0.07 -0.07 -0.62 0.00 0.00 0.00 175.10 174.80 1fie s ASP 396 N 1.06 2.65 0.43 3.32 -1.08 0.32 -1.23 116.67 122.13 1fie s ASP 396 Ca -0.08 -0.55 0.23 0.00 -0.52 0.00 0.00 52.55 51.63 1fie s ASP 396 Cb -0.11 -0.94 0.37 0.00 -1.46 0.00 0.00 42.92 40.77 1fie s ASP 396 CO -0.05 -0.15 1.62 0.28 0.52 0.00 0.00 175.17 177.40 1fie h SER 397 N 8.12 0.00 -3.34 -0.34 0.02 -1.86 -0.79 113.55 115.36 1fie h SER 397 Ca -0.28 0.00 -0.57 0.00 -0.84 0.00 0.00 61.79 60.11 1fie h SER 397 Cb 1.12 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 63.60 1fie h SER 397 CO 0.42 0.00 1.01 -0.89 -1.14 0.00 0.00 176.83 176.23 1fie s THR 398 N -3.20 4.05 0.93 -2.27 2.01 -1.26 -4.51 115.64 111.38 1fie s THR 398 Ca 0.07 1.11 -0.10 0.00 0.31 0.00 0.00 61.69 63.07 1fie s THR 398 Cb 0.05 -4.29 0.14 0.00 0.01 0.00 0.00 72.50 68.41 1fie s THR 398 CO 0.67 -0.74 1.06 -2.65 -0.69 0.00 0.00 174.62 172.27 1fie n PRO 399 N 7.80 -0.49 -3.62 4.92 -0.02 -1.26 -4.70 135.00 137.62 1fie n PRO 399 Ca 0.15 -0.08 -0.08 0.00 -2.02 0.00 0.00 63.50 61.47 1fie n PRO 399 Cb 0.48 -2.32 -0.06 0.00 -0.02 0.00 0.00 33.50 31.58 1fie n PRO 399 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 1fie s GLN 400 N -4.52 0.43 -0.06 -0.52 -2.07 -0.69 -4.87 119.66 107.36 1fie s GLN 400 Ca 0.66 0.31 -0.35 0.00 -1.82 0.00 0.00 55.36 54.16 1fie s GLN 400 Cb -0.23 0.21 -0.13 0.00 -1.09 0.00 0.00 33.01 31.77 1fie s GLN 400 CO 0.59 -0.09 1.76 0.39 -1.32 0.00 0.00 175.29 176.62 1fie n GLU 401 N 1.45 1.94 -0.88 9.60 -0.58 -1.26 -3.74 120.64 127.17 1fie n GLU 401 Ca -0.10 0.71 0.00 0.00 -0.42 0.00 0.00 57.16 57.35 1fie n GLU 401 Cb 0.57 -2.50 0.00 0.00 -0.57 0.00 0.00 31.44 28.94 1fie n GLU 401 CO 0.00 0.00 0.00 0.27 -0.48 0.00 0.00 177.13 176.92 1fie n ASN 402 N 5.50 0.57 -0.34 1.62 0.23 -0.26 -4.48 115.26 118.10 1fie n ASN 402 Ca 0.22 -0.44 0.19 0.00 -0.53 0.00 0.00 54.58 54.02 1fie n ASN 402 Cb 0.26 0.00 0.42 0.00 -2.08 0.00 0.00 39.78 38.38 1fie n ASN 402 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1fie h SER 403 N 0.00 0.61 0.34 0.53 0.02 -1.98 -2.88 113.55 110.19 1fie h SER 403 Ca 0.00 0.13 -0.16 0.00 -0.84 0.00 0.00 61.79 60.91 1fie h SER 403 Cb 0.00 0.03 -0.03 0.00 0.14 0.00 0.00 62.40 62.54 1fie h SER 403 CO 0.00 0.09 -1.80 0.47 -1.14 0.00 0.00 176.83 174.45 1fie n ASP 404 N -4.83 0.40 0.00 3.07 9.92 -1.26 -5.10 116.55 118.75 1fie n ASP 404 Ca 0.27 0.17 0.00 0.00 -0.53 0.00 0.00 54.79 54.70 1fie n ASP 404 Cb 0.80 0.91 0.00 0.00 -0.64 0.00 0.00 41.12 42.19 1fie n ASP 404 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1fie n GLY 405 N 1.44 0.33 2.97 0.44 0.00 -1.09 -4.95 105.19 104.33 1fie n GLY 405 Ca -0.14 -1.26 -0.43 0.00 0.00 0.00 0.00 46.02 44.20 1fie n GLY 405 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1fie n MET 406 N 0.00 3.49 -4.68 1.61 0.00 -1.26 -1.10 117.12 115.19 1fie n MET 406 Ca 0.00 -3.48 -0.30 0.00 -0.00 0.00 0.00 57.70 53.92 1fie n MET 406 Cb 0.00 -3.00 -0.09 0.00 0.00 0.00 0.00 33.22 30.13 1fie n MET 406 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 175.97 176.68 1fie s TYR 407 N 0.96 2.11 1.01 1.12 2.02 -1.25 -4.60 117.35 118.74 1fie s TYR 407 Ca 0.41 -0.87 -0.14 0.00 -0.37 0.00 0.00 57.07 56.10 1fie s TYR 407 Cb 0.08 -1.63 0.19 0.00 -0.40 0.00 0.00 41.96 40.20 1fie s TYR 407 CO -0.00 0.27 1.13 -0.98 -1.57 0.00 0.00 175.55 174.39 1fie s ARG 408 N -3.80 0.33 0.08 -0.62 1.04 -1.26 -1.71 118.95 113.00 1fie s ARG 408 Ca 0.20 0.24 0.06 0.00 -1.04 0.00 0.00 55.73 55.19 1fie s ARG 408 Cb 0.05 -1.75 -0.03 0.00 -2.04 0.00 0.00 34.95 31.18 1fie s ARG 408 CO 0.10 -2.74 -0.17 0.00 -0.04 0.00 0.00 175.30 172.45 1fie n GLY 410 N 1.33 1.95 3.65 0.00 0.00 -1.24 -0.52 105.19 110.36 1fie n GLY 410 Ca -0.20 -2.04 -0.42 0.00 0.00 0.00 0.00 46.02 43.36 1fie n GLY 410 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1fie s PRO 411 N -2.16 4.05 -0.22 1.61 0.04 -1.26 -4.75 135.00 132.31 1fie s PRO 411 Ca 0.00 2.28 -0.06 0.00 0.04 0.00 0.00 61.00 63.26 1fie s PRO 411 Cb 0.00 -4.08 -0.03 0.00 0.04 0.00 0.00 34.50 30.43 1fie s PRO 411 CO 0.00 -1.02 0.03 0.00 0.04 0.00 0.00 177.00 176.05 1fie s ALA 412 N 4.62 3.10 -0.12 8.56 0.00 0.11 -4.37 121.76 133.66 1fie s ALA 412 Ca 0.81 -1.06 -0.29 0.00 0.00 0.00 0.00 51.96 51.42 1fie s ALA 412 Cb -0.36 -1.92 -0.06 0.00 0.00 0.00 0.00 23.12 20.78 1fie s ALA 412 CO 0.34 -0.32 1.96 0.45 0.00 0.00 0.00 175.76 178.20 1fie s SER 413 N 1.30 6.09 0.51 0.00 0.15 -1.26 0.45 113.70 120.94 1fie s SER 413 Ca 0.04 2.12 0.26 0.00 0.70 0.00 0.00 55.95 59.08 1fie s SER 413 Cb -0.15 -2.52 1.37 0.00 -1.71 0.00 0.00 66.02 63.01 1fie s SER 413 CO 0.02 -1.42 1.94 0.58 1.20 0.00 0.00 173.24 175.55 1fie h VAL 414 N 6.29 0.67 -0.06 4.45 2.07 -1.87 0.59 116.25 128.39 1fie h VAL 414 Ca -0.42 -0.03 -0.14 0.00 0.82 0.00 0.00 66.70 66.93 1fie h VAL 414 Cb 1.22 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 31.55 1fie h VAL 414 CO 0.96 0.01 -0.59 1.56 0.02 0.00 0.00 177.57 179.54 1fie h GLN 415 N 0.08 0.21 -0.14 1.57 1.08 -1.83 -2.01 115.11 114.06 1fie h GLN 415 Ca 0.35 -0.14 -0.17 0.00 -1.45 0.00 0.00 58.65 57.25 1fie h GLN 415 Cb 1.27 0.02 0.01 0.00 -0.05 0.00 0.00 27.48 28.73 1fie h GLN 415 CO -0.03 0.74 -0.56 0.00 -0.95 0.00 0.00 178.83 178.03 1fie h ALA 416 N 1.23 0.25 0.35 3.87 0.00 -1.20 -3.12 119.26 120.65 1fie h ALA 416 Ca -0.00 -0.52 -0.01 0.00 0.00 0.00 0.00 54.91 54.38 1fie h ALA 416 Cb 1.08 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.83 1fie h ALA 416 CO 0.09 0.47 -0.45 0.82 0.00 0.00 0.00 179.25 180.19 1fie h ILE 417 N 0.28 0.00 -0.41 0.00 1.08 -1.31 0.67 117.51 117.81 1fie h ILE 417 Ca -0.03 0.00 0.12 0.00 -0.39 0.00 0.00 64.86 64.56 1fie h ILE 417 Cb 1.19 0.00 -0.02 0.00 -3.07 0.00 0.00 36.82 34.92 1fie h ILE 417 CO 0.12 0.00 0.57 0.50 -0.69 0.00 0.00 178.15 178.64 1fie h LYS 418 N -0.82 0.00 -0.24 2.37 3.11 -1.34 0.47 116.57 120.12 1fie h LYS 418 Ca -0.04 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.80 1fie h LYS 418 Cb 0.74 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.97 1fie h LYS 418 CO -0.11 0.00 0.00 0.72 -2.81 0.00 0.00 179.45 177.25 1fie n HIS 419 N -3.43 0.50 -0.80 1.91 8.25 -1.02 -4.63 115.22 115.99 1fie n HIS 419 Ca 0.08 -0.66 0.00 0.00 -0.26 0.00 0.00 57.72 56.88 1fie n HIS 419 Cb 0.73 -0.13 0.00 0.00 1.12 0.00 0.00 29.99 31.71 1fie n HIS 419 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1fie n GLY 420 N -0.12 0.46 3.32 -1.41 0.00 0.16 -4.51 105.19 103.09 1fie n GLY 420 Ca 0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.77 1fie n GLY 420 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1fie n HIS 421 N -2.09 3.05 1.55 1.61 8.25 0.13 -2.81 115.22 124.91 1fie n HIS 421 Ca 0.00 -2.09 0.11 0.00 -0.26 0.00 0.00 57.72 55.48 1fie n HIS 421 Cb 0.05 -2.36 0.49 0.00 1.12 0.00 0.00 29.99 29.29 1fie n HIS 421 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 1fie n VAL 422 N 6.58 0.10 0.20 1.59 0.24 -1.26 -3.64 118.33 122.14 1fie n VAL 422 Ca 0.48 -0.20 0.08 0.00 -2.04 0.00 0.00 64.34 62.65 1fie n VAL 422 Cb 0.44 0.12 0.34 0.00 -1.47 0.00 0.00 33.84 33.27 1fie n VAL 422 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1fie s PHE 424 N -3.49 3.49 0.91 0.00 0.08 -1.24 -4.94 117.98 112.79 1fie s PHE 424 Ca 0.01 1.42 -0.14 0.00 0.12 0.00 0.00 56.93 58.34 1fie s PHE 424 Cb 0.10 -3.33 0.00 0.00 -0.57 0.00 0.00 43.02 39.22 1fie s PHE 424 CO 0.67 -0.88 0.30 0.00 -0.10 0.00 0.00 175.22 175.21 1fie n GLN 425 N 4.02 -0.14 -0.64 0.44 10.64 -1.26 -4.44 117.38 126.01 1fie n GLN 425 Ca 0.08 -0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.25 1fie n GLN 425 Cb 0.48 -1.76 0.00 0.00 -0.86 0.00 0.00 30.24 28.10 1fie n GLN 425 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 1fie n PHE 426 N -3.22 0.00 -3.84 2.61 3.72 -1.26 -4.60 117.46 110.87 1fie n PHE 426 Ca 0.06 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.16 1fie n PHE 426 Cb 0.53 -0.74 -0.02 0.00 -0.94 0.00 0.00 39.48 38.31 1fie n PHE 426 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 176.76 176.46 1fie n ASP 427 N -0.48 -3.30 -0.02 4.37 8.00 -1.26 -3.71 116.55 120.15 1fie n ASP 427 Ca 0.00 -0.72 -0.11 0.00 0.71 0.00 0.00 54.79 54.67 1fie n ASP 427 Cb 0.21 -2.73 -0.05 0.00 -0.02 0.00 0.00 41.12 38.53 1fie n ASP 427 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1fie h ALA 428 N 0.94 -0.50 -1.20 2.24 0.00 -1.80 -2.65 119.26 116.28 1fie h ALA 428 Ca -0.50 0.01 0.36 0.00 0.00 0.00 0.00 54.91 54.78 1fie h ALA 428 Cb 1.33 0.76 -0.11 0.00 0.00 0.00 0.00 17.79 19.77 1fie h ALA 428 CO 0.66 -0.88 0.78 -1.35 0.00 0.00 0.00 179.25 178.46 1fie h PRO 429 N -0.44 0.20 -0.01 0.00 0.11 -1.91 0.68 132.00 130.63 1fie h PRO 429 Ca 0.09 -0.01 -0.21 0.00 0.11 0.00 0.00 66.00 65.98 1fie h PRO 429 Cb 0.60 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 31.66 1fie h PRO 429 CO -0.42 0.13 -0.88 0.74 -0.21 0.00 0.00 178.00 177.36 1fie h PHE 430 N 0.21 0.49 0.06 0.65 0.04 -1.86 0.68 116.94 117.22 1fie h PHE 430 Ca 0.72 -0.26 -0.26 0.00 2.80 0.00 0.00 57.97 60.97 1fie h PHE 430 Cb 2.12 -0.06 -0.02 0.00 2.20 0.00 0.00 35.95 40.19 1fie h PHE 430 CO -0.00 1.06 -1.23 -0.39 -0.60 0.00 0.00 178.31 177.15 1fie h VAL 431 N 0.20 1.47 0.25 -0.55 -1.51 -1.09 -2.67 116.25 112.35 1fie h VAL 431 Ca -0.06 -3.13 -0.01 0.00 -1.23 0.00 0.00 66.70 62.27 1fie h VAL 431 Cb 1.50 2.83 -0.01 0.00 -2.13 0.00 0.00 31.29 33.49 1fie h VAL 431 CO 0.15 0.88 -0.16 0.15 -1.23 0.00 0.00 177.57 177.35 1fie h PHE 432 N 0.04 -0.43 -0.04 5.19 3.04 -0.88 -1.27 116.94 122.58 1fie h PHE 432 Ca -0.12 -0.00 0.01 0.00 3.98 0.00 0.00 57.97 61.84 1fie h PHE 432 Cb 1.90 0.15 -0.00 0.00 2.56 0.00 0.00 35.95 40.57 1fie h PHE 432 CO 0.03 -0.26 0.03 0.00 -2.02 0.00 0.00 178.31 176.10 1fie h ALA 433 N 0.32 1.93 0.00 2.41 0.00 -0.92 -0.27 119.26 122.73 1fie h ALA 433 Ca -0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1fie h ALA 433 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.14 1fie h ALA 433 CO 0.02 -0.06 0.00 0.93 0.00 0.00 0.00 179.25 180.14 1fie h GLU 434 N 0.00 0.00 0.00 0.00 4.39 -0.86 -3.09 114.58 115.03 1fie h GLU 434 Ca 0.02 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.72 1fie h GLU 434 Cb 0.09 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.74 1fie h GLU 434 CO -0.00 0.00 0.00 1.55 -1.16 0.00 0.00 179.01 179.40 1fie n VAL 435 N -2.97 0.00 -0.02 3.13 3.14 -0.28 -3.07 118.33 118.26 1fie n VAL 435 Ca -0.02 -0.31 0.01 0.00 -2.96 0.00 0.00 64.34 61.07 1fie n VAL 435 Cb 0.11 1.09 0.04 0.00 -1.06 0.00 0.00 33.84 34.02 1fie n VAL 435 CO 0.00 0.00 0.00 0.59 -6.46 0.00 0.00 176.83 170.96 1fie n ASN 436 N -0.47 2.09 -4.74 6.55 3.02 -0.27 -1.86 115.26 119.58 1fie n ASN 436 Ca 0.00 -1.86 -0.31 0.00 -0.03 0.00 0.00 54.58 52.39 1fie n ASN 436 Cb 0.02 -0.05 0.12 0.00 -0.61 0.00 0.00 39.78 39.26 1fie n ASN 436 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1fie s SER 437 N -0.88 3.95 -0.03 6.41 0.01 -1.22 -4.93 113.70 117.01 1fie s SER 437 Ca 0.06 1.79 0.05 0.00 1.31 0.00 0.00 55.95 59.16 1fie s SER 437 Cb 0.03 -2.44 -0.03 0.00 0.21 0.00 0.00 66.02 63.80 1fie s SER 437 CO 0.04 -2.38 -0.18 -1.81 0.41 0.00 0.00 173.24 169.32 1fie s ASP 438 N -3.28 3.73 0.01 2.44 1.01 -1.05 -4.28 116.67 115.26 1fie s ASP 438 Ca 0.63 -0.30 -0.23 0.00 0.71 0.00 0.00 52.55 53.36 1fie s ASP 438 Cb -0.18 -0.68 -0.05 0.00 1.01 0.00 0.00 42.92 43.02 1fie s ASP 438 CO 0.57 0.33 0.68 -0.76 0.21 0.00 0.00 175.17 176.20 1fie s LEU 439 N -0.79 4.43 -0.16 1.23 1.43 -1.16 -0.63 118.68 123.03 1fie s LEU 439 Ca 0.11 1.30 0.01 0.00 -1.03 0.00 0.00 54.13 54.52 1fie s LEU 439 Cb -0.10 -3.08 0.01 0.00 0.03 0.00 0.00 46.19 43.05 1fie s LEU 439 CO 0.01 0.05 -0.18 -0.63 0.23 0.00 0.00 176.35 175.82 1fie s ILE 440 N -0.07 2.37 -0.26 -0.59 -1.09 0.70 -0.93 121.20 121.33 1fie s ILE 440 Ca 0.35 -0.86 -0.17 0.00 -2.23 0.00 0.00 60.65 57.74 1fie s ILE 440 Cb -0.19 -1.98 -0.03 0.00 -1.58 0.00 0.00 42.46 38.67 1fie s ILE 440 CO 0.20 0.53 0.45 -0.31 -1.23 0.00 0.00 174.94 174.58 1fie s TYR 441 N 0.94 3.26 -0.09 3.97 1.51 0.79 -0.67 117.35 127.06 1fie s TYR 441 Ca -0.03 0.54 0.03 0.00 -1.01 0.00 0.00 57.07 56.59 1fie s TYR 441 Cb -0.15 -2.65 0.01 0.00 -0.11 0.00 0.00 41.96 39.06 1fie s TYR 441 CO -0.03 -0.24 -0.18 0.42 -1.11 0.00 0.00 175.55 174.41 1fie s ILE 442 N 2.15 1.60 -0.29 2.71 1.01 0.07 -0.85 121.20 127.60 1fie s ILE 442 Ca 0.18 -0.73 -0.25 0.00 0.00 0.00 0.00 60.65 59.85 1fie s ILE 442 Cb -0.16 -1.42 0.00 0.00 0.01 0.00 0.00 42.46 40.90 1fie s ILE 442 CO 0.09 0.46 0.87 -0.89 0.00 0.00 0.00 174.94 175.47 1fie s THR 443 N 0.65 4.74 -0.92 2.92 2.01 0.13 -0.01 115.64 125.15 1fie s THR 443 Ca -0.14 1.41 -0.18 0.00 0.31 0.00 0.00 61.69 63.10 1fie s THR 443 Cb -0.16 -4.20 0.14 0.00 0.01 0.00 0.00 72.50 68.29 1fie s THR 443 CO 0.04 -0.26 1.07 0.00 -0.69 0.00 0.00 174.62 174.78 1fie s ALA 444 N 3.09 3.48 0.08 7.40 0.00 -0.31 -0.81 121.76 134.69 1fie s ALA 444 Ca 0.36 -2.86 -0.31 0.00 0.00 0.00 0.00 51.96 49.16 1fie s ALA 444 Cb -0.14 -3.97 -0.08 0.00 0.00 0.00 0.00 23.12 18.93 1fie s ALA 444 CO 0.12 -2.88 1.54 0.15 0.00 0.00 0.00 175.76 174.69 1fie s LYS 445 N 2.30 4.24 0.49 0.00 1.02 0.16 -4.36 119.74 123.59 1fie s LYS 445 Ca 0.31 2.22 0.00 0.00 0.02 0.00 0.00 55.97 58.51 1fie s LYS 445 Cb -0.06 -3.44 0.00 0.00 -0.52 0.00 0.00 37.83 33.82 1fie s LYS 445 CO -0.09 -0.62 0.86 1.63 -0.92 0.00 0.00 175.35 176.20 1fie n LYS 446 N 4.91 0.02 0.17 1.68 5.02 -1.26 -0.37 118.16 128.33 1fie n LYS 446 Ca 0.14 0.70 0.12 0.00 -2.02 0.00 0.00 58.31 57.26 1fie n LYS 446 Cb 0.41 -2.38 0.21 0.00 -0.02 0.00 0.00 35.03 33.25 1fie n LYS 446 CO 0.00 0.00 0.00 0.38 -0.52 0.00 0.00 177.40 177.26 1fie h ASP 447 N 0.00 0.00 0.00 4.39 2.03 -2.02 -3.46 116.42 117.36 1fie h ASP 447 Ca 0.00 -0.01 0.00 0.00 -0.73 0.00 0.00 57.03 56.29 1fie h ASP 447 Cb 1.72 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 40.22 1fie h ASP 447 CO 0.00 0.01 0.00 0.61 -1.03 0.00 0.00 179.24 178.83 1fie n GLY 448 N 1.17 1.33 3.83 7.15 0.00 0.50 -5.11 105.19 114.06 1fie n GLY 448 Ca 0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 1fie n GLY 448 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1fie s THR 449 N -1.87 4.67 0.11 2.61 2.01 -1.12 -4.91 115.64 117.14 1fie s THR 449 Ca 0.00 1.08 0.09 0.00 0.31 0.00 0.00 61.69 63.17 1fie s THR 449 Cb 0.00 -3.77 -0.04 0.00 0.01 0.00 0.00 72.50 68.70 1fie s THR 449 CO 0.00 0.13 -0.21 -1.00 -0.69 0.00 0.00 174.62 172.86 1fie s HIS 450 N -1.60 2.47 -0.06 4.92 3.76 -1.26 0.39 115.29 123.91 1fie s HIS 450 Ca 0.44 -0.30 -0.02 0.00 -0.15 0.00 0.00 55.06 55.03 1fie s HIS 450 Cb -0.15 -1.33 0.04 0.00 1.11 0.00 0.00 32.58 32.25 1fie s HIS 450 CO 0.20 0.35 0.10 0.54 -0.85 0.00 0.00 174.74 175.09 1fie s VAL 451 N -1.09 -0.14 -0.72 -0.90 0.11 0.01 -4.94 120.40 112.73 1fie s VAL 451 Ca 0.16 0.33 -0.27 0.00 -2.93 0.00 0.00 61.98 59.28 1fie s VAL 451 Cb -0.10 -0.20 0.02 0.00 -1.53 0.00 0.00 36.38 34.57 1fie s VAL 451 CO 0.08 0.14 1.39 0.68 -3.33 0.00 0.00 175.10 174.06 1fie s VAL 452 N 1.88 3.65 0.00 2.04 -7.23 -1.26 -0.70 120.40 118.78 1fie s VAL 452 Ca -0.00 0.37 0.00 0.00 -1.81 0.00 0.00 61.98 60.54 1fie s VAL 452 Cb -0.12 -4.73 0.00 0.00 0.56 0.00 0.00 36.38 32.09 1fie s VAL 452 CO -0.04 -1.68 0.27 -0.62 -0.31 0.00 0.00 175.10 172.72 1fie n GLU 453 N 9.34 0.00 -4.11 4.82 -0.58 -0.03 -4.90 120.64 125.18 1fie n GLU 453 Ca 0.06 0.41 -0.23 0.00 -0.42 0.00 0.00 57.16 56.99 1fie n GLU 453 Cb 0.50 -1.06 -0.06 0.00 -0.57 0.00 0.00 31.44 30.25 1fie n GLU 453 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 1fie s ASN 454 N -2.46 4.83 -0.23 1.62 3.84 -1.18 -4.49 114.94 116.87 1fie s ASN 454 Ca 0.00 -0.64 -0.03 0.00 0.21 0.00 0.00 52.86 52.40 1fie s ASN 454 Cb 0.00 -0.87 0.12 0.00 -0.55 0.00 0.00 41.25 39.95 1fie s ASN 454 CO 0.00 -0.20 0.37 0.54 -2.79 0.00 0.00 177.10 175.02 1fie s VAL 455 N -2.35 -0.59 -0.87 -5.21 0.11 -1.26 -0.15 120.40 110.09 1fie s VAL 455 Ca 0.36 -0.04 -0.08 0.00 -2.93 0.00 0.00 61.98 59.29 1fie s VAL 455 Cb -0.05 -0.78 0.22 0.00 -1.53 0.00 0.00 36.38 34.25 1fie s VAL 455 CO 0.23 -0.10 0.79 -0.62 -3.33 0.00 0.00 175.10 172.06 1fie s ASP 456 N 2.54 6.40 0.00 3.54 2.15 -0.10 -4.91 116.67 126.29 1fie s ASP 456 Ca 0.11 -3.19 0.08 0.00 0.43 0.00 0.00 52.55 49.97 1fie s ASP 456 Cb -0.15 -2.07 0.47 0.00 -0.30 0.00 0.00 42.92 40.87 1fie s ASP 456 CO -0.15 -0.37 0.91 0.00 -0.17 0.00 0.00 175.17 175.40 1fie n ALA 457 N 3.17 2.02 -1.20 3.66 0.00 -1.26 -3.00 120.51 123.91 1fie n ALA 457 Ca 0.17 -0.05 0.09 0.00 0.00 0.00 0.00 53.44 53.65 1fie n ALA 457 Cb 0.41 -1.13 0.14 0.00 0.00 0.00 0.00 19.45 18.87 1fie n ALA 457 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1fie n THR 458 N -0.76 1.77 -0.12 0.00 -2.24 -1.26 -4.79 114.28 106.88 1fie n THR 458 Ca 0.06 -2.19 -0.25 0.00 -2.27 0.00 0.00 64.05 59.40 1fie n THR 458 Cb 0.03 -0.17 -0.11 0.00 -2.10 0.00 0.00 70.33 67.97 1fie n THR 458 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 1fie n HIS 459 N -1.29 0.54 0.15 4.78 -0.00 -1.20 -4.79 115.22 113.41 1fie n HIS 459 Ca 0.15 0.22 -0.06 0.00 0.46 0.00 0.00 57.72 58.49 1fie n HIS 459 Cb 0.65 -1.06 -0.03 0.00 -0.12 0.00 0.00 29.99 29.44 1fie n HIS 459 CO 0.00 0.00 0.00 0.82 0.46 0.00 0.00 176.34 177.62 1fie h ILE 460 N -0.91 0.00 -0.04 3.57 2.04 -1.79 -3.29 117.51 117.09 1fie h ILE 460 Ca -0.52 -0.07 -0.14 0.00 1.00 0.00 0.00 64.86 65.12 1fie h ILE 460 Cb 1.50 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 37.53 1fie h ILE 460 CO -0.29 0.00 -0.24 0.61 0.00 0.00 0.00 178.15 178.23 1fie n GLY 461 N -0.63 2.90 0.51 5.37 0.00 -0.78 -4.26 105.19 108.30 1fie n GLY 461 Ca -0.05 -0.85 -0.19 0.00 0.00 0.00 0.00 46.02 44.93 1fie n GLY 461 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1fie h LYS 462 N 2.36 -1.03 -2.91 1.61 3.64 -1.61 -3.43 116.57 115.20 1fie h LYS 462 Ca 0.14 0.07 -0.36 0.00 -1.27 0.00 0.00 60.65 59.23 1fie h LYS 462 Cb 1.33 0.23 -0.38 0.00 -0.41 0.00 0.00 32.23 33.01 1fie h LYS 462 CO 0.18 -0.69 -0.68 -1.17 -2.27 0.00 0.00 179.45 174.83 1fie s LEU 463 N -10.10 0.06 -0.34 5.20 0.20 -1.25 -4.99 118.68 107.44 1fie s LEU 463 Ca -0.18 -0.15 -0.09 0.00 0.69 0.00 0.00 54.13 54.40 1fie s LEU 463 Cb 0.04 0.12 0.03 0.00 -0.43 0.00 0.00 46.19 45.95 1fie s LEU 463 CO 0.61 -0.30 0.14 -0.63 -0.29 0.00 0.00 176.35 175.88 1fie s ILE 464 N 2.25 4.20 0.18 6.68 1.01 -1.26 -0.23 121.20 134.03 1fie s ILE 464 Ca 0.04 -0.89 0.11 0.00 0.00 0.00 0.00 60.65 59.92 1fie s ILE 464 Cb -0.14 -3.31 -0.04 0.00 0.01 0.00 0.00 42.46 38.98 1fie s ILE 464 CO -0.09 -0.14 -0.24 0.54 0.00 0.00 0.00 174.94 175.01 1fie s VAL 465 N 1.50 2.34 0.16 2.92 0.11 0.55 -1.49 120.40 126.48 1fie s VAL 465 Ca 0.01 -1.99 -0.01 0.00 -2.93 0.00 0.00 61.98 57.06 1fie s VAL 465 Cb -0.19 -2.11 -0.04 0.00 -1.53 0.00 0.00 36.38 32.52 1fie s VAL 465 CO 0.05 -0.08 0.09 0.28 -3.33 0.00 0.00 175.10 172.11 1fie s THR 466 N -1.57 0.06 0.78 5.04 -1.32 0.12 -1.12 115.64 117.63 1fie s THR 466 Ca 0.20 -1.93 -0.11 0.00 -1.21 0.00 0.00 61.69 58.64 1fie s THR 466 Cb -0.08 -2.22 0.06 0.00 -1.51 0.00 0.00 72.50 68.75 1fie s THR 466 CO 0.09 -0.28 1.10 -0.75 -2.21 0.00 0.00 174.62 172.58 1fie s LYS 467 N -4.09 2.14 0.25 7.08 2.20 -1.26 0.50 119.74 126.55 1fie s LYS 467 Ca 0.30 1.25 -0.00 0.00 -0.36 0.00 0.00 55.97 57.16 1fie s LYS 467 Cb 0.07 -1.88 -0.04 0.00 -1.51 0.00 0.00 37.83 34.47 1fie s LYS 467 CO 0.06 -1.74 0.44 1.14 -0.36 0.00 0.00 175.35 174.89 1fie s GLN 468 N -4.77 3.52 0.26 4.03 -2.07 0.38 -4.51 119.66 116.50 1fie s GLN 468 Ca 0.63 -0.33 -0.05 0.00 -1.82 0.00 0.00 55.36 53.78 1fie s GLN 468 Cb -0.18 -2.78 0.29 0.00 -1.09 0.00 0.00 33.01 29.24 1fie s GLN 468 CO 0.55 0.32 1.93 0.82 -1.32 0.00 0.00 175.29 177.59 1fie h ILE 469 N 1.31 1.25 0.00 3.63 2.04 -1.95 -3.37 117.51 120.42 1fie h ILE 469 Ca -0.49 -0.47 0.00 0.00 1.00 0.00 0.00 64.86 64.90 1fie h ILE 469 Cb 1.20 -0.17 0.00 0.00 -0.74 0.00 0.00 36.82 37.11 1fie h ILE 469 CO 0.66 0.25 0.00 0.61 0.00 0.00 0.00 178.15 179.66 1fie n GLY 470 N -1.37 -0.75 0.00 5.37 0.00 -1.26 -4.89 105.19 102.29 1fie n GLY 470 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1fie n GLY 470 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fie n GLY 471 N 1.30 2.33 1.57 -0.02 0.00 -1.26 -5.01 105.19 104.10 1fie n GLY 471 Ca 0.00 -1.39 0.06 0.00 0.00 0.00 0.00 46.02 44.69 1fie n GLY 471 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1fie n ASP 472 N 0.00 4.65 -4.64 1.61 8.00 -1.26 -4.07 116.55 120.83 1fie n ASP 472 Ca 0.00 -2.69 -0.29 0.00 0.71 0.00 0.00 54.79 52.51 1fie n ASP 472 Cb 0.00 -0.63 0.13 0.00 -0.02 0.00 0.00 41.12 40.60 1fie n ASP 472 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1fie s GLY 473 N -0.63 1.63 0.45 0.44 0.00 -1.26 -4.80 107.32 103.15 1fie s GLY 473 Ca 0.43 -0.76 0.03 0.00 0.00 0.00 0.00 44.72 44.42 1fie s GLY 473 CO 0.13 -0.17 0.64 -3.16 0.00 0.00 0.00 173.10 170.54 1fie s MET 474 N -5.57 2.88 -0.08 2.90 0.23 -1.26 -0.47 119.30 117.93 1fie s MET 474 Ca 0.66 -0.83 -0.03 0.00 -1.03 0.00 0.00 55.69 54.46 1fie s MET 474 Cb -0.10 -2.63 0.04 0.00 -1.53 0.00 0.00 34.83 30.61 1fie s MET 474 CO 0.51 -0.32 0.13 1.41 -2.03 0.00 0.00 175.02 174.72 1fie s MET 475 N -4.49 0.01 -0.23 3.16 0.00 0.18 -4.61 119.30 113.31 1fie s MET 475 Ca 0.51 0.50 -0.29 0.00 0.00 0.00 0.00 55.69 56.42 1fie s MET 475 Cb -0.10 -0.36 0.01 0.00 0.00 0.00 0.00 34.83 34.37 1fie s MET 475 CO 0.36 -0.32 1.02 0.34 0.00 0.00 0.00 175.02 176.42 1fie s ASP 476 N 2.26 7.07 -0.01 1.11 -1.08 -1.26 -0.70 116.67 124.06 1fie s ASP 476 Ca 0.04 1.34 0.02 0.00 -0.52 0.00 0.00 52.55 53.43 1fie s ASP 476 Cb -0.12 -2.53 0.05 0.00 -1.46 0.00 0.00 42.92 38.86 1fie s ASP 476 CO -0.05 -0.66 1.04 2.30 0.52 0.00 0.00 175.17 178.32 1fie n ILE 477 N 5.32 1.07 -0.41 4.11 -5.35 -0.56 -4.75 119.36 118.79 1fie n ILE 477 Ca 0.11 -1.09 0.37 0.00 -0.27 0.00 0.00 62.75 61.87 1fie n ILE 477 Cb 0.46 0.45 0.71 0.00 -1.74 0.00 0.00 39.64 39.51 1fie n ILE 477 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1fie h THR 478 N 0.20 0.31 0.00 7.28 2.02 -1.83 0.35 112.91 121.25 1fie h THR 478 Ca 0.00 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.15 1fie h THR 478 Cb 0.56 0.22 0.00 0.00 -1.74 0.00 0.00 68.15 67.19 1fie h THR 478 CO 0.00 0.02 0.00 -0.90 0.37 0.00 0.00 175.52 175.01 1fie n ASP 479 N -4.29 0.00 -0.06 4.18 5.75 -1.26 -1.82 116.55 119.04 1fie n ASP 479 Ca 0.31 -1.10 -0.17 0.00 -0.01 0.00 0.00 54.79 53.81 1fie n ASP 479 Cb 1.36 0.00 -0.13 0.00 -1.03 0.00 0.00 41.12 41.31 1fie n ASP 479 CO 0.00 0.00 0.00 0.35 -0.11 0.00 0.00 177.20 177.44 1fie n THR 480 N -0.79 1.61 0.02 2.12 -2.24 0.12 -4.45 114.28 110.68 1fie n THR 480 Ca 0.11 -0.66 -0.09 0.00 -2.27 0.00 0.00 64.05 61.14 1fie n THR 480 Cb 0.05 -1.39 -0.13 0.00 -2.10 0.00 0.00 70.33 66.76 1fie n THR 480 CO 0.00 0.00 0.00 1.88 -0.57 0.00 0.00 175.07 176.38 1fie h TYR 481 N 0.03 0.05 -3.35 4.78 -1.99 -1.61 -3.39 116.97 111.49 1fie h TYR 481 Ca -0.48 -0.03 -0.13 0.00 2.00 0.00 0.00 58.73 60.09 1fie h TYR 481 Cb 2.01 -0.00 -0.20 0.00 2.00 0.00 0.00 36.73 40.54 1fie h TYR 481 CO 0.04 1.04 -0.38 -1.59 -0.00 0.00 0.00 178.16 177.27 1fie s LYS 482 N -2.64 0.61 0.32 4.88 -2.85 -0.76 -3.25 119.74 116.04 1fie s LYS 482 Ca -0.03 -0.38 -0.05 0.00 -1.00 0.00 0.00 55.97 54.50 1fie s LYS 482 Cb 0.09 0.26 0.07 0.00 -2.06 0.00 0.00 37.83 36.19 1fie s LYS 482 CO 0.82 -0.16 0.38 1.19 0.10 0.00 0.00 175.35 177.68 1fie n PHE 483 N 1.18 -3.79 -2.60 1.78 3.72 -1.26 -4.11 117.46 112.37 1fie n PHE 483 Ca -0.21 -0.34 -0.37 0.00 -0.05 0.00 0.00 57.45 56.47 1fie n PHE 483 Cb 0.57 -0.32 -0.05 0.00 -0.94 0.00 0.00 39.48 38.74 1fie n PHE 483 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1fie s GLN 484 N -3.84 4.39 -0.25 -1.08 -1.52 -1.26 -4.96 119.66 111.14 1fie s GLN 484 Ca 0.22 1.51 -0.36 0.00 -1.95 0.00 0.00 55.36 54.78 1fie s GLN 484 Cb -0.01 -2.76 -0.13 0.00 -0.22 0.00 0.00 33.01 29.89 1fie s GLN 484 CO 0.16 0.07 1.97 -1.91 -0.25 0.00 0.00 175.29 175.32 1fie n GLU 485 N 0.39 1.42 -3.39 2.91 0.00 -1.26 -2.76 120.64 117.96 1fie n GLU 485 Ca 0.03 0.48 -0.17 0.00 0.00 0.00 0.00 57.16 57.50 1fie n GLU 485 Cb 0.49 -2.41 0.08 0.00 0.00 0.00 0.00 31.44 29.60 1fie n GLU 485 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1fie n GLY 486 N 5.21 -0.63 2.99 8.31 0.00 -1.26 -5.04 105.19 114.76 1fie n GLY 486 Ca 0.31 0.26 -0.17 0.00 0.00 0.00 0.00 46.02 46.43 1fie n GLY 486 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1fie s GLN 487 N -5.09 0.58 0.24 1.61 0.74 -1.11 -5.05 119.66 111.58 1fie s GLN 487 Ca 0.16 -0.25 -0.01 0.00 0.05 0.00 0.00 55.36 55.31 1fie s GLN 487 Cb -0.02 -0.56 0.53 0.00 1.10 0.00 0.00 33.01 34.06 1fie s GLN 487 CO 0.74 0.15 1.22 0.39 -0.55 0.00 0.00 175.29 177.24 1fie n GLU 488 N 2.94 -0.06 -0.28 1.67 -0.58 -1.26 0.13 120.64 123.20 1fie n GLU 488 Ca -0.13 1.18 0.04 0.00 -0.42 0.00 0.00 57.16 57.82 1fie n GLU 488 Cb 0.57 -1.85 0.25 0.00 -0.57 0.00 0.00 31.44 29.85 1fie n GLU 488 CO 0.00 0.00 0.00 1.05 -0.48 0.00 0.00 177.13 177.70 1fie h GLU 489 N 0.00 0.98 0.00 3.49 9.09 -1.98 0.14 114.58 126.30 1fie h GLU 489 Ca 0.45 -0.06 -0.05 0.00 0.05 0.00 0.00 59.36 59.74 1fie h GLU 489 Cb 0.86 -0.22 -0.01 0.00 -1.65 0.00 0.00 28.75 27.74 1fie h GLU 489 CO -0.75 0.65 -0.25 1.49 0.05 0.00 0.00 179.01 180.19 1fie h GLU 490 N 1.01 0.00 -0.03 1.06 4.22 -0.57 -0.45 114.58 119.82 1fie h GLU 490 Ca 0.36 0.00 -0.25 0.00 0.08 0.00 0.00 59.36 59.55 1fie h GLU 490 Cb 0.14 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.41 1fie h GLU 490 CO -0.12 0.25 -0.96 -0.09 -2.18 0.00 0.00 179.01 175.90 1fie h ARG 491 N 0.00 0.63 -0.05 1.92 2.43 -0.15 -2.86 114.38 116.30 1fie h ARG 491 Ca -0.00 -0.64 -0.03 0.00 -0.81 0.00 0.00 59.98 58.50 1fie h ARG 491 Cb 0.91 0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.64 1fie h ARG 491 CO 0.03 1.25 -0.09 -0.07 -1.51 0.00 0.00 179.97 179.58 1fie h LEU 492 N 0.37 0.16 -0.01 3.80 -0.00 -0.70 -2.03 115.31 116.90 1fie h LEU 492 Ca -0.10 -0.56 0.03 0.00 -0.00 0.00 0.00 57.88 57.25 1fie h LEU 492 Cb 1.61 -0.05 -0.06 0.00 -0.00 0.00 0.00 40.66 42.16 1fie h LEU 492 CO 0.18 0.69 -0.44 0.00 -0.00 0.00 0.00 178.44 178.87 1fie h ALA 493 N 0.48 -0.71 -0.84 1.53 0.00 -1.19 0.26 119.26 118.79 1fie h ALA 493 Ca 0.00 -0.05 0.13 0.00 0.00 0.00 0.00 54.91 54.99 1fie h ALA 493 Cb 0.66 0.78 -0.06 0.00 0.00 0.00 0.00 17.79 19.17 1fie h ALA 493 CO 0.02 -0.98 0.55 1.25 0.00 0.00 0.00 179.25 180.09 1fie h LEU 494 N -0.58 0.62 -0.64 0.00 6.46 -1.56 0.14 115.31 119.76 1fie h LEU 494 Ca 0.05 0.03 -0.15 0.00 -0.12 0.00 0.00 57.88 57.69 1fie h LEU 494 Cb 0.66 -0.10 -0.02 0.00 -0.73 0.00 0.00 40.66 40.48 1fie h LEU 494 CO -0.33 0.34 -0.67 -0.08 -0.62 0.00 0.00 178.44 177.08 1fie h GLU 495 N 0.67 0.06 -0.36 1.25 4.81 -0.48 -2.84 114.58 117.70 1fie h GLU 495 Ca 0.41 -0.05 -0.16 0.00 -0.13 0.00 0.00 59.36 59.43 1fie h GLU 495 Cb 0.63 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 30.02 1fie h GLU 495 CO -0.17 0.71 -0.41 1.15 -0.73 0.00 0.00 179.01 179.55 1fie h THR 496 N 0.04 1.27 0.60 0.32 2.02 0.23 -3.01 112.91 114.38 1fie h THR 496 Ca -0.01 -1.59 -0.02 0.00 0.77 0.00 0.00 66.41 65.56 1fie h THR 496 Cb 1.19 1.43 -0.01 0.00 -1.74 0.00 0.00 68.15 69.02 1fie h THR 496 CO 0.09 0.53 -0.48 0.00 0.37 0.00 0.00 175.52 176.03 1fie h ALA 497 N 0.80 -1.19 -0.42 6.16 0.00 -1.16 -0.05 119.26 123.40 1fie h ALA 497 Ca 0.05 -0.21 0.12 0.00 0.00 0.00 0.00 54.91 54.88 1fie h ALA 497 Cb 1.00 0.66 -0.02 0.00 0.00 0.00 0.00 17.79 19.43 1fie h ALA 497 CO 0.10 -1.19 0.65 -0.07 0.00 0.00 0.00 179.25 178.74 1fie h LEU 498 N -1.04 0.00 0.00 0.00 3.38 -1.54 0.58 115.31 116.69 1fie h LEU 498 Ca -0.08 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.79 1fie h LEU 498 Cb 0.87 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.61 1fie h LEU 498 CO 0.01 0.00 -0.60 -0.03 0.09 0.00 0.00 178.44 177.91 1fie h MET 499 N 0.00 0.00 -0.68 1.13 4.05 -0.87 -3.33 114.93 115.23 1fie h MET 499 Ca 0.20 0.00 -0.45 0.00 -0.28 0.00 0.00 59.70 59.17 1fie h MET 499 Cb 1.49 0.00 -0.28 0.00 -0.80 0.00 0.00 31.60 32.02 1fie h MET 499 CO -0.00 0.41 -0.11 0.66 0.23 0.00 0.00 176.91 178.09 1fie n TYR 500 N -3.15 2.29 0.00 1.39 4.01 0.20 -4.96 117.16 116.94 1fie n TYR 500 Ca 0.00 -2.20 0.00 0.00 -0.16 0.00 0.00 57.90 55.54 1fie n TYR 500 Cb 0.72 -0.68 0.00 0.00 -0.31 0.00 0.00 39.34 39.07 1fie n TYR 500 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1fie n GLY 501 N -0.92 3.08 3.76 2.72 0.00 -1.16 -4.45 105.19 108.22 1fie n GLY 501 Ca 0.45 -1.12 -0.38 0.00 0.00 0.00 0.00 46.02 44.97 1fie n GLY 501 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fie s ALA 502 N -0.05 2.94 0.15 4.61 0.00 -1.16 -4.97 121.76 123.27 1fie s ALA 502 Ca 0.00 1.27 0.06 0.00 0.00 0.00 0.00 51.96 53.29 1fie s ALA 502 Cb 0.00 -3.53 -0.04 0.00 0.00 0.00 0.00 23.12 19.55 1fie s ALA 502 CO 0.00 -1.18 -0.12 -1.59 0.00 0.00 0.00 175.76 172.87 1fie s LYS 503 N -2.76 1.09 -0.31 0.00 -2.85 -0.92 -4.07 119.74 109.93 1fie s LYS 503 Ca 0.68 -1.39 0.00 0.00 -1.00 0.00 0.00 55.97 54.26 1fie s LYS 503 Cb -0.39 -0.80 0.10 0.00 -2.06 0.00 0.00 37.83 34.68 1fie s LYS 503 CO 0.47 0.13 0.07 0.15 0.10 0.00 0.00 175.35 176.27 1fie s LYS 504 N -3.32 0.93 0.05 1.78 1.02 -1.26 -0.88 119.74 118.07 1fie s LYS 504 Ca 0.15 -1.21 -0.29 0.00 0.02 0.00 0.00 55.97 54.63 1fie s LYS 504 Cb -0.01 -2.29 -0.16 0.00 -0.52 0.00 0.00 37.83 34.85 1fie s LYS 504 CO 0.03 -0.94 1.44 -1.35 -0.92 0.00 0.00 175.35 173.61 1fie h PRO 505 N 7.98 -0.99 -6.69 -1.68 0.11 -1.96 -3.44 132.00 125.34 1fie h PRO 505 Ca -0.12 0.07 -0.50 0.00 0.11 0.00 0.00 66.00 65.56 1fie h PRO 505 Cb 1.02 0.22 -0.03 0.00 0.11 0.00 0.00 31.00 32.33 1fie h PRO 505 CO 0.47 -0.66 0.09 -0.51 -0.21 0.00 0.00 178.00 177.19 1fie s LEU 506 N -8.71 4.11 -0.05 2.35 1.43 -1.26 -5.08 118.68 111.48 1fie s LEU 506 Ca -0.15 1.30 -0.03 0.00 -1.03 0.00 0.00 54.13 54.21 1fie s LEU 506 Cb 0.02 -3.98 -0.04 0.00 0.03 0.00 0.00 46.19 42.21 1fie s LEU 506 CO 0.47 -0.16 0.13 0.21 0.23 0.00 0.00 176.35 177.23 1fie s ASN 507 N -2.16 6.11 -0.23 2.29 3.84 -1.26 -5.00 114.94 118.53 1fie s ASN 507 Ca 0.52 0.31 0.04 0.00 0.21 0.00 0.00 52.86 53.95 1fie s ASN 507 Cb -0.11 -1.88 0.43 0.00 -0.55 0.00 0.00 41.25 39.13 1fie s ASN 507 CO 0.18 0.32 1.45 0.35 -2.79 0.00 0.00 177.10 176.61 1fie n THR 508 N 1.40 2.11 -2.92 -5.21 -2.24 -1.26 -5.02 114.28 101.13 1fie n THR 508 Ca -0.15 -1.05 0.00 0.00 -2.27 0.00 0.00 64.05 60.59 1fie n THR 508 Cb 0.53 -0.58 0.00 0.00 -2.10 0.00 0.00 70.33 68.18 1fie n THR 508 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1fie n GLU 509 N -0.21 0.00 0.05 -0.78 -0.58 -1.26 -3.07 120.64 114.79 1fie n GLU 509 Ca 0.30 0.00 -0.05 0.00 -0.42 0.00 0.00 57.16 56.98 1fie n GLU 509 Cb 1.08 0.00 0.14 0.00 -0.57 0.00 0.00 31.44 32.09 1fie n GLU 509 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 1fie h GLY 510 N 0.00 0.40 -0.75 0.62 0.00 -2.04 -3.46 103.07 97.85 1fie h GLY 510 Ca 0.00 -0.43 -0.07 0.00 0.00 0.00 0.00 47.33 46.83 1fie h GLY 510 CO 0.00 0.39 0.09 -0.62 0.00 0.00 0.00 176.54 176.40 1fie n VAL 511 N -3.98 0.00 -1.62 4.60 0.31 -1.17 -5.10 118.33 111.37 1fie n VAL 511 Ca -0.02 -0.81 0.00 0.00 -0.01 0.00 0.00 64.34 63.50 1fie n VAL 511 Cb 0.54 0.67 0.00 0.00 -0.91 0.00 0.00 33.84 34.14 1fie n VAL 511 CO 0.00 0.00 0.00 1.15 -1.32 0.00 0.00 176.83 176.66 1fie n MET 512 N -0.36 0.00 0.00 5.55 0.00 -1.25 -4.92 117.12 116.14 1fie n MET 512 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.66 1fie n MET 512 Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.60 1fie n MET 512 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 175.97 177.14 1fie n LYS 513 N 0.00 0.00 0.00 3.17 4.81 -1.26 -4.71 118.16 120.17 1fie n LYS 513 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 1fie n LYS 513 Cb 0.36 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.41 1fie n LYS 513 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1fie n SER 514 N 0.00 0.00 -0.25 3.14 2.88 -1.26 -5.01 113.62 113.11 1fie n SER 514 Ca 0.00 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 57.52 1fie n SER 514 Cb 0.00 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.45 1fie n SER 514 CO 0.00 0.00 0.00 -2.11 -1.23 0.00 0.00 175.04 171.70 1fie n ARG 515 N -0.03 -1.87 -2.41 -1.46 1.85 -1.26 -2.30 116.66 109.17 1fie n ARG 515 Ca 0.00 0.42 -0.11 0.00 -1.00 0.00 0.00 57.85 57.16 1fie n ARG 515 Cb 0.00 -4.31 -0.01 0.00 -1.05 0.00 0.00 32.46 27.09 1fie n ARG 515 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 1fie n SER 516 N 0.20 -3.56 -2.57 2.89 7.64 -1.26 -1.21 113.62 115.75 1fie n SER 516 Ca -0.02 0.23 -0.14 0.00 1.01 0.00 0.00 58.87 59.95 1fie n SER 516 Cb 0.35 -3.05 -0.00 0.00 -1.01 0.00 0.00 64.21 60.50 1fie n SER 516 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1fie n ASN 517 N -1.72 -3.92 -4.41 6.43 3.02 -0.97 -4.49 115.26 109.19 1fie n ASN 517 Ca -0.13 0.11 -0.45 0.00 -0.03 0.00 0.00 54.58 54.09 1fie n ASN 517 Cb 0.59 -3.31 -0.03 0.00 -0.61 0.00 0.00 39.78 36.42 1fie n ASN 517 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1fie s VAL 518 N -2.66 4.90 0.59 2.41 1.01 -0.35 -1.89 120.40 124.41 1fie s VAL 518 Ca 0.06 -1.57 -0.14 0.00 0.00 0.00 0.00 61.98 60.33 1fie s VAL 518 Cb -0.03 -4.65 -0.05 0.00 0.00 0.00 0.00 36.38 31.65 1fie s VAL 518 CO 0.07 -1.33 1.02 -0.62 0.00 0.00 0.00 175.10 174.24 1fie s ASP 519 N 3.32 6.16 0.02 3.32 -1.08 -0.10 -4.84 116.67 123.47 1fie s ASP 519 Ca 0.25 1.57 -0.02 0.00 -0.52 0.00 0.00 52.55 53.83 1fie s ASP 519 Cb -0.10 -2.50 -0.02 0.00 -1.46 0.00 0.00 42.92 38.84 1fie s ASP 519 CO -0.05 -0.91 0.01 -0.32 0.52 0.00 0.00 175.17 174.42 1fie s MET 520 N -4.58 0.40 -0.29 4.34 -2.45 -1.26 -1.03 119.30 114.42 1fie s MET 520 Ca 0.58 -0.66 -0.29 0.00 -1.25 0.00 0.00 55.69 54.08 1fie s MET 520 Cb -0.12 0.15 0.20 0.00 1.25 0.00 0.00 34.83 36.31 1fie s MET 520 CO 0.43 -0.08 1.39 0.34 1.05 0.00 0.00 175.02 178.15 1fie s ASP 521 N -1.68 -0.02 0.14 1.11 2.15 -1.20 -5.03 116.67 112.15 1fie s ASP 521 Ca -0.12 0.02 0.00 0.00 0.43 0.00 0.00 52.55 52.88 1fie s ASP 521 Cb -0.07 0.02 -0.04 0.00 -0.30 0.00 0.00 42.92 42.53 1fie s ASP 521 CO -0.02 -0.02 0.03 0.72 -0.17 0.00 0.00 175.17 175.71 1fie s PHE 522 N -0.90 0.98 -0.02 -5.34 -0.71 -1.26 -1.12 117.98 109.61 1fie s PHE 522 Ca 0.09 -1.13 0.02 0.00 -1.04 0.00 0.00 56.93 54.87 1fie s PHE 522 Cb -0.01 -0.56 0.00 0.00 -1.21 0.00 0.00 43.02 41.24 1fie s PHE 522 CO -0.09 -0.38 -0.06 -1.83 -1.34 0.00 0.00 175.22 171.52 1fie s GLU 523 N -3.98 0.66 -0.13 1.99 -1.05 -0.78 -4.98 118.70 110.42 1fie s GLU 523 Ca 0.23 -0.20 -0.01 0.00 -0.15 0.00 0.00 54.97 54.84 1fie s GLU 523 Cb 0.07 -0.65 -0.02 0.00 -0.44 0.00 0.00 34.13 33.09 1fie s GLU 523 CO 0.02 0.07 -0.09 0.08 0.95 0.00 0.00 175.26 176.28 1fie s VAL 524 N 0.22 3.39 0.54 1.83 1.01 -1.26 -0.51 120.40 125.62 1fie s VAL 524 Ca -0.03 -0.55 -0.14 0.00 0.00 0.00 0.00 61.98 61.26 1fie s VAL 524 Cb -0.07 -2.44 -0.07 0.00 0.00 0.00 0.00 36.38 33.80 1fie s VAL 524 CO -0.00 0.52 0.99 -1.83 0.00 0.00 0.00 175.10 174.78 1fie s GLU 525 N 0.26 3.83 -0.22 2.72 -1.05 -0.86 -5.03 118.70 118.34 1fie s GLU 525 Ca -0.07 0.86 -0.05 0.00 -0.15 0.00 0.00 54.97 55.56 1fie s GLU 525 Cb -0.15 -2.13 -0.02 0.00 -0.44 0.00 0.00 34.13 31.39 1fie s GLU 525 CO 0.04 -0.35 -0.01 0.54 0.95 0.00 0.00 175.26 176.43 1fie s ASN 526 N -3.44 4.57 0.68 0.83 2.20 -1.26 -4.67 114.94 113.84 1fie s ASN 526 Ca 0.57 -0.31 -0.05 0.00 -0.94 0.00 0.00 52.86 52.13 1fie s ASN 526 Cb -0.10 -1.79 0.06 0.00 -2.00 0.00 0.00 41.25 37.42 1fie s ASN 526 CO 0.39 -0.00 0.96 0.00 -2.94 0.00 0.00 177.10 175.51 1fie s ALA 527 N 1.38 3.34 0.49 3.54 0.00 -1.26 -4.91 121.76 124.35 1fie s ALA 527 Ca 0.05 -1.08 -0.03 0.00 0.00 0.00 0.00 51.96 50.89 1fie s ALA 527 Cb -0.14 -2.44 -0.01 0.00 0.00 0.00 0.00 23.12 20.52 1fie s ALA 527 CO -0.01 -1.21 0.75 0.08 0.00 0.00 0.00 175.76 175.38 1fie s VAL 528 N -3.14 4.23 0.18 0.00 1.01 -1.26 -2.19 120.40 119.23 1fie s VAL 528 Ca 0.60 -0.18 -0.33 0.00 0.00 0.00 0.00 61.98 62.08 1fie s VAL 528 Cb -0.10 -3.60 -0.15 0.00 0.00 0.00 0.00 36.38 32.53 1fie s VAL 528 CO 0.43 -0.52 1.32 -0.11 0.00 0.00 0.00 175.10 176.22 1fie n LEU 529 N -2.24 2.28 -0.20 3.92 -0.00 -0.11 -2.29 117.00 118.35 1fie n LEU 529 Ca 0.01 1.13 -0.03 0.00 -0.00 0.00 0.00 56.01 57.13 1fie n LEU 529 Cb 0.57 -1.31 -0.01 0.00 -0.00 0.00 0.00 43.42 42.67 1fie n LEU 529 CO 0.51 -0.86 -0.03 0.61 -0.00 0.00 0.00 177.39 177.62 1fie n GLY 530 N 2.30 0.59 3.57 -3.96 0.00 -1.26 -5.03 105.19 101.40 1fie n GLY 530 Ca 0.14 -0.45 -0.26 0.00 0.00 0.00 0.00 46.02 45.45 1fie n GLY 530 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fie s LYS 531 N -1.52 2.07 0.53 1.61 1.02 -0.97 -4.80 119.74 117.68 1fie s LYS 531 Ca 0.00 -1.29 -0.17 0.00 0.02 0.00 0.00 55.97 54.54 1fie s LYS 531 Cb 0.00 -2.15 -0.07 0.00 -0.52 0.00 0.00 37.83 35.09 1fie s LYS 531 CO 0.00 0.43 1.01 -0.51 -0.92 0.00 0.00 175.35 175.35 1fie s ASP 532 N -2.88 6.40 0.29 2.83 1.11 -1.26 -4.20 116.67 118.95 1fie s ASP 532 Ca 0.25 1.65 -0.14 0.00 0.18 0.00 0.00 52.55 54.49 1fie s ASP 532 Cb -0.09 -2.52 0.01 0.00 1.07 0.00 0.00 42.92 41.40 1fie s ASP 532 CO 0.15 -0.74 0.58 0.72 1.18 0.00 0.00 175.17 177.07 1fie s PHE 533 N -2.54 0.27 0.17 4.23 -0.71 0.10 -4.84 117.98 114.66 1fie s PHE 533 Ca 0.61 -0.69 0.11 0.00 -1.04 0.00 0.00 56.93 55.91 1fie s PHE 533 Cb -0.12 0.38 -0.04 0.00 -1.21 0.00 0.00 43.02 42.03 1fie s PHE 533 CO 0.32 -1.16 -0.23 0.15 -1.34 0.00 0.00 175.22 172.96 1fie s LYS 534 N -3.63 1.57 -0.00 1.99 1.02 -1.26 0.49 119.74 119.90 1fie s LYS 534 Ca 0.20 -1.44 0.08 0.00 0.02 0.00 0.00 55.97 54.82 1fie s LYS 534 Cb -0.03 -1.91 -0.02 0.00 -0.52 0.00 0.00 37.83 35.35 1fie s LYS 534 CO 0.10 0.42 -0.24 -1.17 -0.92 0.00 0.00 175.35 173.54 1fie s LEU 535 N -2.53 2.21 -0.25 3.17 0.20 0.02 -2.04 118.68 119.46 1fie s LEU 535 Ca 0.20 -0.46 -0.02 0.00 0.69 0.00 0.00 54.13 54.54 1fie s LEU 535 Cb -0.09 -1.37 0.08 0.00 -0.43 0.00 0.00 46.19 44.38 1fie s LEU 535 CO 0.10 0.30 0.06 -0.44 -0.29 0.00 0.00 176.35 176.08 1fie s SER 536 N -0.84 3.47 0.17 3.68 0.01 0.33 -0.09 113.70 120.43 1fie s SER 536 Ca 0.11 -1.21 -0.11 0.00 1.31 0.00 0.00 55.95 56.05 1fie s SER 536 Cb -0.10 -0.72 -0.07 0.00 0.21 0.00 0.00 66.02 65.34 1fie s SER 536 CO 0.00 -0.36 0.50 -0.63 0.41 0.00 0.00 173.24 173.17 1fie s ILE 537 N 1.75 4.96 0.20 1.44 1.09 0.67 -1.86 121.20 129.46 1fie s ILE 537 Ca 0.04 0.53 0.06 0.00 -1.10 0.00 0.00 60.65 60.18 1fie s ILE 537 Cb -0.17 -3.66 -0.05 0.00 -1.06 0.00 0.00 42.46 37.52 1fie s ILE 537 CO -0.17 0.11 -0.09 0.42 -0.10 0.00 0.00 174.94 175.10 1fie s THR 538 N -1.61 1.41 -0.03 2.92 -4.23 -0.27 -0.11 115.64 113.71 1fie s THR 538 Ca 0.41 -2.12 0.01 0.00 -1.18 0.00 0.00 61.69 58.81 1fie s THR 538 Cb -0.13 -2.08 0.02 0.00 1.34 0.00 0.00 72.50 71.65 1fie s THR 538 CO 0.20 -0.56 -0.01 -0.36 -0.54 0.00 0.00 174.62 173.35 1fie s PHE 539 N -3.18 0.35 -0.09 3.99 0.40 -0.23 -3.23 117.98 115.99 1fie s PHE 539 Ca 0.22 -0.03 0.02 0.00 -0.60 0.00 0.00 56.93 56.54 1fie s PHE 539 Cb 0.02 -0.40 -0.02 0.00 0.51 0.00 0.00 43.02 43.13 1fie s PHE 539 CO 0.06 -0.11 -0.14 1.03 0.70 0.00 0.00 175.22 176.76 1fie s ARG 540 N 0.83 2.98 -0.49 0.44 3.00 -0.20 -2.69 118.95 122.82 1fie s ARG 540 Ca -0.09 -0.69 -0.01 0.00 0.00 0.00 0.00 55.73 54.95 1fie s ARG 540 Cb -0.12 -2.52 0.13 0.00 0.00 0.00 0.00 34.95 32.44 1fie s ARG 540 CO -0.01 0.40 0.27 1.21 0.00 0.00 0.00 175.30 177.17 1fie s ASN 541 N -0.15 5.02 -0.00 0.23 3.84 -0.16 -0.92 114.94 122.80 1fie s ASN 541 Ca -0.01 -2.49 0.01 0.00 0.21 0.00 0.00 52.86 50.59 1fie s ASN 541 Cb -0.13 -1.78 0.04 0.00 -0.55 0.00 0.00 41.25 38.83 1fie s ASN 541 CO 0.03 -0.41 0.90 0.59 -2.79 0.00 0.00 177.10 175.42 1fie n ASN 542 N 3.93 0.53 -4.43 -4.21 3.02 -0.79 -3.19 115.26 110.12 1fie n ASN 542 Ca 0.03 -2.02 -0.28 0.00 -0.03 0.00 0.00 54.58 52.28 1fie n ASN 542 Cb 0.39 -0.17 -0.12 0.00 -0.61 0.00 0.00 39.78 39.27 1fie n ASN 542 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1fie s SER 543 N -0.72 3.52 -1.29 6.41 1.04 -1.26 -4.99 113.70 116.40 1fie s SER 543 Ca 0.03 -0.74 -0.14 0.00 0.48 0.00 0.00 55.95 55.58 1fie s SER 543 Cb 0.02 -0.32 -0.04 0.00 0.10 0.00 0.00 66.02 65.77 1fie s SER 543 CO 0.02 0.16 2.32 1.41 0.98 0.00 0.00 173.24 178.13 1fie n HIS 544 N 0.64 2.67 -3.55 5.02 8.25 -1.26 -2.46 115.22 124.54 1fie n HIS 544 Ca -0.15 -2.64 -0.10 0.00 -0.26 0.00 0.00 57.72 54.56 1fie n HIS 544 Cb 0.54 -2.26 -0.02 0.00 1.12 0.00 0.00 29.99 29.37 1fie n HIS 544 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 1fie s ASN 545 N 3.36 -0.46 -0.06 0.41 3.84 -1.26 -5.01 114.94 115.76 1fie s ASN 545 Ca 0.54 -0.17 0.05 0.00 0.21 0.00 0.00 52.86 53.49 1fie s ASN 545 Cb 0.15 0.61 -0.01 0.00 -0.55 0.00 0.00 41.25 41.45 1fie s ASN 545 CO -0.03 -1.03 -0.22 -0.60 -2.79 0.00 0.00 177.10 172.43 1fie s ARG 546 N -3.72 2.36 0.42 0.43 3.00 -1.26 -2.99 118.95 117.18 1fie s ARG 546 Ca 0.04 -0.79 0.03 0.00 -1.00 0.00 0.00 55.73 54.02 1fie s ARG 546 Cb -0.02 -1.96 -0.02 0.00 0.00 0.00 0.00 34.95 32.94 1fie s ARG 546 CO -0.07 0.29 0.11 0.71 0.00 0.00 0.00 175.30 176.33 1fie s TYR 547 N 0.02 1.81 -0.01 5.12 2.02 -0.98 -4.98 117.35 120.36 1fie s TYR 547 Ca -0.07 -1.21 0.01 0.00 -0.37 0.00 0.00 57.07 55.43 1fie s TYR 547 Cb -0.14 -1.24 0.01 0.00 -0.40 0.00 0.00 41.96 40.19 1fie s TYR 547 CO 0.04 -0.20 -0.03 0.99 -1.57 0.00 0.00 175.55 174.78 1fie s THR 548 N -3.16 0.30 0.38 -0.71 2.01 -1.26 -2.68 115.64 110.52 1fie s THR 548 Ca 0.22 -0.10 0.04 0.00 0.31 0.00 0.00 61.69 62.16 1fie s THR 548 Cb 0.03 -0.30 -0.03 0.00 0.01 0.00 0.00 72.50 72.20 1fie s THR 548 CO 0.13 0.12 0.11 -0.63 -0.69 0.00 0.00 174.62 173.65 1fie s ILE 549 N 0.31 0.76 -0.25 1.82 1.01 -0.22 -2.50 121.20 122.13 1fie s ILE 549 Ca -0.03 -2.00 -0.03 0.00 0.00 0.00 0.00 60.65 58.59 1fie s ILE 549 Cb -0.06 -2.47 0.14 0.00 0.01 0.00 0.00 42.46 40.08 1fie s ILE 549 CO -0.01 0.00 0.42 -0.89 0.00 0.00 0.00 174.94 174.47 1fie s THR 550 N -3.25 -0.68 0.19 2.92 2.01 -1.10 -3.36 115.64 112.37 1fie s THR 550 Ca 0.27 -0.05 0.02 0.00 0.31 0.00 0.00 61.69 62.24 1fie s THR 550 Cb 0.04 -0.84 -0.04 0.00 0.01 0.00 0.00 72.50 71.67 1fie s THR 550 CO 0.14 -0.09 0.34 0.00 -0.69 0.00 0.00 174.62 174.32 1fie s ALA 551 N 2.61 3.91 -0.04 7.40 0.00 -0.51 -1.33 121.76 133.80 1fie s ALA 551 Ca 0.14 -1.00 0.03 0.00 0.00 0.00 0.00 51.96 51.12 1fie s ALA 551 Cb -0.15 -1.84 0.01 0.00 0.00 0.00 0.00 23.12 21.13 1fie s ALA 551 CO -0.17 0.44 -0.11 0.71 0.00 0.00 0.00 175.76 176.63 1fie s TYR 552 N -1.84 1.17 -0.21 0.00 2.02 0.45 -2.57 117.35 116.37 1fie s TYR 552 Ca 0.36 -0.35 0.01 0.00 -0.37 0.00 0.00 57.07 56.72 1fie s TYR 552 Cb -0.11 -0.85 0.03 0.00 -0.40 0.00 0.00 41.96 40.63 1fie s TYR 552 CO 0.29 -0.17 -0.14 -1.17 -1.57 0.00 0.00 175.55 172.79 1fie s LEU 553 N 0.38 2.70 -0.23 -1.29 1.98 0.37 -1.89 118.68 120.69 1fie s LEU 553 Ca -0.07 -0.87 0.01 0.00 -2.89 0.00 0.00 54.13 50.31 1fie s LEU 553 Cb -0.12 -1.55 0.04 0.00 0.66 0.00 0.00 46.19 45.23 1fie s LEU 553 CO 0.02 -0.07 -0.12 -0.55 -1.89 0.00 0.00 176.35 173.73 1fie s SER 554 N 1.26 3.99 -0.25 3.68 0.15 0.03 -1.75 113.70 120.80 1fie s SER 554 Ca 0.01 -1.01 -0.06 0.00 0.70 0.00 0.00 55.95 55.59 1fie s SER 554 Cb -0.15 -1.56 -0.01 0.00 -1.71 0.00 0.00 66.02 62.58 1fie s SER 554 CO -0.09 -0.11 0.04 0.00 1.20 0.00 0.00 173.24 174.27 1fie s ALA 555 N 1.23 3.03 0.17 5.45 0.00 -0.75 0.01 121.76 130.88 1fie s ALA 555 Ca -0.02 -1.22 0.11 0.00 0.00 0.00 0.00 51.96 50.83 1fie s ALA 555 Cb -0.17 -1.97 -0.04 0.00 0.00 0.00 0.00 23.12 20.94 1fie s ALA 555 CO -0.07 -0.57 -0.25 -0.80 0.00 0.00 0.00 175.76 174.06 1fie s ASN 556 N 1.54 3.40 -0.35 0.00 0.01 0.71 -2.10 114.94 118.15 1fie s ASN 556 Ca 0.05 -0.81 -0.17 0.00 -0.71 0.00 0.00 52.86 51.22 1fie s ASN 556 Cb -0.15 -0.25 -0.01 0.00 0.41 0.00 0.00 41.25 41.25 1fie s ASN 556 CO 0.01 0.15 0.45 -0.63 -1.51 0.00 0.00 177.10 175.57 1fie s ILE 557 N -1.41 5.08 0.39 0.60 1.01 0.12 0.42 121.20 127.42 1fie s ILE 557 Ca 0.18 0.21 0.05 0.00 0.00 0.00 0.00 60.65 61.10 1fie s ILE 557 Cb -0.09 -3.91 -0.07 0.00 0.01 0.00 0.00 42.46 38.41 1fie s ILE 557 CO 0.08 -0.17 0.03 0.42 0.00 0.00 0.00 174.94 175.30 1fie s THR 558 N 2.23 1.65 0.54 2.92 -4.23 -1.11 0.44 115.64 118.08 1fie s THR 558 Ca 0.16 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 58.66 1fie s THR 558 Cb -0.16 -2.86 0.02 0.00 1.34 0.00 0.00 72.50 70.84 1fie s THR 558 CO 0.13 0.00 0.78 -0.36 -0.54 0.00 0.00 174.62 174.63 1fie s PHE 559 N -2.92 3.02 -0.22 3.99 0.40 -0.03 -4.40 117.98 117.81 1fie s PHE 559 Ca 0.33 0.18 0.24 0.00 -0.60 0.00 0.00 56.93 57.08 1fie s PHE 559 Cb 0.09 -2.66 1.20 0.00 0.51 0.00 0.00 43.02 42.16 1fie s PHE 559 CO 0.16 -0.76 1.73 0.10 0.70 0.00 0.00 175.22 177.14 1fie h TYR 560 N 0.08 0.00 -0.00 0.36 -0.00 -1.96 -0.82 116.97 114.63 1fie h TYR 560 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.29 1fie h TYR 560 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.01 1fie h TYR 560 CO 0.40 0.00 -0.23 0.25 -0.00 0.00 0.00 178.16 178.58 1fie n THR 561 N -2.33 0.00 0.00 -0.90 -2.24 -1.26 -1.32 114.28 106.23 1fie n THR 561 Ca -0.00 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 1fie n THR 561 Cb 0.10 0.09 0.00 0.00 -2.10 0.00 0.00 70.33 68.42 1fie n THR 561 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1fie n GLY 562 N 1.37 2.55 3.70 3.38 0.00 -0.31 -2.95 105.19 112.93 1fie n GLY 562 Ca 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1fie n GLY 562 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1fie s VAL 563 N -2.54 3.01 0.42 1.61 1.01 -1.26 -4.72 120.40 117.94 1fie s VAL 563 Ca 0.00 0.55 -0.10 0.00 0.00 0.00 0.00 61.98 62.43 1fie s VAL 563 Cb 0.00 -3.36 -0.06 0.00 0.00 0.00 0.00 36.38 32.96 1fie s VAL 563 CO 0.00 0.01 0.79 -2.16 0.00 0.00 0.00 175.10 173.74 1fie s PRO 564 N 2.18 3.77 -0.04 2.72 0.04 -1.26 -0.85 135.00 141.55 1fie s PRO 564 Ca 0.72 0.49 0.01 0.00 0.04 0.00 0.00 61.00 62.25 1fie s PRO 564 Cb -0.40 -2.36 -0.03 0.00 0.04 0.00 0.00 34.50 31.74 1fie s PRO 564 CO 0.31 -0.08 -0.03 1.17 0.04 0.00 0.00 177.00 178.42 1fie n LYS 565 N -1.43 0.89 -3.58 4.56 4.81 0.17 -4.94 118.16 118.63 1fie n LYS 565 Ca 0.03 0.02 -0.08 0.00 -0.87 0.00 0.00 58.31 57.40 1fie n LYS 565 Cb 0.54 -1.09 -0.02 0.00 0.02 0.00 0.00 35.03 34.48 1fie n LYS 565 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1fie s ALA 566 N -2.09 -1.61 -0.25 3.14 0.00 -1.19 -4.99 121.76 114.77 1fie s ALA 566 Ca -0.05 0.45 -0.02 0.00 0.00 0.00 0.00 51.96 52.33 1fie s ALA 566 Cb 0.01 0.69 0.02 0.00 0.00 0.00 0.00 23.12 23.85 1fie s ALA 566 CO 0.12 -0.84 -0.05 -2.00 0.00 0.00 0.00 175.76 172.98 1fie s GLU 567 N -3.50 2.91 0.00 0.00 2.12 -1.26 -0.70 118.70 118.27 1fie s GLU 567 Ca 0.06 -0.93 0.23 0.00 0.36 0.00 0.00 54.97 54.69 1fie s GLU 567 Cb -0.02 -3.00 0.29 0.00 0.26 0.00 0.00 34.13 31.66 1fie s GLU 567 CO -0.06 -0.38 1.30 1.97 -0.54 0.00 0.00 175.26 177.55 1fie n PHE 568 N 4.69 0.23 -3.27 5.30 -1.74 -0.89 -4.94 117.46 116.84 1fie n PHE 568 Ca -0.17 -0.12 0.03 0.00 -0.56 0.00 0.00 57.45 56.63 1fie n PHE 568 Cb 0.48 -0.00 -0.04 0.00 1.52 0.00 0.00 39.48 41.44 1fie n PHE 568 CO 0.00 0.00 0.00 0.21 -0.56 0.00 0.00 176.76 176.41 1fie s LYS 569 N -1.69 0.17 0.08 3.97 2.20 -1.23 -4.90 119.74 118.33 1fie s LYS 569 Ca 0.32 0.41 0.10 0.00 -0.36 0.00 0.00 55.97 56.44 1fie s LYS 569 Cb 0.20 0.24 -0.03 0.00 -1.51 0.00 0.00 37.83 36.74 1fie s LYS 569 CO 0.30 -0.08 -0.26 0.21 -0.36 0.00 0.00 175.35 175.15 1fie s LYS 570 N 2.39 1.62 -0.14 4.03 2.20 -1.26 -1.81 119.74 126.77 1fie s LYS 570 Ca -0.01 -1.20 -0.16 0.00 -0.36 0.00 0.00 55.97 54.24 1fie s LYS 570 Cb -0.05 -1.92 0.04 0.00 -1.51 0.00 0.00 37.83 34.40 1fie s LYS 570 CO -0.16 0.48 0.43 -2.00 -0.36 0.00 0.00 175.35 173.74 1fie s GLU 571 N -1.56 0.55 -0.01 4.03 2.56 -0.72 -4.97 118.70 118.58 1fie s GLU 571 Ca 0.12 0.50 0.03 0.00 0.00 0.00 0.00 54.97 55.62 1fie s GLU 571 Cb -0.10 0.26 -0.01 0.00 2.00 0.00 0.00 34.13 36.29 1fie s GLU 571 CO 0.04 -0.09 -0.10 -0.08 -0.56 0.00 0.00 175.26 174.47 1fie s THR 572 N -0.01 0.81 -0.04 -1.70 -1.32 -1.26 -0.48 115.64 111.63 1fie s THR 572 Ca -0.02 -0.43 -0.16 0.00 -1.21 0.00 0.00 61.69 59.87 1fie s THR 572 Cb -0.03 -0.68 0.03 0.00 -1.51 0.00 0.00 72.50 70.31 1fie s THR 572 CO 0.01 0.23 0.37 0.72 -2.21 0.00 0.00 174.62 173.74 1fie s PHE 573 N -0.18 -0.28 -0.31 9.09 -0.71 -1.06 -5.00 117.98 119.53 1fie s PHE 573 Ca 0.03 0.51 -0.14 0.00 -1.04 0.00 0.00 56.93 56.29 1fie s PHE 573 Cb -0.05 0.14 -0.03 0.00 -1.21 0.00 0.00 43.02 41.88 1fie s PHE 573 CO -0.00 -0.38 0.31 -0.51 -1.34 0.00 0.00 175.22 173.30 1fie s ASP 574 N -1.03 6.14 -0.13 1.98 1.01 -1.26 -1.43 116.67 121.95 1fie s ASP 574 Ca -0.11 -0.09 -0.01 0.00 0.71 0.00 0.00 52.55 53.05 1fie s ASP 574 Cb -0.04 -2.18 -0.02 0.00 1.01 0.00 0.00 42.92 41.69 1fie s ASP 574 CO 0.04 -0.23 -0.09 -0.69 0.21 0.00 0.00 175.17 174.42 1fie s VAL 575 N 1.93 3.44 -0.40 -1.27 1.01 -1.21 -4.99 120.40 118.91 1fie s VAL 575 Ca 0.11 -0.53 -0.03 0.00 0.00 0.00 0.00 61.98 61.53 1fie s VAL 575 Cb -0.16 -2.46 0.11 0.00 0.00 0.00 0.00 36.38 33.86 1fie s VAL 575 CO 0.11 0.53 0.18 -0.89 0.00 0.00 0.00 175.10 175.03 1fie s THR 576 N 0.14 3.24 -0.30 3.92 2.01 -1.26 -1.05 115.64 122.33 1fie s THR 576 Ca -0.04 -2.01 -0.22 0.00 0.31 0.00 0.00 61.69 59.72 1fie s THR 576 Cb -0.14 -3.20 -0.00 0.00 0.01 0.00 0.00 72.50 69.16 1fie s THR 576 CO 0.04 -0.65 0.74 -0.76 -0.69 0.00 0.00 174.62 173.30 1fie s LEU 577 N 1.14 4.10 0.89 4.42 1.02 -1.09 -5.02 118.68 124.13 1fie s LEU 577 Ca 0.07 0.62 -0.12 0.00 0.02 0.00 0.00 54.13 54.73 1fie s LEU 577 Cb -0.22 -3.00 0.12 0.00 0.02 0.00 0.00 46.19 43.11 1fie s LEU 577 CO -0.04 -0.56 1.11 -1.61 0.02 0.00 0.00 176.35 175.27 1fie s GLU 578 N 2.83 1.33 0.33 1.70 0.41 -1.26 -2.31 118.70 121.73 1fie s GLU 578 Ca 0.30 0.49 -0.29 0.00 -0.41 0.00 0.00 54.97 55.06 1fie s GLU 578 Cb -0.14 -1.84 -0.12 0.00 -1.78 0.00 0.00 34.13 30.24 1fie s GLU 578 CO 0.12 -2.11 1.50 -2.30 -0.49 0.00 0.00 175.26 171.98 1fie n PRO 579 N -3.74 2.56 -2.17 0.39 -0.02 -1.16 -1.38 135.00 129.48 1fie n PRO 579 Ca 0.06 0.90 -0.17 0.00 -2.02 0.00 0.00 63.50 62.28 1fie n PRO 579 Cb 0.58 -2.63 -0.03 0.00 -0.02 0.00 0.00 33.50 31.40 1fie n PRO 579 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1fie n LEU 580 N 1.25 -1.48 -4.89 2.45 7.99 -1.03 -4.90 117.00 116.39 1fie n LEU 580 Ca 0.05 0.17 -0.29 0.00 -0.01 0.00 0.00 56.01 55.93 1fie n LEU 580 Cb 0.37 -2.53 -0.03 0.00 -0.11 0.00 0.00 43.42 41.12 1fie n LEU 580 CO 0.64 -0.37 0.34 -0.44 -1.51 0.00 0.00 177.39 176.04 1fie s SER 581 N -2.15 6.47 -0.40 -1.43 0.01 -0.48 -4.82 113.70 110.90 1fie s SER 581 Ca 0.00 0.93 0.07 0.00 1.31 0.00 0.00 55.95 58.26 1fie s SER 581 Cb 0.00 -2.24 0.22 0.00 0.21 0.00 0.00 66.02 64.22 1fie s SER 581 CO 0.00 -0.32 0.47 0.49 0.41 0.00 0.00 173.24 174.29 1fie n PHE 582 N -1.19 -0.45 -1.77 2.43 3.72 -1.25 -0.98 117.46 117.96 1fie n PHE 582 Ca 0.00 -3.49 -0.32 0.00 -0.05 0.00 0.00 57.45 53.59 1fie n PHE 582 Cb 0.54 -0.16 0.04 0.00 -0.94 0.00 0.00 39.48 38.96 1fie n PHE 582 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 1fie s LYS 583 N -0.81 3.01 -0.04 -1.08 2.20 -1.09 -4.82 119.74 117.11 1fie s LYS 583 Ca 0.34 1.15 0.01 0.00 -0.36 0.00 0.00 55.97 57.12 1fie s LYS 583 Cb 0.13 -1.99 0.02 0.00 -1.51 0.00 0.00 37.83 34.48 1fie s LYS 583 CO -0.14 -1.05 -0.03 0.21 -0.36 0.00 0.00 175.35 173.98 1fie s LYS 584 N -4.46 0.65 -0.06 4.03 2.20 -1.26 -1.07 119.74 119.78 1fie s LYS 584 Ca 0.62 -0.06 0.04 0.00 -0.36 0.00 0.00 55.97 56.21 1fie s LYS 584 Cb -0.16 -0.70 -0.02 0.00 -1.51 0.00 0.00 37.83 35.44 1fie s LYS 584 CO 0.45 -0.08 -0.17 -1.21 -0.36 0.00 0.00 175.35 173.99 1fie s GLU 585 N 0.85 2.57 -0.02 4.03 0.41 0.84 -5.00 118.70 122.38 1fie s GLU 585 Ca -0.10 -0.75 0.06 0.00 -0.41 0.00 0.00 54.97 53.77 1fie s GLU 585 Cb -0.13 -2.35 -0.02 0.00 -1.78 0.00 0.00 34.13 29.85 1fie s GLU 585 CO -0.00 0.54 -0.21 0.00 -0.49 0.00 0.00 175.26 175.09 1fie s ALA 586 N -0.52 1.79 0.03 5.21 0.00 -1.26 -0.24 121.76 126.77 1fie s ALA 586 Ca 0.07 -0.92 0.09 0.00 0.00 0.00 0.00 51.96 51.20 1fie s ALA 586 Cb -0.11 -0.47 -0.03 0.00 0.00 0.00 0.00 23.12 22.51 1fie s ALA 586 CO 0.01 0.43 -0.25 0.08 0.00 0.00 0.00 175.76 176.03 1fie s VAL 587 N -0.46 2.03 -0.24 0.00 1.01 0.87 -4.98 120.40 118.62 1fie s VAL 587 Ca 0.07 -1.30 -0.04 0.00 0.00 0.00 0.00 61.98 60.70 1fie s VAL 587 Cb -0.09 -1.73 -0.00 0.00 0.00 0.00 0.00 36.38 34.56 1fie s VAL 587 CO -0.00 0.37 -0.01 -0.22 0.00 0.00 0.00 175.10 175.24 1fie s LEU 588 N -1.12 3.20 -0.36 3.92 1.98 -1.26 -0.80 118.68 124.23 1fie s LEU 588 Ca 0.11 -0.53 -0.15 0.00 -2.89 0.00 0.00 54.13 50.67 1fie s LEU 588 Cb -0.10 -1.77 -0.00 0.00 0.66 0.00 0.00 46.19 44.98 1fie s LEU 588 CO 0.02 -0.08 0.31 -0.63 -1.89 0.00 0.00 176.35 174.08 1fie s ILE 589 N 1.47 5.22 0.25 6.68 -1.09 0.18 -4.97 121.20 128.93 1fie s ILE 589 Ca 0.04 -0.22 -0.24 0.00 -2.23 0.00 0.00 60.65 58.00 1fie s ILE 589 Cb -0.15 -3.83 -0.09 0.00 -1.58 0.00 0.00 42.46 36.81 1fie s ILE 589 CO -0.02 -0.14 0.83 -1.10 -1.23 0.00 0.00 174.94 173.28 1fie s GLN 590 N 1.86 4.46 0.40 2.79 -0.21 -1.26 -0.72 119.66 126.98 1fie s GLN 590 Ca 0.08 1.12 0.16 0.00 0.02 0.00 0.00 55.36 56.75 1fie s GLN 590 Cb -0.17 -2.93 1.05 0.00 1.00 0.00 0.00 33.01 31.95 1fie s GLN 590 CO 0.11 0.39 1.83 0.00 -2.12 0.00 0.00 175.29 175.50 1fie h ALA 591 N 3.51 2.15 -0.15 6.09 0.00 -1.87 -1.22 119.26 127.77 1fie h ALA 591 Ca -0.47 0.03 0.04 0.00 0.00 0.00 0.00 54.91 54.51 1fie h ALA 591 Cb 1.19 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1fie h ALA 591 CO 0.65 -0.46 0.22 0.78 0.00 0.00 0.00 179.25 180.44 1fie h GLY 592 N 0.45 0.00 2.00 0.00 0.00 -1.92 -0.87 103.07 102.73 1fie h GLY 592 Ca 0.50 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.76 1fie h GLY 592 CO -0.21 0.00 -0.33 0.83 0.00 0.00 0.00 176.54 176.82 1fie h GLU 593 N 0.00 0.00 0.00 4.80 5.08 -1.58 -3.40 114.58 119.48 1fie h GLU 593 Ca 0.07 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.38 1fie h GLU 593 Cb 0.52 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 1fie h GLU 593 CO -0.00 0.33 -1.19 2.48 -1.00 0.00 0.00 179.01 179.63 1fie n TYR 594 N -3.27 0.00 -0.19 4.33 0.18 -0.62 -4.82 117.16 112.78 1fie n TYR 594 Ca 0.02 0.00 -0.05 0.00 1.88 0.00 0.00 57.90 59.75 1fie n TYR 594 Cb 0.60 -0.13 -0.04 0.00 -0.38 0.00 0.00 39.34 39.38 1fie n TYR 594 CO 0.00 0.00 0.00 -1.33 -2.08 0.00 0.00 176.86 173.45 1fie n MET 595 N -2.35 -0.19 -1.00 -3.48 2.81 -0.43 -1.68 117.12 110.80 1fie n MET 595 Ca -0.05 0.81 -0.16 0.00 -1.81 0.00 0.00 57.70 56.49 1fie n MET 595 Cb 0.58 -1.20 -0.03 0.00 -0.71 0.00 0.00 33.22 31.86 1fie n MET 595 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1fie n GLY 596 N -1.11 3.69 0.00 3.03 0.00 -1.26 -3.71 105.19 105.84 1fie n GLY 596 Ca 0.01 -1.12 0.00 0.00 0.00 0.00 0.00 46.02 44.91 1fie n GLY 596 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1fie n GLN 597 N 1.05 0.00 -2.42 1.61 7.27 -0.67 -5.14 117.38 119.08 1fie n GLN 597 Ca 0.32 -0.02 -0.38 0.00 0.07 0.00 0.00 57.00 56.99 1fie n GLN 597 Cb 0.61 -0.09 -0.03 0.00 2.41 0.00 0.00 30.24 33.14 1fie n GLN 597 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 1fie s LEU 598 N 0.00 4.19 0.64 1.69 1.43 -1.22 -4.98 118.68 120.43 1fie s LEU 598 Ca 0.00 2.20 0.07 0.00 -1.03 0.00 0.00 54.13 55.36 1fie s LEU 598 Cb 0.00 -4.07 0.11 0.00 0.03 0.00 0.00 46.19 42.26 1fie s LEU 598 CO 0.00 -0.56 0.88 -0.76 0.23 0.00 0.00 176.35 176.14 1fie s LEU 599 N -2.50 3.02 0.12 1.79 1.43 -1.26 -5.00 118.68 116.28 1fie s LEU 599 Ca 0.57 -0.75 -0.24 0.00 -1.03 0.00 0.00 54.13 52.67 1fie s LEU 599 Cb -0.27 -1.61 -0.05 0.00 0.03 0.00 0.00 46.19 44.28 1fie s LEU 599 CO 0.34 -1.58 1.28 -0.62 0.23 0.00 0.00 176.35 176.00 1fie n GLU 600 N -2.47 -0.34 -0.51 1.70 1.02 -1.26 -2.04 120.64 116.74 1fie n GLU 600 Ca 0.16 1.26 -0.00 0.00 -0.02 0.00 0.00 57.16 58.56 1fie n GLU 600 Cb 0.61 -1.85 0.18 0.00 -0.02 0.00 0.00 31.44 30.37 1fie n GLU 600 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1fie n GLN 601 N -4.84 2.71 -4.07 3.49 6.02 -1.26 -4.67 117.38 114.75 1fie n GLN 601 Ca 0.02 -1.62 -0.39 0.00 -0.01 0.00 0.00 57.00 55.00 1fie n GLN 601 Cb 0.20 -1.83 -0.01 0.00 1.02 0.00 0.00 30.24 29.62 1fie n GLN 601 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1fie n ALA 602 N 0.17 -2.39 -2.81 -1.58 0.00 -0.87 -4.51 120.51 108.53 1fie n ALA 602 Ca 0.18 -0.47 -0.35 0.00 0.00 0.00 0.00 53.44 52.81 1fie n ALA 602 Cb 0.83 -2.24 -0.09 0.00 0.00 0.00 0.00 19.45 17.94 1fie n ALA 602 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1fie s SER 603 N -3.83 5.63 -0.03 0.00 0.15 -1.26 -0.49 113.70 113.87 1fie s SER 603 Ca 0.31 0.14 0.07 0.00 0.70 0.00 0.00 55.95 57.17 1fie s SER 603 Cb -0.16 -1.88 -0.02 0.00 -1.71 0.00 0.00 66.02 62.25 1fie s SER 603 CO 0.96 0.24 -0.24 -0.76 1.20 0.00 0.00 173.24 174.63 1fie s LEU 604 N -0.04 2.05 0.06 3.45 1.02 0.40 -2.76 118.68 122.86 1fie s LEU 604 Ca 0.06 -0.46 0.08 0.00 0.02 0.00 0.00 54.13 53.83 1fie s LEU 604 Cb -0.12 -1.29 -0.03 0.00 0.02 0.00 0.00 46.19 44.77 1fie s LEU 604 CO 0.01 0.28 -0.20 -2.28 0.02 0.00 0.00 176.35 174.18 1fie s HIS 605 N -0.41 2.49 -0.07 0.29 2.46 0.17 -1.19 115.29 119.03 1fie s HIS 605 Ca 0.04 -0.29 0.01 0.00 0.47 0.00 0.00 55.06 55.29 1fie s HIS 605 Cb -0.11 -1.41 0.02 0.00 -0.13 0.00 0.00 32.58 30.95 1fie s HIS 605 CO 0.01 0.27 -0.08 -0.06 -2.47 0.00 0.00 174.74 172.40 1fie s PHE 606 N -0.96 1.18 -0.13 3.88 0.08 -0.44 -0.21 117.98 121.39 1fie s PHE 606 Ca 0.15 -0.44 -0.00 0.00 0.12 0.00 0.00 56.93 56.75 1fie s PHE 606 Cb -0.10 -0.95 -0.02 0.00 -0.57 0.00 0.00 43.02 41.38 1fie s PHE 606 CO 0.06 -0.29 -0.11 -0.06 -0.10 0.00 0.00 175.22 174.72 1fie s PHE 607 N 0.97 2.85 -0.18 0.36 0.08 0.10 -2.19 117.98 119.96 1fie s PHE 607 Ca -0.10 -0.51 -0.03 0.00 0.12 0.00 0.00 56.93 56.42 1fie s PHE 607 Cb -0.15 -1.84 0.06 0.00 -0.57 0.00 0.00 43.02 40.52 1fie s PHE 607 CO 0.00 -0.12 0.03 0.08 -0.10 0.00 0.00 175.22 175.11 1fie s VAL 608 N 0.22 0.54 0.02 -0.44 1.01 0.17 -0.79 120.40 121.12 1fie s VAL 608 Ca -0.07 -0.51 0.08 0.00 0.00 0.00 0.00 61.98 61.48 1fie s VAL 608 Cb -0.15 -1.01 -0.02 0.00 0.00 0.00 0.00 36.38 35.20 1fie s VAL 608 CO 0.05 -0.16 -0.25 0.42 0.00 0.00 0.00 175.10 175.16 1fie s THR 609 N 1.86 1.97 0.06 3.92 -4.23 -0.79 0.95 115.64 119.38 1fie s THR 609 Ca -0.00 -1.22 0.01 0.00 -1.18 0.00 0.00 61.69 59.29 1fie s THR 609 Cb -0.17 -1.67 -0.03 0.00 1.34 0.00 0.00 72.50 71.97 1fie s THR 609 CO -0.08 0.41 -0.05 0.00 -0.54 0.00 0.00 174.62 174.36 1fie s ALA 610 N -0.71 0.59 -0.18 3.99 0.00 0.58 0.17 121.76 126.19 1fie s ALA 610 Ca 0.10 -1.05 0.01 0.00 0.00 0.00 0.00 51.96 51.02 1fie s ALA 610 Cb -0.10 0.17 0.03 0.00 0.00 0.00 0.00 23.12 23.22 1fie s ALA 610 CO 0.01 -0.22 -0.15 0.50 0.00 0.00 0.00 175.76 175.90 1fie s ARG 611 N -2.96 2.49 0.00 0.00 3.52 -0.44 -1.88 118.95 119.68 1fie s ARG 611 Ca 0.01 -0.79 0.00 0.00 -0.13 0.00 0.00 55.73 54.82 1fie s ARG 611 Cb 0.00 -2.41 0.00 0.00 -1.56 0.00 0.00 34.95 30.98 1fie s ARG 611 CO -0.05 -0.30 1.22 -0.89 -0.81 0.00 0.00 175.30 174.48 1fie n ILE 612 N 4.67 1.22 0.00 4.11 5.41 -0.93 -2.71 119.36 131.12 1fie n ILE 612 Ca -0.18 -0.12 0.00 0.00 1.00 0.00 0.00 62.75 63.45 1fie n ILE 612 Cb 0.49 -1.11 0.00 0.00 -0.71 0.00 0.00 39.64 38.30 1fie n ILE 612 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 1fie n ASN 613 N 0.76 0.00 0.00 4.38 3.02 -1.04 -2.17 115.26 120.21 1fie n ASN 613 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1fie n ASN 613 Cb 0.49 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.66 1fie n ASN 613 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1fie n GLU 614 N 0.00 0.00 -2.23 3.52 4.71 -1.26 -2.98 120.64 122.40 1fie n GLU 614 Ca 0.00 0.36 -0.42 0.00 -0.01 0.00 0.00 57.16 57.09 1fie n GLU 614 Cb 0.00 -1.22 0.00 0.00 -1.01 0.00 0.00 31.44 29.21 1fie n GLU 614 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 1fie n THR 615 N -1.36 4.44 -0.56 2.62 -2.24 -0.92 -4.91 114.28 111.35 1fie n THR 615 Ca 0.00 -4.28 -0.02 0.00 -2.27 0.00 0.00 64.05 57.48 1fie n THR 615 Cb 0.00 -2.33 -0.00 0.00 -2.10 0.00 0.00 70.33 65.89 1fie n THR 615 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 1fie n ARG 616 N 3.62 0.00 -3.84 -0.78 0.00 -1.16 -4.48 116.66 110.02 1fie n ARG 616 Ca 0.45 -0.10 -0.36 0.00 -0.00 0.00 0.00 57.85 57.84 1fie n ARG 616 Cb 0.34 -1.17 -0.06 0.00 -0.00 0.00 0.00 32.46 31.57 1fie n ARG 616 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 1fie s ASP 617 N 2.15 6.43 -0.13 2.89 1.01 -1.26 -4.85 116.67 122.92 1fie s ASP 617 Ca 0.03 0.50 -0.06 0.00 0.71 0.00 0.00 52.55 53.73 1fie s ASP 617 Cb 0.01 -2.07 -0.04 0.00 1.01 0.00 0.00 42.92 41.82 1fie s ASP 617 CO 0.01 0.35 0.08 -0.69 0.21 0.00 0.00 175.17 175.14 1fie s VAL 618 N -1.13 4.97 -0.11 -1.27 1.01 -1.26 -2.20 120.40 120.41 1fie s VAL 618 Ca 0.20 0.01 0.03 0.00 0.00 0.00 0.00 61.98 62.22 1fie s VAL 618 Cb -0.13 -3.16 -0.00 0.00 0.00 0.00 0.00 36.38 33.09 1fie s VAL 618 CO 0.09 0.57 -0.21 -0.76 0.00 0.00 0.00 175.10 174.79 1fie s LEU 619 N -0.62 2.23 0.07 3.92 1.43 -0.79 -4.72 118.68 120.21 1fie s LEU 619 Ca 0.12 -0.51 0.04 0.00 -1.03 0.00 0.00 54.13 52.75 1fie s LEU 619 Cb -0.12 -1.46 -0.03 0.00 0.03 0.00 0.00 46.19 44.62 1fie s LEU 619 CO 0.02 0.16 -0.12 0.00 0.23 0.00 0.00 176.35 176.65 1fie s ALA 620 N 0.34 1.01 -0.16 4.21 0.00 -1.26 -0.31 121.76 125.60 1fie s ALA 620 Ca -0.17 -0.98 -0.17 0.00 0.00 0.00 0.00 51.96 50.64 1fie s ALA 620 Cb -0.18 -0.04 0.05 0.00 0.00 0.00 0.00 23.12 22.95 1fie s ALA 620 CO 0.08 0.08 0.47 0.15 0.00 0.00 0.00 175.76 176.54 1fie s LYS 621 N -1.90 0.59 -0.00 0.00 -0.14 0.27 -4.95 119.74 113.59 1fie s LYS 621 Ca -0.03 0.57 -0.01 0.00 -1.36 0.00 0.00 55.97 55.15 1fie s LYS 621 Cb -0.09 0.28 -0.00 0.00 -1.68 0.00 0.00 37.83 36.34 1fie s LYS 621 CO 0.01 -0.09 0.02 1.14 -0.76 0.00 0.00 175.35 175.68 1fie s GLN 622 N 0.06 0.12 0.28 1.68 -2.07 -1.25 0.43 119.66 118.90 1fie s GLN 622 Ca -0.02 -0.13 -0.02 0.00 -1.82 0.00 0.00 55.36 53.37 1fie s GLN 622 Cb -0.03 0.05 -0.02 0.00 -1.09 0.00 0.00 33.01 31.92 1fie s GLN 622 CO 0.01 -0.02 0.33 0.15 -1.32 0.00 0.00 175.29 174.45 1fie s LYS 623 N -0.39 1.59 0.02 9.60 1.02 -0.93 -5.00 119.74 125.64 1fie s LYS 623 Ca -0.04 -1.66 -0.01 0.00 0.02 0.00 0.00 55.97 54.28 1fie s LYS 623 Cb -0.03 0.37 -0.02 0.00 -0.52 0.00 0.00 37.83 37.64 1fie s LYS 623 CO -0.00 -0.61 -0.01 -1.12 -0.92 0.00 0.00 175.35 172.69 1fie s SER 624 N -3.19 0.20 0.06 2.83 0.01 -1.26 -1.32 113.70 111.03 1fie s SER 624 Ca 0.33 -0.43 0.06 0.00 1.31 0.00 0.00 55.95 57.22 1fie s SER 624 Cb 0.02 0.10 -0.03 0.00 0.21 0.00 0.00 66.02 66.33 1fie s SER 624 CO 0.17 -0.28 -0.15 -0.89 0.41 0.00 0.00 173.24 172.49 1fie s THR 625 N -1.34 1.23 -0.06 1.44 2.01 -0.34 -4.91 115.64 113.68 1fie s THR 625 Ca -0.15 -1.22 0.05 0.00 0.31 0.00 0.00 61.69 60.68 1fie s THR 625 Cb -0.09 -1.14 -0.00 0.00 0.01 0.00 0.00 72.50 71.28 1fie s THR 625 CO -0.01 -0.09 -0.20 0.68 -0.69 0.00 0.00 174.62 174.31 1fie s VAL 626 N -1.07 1.67 0.11 3.82 -7.23 -1.25 -0.46 120.40 115.99 1fie s VAL 626 Ca 0.01 -0.84 -0.29 0.00 -1.81 0.00 0.00 61.98 59.06 1fie s VAL 626 Cb -0.09 -1.43 -0.06 0.00 0.56 0.00 0.00 36.38 35.35 1fie s VAL 626 CO 0.02 0.47 0.91 -0.76 -0.31 0.00 0.00 175.10 175.43 1fie s LEU 627 N 0.09 4.50 0.04 1.32 1.43 0.36 -4.78 118.68 121.65 1fie s LEU 627 Ca -0.07 1.73 -0.31 0.00 -1.03 0.00 0.00 54.13 54.45 1fie s LEU 627 Cb -0.14 -3.50 -0.07 0.00 0.03 0.00 0.00 46.19 42.51 1fie s LEU 627 CO 0.04 -0.02 1.49 -0.89 0.23 0.00 0.00 176.35 177.19 1fie s THR 628 N -0.16 3.42 -0.13 5.49 2.01 -0.93 -4.70 115.64 120.64 1fie s THR 628 Ca 0.44 0.86 -0.02 0.00 0.31 0.00 0.00 61.69 63.28 1fie s THR 628 Cb -0.23 -3.55 -0.02 0.00 0.01 0.00 0.00 72.50 68.70 1fie s THR 628 CO 0.28 0.01 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.52 1fie s ILE 629 N 2.29 3.64 0.48 1.82 1.01 -1.26 -0.93 121.20 128.23 1fie s ILE 629 Ca 0.67 -0.46 -0.22 0.00 0.00 0.00 0.00 60.65 60.64 1fie s ILE 629 Cb -0.35 -2.56 -0.07 0.00 0.01 0.00 0.00 42.46 39.49 1fie s ILE 629 CO 0.29 0.52 1.16 -2.16 0.00 0.00 0.00 174.94 174.75 1fie s PRO 630 N 0.14 3.68 1.34 2.79 0.04 -1.26 -4.97 135.00 136.76 1fie s PRO 630 Ca -0.03 1.74 -0.20 0.00 0.04 0.00 0.00 61.00 62.55 1fie s PRO 630 Cb -0.14 -2.33 0.33 0.00 0.04 0.00 0.00 34.50 32.40 1fie s PRO 630 CO 0.03 -0.61 0.80 0.39 0.04 0.00 0.00 177.00 177.65 1fie n GLU 631 N -0.65 -3.84 -4.59 4.56 1.02 -1.26 -4.75 120.64 111.13 1fie n GLU 631 Ca 0.08 -1.13 -0.31 0.00 -0.02 0.00 0.00 57.16 55.78 1fie n GLU 631 Cb 0.49 -1.92 -0.12 0.00 -0.02 0.00 0.00 31.44 29.87 1fie n GLU 631 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1fie s ILE 632 N -2.19 3.19 -0.23 -3.67 1.01 -0.77 -4.86 121.20 113.69 1fie s ILE 632 Ca 0.64 -0.97 -0.09 0.00 0.00 0.00 0.00 60.65 60.22 1fie s ILE 632 Cb -0.15 -2.36 -0.04 0.00 0.01 0.00 0.00 42.46 39.92 1fie s ILE 632 CO 0.57 0.38 0.13 -0.63 0.00 0.00 0.00 174.94 175.39 1fie s ILE 633 N -0.94 5.07 -0.18 2.92 -1.09 0.16 -4.48 121.20 122.65 1fie s ILE 633 Ca 0.16 0.08 0.01 0.00 -2.23 0.00 0.00 60.65 58.66 1fie s ILE 633 Cb -0.11 -3.35 0.02 0.00 -1.58 0.00 0.00 42.46 37.44 1fie s ILE 633 CO 0.06 0.36 -0.19 -0.63 -1.23 0.00 0.00 174.94 173.31 1fie s ILE 634 N 1.05 2.17 -0.05 2.92 1.01 -1.25 0.02 121.20 127.06 1fie s ILE 634 Ca 0.06 -0.91 0.02 0.00 0.00 0.00 0.00 60.65 59.82 1fie s ILE 634 Cb -0.14 -1.91 0.02 0.00 0.01 0.00 0.00 42.46 40.44 1fie s ILE 634 CO 0.04 0.53 -0.09 -0.54 0.00 0.00 0.00 174.94 174.89 1fie s LYS 635 N 1.26 1.29 -0.00 2.79 1.02 -0.90 -4.85 119.74 120.33 1fie s LYS 635 Ca 0.04 -0.27 0.01 0.00 0.02 0.00 0.00 55.97 55.77 1fie s LYS 635 Cb -0.13 -1.13 -0.04 0.00 -0.52 0.00 0.00 37.83 36.01 1fie s LYS 635 CO -0.11 -0.02 0.03 0.14 -0.92 0.00 0.00 175.35 174.47 1fie s VAL 636 N 0.75 4.38 -0.09 3.17 -7.23 -1.26 -1.00 120.40 119.12 1fie s VAL 636 Ca -0.13 -0.53 -0.03 0.00 -1.81 0.00 0.00 61.98 59.47 1fie s VAL 636 Cb -0.15 -2.97 0.05 0.00 0.56 0.00 0.00 36.38 33.86 1fie s VAL 636 CO 0.02 0.36 0.11 0.00 -0.31 0.00 0.00 175.10 175.28 1fie s ARG 637 N -1.64 -0.00 0.00 4.82 1.70 0.12 -4.95 118.95 119.00 1fie s ARG 637 Ca 0.21 0.36 0.00 0.00 -0.47 0.00 0.00 55.73 55.83 1fie s ARG 637 Cb -0.12 -0.69 0.00 0.00 -0.57 0.00 0.00 34.95 33.58 1fie s ARG 637 CO 0.12 -0.40 0.00 0.41 -1.08 0.00 0.00 175.30 174.35 1fie n GLY 638 N 5.31 -0.40 3.20 3.88 0.00 -1.26 0.06 105.19 115.97 1fie n GLY 638 Ca -0.04 -0.26 -0.28 0.00 0.00 0.00 0.00 46.02 45.43 1fie n GLY 638 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1fie s THR 639 N -0.40 1.69 -0.23 2.61 2.01 -1.02 -4.97 115.64 115.33 1fie s THR 639 Ca 0.00 -0.88 -0.03 0.00 0.31 0.00 0.00 61.69 61.09 1fie s THR 639 Cb 0.00 -1.43 0.02 0.00 0.01 0.00 0.00 72.50 71.10 1fie s THR 639 CO 0.00 0.48 2.63 0.00 -0.69 0.00 0.00 174.62 177.04 1fie n GLN 640 N 2.92 1.90 -4.23 4.92 3.00 -1.26 -4.49 117.38 120.14 1fie n GLN 640 Ca -0.17 -1.41 -0.29 0.00 -0.01 0.00 0.00 57.00 55.12 1fie n GLN 640 Cb 0.53 -1.76 -0.17 0.00 0.00 0.00 0.00 30.24 28.84 1fie n GLN 640 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 1fie s VAL 641 N -1.12 1.54 0.64 5.09 1.01 -1.25 0.81 120.40 127.12 1fie s VAL 641 Ca 0.43 -0.64 -0.17 0.00 0.00 0.00 0.00 61.98 61.60 1fie s VAL 641 Cb 0.26 -1.43 -0.05 0.00 0.00 0.00 0.00 36.38 35.17 1fie s VAL 641 CO -0.07 0.45 0.79 1.33 0.00 0.00 0.00 175.10 177.60 1fie n VAL 642 N 4.51 2.99 0.00 2.92 0.24 -1.06 -1.21 118.33 126.71 1fie n VAL 642 Ca -0.18 -0.46 0.00 0.00 -2.04 0.00 0.00 64.34 61.66 1fie n VAL 642 Cb 0.51 -0.97 0.00 0.00 -1.47 0.00 0.00 33.84 31.91 1fie n VAL 642 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1fie n GLY 643 N 1.43 1.13 3.81 7.63 0.00 0.20 -4.92 105.19 114.47 1fie n GLY 643 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.80 1fie n GLY 643 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1fie s SER 644 N 0.00 7.09 0.54 1.61 0.01 -0.35 -4.81 113.70 117.79 1fie s SER 644 Ca 0.00 1.63 -0.20 0.00 1.31 0.00 0.00 55.95 58.69 1fie s SER 644 Cb 0.00 -2.51 -0.05 0.00 0.21 0.00 0.00 66.02 63.67 1fie s SER 644 CO 0.00 -0.15 1.19 -1.81 0.41 0.00 0.00 173.24 172.88 1fie s ASP 645 N -1.87 5.62 -0.10 2.44 1.11 -1.26 -3.95 116.67 118.66 1fie s ASP 645 Ca 0.53 2.35 -0.12 0.00 0.18 0.00 0.00 52.55 55.48 1fie s ASP 645 Cb -0.14 -2.60 0.03 0.00 1.07 0.00 0.00 42.92 41.28 1fie s ASP 645 CO 0.19 -1.30 0.33 -0.32 1.18 0.00 0.00 175.17 175.25 1fie s MET 646 N -3.09 0.46 -0.12 8.23 -2.45 -0.66 -2.44 119.30 119.23 1fie s MET 646 Ca 0.72 0.30 -0.05 0.00 -1.25 0.00 0.00 55.69 55.41 1fie s MET 646 Cb -0.29 0.22 -0.04 0.00 1.25 0.00 0.00 34.83 35.97 1fie s MET 646 CO 0.33 -0.08 0.07 0.99 1.05 0.00 0.00 175.02 177.38 1fie s THR 647 N -0.19 4.88 -0.15 10.11 2.01 0.11 -1.37 115.64 131.04 1fie s THR 647 Ca -0.03 -0.02 0.02 0.00 0.31 0.00 0.00 61.69 61.96 1fie s THR 647 Cb -0.03 -3.11 0.01 0.00 0.01 0.00 0.00 72.50 69.38 1fie s THR 647 CO 0.01 0.58 -0.20 -0.69 -0.69 0.00 0.00 174.62 173.64 1fie s VAL 648 N -0.71 2.18 -0.25 3.82 1.01 0.14 0.11 120.40 126.69 1fie s VAL 648 Ca 0.12 -0.93 -0.03 0.00 0.00 0.00 0.00 61.98 61.14 1fie s VAL 648 Cb -0.12 -1.89 0.02 0.00 0.00 0.00 0.00 36.38 34.40 1fie s VAL 648 CO 0.03 0.54 -0.04 -0.89 0.00 0.00 0.00 175.10 174.74 1fie s THR 649 N 0.91 3.07 -0.31 3.92 2.01 -0.17 -0.49 115.64 124.58 1fie s THR 649 Ca -0.04 -0.94 -0.12 0.00 0.31 0.00 0.00 61.69 60.90 1fie s THR 649 Cb -0.15 -2.55 -0.03 0.00 0.01 0.00 0.00 72.50 69.78 1fie s THR 649 CO -0.04 0.20 0.20 -0.63 -0.69 0.00 0.00 174.62 173.66 1fie s ILE 650 N 1.36 5.18 -0.10 1.82 1.09 0.11 -2.13 121.20 128.54 1fie s ILE 650 Ca 0.01 -0.08 0.02 0.00 -1.10 0.00 0.00 60.65 59.50 1fie s ILE 650 Cb -0.17 -3.57 -0.01 0.00 -1.06 0.00 0.00 42.46 37.65 1fie s ILE 650 CO -0.03 0.12 -0.18 -1.58 -0.10 0.00 0.00 174.94 173.17 1fie s GLN 651 N 1.72 3.06 -0.11 2.79 0.74 0.10 -0.24 119.66 127.73 1fie s GLN 651 Ca 0.06 -0.77 -0.04 0.00 0.05 0.00 0.00 55.36 54.67 1fie s GLN 651 Cb -0.17 -2.45 0.06 0.00 1.10 0.00 0.00 33.01 31.55 1fie s GLN 651 CO 0.10 0.29 0.19 0.12 -0.55 0.00 0.00 175.29 175.44 1fie s PHE 652 N 0.12 -0.23 -0.19 1.67 5.36 -0.73 -0.67 117.98 123.30 1fie s PHE 652 Ca -0.09 0.62 -0.09 0.00 -0.96 0.00 0.00 56.93 56.42 1fie s PHE 652 Cb -0.15 -0.24 -0.05 0.00 -0.34 0.00 0.00 43.02 42.24 1fie s PHE 652 CO 0.05 -0.33 0.10 0.99 -1.46 0.00 0.00 175.22 174.58 1fie s THR 653 N 2.32 5.18 -0.51 0.12 2.01 -1.26 -2.31 115.64 121.19 1fie s THR 653 Ca 0.03 0.11 -0.27 0.00 0.31 0.00 0.00 61.69 61.87 1fie s THR 653 Cb -0.13 -3.35 -0.03 0.00 0.01 0.00 0.00 72.50 69.00 1fie s THR 653 CO -0.07 0.45 1.98 0.21 -0.69 0.00 0.00 174.62 176.50 1fie s ASN 654 N 0.32 5.22 0.31 3.53 3.84 0.10 -4.85 114.94 123.41 1fie s ASN 654 Ca 0.06 0.75 0.07 0.00 0.21 0.00 0.00 52.86 53.96 1fie s ASN 654 Cb -0.11 -2.52 0.53 0.00 -0.55 0.00 0.00 41.25 38.59 1fie s ASN 654 CO -0.01 -2.34 1.75 1.55 -2.79 0.00 0.00 177.10 175.26 1fie h PRO 655 N 15.55 0.23 -7.26 0.43 0.13 -1.94 -2.10 132.00 137.03 1fie h PRO 655 Ca -0.28 -0.10 -0.51 0.00 -0.87 0.00 0.00 66.00 64.24 1fie h PRO 655 Cb 1.19 -0.01 0.13 0.00 0.13 0.00 0.00 31.00 32.44 1fie h PRO 655 CO 1.16 0.56 0.34 -0.51 -0.23 0.00 0.00 178.00 179.32 1fie s LEU 656 N -8.34 3.16 -0.07 1.56 1.43 -1.26 -4.78 118.68 110.39 1fie s LEU 656 Ca -0.05 1.93 0.07 0.00 -1.03 0.00 0.00 54.13 55.06 1fie s LEU 656 Cb 0.14 -4.54 0.32 0.00 0.03 0.00 0.00 46.19 42.14 1fie s LEU 656 CO 0.76 -1.96 1.09 0.29 0.23 0.00 0.00 176.35 176.76 1fie n LYS 657 N -3.13 2.32 -4.27 1.70 5.02 -1.26 -3.38 118.16 115.15 1fie n LYS 657 Ca 0.10 -1.24 -0.18 0.00 -2.02 0.00 0.00 58.31 54.97 1fie n LYS 657 Cb 0.52 -1.63 -0.11 0.00 -0.02 0.00 0.00 35.03 33.80 1fie n LYS 657 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1fie s GLU 658 N -1.68 1.12 0.21 1.97 8.01 -1.26 -4.85 118.70 122.21 1fie s GLU 658 Ca 0.22 -1.36 -0.30 0.00 0.01 0.00 0.00 54.97 53.54 1fie s GLU 658 Cb 0.15 -0.96 -0.08 0.00 -4.31 0.00 0.00 34.13 28.93 1fie s GLU 658 CO 0.09 0.17 1.07 0.95 0.01 0.00 0.00 175.26 177.55 1fie s THR 659 N -2.47 3.84 -0.24 3.63 -4.23 -1.26 -4.23 115.64 110.67 1fie s THR 659 Ca 0.14 1.68 -0.12 0.00 -1.18 0.00 0.00 61.69 62.21 1fie s THR 659 Cb -0.03 -4.07 -0.05 0.00 1.34 0.00 0.00 72.50 69.69 1fie s THR 659 CO 0.04 0.33 0.24 -0.76 -0.54 0.00 0.00 174.62 173.94 1fie s LEU 660 N -0.75 4.09 0.07 4.79 1.43 -0.77 -4.93 118.68 122.61 1fie s LEU 660 Ca 0.47 0.19 -0.03 0.00 -1.03 0.00 0.00 54.13 53.73 1fie s LEU 660 Cb -0.29 -2.23 -0.05 0.00 0.03 0.00 0.00 46.19 43.65 1fie s LEU 660 CO 0.36 -0.02 0.28 -0.13 0.23 0.00 0.00 176.35 177.07 1fie s ARG 661 N 1.39 3.53 -1.10 1.70 1.81 -1.26 -1.03 118.95 123.99 1fie s ARG 661 Ca 0.11 -0.23 -0.23 0.00 -1.72 0.00 0.00 55.73 53.65 1fie s ARG 661 Cb -0.15 -2.98 0.02 0.00 -0.45 0.00 0.00 34.95 31.39 1fie s ARG 661 CO 0.07 0.57 0.69 0.09 -0.68 0.00 0.00 175.30 176.04 1fie n ASN 662 N 0.44 -4.68 -4.63 0.23 5.03 -0.21 -2.68 115.26 108.76 1fie n ASN 662 Ca -0.06 -1.13 -0.43 0.00 0.87 0.00 0.00 54.58 53.84 1fie n ASN 662 Cb 0.52 -2.14 -0.03 0.00 -1.02 0.00 0.00 39.78 37.11 1fie n ASN 662 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1fie s VAL 663 N -3.38 4.60 -0.34 2.41 1.01 0.28 -4.17 120.40 120.81 1fie s VAL 663 Ca 0.37 1.52 -0.15 0.00 0.00 0.00 0.00 61.98 63.71 1fie s VAL 663 Cb -0.18 -4.33 -0.01 0.00 0.00 0.00 0.00 36.38 31.85 1fie s VAL 663 CO 0.93 -0.42 0.36 0.26 0.00 0.00 0.00 175.10 176.22 1fie s TRP 664 N 3.44 3.21 0.05 5.22 0.52 0.50 -0.34 118.94 131.53 1fie s TRP 664 Ca 0.41 -0.00 -0.00 0.00 0.02 0.00 0.00 56.10 56.52 1fie s TRP 664 Cb -0.13 -2.67 -0.04 0.00 -1.15 0.00 0.00 33.47 29.49 1fie s TRP 664 CO 0.15 -0.42 0.20 0.08 0.02 0.00 0.00 176.95 176.98 1fie s VAL 665 N 2.02 5.39 0.09 4.03 1.01 0.10 -1.65 120.40 131.39 1fie s VAL 665 Ca 0.12 -0.35 0.07 0.00 0.00 0.00 0.00 61.98 61.82 1fie s VAL 665 Cb -0.16 -3.61 -0.03 0.00 0.00 0.00 0.00 36.38 32.57 1fie s VAL 665 CO 0.12 0.18 -0.17 -1.00 0.00 0.00 0.00 175.10 174.22 1fie s HIS 666 N -1.47 1.52 0.02 5.22 3.76 0.13 -1.22 115.29 123.25 1fie s HIS 666 Ca 0.33 -0.45 0.02 0.00 -0.15 0.00 0.00 55.06 54.81 1fie s HIS 666 Cb -0.13 -0.83 -0.01 0.00 1.11 0.00 0.00 32.58 32.72 1fie s HIS 666 CO 0.26 0.14 -0.07 -1.17 -0.85 0.00 0.00 174.74 173.06 1fie s LEU 667 N -1.93 2.12 -0.03 0.89 2.96 -0.48 -2.84 118.68 119.37 1fie s LEU 667 Ca 0.04 -0.30 -0.29 0.00 -0.22 0.00 0.00 54.13 53.35 1fie s LEU 667 Cb -0.09 -0.24 0.11 0.00 0.50 0.00 0.00 46.19 46.46 1fie s LEU 667 CO 0.03 -0.05 0.91 -0.62 -1.32 0.00 0.00 176.35 175.30 1fie s ASP 668 N -0.78 -0.36 0.00 3.68 -1.08 -0.28 -0.74 116.67 117.10 1fie s ASP 668 Ca -0.03 0.06 0.00 0.00 -0.52 0.00 0.00 52.55 52.06 1fie s ASP 668 Cb -0.06 0.37 0.00 0.00 -1.46 0.00 0.00 42.92 41.77 1fie s ASP 668 CO 0.00 -0.58 0.00 0.61 0.52 0.00 0.00 175.17 175.72 1fie n GLY 669 N -0.11 -0.24 3.73 2.66 0.00 -1.26 0.33 105.19 110.30 1fie n GLY 669 Ca -0.09 0.75 -0.42 0.00 0.00 0.00 0.00 46.02 46.26 1fie n GLY 669 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1fie n PRO 670 N 0.00 2.60 -0.86 1.61 -0.04 -1.26 -1.08 135.00 135.96 1fie n PRO 670 Ca 0.00 0.92 0.00 0.00 -0.04 0.00 0.00 63.50 64.38 1fie n PRO 670 Cb 0.00 -2.69 0.00 0.00 -0.04 0.00 0.00 33.50 30.77 1fie n PRO 670 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1fie n GLY 671 N 2.19 0.71 1.72 0.55 0.00 -1.26 -4.76 105.19 104.34 1fie n GLY 671 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1fie n GLY 671 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1fie n VAL 672 N -2.54 0.11 -3.99 1.61 0.31 -0.87 -1.96 118.33 111.00 1fie n VAL 672 Ca 0.00 0.03 -0.09 0.00 -0.01 0.00 0.00 64.34 64.28 1fie n VAL 672 Cb 0.00 -0.79 -0.10 0.00 -0.91 0.00 0.00 33.84 32.04 1fie n VAL 672 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1fie s THR 673 N -2.00 0.15 0.25 2.52 -1.32 -0.24 -4.26 115.64 110.73 1fie s THR 673 Ca 0.00 -1.22 -0.28 0.00 -1.21 0.00 0.00 61.69 58.99 1fie s THR 673 Cb 0.00 -0.84 -0.09 0.00 -1.51 0.00 0.00 72.50 70.06 1fie s THR 673 CO 0.00 -0.67 0.90 -0.60 -2.21 0.00 0.00 174.62 172.04 1fie s ARG 674 N -2.55 4.71 -0.06 7.08 6.06 -1.26 -4.05 118.95 128.88 1fie s ARG 674 Ca -0.06 1.36 -0.37 0.00 -2.50 0.00 0.00 55.73 54.16 1fie s ARG 674 Cb -0.02 -3.14 -0.15 0.00 0.06 0.00 0.00 34.95 31.70 1fie s ARG 674 CO -0.05 0.46 1.61 -2.30 -2.50 0.00 0.00 175.30 172.53 1fie n PRO 675 N 1.24 1.48 -4.54 5.12 -0.02 -1.26 -4.74 135.00 132.28 1fie n PRO 675 Ca -0.02 0.54 -0.25 0.00 -2.02 0.00 0.00 63.50 61.75 1fie n PRO 675 Cb 0.48 -2.25 -0.10 0.00 -0.02 0.00 0.00 33.50 31.62 1fie n PRO 675 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 1fie s MET 676 N 2.22 1.85 -0.27 -0.52 -1.94 0.08 -5.00 119.30 115.72 1fie s MET 676 Ca 0.90 -2.09 -0.16 0.00 -1.71 0.00 0.00 55.69 52.63 1fie s MET 676 Cb -0.91 -1.03 0.08 0.00 2.01 0.00 0.00 34.83 34.98 1fie s MET 676 CO 0.53 -0.26 0.67 -1.59 -0.01 0.00 0.00 175.02 174.35 1fie s LYS 677 N -3.82 0.69 -0.10 2.03 -2.85 -1.26 -1.38 119.74 113.06 1fie s LYS 677 Ca 0.28 1.17 0.03 0.00 -1.00 0.00 0.00 55.97 56.45 1fie s LYS 677 Cb 0.06 0.15 0.01 0.00 -2.06 0.00 0.00 37.83 35.99 1fie s LYS 677 CO 0.14 -0.15 -0.19 0.21 0.10 0.00 0.00 175.35 175.46 1fie s LYS 678 N 1.49 2.53 -0.11 1.78 2.36 -0.35 -4.97 119.74 122.47 1fie s LYS 678 Ca -0.09 -0.69 -0.07 0.00 -2.55 0.00 0.00 55.97 52.57 1fie s LYS 678 Cb -0.05 -2.00 -0.04 0.00 -1.05 0.00 0.00 37.83 34.68 1fie s LYS 678 CO -0.17 0.07 0.14 1.41 1.55 0.00 0.00 175.35 178.35 1fie s MET 679 N 0.61 3.44 -0.13 4.03 -2.45 -1.26 -0.73 119.30 122.81 1fie s MET 679 Ca -0.14 -0.15 0.01 0.00 -1.25 0.00 0.00 55.69 54.17 1fie s MET 679 Cb -0.17 -3.18 -0.01 0.00 1.25 0.00 0.00 34.83 32.73 1fie s MET 679 CO 0.04 0.77 -0.17 -0.06 1.05 0.00 0.00 175.02 176.65 1fie s PHE 680 N -1.05 2.72 0.21 4.11 0.40 0.54 -4.98 117.98 119.93 1fie s PHE 680 Ca 0.16 -0.91 -0.09 0.00 -0.60 0.00 0.00 56.93 55.49 1fie s PHE 680 Cb -0.12 -1.81 0.28 0.00 0.51 0.00 0.00 43.02 41.88 1fie s PHE 680 CO 0.05 -0.37 1.76 0.00 0.70 0.00 0.00 175.22 177.37 1fie h ARG 681 N 6.90 0.49 -2.41 0.44 2.47 -1.93 0.84 114.38 121.18 1fie h ARG 681 Ca -0.26 -0.03 0.08 0.00 -1.26 0.00 0.00 59.98 58.52 1fie h ARG 681 Cb 1.21 -0.11 -0.15 0.00 -1.65 0.00 0.00 29.97 29.28 1fie h ARG 681 CO 0.53 0.32 0.44 -1.83 0.56 0.00 0.00 179.97 179.99 1fie s GLU 682 N -6.08 0.91 -0.24 0.04 -1.05 -1.26 -1.05 118.70 109.97 1fie s GLU 682 Ca -0.13 -0.32 -0.02 0.00 -0.15 0.00 0.00 54.97 54.35 1fie s GLU 682 Cb 0.17 0.42 0.07 0.00 -0.44 0.00 0.00 34.13 34.35 1fie s GLU 682 CO 0.75 -0.39 0.05 0.42 0.95 0.00 0.00 175.26 177.04 1fie s ILE 683 N -3.20 0.69 1.06 1.83 1.01 -0.19 -4.97 121.20 117.42 1fie s ILE 683 Ca 0.04 -0.90 -0.14 0.00 0.00 0.00 0.00 60.65 59.65 1fie s ILE 683 Cb -0.01 -1.30 0.15 0.00 0.01 0.00 0.00 42.46 41.31 1fie s ILE 683 CO -0.10 -0.38 0.59 0.54 0.00 0.00 0.00 174.94 175.60 1fie n ARG 684 N 4.96 -1.33 -1.69 2.79 5.12 -1.26 -1.85 116.66 123.40 1fie n ARG 684 Ca -0.07 -0.35 -0.44 0.00 -1.93 0.00 0.00 57.85 55.05 1fie n ARG 684 Cb 0.45 -1.99 -0.04 0.00 -1.16 0.00 0.00 32.46 29.72 1fie n ARG 684 CO 0.00 0.00 0.00 -2.30 -1.93 0.00 0.00 177.63 173.40 1fie n PRO 685 N -3.20 2.49 -2.24 5.56 -0.02 -1.26 -1.66 135.00 134.67 1fie n PRO 685 Ca 0.05 0.90 -0.20 0.00 -2.02 0.00 0.00 63.50 62.23 1fie n PRO 685 Cb 0.56 -2.74 -0.03 0.00 -0.02 0.00 0.00 33.50 31.27 1fie n PRO 685 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1fie n ASN 686 N 4.88 -5.74 -4.93 2.55 5.03 -0.79 -4.99 115.26 111.27 1fie n ASN 686 Ca 0.18 0.10 -0.26 0.00 0.87 0.00 0.00 54.58 55.47 1fie n ASN 686 Cb 0.33 -4.84 0.04 0.00 -1.02 0.00 0.00 39.78 34.29 1fie n ASN 686 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 1fie s SER 687 N -2.19 5.47 -0.15 6.41 0.01 -0.66 -4.77 113.70 117.82 1fie s SER 687 Ca 0.00 0.55 -0.02 0.00 1.31 0.00 0.00 55.95 57.79 1fie s SER 687 Cb 0.00 -1.51 0.05 0.00 0.21 0.00 0.00 66.02 64.76 1fie s SER 687 CO 0.00 -1.11 0.01 -0.89 0.41 0.00 0.00 173.24 171.65 1fie s THR 688 N -2.96 0.58 0.06 1.44 2.01 -1.26 -0.73 115.64 114.79 1fie s THR 688 Ca 0.54 -0.33 -0.02 0.00 0.31 0.00 0.00 61.69 62.19 1fie s THR 688 Cb -0.10 -0.91 -0.04 0.00 0.01 0.00 0.00 72.50 71.46 1fie s THR 688 CO 0.44 0.02 0.24 0.68 -0.69 0.00 0.00 174.62 175.30 1fie s VAL 689 N 1.86 5.36 0.10 3.82 -7.23 -0.98 -4.97 120.40 118.35 1fie s VAL 689 Ca 0.01 -0.25 0.06 0.00 -1.81 0.00 0.00 61.98 60.00 1fie s VAL 689 Cb -0.15 -3.61 -0.03 0.00 0.56 0.00 0.00 36.38 33.15 1fie s VAL 689 CO -0.07 0.17 -0.15 -1.10 -0.31 0.00 0.00 175.10 173.64 1fie s GLN 690 N -2.39 0.95 -0.17 4.82 -0.21 -1.26 -1.78 119.66 119.61 1fie s GLN 690 Ca 0.34 -1.10 -0.04 0.00 0.02 0.00 0.00 55.36 54.59 1fie s GLN 690 Cb -0.13 -0.95 0.06 0.00 1.00 0.00 0.00 33.01 32.99 1fie s GLN 690 CO 0.25 0.20 0.06 -0.46 -2.12 0.00 0.00 175.29 173.22 1fie s TRP 691 N -1.59 0.63 0.17 0.91 -0.00 0.67 -4.97 118.94 114.77 1fie s TRP 691 Ca 0.04 -0.56 -0.05 0.00 -0.00 0.00 0.00 56.10 55.53 1fie s TRP 691 Cb -0.08 -0.86 -0.06 0.00 -0.00 0.00 0.00 33.47 32.47 1fie s TRP 691 CO 0.03 -0.54 0.41 -1.21 -0.00 0.00 0.00 176.95 175.64 1fie s GLU 692 N 1.99 3.63 -0.07 5.86 0.41 -1.26 0.09 118.70 129.35 1fie s GLU 692 Ca 0.01 -0.06 -0.31 0.00 -0.41 0.00 0.00 54.97 54.20 1fie s GLU 692 Cb -0.16 -2.80 0.08 0.00 -1.78 0.00 0.00 34.13 29.46 1fie s GLU 692 CO -0.08 0.42 0.72 -2.00 -0.49 0.00 0.00 175.26 173.83 1fie s GLU 693 N -2.82 0.99 -0.15 1.61 2.56 0.35 -4.98 118.70 116.27 1fie s GLU 693 Ca 0.42 0.28 -0.00 0.00 0.00 0.00 0.00 54.97 55.67 1fie s GLU 693 Cb -0.12 0.47 -0.01 0.00 2.00 0.00 0.00 34.13 36.47 1fie s GLU 693 CO 0.25 -0.30 -0.14 0.08 -0.56 0.00 0.00 175.26 174.59 1fie s VAL 694 N -1.11 2.82 0.06 3.70 1.01 -1.26 0.25 120.40 125.88 1fie s VAL 694 Ca -0.09 -0.72 0.09 0.00 0.00 0.00 0.00 61.98 61.26 1fie s VAL 694 Cb -0.00 -2.19 -0.03 0.00 0.00 0.00 0.00 36.38 34.15 1fie s VAL 694 CO 0.09 0.51 -0.26 0.00 0.00 0.00 0.00 175.10 175.44 1fie s ARG 696 N -1.38 2.68 0.21 0.00 0.52 -1.26 -1.65 118.95 118.08 1fie s ARG 696 Ca 0.12 -2.81 -0.30 0.00 -0.52 0.00 0.00 55.73 52.22 1fie s ARG 696 Cb -0.10 -3.72 -0.16 0.00 0.52 0.00 0.00 34.95 31.49 1fie s ARG 696 CO 0.03 -1.20 0.84 -0.35 0.02 0.00 0.00 175.30 174.64 1fie n PRO 697 N 3.00 0.65 -0.02 3.54 -0.04 -1.25 -4.49 135.00 136.38 1fie n PRO 697 Ca 0.12 0.23 0.01 0.00 -0.04 0.00 0.00 63.50 63.82 1fie n PRO 697 Cb 0.37 -1.48 0.01 0.00 -0.04 0.00 0.00 33.50 32.36 1fie n PRO 697 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1fie n TRP 698 N 0.48 0.00 -4.09 0.54 2.14 -0.83 0.61 117.44 116.30 1fie n TRP 698 Ca 0.15 -0.41 -0.14 0.00 2.07 0.00 0.00 57.50 59.17 1fie n TRP 698 Cb 0.26 -0.05 -0.12 0.00 -0.81 0.00 0.00 31.31 30.59 1fie n TRP 698 CO 0.00 0.00 0.00 0.08 2.07 0.00 0.00 177.69 179.84 1fie s VAL 699 N -0.90 0.53 0.18 -1.67 1.01 -1.03 -4.98 120.40 113.55 1fie s VAL 699 Ca 0.03 -0.88 0.07 0.00 0.00 0.00 0.00 61.98 61.20 1fie s VAL 699 Cb 0.03 -0.57 -0.04 0.00 0.00 0.00 0.00 36.38 35.80 1fie s VAL 699 CO 0.00 -0.25 0.03 -0.44 0.00 0.00 0.00 175.10 174.44 1fie s SER 700 N -1.23 4.91 0.00 3.32 0.01 -1.26 -4.80 113.70 114.65 1fie s SER 700 Ca -0.07 -0.36 0.00 0.00 1.31 0.00 0.00 55.95 56.83 1fie s SER 700 Cb -0.08 -1.09 0.00 0.00 0.21 0.00 0.00 66.02 65.06 1fie s SER 700 CO 0.00 0.08 0.00 0.61 0.41 0.00 0.00 173.24 174.34 1fie n GLY 701 N -0.22 -0.99 3.74 3.44 0.00 0.11 -4.97 105.19 106.30 1fie n GLY 701 Ca -0.09 -2.05 -0.41 0.00 0.00 0.00 0.00 46.02 43.46 1fie n GLY 701 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1fie s HIS 702 N 0.00 3.13 0.25 1.61 5.65 -1.26 -1.53 115.29 123.14 1fie s HIS 702 Ca 0.00 1.13 0.01 0.00 0.25 0.00 0.00 55.06 56.45 1fie s HIS 702 Cb 0.00 -3.71 -0.04 0.00 -1.18 0.00 0.00 32.58 27.65 1fie s HIS 702 CO 0.00 -2.27 0.15 1.03 -0.65 0.00 0.00 174.74 172.99 1fie s ARG 703 N -0.27 1.40 -0.09 2.88 1.81 0.44 -4.92 118.95 120.20 1fie s ARG 703 Ca 0.58 -1.77 -0.08 0.00 -1.72 0.00 0.00 55.73 52.74 1fie s ARG 703 Cb -0.39 0.08 0.02 0.00 -0.45 0.00 0.00 34.95 34.21 1fie s ARG 703 CO 0.41 -0.42 0.24 0.21 -0.68 0.00 0.00 175.30 175.06 1fie s LYS 704 N -3.97 0.28 -0.04 3.54 2.20 -1.26 -0.91 119.74 119.57 1fie s LYS 704 Ca 0.38 0.34 -0.02 0.00 -0.36 0.00 0.00 55.97 56.30 1fie s LYS 704 Cb 0.06 0.13 -0.04 0.00 -1.51 0.00 0.00 37.83 36.47 1fie s LYS 704 CO 0.16 -0.04 0.10 -0.51 -0.36 0.00 0.00 175.35 174.70 1fie s LEU 705 N 0.16 4.04 -0.03 5.43 1.43 -0.19 -4.42 118.68 125.09 1fie s LEU 705 Ca -0.00 0.25 0.03 0.00 -1.03 0.00 0.00 54.13 53.37 1fie s LEU 705 Cb -0.02 -2.22 0.00 0.00 0.03 0.00 0.00 46.19 43.98 1fie s LEU 705 CO 0.00 0.32 -0.10 -0.63 0.23 0.00 0.00 176.35 176.16 1fie s ILE 706 N -1.14 0.91 0.34 -0.59 1.01 0.15 -1.98 121.20 119.90 1fie s ILE 706 Ca 0.21 -0.41 0.10 0.00 0.00 0.00 0.00 60.65 60.54 1fie s ILE 706 Cb -0.12 -0.81 -0.06 0.00 0.01 0.00 0.00 42.46 41.48 1fie s ILE 706 CO 0.11 0.28 -0.10 0.00 0.00 0.00 0.00 174.94 175.24 1fie s ALA 707 N 0.27 2.96 -0.04 9.38 0.00 -0.91 -1.12 121.76 132.29 1fie s ALA 707 Ca -0.05 -2.08 -0.29 0.00 0.00 0.00 0.00 51.96 49.54 1fie s ALA 707 Cb -0.10 -0.07 0.06 0.00 0.00 0.00 0.00 23.12 23.01 1fie s ALA 707 CO 0.01 0.09 0.63 -1.54 0.00 0.00 0.00 175.76 174.95 1fie s SER 708 N -3.61 -0.60 0.01 0.00 1.04 -1.13 -3.24 113.70 106.17 1fie s SER 708 Ca 0.32 0.62 0.02 0.00 0.48 0.00 0.00 55.95 57.40 1fie s SER 708 Cb 0.02 0.51 -0.01 0.00 0.10 0.00 0.00 66.02 66.64 1fie s SER 708 CO 0.17 -0.60 -0.07 -0.32 0.98 0.00 0.00 173.24 173.40 1fie s MET 709 N -1.28 0.51 -0.23 4.02 1.75 0.18 -0.69 119.30 123.55 1fie s MET 709 Ca -0.11 -0.38 -0.12 0.00 -1.25 0.00 0.00 55.69 53.84 1fie s MET 709 Cb -0.01 -0.44 0.08 0.00 2.84 0.00 0.00 34.83 37.30 1fie s MET 709 CO 0.09 0.11 0.54 0.45 -0.65 0.00 0.00 175.02 175.56 1fie s SER 710 N -0.56 -0.72 0.18 1.11 0.15 -0.66 -3.37 113.70 109.84 1fie s SER 710 Ca -0.01 1.22 0.02 0.00 0.70 0.00 0.00 55.95 57.88 1fie s SER 710 Cb -0.05 1.26 -0.01 0.00 -1.71 0.00 0.00 66.02 65.51 1fie s SER 710 CO 0.00 -0.22 0.08 -1.54 1.20 0.00 0.00 173.24 172.77 1fie n SER 711 N 4.57 0.70 -0.33 5.45 3.41 0.49 -0.37 113.62 127.53 1fie n SER 711 Ca -0.19 -2.01 -0.04 0.00 -0.26 0.00 0.00 58.87 56.37 1fie n SER 711 Cb 0.55 0.56 0.09 0.00 -0.26 0.00 0.00 64.21 65.14 1fie n SER 711 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1fie h ASP 712 N 0.81 1.08 0.00 4.04 5.19 -1.67 -3.40 116.42 122.46 1fie h ASP 712 Ca -0.14 -0.08 0.00 0.00 -0.62 0.00 0.00 57.03 56.20 1fie h ASP 712 Cb 0.56 -0.27 0.00 0.00 0.18 0.00 0.00 39.33 39.80 1fie h ASP 712 CO 0.21 0.84 0.00 -1.20 -3.12 0.00 0.00 179.24 175.97 1fie n SER 713 N -4.39 0.00 -4.77 6.45 7.64 -1.26 -4.99 113.62 112.30 1fie n SER 713 Ca 0.09 0.00 -0.39 0.00 1.01 0.00 0.00 58.87 59.58 1fie n SER 713 Cb 0.07 0.00 -0.00 0.00 -1.01 0.00 0.00 64.21 63.27 1fie n SER 713 CO 0.00 0.00 0.00 -0.22 -3.01 0.00 0.00 175.04 171.81 1fie s LEU 714 N -0.90 4.15 0.07 -3.43 2.96 -1.26 -4.98 118.68 115.29 1fie s LEU 714 Ca 0.00 2.59 -0.27 0.00 -0.22 0.00 0.00 54.13 56.23 1fie s LEU 714 Cb 0.00 -3.99 0.09 0.00 0.50 0.00 0.00 46.19 42.79 1fie s LEU 714 CO 0.00 -0.91 0.84 -0.60 -1.32 0.00 0.00 176.35 174.37 1fie s ARG 715 N -2.36 1.01 -0.02 1.98 3.52 -1.26 -0.38 118.95 121.44 1fie s ARG 715 Ca 0.59 -0.43 -0.00 0.00 -0.13 0.00 0.00 55.73 55.76 1fie s ARG 715 Cb -0.36 0.43 0.00 0.00 -1.56 0.00 0.00 34.95 33.46 1fie s ARG 715 CO 0.46 -0.45 0.01 1.58 -0.81 0.00 0.00 175.30 176.09 1fie n HIS 716 N -0.32 -0.02 -4.13 5.12 -0.00 -1.22 -4.82 115.22 109.83 1fie n HIS 716 Ca -0.10 0.01 -0.35 0.00 0.46 0.00 0.00 57.72 57.75 1fie n HIS 716 Cb 0.62 -1.04 -0.13 0.00 -0.12 0.00 0.00 29.99 29.32 1fie n HIS 716 CO 0.00 0.00 0.00 0.08 0.46 0.00 0.00 176.34 176.88 1fie s VAL 717 N -2.62 3.54 0.25 3.57 1.01 -1.22 -5.03 120.40 119.90 1fie s VAL 717 Ca 0.00 -0.45 0.01 0.00 0.00 0.00 0.00 61.98 61.54 1fie s VAL 717 Cb -0.00 -2.58 -0.00 0.00 0.00 0.00 0.00 36.38 33.79 1fie s VAL 717 CO 0.00 0.45 0.04 -1.22 0.00 0.00 0.00 175.10 174.37 1fie n TYR 718 N 4.33 0.36 -3.72 5.22 4.01 -1.26 -0.65 117.16 125.45 1fie n TYR 718 Ca -0.18 -1.42 0.02 0.00 -0.16 0.00 0.00 57.90 56.16 1fie n TYR 718 Cb 0.52 -0.09 0.00 0.00 -0.31 0.00 0.00 39.34 39.45 1fie n TYR 718 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1fie s GLY 719 N -2.46 -0.32 0.12 2.72 0.00 -1.20 -1.84 107.32 104.34 1fie s GLY 719 Ca 0.06 0.48 -0.25 0.00 0.00 0.00 0.00 44.72 45.00 1fie s GLY 719 CO 0.04 1.60 1.09 -1.83 0.00 0.00 0.00 173.10 174.00 1fie s GLU 720 N -2.32 1.02 -0.29 2.90 -1.05 -1.26 -2.15 118.70 115.55 1fie s GLU 720 Ca 0.18 -0.62 -0.15 0.00 -0.15 0.00 0.00 54.97 54.24 1fie s GLU 720 Cb 0.03 0.31 0.11 0.00 -0.44 0.00 0.00 34.13 34.14 1fie s GLU 720 CO -0.03 -0.47 0.78 -1.17 0.95 0.00 0.00 175.26 175.32 1fie s LEU 721 N -3.25 -0.84 -0.45 1.83 2.96 -0.84 -4.63 118.68 113.46 1fie s LEU 721 Ca 0.19 1.29 -0.23 0.00 -0.22 0.00 0.00 54.13 55.16 1fie s LEU 721 Cb -0.01 2.15 0.03 0.00 0.50 0.00 0.00 46.19 48.86 1fie s LEU 721 CO 0.02 -0.20 0.77 -1.81 -1.32 0.00 0.00 176.35 173.82 1fie s ASP 722 N 1.86 6.40 0.22 3.68 1.11 -1.26 -1.02 116.67 127.66 1fie s ASP 722 Ca -0.08 -0.14 0.05 0.00 0.18 0.00 0.00 52.55 52.56 1fie s ASP 722 Cb -0.06 -2.38 -0.03 0.00 1.07 0.00 0.00 42.92 41.52 1fie s ASP 722 CO -0.18 -0.91 0.33 0.68 1.18 0.00 0.00 175.17 176.27 1fie s VAL 723 N 3.25 5.21 -0.43 -1.27 -7.23 -0.09 -4.94 120.40 114.89 1fie s VAL 723 Ca 0.29 -0.96 0.03 0.00 -1.81 0.00 0.00 61.98 59.53 1fie s VAL 723 Cb -0.12 -3.80 0.12 0.00 0.56 0.00 0.00 36.38 33.14 1fie s VAL 723 CO 0.22 -0.28 0.18 -1.58 -0.31 0.00 0.00 175.10 173.33 1fie s GLN 724 N -3.82 1.55 -0.60 4.82 2.00 -1.26 -0.42 119.66 121.93 1fie s GLN 724 Ca 0.34 -2.12 -0.18 0.00 -2.00 0.00 0.00 55.36 51.41 1fie s GLN 724 Cb -0.09 -2.92 0.12 0.00 0.80 0.00 0.00 33.01 30.91 1fie s GLN 724 CO 0.29 -1.06 0.66 0.42 -0.50 0.00 0.00 175.29 175.09 1fie s ILE 725 N 0.38 4.97 0.11 -2.34 1.01 -0.58 -4.70 121.20 120.04 1fie s ILE 725 Ca 0.15 -1.23 0.01 0.00 0.00 0.00 0.00 60.65 59.58 1fie s ILE 725 Cb -0.23 -4.45 0.02 0.00 0.01 0.00 0.00 42.46 37.81 1fie s ILE 725 CO -0.05 -1.06 0.15 0.00 0.00 0.00 0.00 174.94 173.99 1fie n GLN 726 N 5.91 0.74 0.00 2.79 0.00 0.24 0.04 117.38 127.10 1fie n GLN 726 Ca -0.09 -0.51 0.04 0.00 0.00 0.00 0.00 57.00 56.44 1fie n GLN 726 Cb 0.42 -0.07 0.23 0.00 0.00 0.00 0.00 30.24 30.82 1fie n GLN 726 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60