#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1fty n SER 14 N 0.00 0.00 -3.09 4.38 2.88 -1.26 -4.97 113.62 111.56 1fty n SER 14 Ca 0.00 0.00 -0.36 0.00 -1.33 0.00 0.00 58.87 57.18 1fty n SER 14 Cb 0.00 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1fty n SER 14 CO 0.00 0.00 0.00 0.55 -1.23 0.00 0.00 175.04 174.36 1fty n VAL 15 N -1.28 4.49 -0.21 2.46 3.14 -1.26 -4.42 118.33 121.25 1fty n VAL 15 Ca 0.00 -4.30 -0.05 0.00 -2.96 0.00 0.00 64.34 57.03 1fty n VAL 15 Cb 0.00 -1.62 0.17 0.00 -1.06 0.00 0.00 33.84 31.33 1fty n VAL 15 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 1fty n ARG 16 N 0.55 2.52 0.00 1.45 1.74 -1.26 -4.99 116.66 116.67 1fty n ARG 16 Ca 0.53 -1.81 0.00 0.00 -0.77 0.00 0.00 57.85 55.80 1fty n ARG 16 Cb 0.34 -1.82 0.00 0.00 -1.02 0.00 0.00 32.46 29.95 1fty n ARG 16 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1fty n GLY 17 N -0.05 -2.56 3.86 -0.13 0.00 -1.26 -1.32 105.19 103.73 1fty n GLY 17 Ca 0.26 -1.96 -0.36 0.00 0.00 0.00 0.00 46.02 43.96 1fty n GLY 17 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fty s LEU 18 N 0.00 4.40 -0.98 0.99 2.01 -1.26 -4.70 118.68 119.14 1fty s LEU 18 Ca 0.00 0.86 -0.01 0.00 0.01 0.00 0.00 54.13 54.98 1fty s LEU 18 Cb 0.00 -2.81 0.31 0.00 0.01 0.00 0.00 46.19 43.70 1fty s LEU 18 CO 0.00 0.24 1.51 0.00 1.01 0.00 0.00 176.35 179.11 1fty n ALA 19 N 1.28 5.40 -1.62 4.21 0.00 -1.26 -3.80 120.51 124.72 1fty n ALA 19 Ca -0.11 -4.72 -0.39 0.00 0.00 0.00 0.00 53.44 48.23 1fty n ALA 19 Cb 0.52 -2.02 0.04 0.00 0.00 0.00 0.00 19.45 17.99 1fty n ALA 19 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fty n GLY 20 N 0.60 -0.25 0.19 0.00 0.00 -1.26 -4.86 105.19 99.61 1fty n GLY 20 Ca 0.35 -0.06 -0.14 0.00 0.00 0.00 0.00 46.02 46.16 1fty n GLY 20 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1fty h VAL 21 N 0.80 0.72 -0.65 1.61 2.07 -2.00 -2.01 116.25 116.80 1fty h VAL 21 Ca -0.48 -0.13 -0.06 0.00 0.82 0.00 0.00 66.70 66.85 1fty h VAL 21 Cb 1.35 0.80 -0.03 0.00 -1.52 0.00 0.00 31.29 31.89 1fty h VAL 21 CO 0.53 0.03 0.15 -0.33 0.02 0.00 0.00 177.57 177.96 1fty h GLU 22 N -0.47 1.03 0.00 1.57 3.07 -2.00 -3.13 114.58 114.65 1fty h GLU 22 Ca -0.04 -0.24 -0.15 0.00 -0.50 0.00 0.00 59.36 58.43 1fty h GLU 22 Cb 0.35 -0.14 -0.02 0.00 -0.84 0.00 0.00 28.75 28.10 1fty h GLU 22 CO 0.07 0.91 -0.72 -0.91 -1.40 0.00 0.00 179.01 176.97 1fty h ASN 23 N 0.98 0.00 0.08 1.42 4.21 -1.94 -1.43 115.58 118.91 1fty h ASN 23 Ca 0.21 0.00 -0.16 0.00 1.21 0.00 0.00 56.30 57.55 1fty h ASN 23 Cb 0.35 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.55 1fty h ASN 23 CO 0.00 0.72 -0.57 0.58 -1.29 0.00 0.00 177.43 176.87 1fty h VAL 24 N 0.00 1.33 -0.30 2.81 2.07 -1.38 -0.31 116.25 120.48 1fty h VAL 24 Ca -0.01 -1.84 -0.09 0.00 0.82 0.00 0.00 66.70 65.58 1fty h VAL 24 Cb 1.39 1.83 -0.01 0.00 -1.52 0.00 0.00 31.29 32.98 1fty h VAL 24 CO 0.09 0.57 -0.15 0.74 0.02 0.00 0.00 177.57 178.84 1fty h THR 25 N 0.38 1.29 -0.64 2.57 2.02 -1.51 -1.76 112.91 115.27 1fty h THR 25 Ca 0.00 -1.26 -0.03 0.00 0.77 0.00 0.00 66.41 65.89 1fty h THR 25 Cb 1.11 1.48 -0.03 0.00 -1.74 0.00 0.00 68.15 68.98 1fty h THR 25 CO 0.10 0.40 0.29 -0.08 0.37 0.00 0.00 175.52 176.61 1fty h GLU 26 N 0.38 0.94 -0.05 6.66 4.57 -1.15 -2.74 114.58 123.19 1fty h GLU 26 Ca 0.06 -0.15 -0.00 0.00 -1.18 0.00 0.00 59.36 58.09 1fty h GLU 26 Cb 0.68 -0.16 -0.00 0.00 -0.16 0.00 0.00 28.75 29.10 1fty h GLU 26 CO 0.05 0.76 0.03 -0.07 -1.18 0.00 0.00 179.01 178.60 1fty h LEU 27 N 0.89 0.06 -0.60 1.64 4.07 -0.93 -2.80 115.31 117.65 1fty h LEU 27 Ca 0.22 -0.05 0.09 0.00 0.08 0.00 0.00 57.88 58.22 1fty h LEU 27 Cb 0.15 -0.02 -0.07 0.00 1.08 0.00 0.00 40.66 41.80 1fty h LEU 27 CO -0.02 0.09 0.23 0.11 -1.08 0.00 0.00 178.44 177.76 1fty h LYS 28 N 0.03 0.40 0.00 1.13 1.57 -1.15 0.24 116.57 118.79 1fty h LYS 28 Ca 0.02 -0.02 -0.10 0.00 -1.87 0.00 0.00 60.65 58.67 1fty h LYS 28 Cb 0.04 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.25 1fty h LYS 28 CO -0.00 0.27 -0.48 1.57 -0.57 0.00 0.00 179.45 180.24 1fty h LYS 29 N 0.41 0.00 0.00 3.15 2.10 -1.43 -1.99 116.57 118.81 1fty h LYS 29 Ca 0.30 0.00 -0.16 0.00 -2.00 0.00 0.00 60.65 58.80 1fty h LYS 29 Cb 0.37 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.67 1fty h LYS 29 CO -0.30 0.48 -0.74 -0.91 -2.00 0.00 0.00 179.45 175.98 1fty h ASN 30 N 0.00 0.00 -0.43 7.07 2.35 -1.11 0.85 115.58 124.31 1fty h ASN 30 Ca -0.00 0.00 -0.07 0.00 -0.55 0.00 0.00 56.30 55.68 1fty h ASN 30 Cb 0.89 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.24 1fty h ASN 30 CO 0.06 0.74 0.01 0.15 -1.65 0.00 0.00 177.43 176.74 1fty h PHE 31 N 0.00 0.81 -0.44 1.19 3.57 -0.65 -2.44 116.94 118.99 1fty h PHE 31 Ca -0.01 -0.14 -0.13 0.00 3.53 0.00 0.00 57.97 61.22 1fty h PHE 31 Cb 1.38 -0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.90 1fty h PHE 31 CO 0.00 0.81 -0.24 -0.91 -2.23 0.00 0.00 178.31 175.74 1fty h ASN 32 N 0.59 0.94 0.11 0.41 2.35 -1.10 -1.92 115.58 116.95 1fty h ASN 32 Ca 0.12 -0.36 0.02 0.00 -0.55 0.00 0.00 56.30 55.53 1fty h ASN 32 Cb 0.48 -0.26 -0.04 0.00 0.05 0.00 0.00 38.32 38.55 1fty h ASN 32 CO 0.02 1.13 -0.28 -0.09 -1.65 0.00 0.00 177.43 176.56 1fty h ARG 33 N 0.79 -0.47 -0.48 0.81 2.43 -0.66 -2.17 114.38 114.62 1fty h ARG 33 Ca 0.10 0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.28 1fty h ARG 33 Cb 0.80 0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 30.43 1fty h ARG 33 CO 0.07 -0.31 0.22 0.45 -1.51 0.00 0.00 179.97 178.88 1fty h HIS 34 N -0.49 0.66 -0.64 2.20 3.86 -1.37 0.45 115.15 119.82 1fty h HIS 34 Ca 0.03 -0.02 -0.06 0.00 -1.16 0.00 0.00 60.37 59.17 1fty h HIS 34 Cb 0.52 -0.21 -0.03 0.00 1.06 0.00 0.00 27.41 28.76 1fty h HIS 34 CO -0.26 0.49 0.15 1.25 0.86 0.00 0.00 177.93 180.43 1fty h LEU 35 N 0.67 0.94 0.00 2.43 5.85 -1.07 0.27 115.31 124.40 1fty h LEU 35 Ca 0.17 -0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.70 1fty h LEU 35 Cb 0.09 -0.25 0.00 0.00 0.37 0.00 0.00 40.66 40.87 1fty h LEU 35 CO -0.02 0.91 -0.01 -0.74 -0.34 0.00 0.00 178.44 178.24 1fty h HIS 36 N 0.95 0.00 -0.14 1.25 2.76 -0.80 -2.00 115.15 117.16 1fty h HIS 36 Ca 0.20 0.00 -0.14 0.00 -2.20 0.00 0.00 60.37 58.23 1fty h HIS 36 Cb 0.34 0.00 -0.01 0.00 1.55 0.00 0.00 27.41 29.29 1fty h HIS 36 CO 0.02 0.00 -0.52 0.74 -1.30 0.00 0.00 177.93 176.88 1fty h PHE 37 N -0.17 0.49 0.08 5.26 0.04 -0.26 -1.13 116.94 121.25 1fty h PHE 37 Ca 0.00 -0.17 -0.36 0.00 2.80 0.00 0.00 57.97 60.24 1fty h PHE 37 Cb 0.01 -0.10 -0.03 0.00 2.20 0.00 0.00 35.95 38.03 1fty h PHE 37 CO -0.00 0.83 -2.07 2.41 -0.60 0.00 0.00 178.31 178.88 1fty n THR 38 N -3.96 1.68 0.12 -1.55 -1.04 -0.60 -4.41 114.28 104.53 1fty n THR 38 Ca -0.02 -0.57 0.11 0.00 -2.04 0.00 0.00 64.05 61.53 1fty n THR 38 Cb 0.57 -1.69 -0.01 0.00 -1.82 0.00 0.00 70.33 67.38 1fty n THR 38 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1fty n LEU 39 N -3.54 0.74 -3.51 -4.42 4.32 0.84 -4.99 117.00 106.44 1fty n LEU 39 Ca -0.36 0.28 -0.24 0.00 -0.02 0.00 0.00 56.01 55.67 1fty n LEU 39 Cb 1.00 -0.06 0.05 0.00 -1.62 0.00 0.00 43.42 42.79 1fty n LEU 39 CO 0.35 -0.16 -0.03 0.52 -1.22 0.00 0.00 177.39 176.86 1fty n VAL 40 N -2.59 -6.97 -4.26 4.08 0.31 -0.43 -4.99 118.33 103.49 1fty n VAL 40 Ca -0.00 -1.05 -0.14 0.00 -0.01 0.00 0.00 64.34 63.14 1fty n VAL 40 Cb 0.54 -5.13 -0.10 0.00 -0.91 0.00 0.00 33.84 28.25 1fty n VAL 40 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1fty s LYS 41 N -5.36 1.26 0.02 5.55 -0.14 -0.77 -5.03 119.74 115.27 1fty s LYS 41 Ca 0.40 -1.66 0.04 0.00 -1.36 0.00 0.00 55.97 53.38 1fty s LYS 41 Cb -0.10 -0.05 -0.02 0.00 -1.68 0.00 0.00 37.83 35.98 1fty s LYS 41 CO 0.81 -0.30 -0.11 0.16 -0.76 0.00 0.00 175.35 175.15 1fty s ASP 42 N -3.22 1.32 0.48 2.83 1.47 -1.26 -4.09 116.67 114.19 1fty s ASP 42 Ca 0.35 -0.34 0.42 0.00 1.18 0.00 0.00 52.55 54.16 1fty s ASP 42 Cb 0.07 -0.10 1.44 0.00 -0.34 0.00 0.00 42.92 44.00 1fty s ASP 42 CO 0.11 0.04 1.32 0.54 0.68 0.00 0.00 175.17 177.86 1fty n ARG 43 N 2.26 0.00 0.06 2.11 5.12 -1.26 -0.49 116.66 124.46 1fty n ARG 43 Ca -0.17 0.93 0.12 0.00 -1.93 0.00 0.00 57.85 56.80 1fty n ARG 43 Cb 0.56 -2.15 0.46 0.00 -1.16 0.00 0.00 32.46 30.17 1fty n ARG 43 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1fty n ASN 44 N -3.60 0.37 0.00 0.55 3.02 -1.26 -3.54 115.26 110.80 1fty n ASN 44 Ca 0.37 0.56 0.00 0.00 -0.03 0.00 0.00 54.58 55.48 1fty n ASN 44 Cb 1.71 -0.65 0.00 0.00 -0.61 0.00 0.00 39.78 40.23 1fty n ASN 44 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 1fty n VAL 45 N -1.87 0.13 -2.32 2.41 0.24 0.36 -5.06 118.33 112.23 1fty n VAL 45 Ca 0.05 -0.36 -0.41 0.00 -2.04 0.00 0.00 64.34 61.58 1fty n VAL 45 Cb 0.30 1.25 -0.03 0.00 -1.47 0.00 0.00 33.84 33.88 1fty n VAL 45 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1fty s ALA 46 N -0.13 3.45 0.36 2.33 0.00 -1.09 -4.94 121.76 121.73 1fty s ALA 46 Ca 0.00 1.04 0.08 0.00 0.00 0.00 0.00 51.96 53.08 1fty s ALA 46 Cb 0.00 -3.41 -0.04 0.00 0.00 0.00 0.00 23.12 19.67 1fty s ALA 46 CO 0.00 -0.38 0.14 0.95 0.00 0.00 0.00 175.76 176.47 1fty s THR 47 N -0.78 2.79 0.41 0.00 -4.23 -1.26 -4.97 115.64 107.60 1fty s THR 47 Ca 0.49 -1.72 0.21 0.00 -1.18 0.00 0.00 61.69 59.49 1fty s THR 47 Cb -0.35 -2.96 0.41 0.00 1.34 0.00 0.00 72.50 70.94 1fty s THR 47 CO 0.43 -0.14 1.77 -0.65 -0.54 0.00 0.00 174.62 175.50 1fty h PRO 48 N 1.53 0.33 -0.53 3.99 0.11 -1.99 0.38 132.00 135.83 1fty h PRO 48 Ca -0.43 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 65.58 1fty h PRO 48 Cb 1.25 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.27 1fty h PRO 48 CO 0.65 0.22 -0.00 -0.09 -0.21 0.00 0.00 178.00 178.57 1fty h ARG 49 N 0.34 0.90 -0.41 1.05 2.43 -1.96 -0.14 114.38 116.59 1fty h ARG 49 Ca 0.59 -0.26 -0.06 0.00 -0.81 0.00 0.00 59.98 59.44 1fty h ARG 49 Cb 1.59 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 31.03 1fty h ARG 49 CO -0.27 0.89 0.02 -0.44 -1.51 0.00 0.00 179.97 178.67 1fty h ASP 50 N 0.83 0.69 -0.55 -3.80 3.45 -0.67 -2.46 116.42 113.91 1fty h ASP 50 Ca 0.16 -0.29 -0.01 0.00 0.43 0.00 0.00 57.03 57.32 1fty h ASP 50 Cb 0.49 -0.19 -0.03 0.00 -0.56 0.00 0.00 39.33 39.05 1fty h ASP 50 CO 0.02 0.82 0.33 1.88 -1.57 0.00 0.00 179.24 180.72 1fty h TYR 51 N 0.55 0.75 -0.63 4.55 0.05 -0.96 -1.07 116.97 120.19 1fty h TYR 51 Ca 0.12 -0.00 -0.09 0.00 0.05 0.00 0.00 58.73 58.81 1fty h TYR 51 Cb 0.45 -0.25 -0.02 0.00 1.01 0.00 0.00 36.73 37.92 1fty h TYR 51 CO 0.03 0.51 0.05 -0.92 -1.05 0.00 0.00 178.16 176.79 1fty h TYR 52 N 0.78 1.17 -0.26 4.88 3.20 -0.74 -2.65 116.97 123.35 1fty h TYR 52 Ca 0.20 -0.18 -0.16 0.00 3.14 0.00 0.00 58.73 61.73 1fty h TYR 52 Cb -0.01 -0.31 -0.01 0.00 1.54 0.00 0.00 36.73 37.94 1fty h TYR 52 CO 0.00 1.00 -0.50 0.74 -1.64 0.00 0.00 178.16 177.77 1fty h PHE 53 N 0.99 0.87 -0.51 -3.82 -1.00 -0.88 -0.20 116.94 112.39 1fty h PHE 53 Ca 0.19 -0.29 0.02 0.00 2.81 0.00 0.00 57.97 60.69 1fty h PHE 53 Cb 0.50 -0.17 -0.03 0.00 3.61 0.00 0.00 35.95 39.86 1fty h PHE 53 CO 0.04 1.06 0.32 0.00 -1.61 0.00 0.00 178.31 178.11 1fty h ALA 54 N 0.89 0.66 0.03 2.45 0.00 -1.18 0.73 119.26 122.83 1fty h ALA 54 Ca 0.02 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1fty h ALA 54 Cb 1.06 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1fty h ALA 54 CO 0.10 0.03 -0.02 1.25 0.00 0.00 0.00 179.25 180.62 1fty h LEU 55 N 0.63 -0.04 -0.52 0.00 5.85 -1.35 -1.00 115.31 118.88 1fty h LEU 55 Ca 0.20 -0.21 0.10 0.00 0.84 0.00 0.00 57.88 58.80 1fty h LEU 55 Cb -0.01 0.01 -0.08 0.00 0.37 0.00 0.00 40.66 40.95 1fty h LEU 55 CO -0.08 0.19 0.06 0.00 -0.34 0.00 0.00 178.44 178.27 1fty h ALA 56 N 0.68 0.55 -0.39 1.25 0.00 -0.76 0.25 119.26 120.85 1fty h ALA 56 Ca -0.00 0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.97 1fty h ALA 56 Cb 0.25 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1fty h ALA 56 CO 0.01 -0.34 -0.04 0.45 0.00 0.00 0.00 179.25 179.32 1fty h HIS 57 N 0.18 0.67 -0.49 0.00 3.86 -0.75 0.29 115.15 118.92 1fty h HIS 57 Ca 0.26 -0.09 -0.10 0.00 -1.16 0.00 0.00 60.37 59.28 1fty h HIS 57 Cb 0.38 -0.19 -0.02 0.00 1.06 0.00 0.00 27.41 28.65 1fty h HIS 57 CO -0.27 0.66 -0.10 1.15 0.86 0.00 0.00 177.93 180.23 1fty h THR 58 N 0.59 1.27 -0.34 2.45 2.02 0.32 -2.37 112.91 116.85 1fty h THR 58 Ca 0.12 -1.23 -0.15 0.00 0.77 0.00 0.00 66.41 65.92 1fty h THR 58 Cb 0.43 1.06 -0.00 0.00 -1.74 0.00 0.00 68.15 67.90 1fty h THR 58 CO 0.02 0.43 -0.36 0.58 0.37 0.00 0.00 175.52 176.56 1fty h VAL 59 N 0.79 1.28 -0.13 3.16 2.07 -0.27 -2.98 116.25 120.17 1fty h VAL 59 Ca 0.13 -1.53 -0.00 0.00 0.82 0.00 0.00 66.70 66.11 1fty h VAL 59 Cb 0.66 1.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.89 1fty h VAL 59 CO 0.05 0.51 0.06 -0.09 0.02 0.00 0.00 177.57 178.11 1fty h ARG 60 N 0.64 0.17 -0.74 1.57 2.43 -0.87 -2.03 114.38 115.55 1fty h ARG 60 Ca 0.05 -0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.24 1fty h ARG 60 Cb 0.95 -0.04 -0.05 0.00 -0.42 0.00 0.00 29.97 30.42 1fty h ARG 60 CO 0.09 0.14 0.47 -0.44 -1.51 0.00 0.00 179.97 178.72 1fty h ASP 61 N 0.18 0.77 0.27 -3.80 3.45 -1.26 -2.39 116.42 113.64 1fty h ASP 61 Ca 0.05 -0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.51 1fty h ASP 61 Cb 0.03 -0.17 0.00 0.00 -0.56 0.00 0.00 39.33 38.63 1fty h ASP 61 CO -0.01 0.53 0.00 0.45 -1.57 0.00 0.00 179.24 178.65 1fty h HIS 62 N 0.92 0.00 -0.02 4.55 3.86 -1.42 -3.02 115.15 120.02 1fty h HIS 62 Ca 0.30 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.51 1fty h HIS 62 Cb 0.02 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.49 1fty h HIS 62 CO -0.04 0.00 -0.03 1.47 0.86 0.00 0.00 177.93 180.19 1fty n LEU 63 N -2.93 2.03 -0.08 2.43 -0.00 -0.91 -4.44 117.00 113.10 1fty n LEU 63 Ca -0.02 -0.97 -0.13 0.00 -0.00 0.00 0.00 56.01 54.89 1fty n LEU 63 Cb 0.13 0.00 -0.01 0.00 -0.00 0.00 0.00 43.42 43.53 1fty n LEU 63 CO 0.20 0.38 0.49 -0.37 -0.00 0.00 0.00 177.39 178.08 1fty h VAL 64 N 2.48 1.28 -0.27 1.47 -1.51 -1.45 0.13 116.25 118.38 1fty h VAL 64 Ca 0.00 -1.67 0.03 0.00 -1.23 0.00 0.00 66.70 63.83 1fty h VAL 64 Cb 0.54 1.56 -0.03 0.00 -2.13 0.00 0.00 31.29 31.23 1fty h VAL 64 CO 0.00 0.55 0.07 1.23 -1.23 0.00 0.00 177.57 178.18 1fty h GLY 65 N 0.79 0.31 1.28 5.19 0.00 -1.78 -0.14 103.07 108.72 1fty h GLY 65 Ca 0.03 -0.03 -0.13 0.00 0.00 0.00 0.00 47.33 47.20 1fty h GLY 65 CO 0.11 0.00 -0.31 3.21 0.00 0.00 0.00 176.54 179.55 1fty h ARG 66 N 0.17 0.81 -0.51 4.80 3.08 -1.77 -2.63 114.38 118.33 1fty h ARG 66 Ca 0.12 -0.37 0.04 0.00 0.07 0.00 0.00 59.98 59.84 1fty h ARG 66 Cb 0.11 -0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.11 1fty h ARG 66 CO -0.15 1.00 0.26 2.35 -1.07 0.00 0.00 179.97 182.37 1fty h TRP 67 N 0.68 0.48 -0.30 3.04 7.01 -0.24 0.98 115.95 127.60 1fty h TRP 67 Ca 0.08 0.02 -0.08 0.00 2.11 0.00 0.00 58.89 61.02 1fty h TRP 67 Cb 0.85 -0.14 -0.01 0.00 -2.10 0.00 0.00 29.16 27.76 1fty h TRP 67 CO 0.05 0.24 -0.10 0.82 -2.79 0.00 0.00 178.44 176.65 1fty h ILE 68 N 0.51 1.29 -0.02 2.65 2.04 -0.97 -2.49 117.51 120.52 1fty h ILE 68 Ca 0.22 -1.17 -0.13 0.00 1.00 0.00 0.00 64.86 64.78 1fty h ILE 68 Cb 0.12 1.41 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 1fty h ILE 68 CO -0.15 0.38 -0.59 0.08 0.00 0.00 0.00 178.15 177.87 1fty h ARG 69 N 0.37 0.06 0.10 2.37 0.11 -1.26 -1.07 114.38 115.07 1fty h ARG 69 Ca 0.07 -0.04 -0.01 0.00 0.10 0.00 0.00 59.98 60.11 1fty h ARG 69 Cb 0.61 0.01 0.00 0.00 1.11 0.00 0.00 29.97 31.69 1fty h ARG 69 CO 0.04 0.63 -0.05 1.15 0.10 0.00 0.00 179.97 181.84 1fty h THR 70 N 0.05 1.02 -0.63 0.08 2.02 -0.75 0.11 112.91 114.80 1fty h THR 70 Ca -0.01 -0.44 -0.04 0.00 0.77 0.00 0.00 66.41 66.69 1fty h THR 70 Cb 1.05 1.30 -0.03 0.00 -1.74 0.00 0.00 68.15 68.73 1fty h THR 70 CO 0.08 0.11 0.22 1.56 0.37 0.00 0.00 175.52 177.86 1fty h GLN 71 N -0.34 0.95 -0.45 6.66 1.08 -1.41 -1.84 115.11 119.75 1fty h GLN 71 Ca -0.01 -0.17 -0.07 0.00 -1.45 0.00 0.00 58.65 56.95 1fty h GLN 71 Cb 0.28 -0.15 -0.02 0.00 -0.05 0.00 0.00 27.48 27.54 1fty h GLN 71 CO 0.02 0.79 0.01 0.37 -0.95 0.00 0.00 178.83 179.07 1fty h GLN 72 N 0.92 0.79 -0.00 1.46 5.75 -1.10 -2.77 115.11 120.15 1fty h GLN 72 Ca 0.21 -0.25 0.03 0.00 -0.15 0.00 0.00 58.65 58.50 1fty h GLN 72 Cb 0.22 -0.07 -0.05 0.00 1.07 0.00 0.00 27.48 28.65 1fty h GLN 72 CO -0.01 0.84 -0.33 1.25 -2.65 0.00 0.00 178.83 177.93 1fty h HIS 73 N 0.63 -0.92 -0.24 3.99 2.76 -0.20 -0.21 115.15 120.97 1fty h HIS 73 Ca 0.13 0.03 0.07 0.00 -2.20 0.00 0.00 60.37 58.40 1fty h HIS 73 Cb 0.48 0.41 -0.01 0.00 1.55 0.00 0.00 27.41 29.84 1fty h HIS 73 CO 0.04 -0.42 0.19 1.88 -1.30 0.00 0.00 177.93 178.32 1fty h TYR 74 N -0.49 0.00 -0.19 5.26 0.05 -1.30 -0.63 116.97 119.67 1fty h TYR 74 Ca 0.06 0.00 -0.21 0.00 0.05 0.00 0.00 58.73 58.63 1fty h TYR 74 Cb 0.57 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.32 1fty h TYR 74 CO -0.36 0.00 -0.70 -0.92 -1.05 0.00 0.00 178.16 175.13 1fty h TYR 75 N 0.00 1.06 0.47 4.88 3.20 -0.79 0.41 116.97 126.20 1fty h TYR 75 Ca 0.11 -0.44 -0.02 0.00 3.14 0.00 0.00 58.73 61.52 1fty h TYR 75 Cb 0.50 -0.17 0.00 0.00 1.54 0.00 0.00 36.73 38.60 1fty h TYR 75 CO 0.00 1.27 -0.23 0.93 -1.64 0.00 0.00 178.16 178.49 1fty h GLU 76 N 0.57 -0.61 0.00 1.82 4.39 -0.14 -3.32 114.58 117.29 1fty h GLU 76 Ca -0.03 0.04 -0.08 0.00 0.34 0.00 0.00 59.36 59.63 1fty h GLU 76 Cb 1.32 0.14 -0.01 0.00 -0.10 0.00 0.00 28.75 30.10 1fty h GLU 76 CO 0.15 -0.41 -0.37 0.87 -1.16 0.00 0.00 179.01 178.09 1fty h LYS 77 N -1.12 0.00 -5.87 2.33 1.79 -1.30 -3.48 116.57 108.91 1fty h LYS 77 Ca -0.07 0.00 -0.31 0.00 -2.18 0.00 0.00 60.65 58.10 1fty h LYS 77 Cb 0.49 0.00 0.10 0.00 -1.58 0.00 0.00 32.23 31.24 1fty h LYS 77 CO 0.11 0.37 -0.77 -3.47 -1.08 0.00 0.00 179.45 174.60 1fty n ASP 78 N -4.09 -6.15 -4.58 0.86 2.03 0.13 -5.01 116.55 99.74 1fty n ASP 78 Ca -0.02 -0.76 -0.26 0.00 0.52 0.00 0.00 54.79 54.27 1fty n ASP 78 Cb 0.40 -4.18 0.12 0.00 -0.72 0.00 0.00 41.12 36.74 1fty n ASP 78 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1fty s PRO 79 N -4.90 1.52 0.22 -0.67 0.04 -1.26 -5.00 135.00 124.95 1fty s PRO 79 Ca 0.36 -0.66 -0.30 0.00 0.04 0.00 0.00 61.00 60.43 1fty s PRO 79 Cb -0.09 -2.14 -0.10 0.00 0.04 0.00 0.00 34.50 32.20 1fty s PRO 79 CO 0.81 -1.67 1.45 0.21 0.04 0.00 0.00 177.00 177.84 1fty s LYS 80 N -5.39 4.27 -0.13 4.56 2.20 -1.26 -4.97 119.74 119.01 1fty s LYS 80 Ca 0.67 2.28 -0.09 0.00 -0.36 0.00 0.00 55.97 58.46 1fty s LYS 80 Cb -0.06 -3.13 -0.05 0.00 -1.51 0.00 0.00 37.83 33.08 1fty s LYS 80 CO 0.47 -0.44 0.19 1.03 -0.36 0.00 0.00 175.35 176.23 1fty s ARG 81 N 0.04 3.79 -0.23 4.03 3.00 -0.20 -4.52 118.95 124.86 1fty s ARG 81 Ca 0.61 -0.07 -0.07 0.00 0.00 0.00 0.00 55.73 56.21 1fty s ARG 81 Cb -0.41 -3.28 -0.03 0.00 0.00 0.00 0.00 34.95 31.22 1fty s ARG 81 CO 0.40 0.58 0.06 0.42 0.00 0.00 0.00 175.30 176.75 1fty s ILE 82 N -0.48 4.30 -0.33 1.52 -1.09 -0.35 -1.63 121.20 123.13 1fty s ILE 82 Ca 0.14 -0.18 -0.03 0.00 -2.23 0.00 0.00 60.65 58.34 1fty s ILE 82 Cb -0.12 -2.99 0.06 0.00 -1.58 0.00 0.00 42.46 37.82 1fty s ILE 82 CO 0.03 0.37 0.07 -0.31 -1.23 0.00 0.00 174.94 173.87 1fty s TYR 83 N 1.34 3.31 -0.70 3.97 2.02 0.11 -0.09 117.35 127.32 1fty s TYR 83 Ca 0.05 -1.81 -0.19 0.00 -0.37 0.00 0.00 57.07 54.75 1fty s TYR 83 Cb -0.15 -2.35 0.12 0.00 -0.40 0.00 0.00 41.96 39.18 1fty s TYR 83 CO 0.03 -0.81 0.84 -0.47 -1.57 0.00 0.00 175.55 173.57 1fty s TYR 84 N 1.28 3.06 -0.11 2.71 5.04 -0.33 -0.66 117.35 128.35 1fty s TYR 84 Ca -0.02 -1.11 -0.24 0.00 -2.44 0.00 0.00 57.07 53.26 1fty s TYR 84 Cb -0.20 -4.09 -0.03 0.00 0.35 0.00 0.00 41.96 37.99 1fty s TYR 84 CO -0.00 -1.35 0.76 -0.51 -1.34 0.00 0.00 175.55 173.10 1fty s LEU 85 N 2.60 4.25 -0.17 6.97 1.02 -0.87 -1.70 118.68 130.77 1fty s LEU 85 Ca 0.18 1.17 -0.23 0.00 0.02 0.00 0.00 54.13 55.28 1fty s LEU 85 Cb -0.17 -3.15 0.06 0.00 0.02 0.00 0.00 46.19 42.95 1fty s LEU 85 CO 0.02 -0.24 0.60 -0.55 0.02 0.00 0.00 176.35 176.20 1fty s SER 86 N 0.98 -0.60 0.00 2.29 0.15 -0.95 -2.10 113.70 113.46 1fty s SER 86 Ca 0.38 1.03 0.30 0.00 0.70 0.00 0.00 55.95 58.36 1fty s SER 86 Cb -0.17 1.03 1.47 0.00 -1.71 0.00 0.00 66.02 66.63 1fty s SER 86 CO 0.16 -0.31 1.98 0.18 1.20 0.00 0.00 173.24 176.45 1fty n LEU 87 N 2.26 0.77 -3.89 3.45 4.32 -1.26 -4.20 117.00 118.45 1fty n LEU 87 Ca -0.15 -0.26 -0.13 0.00 -0.02 0.00 0.00 56.01 55.45 1fty n LEU 87 Cb 0.56 -0.00 -0.14 0.00 -1.62 0.00 0.00 43.42 42.22 1fty n LEU 87 CO 0.11 0.13 -0.37 -1.61 -1.22 0.00 0.00 177.39 174.43 1fty s GLU 88 N -2.00 0.13 -0.33 3.23 2.02 -1.26 -4.74 118.70 115.75 1fty s GLU 88 Ca 0.43 -0.04 0.01 0.00 0.02 0.00 0.00 54.97 55.39 1fty s GLU 88 Cb 0.21 -0.14 0.15 0.00 0.10 0.00 0.00 34.13 34.45 1fty s GLU 88 CO 0.35 0.02 0.34 -0.06 0.02 0.00 0.00 175.26 175.93 1fty s PHE 89 N 0.04 -0.37 -1.28 1.61 0.40 0.66 -4.64 117.98 114.40 1fty s PHE 89 Ca -0.00 -0.52 -0.16 0.00 -0.60 0.00 0.00 56.93 55.65 1fty s PHE 89 Cb -0.02 -0.44 0.11 0.00 0.51 0.00 0.00 43.02 43.19 1fty s PHE 89 CO -0.00 -0.95 1.67 0.98 0.70 0.00 0.00 175.22 177.62 1fty n TYR 90 N 4.75 4.64 -0.04 0.36 4.19 0.02 -3.68 117.16 127.41 1fty n TYR 90 Ca 0.05 -3.03 -0.17 0.00 3.31 0.00 0.00 57.90 58.06 1fty n TYR 90 Cb 0.46 -2.45 -0.06 0.00 0.49 0.00 0.00 39.34 37.78 1fty n TYR 90 CO 0.00 0.00 0.00 0.52 0.91 0.00 0.00 176.86 178.29 1fty h MET 91 N 7.24 0.83 0.00 2.98 2.86 -1.80 -3.41 114.93 123.63 1fty h MET 91 Ca 0.41 -0.63 0.00 0.00 -2.06 0.00 0.00 59.70 57.42 1fty h MET 91 Cb 0.85 0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.62 1fty h MET 91 CO 1.42 1.24 0.00 0.41 1.06 0.00 0.00 176.91 181.04 1fty n GLY 92 N 0.61 -1.32 3.78 8.32 0.00 -1.08 -4.82 105.19 110.68 1fty n GLY 92 Ca -0.07 -1.25 -0.35 0.00 0.00 0.00 0.00 46.02 44.35 1fty n GLY 92 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1fty s ARG 93 N 0.00 3.47 0.00 1.61 0.52 -1.26 -2.55 118.95 120.74 1fty s ARG 93 Ca 0.00 1.61 0.00 0.00 -0.52 0.00 0.00 55.73 56.82 1fty s ARG 93 Cb 0.00 -2.08 0.00 0.00 0.52 0.00 0.00 34.95 33.39 1fty s ARG 93 CO 0.00 -0.75 0.52 0.25 0.02 0.00 0.00 175.30 175.34 1fty n THR 94 N -1.13 0.05 0.27 0.02 -2.24 -1.26 -4.71 114.28 105.29 1fty n THR 94 Ca 0.11 -0.52 -0.13 0.00 -2.27 0.00 0.00 64.05 61.23 1fty n THR 94 Cb 0.51 0.99 -0.07 0.00 -2.10 0.00 0.00 70.33 69.65 1fty n THR 94 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1fty h LEU 95 N 0.00 -0.61 -0.23 3.22 5.85 -1.96 -2.70 115.31 118.88 1fty h LEU 95 Ca 0.00 -0.04 -0.00 0.00 0.84 0.00 0.00 57.88 58.67 1fty h LEU 95 Cb 0.03 0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 1fty h LEU 95 CO 0.00 -0.23 0.13 -0.61 -0.34 0.00 0.00 178.44 177.39 1fty h GLN 96 N -1.08 0.31 -0.93 1.25 4.15 -1.96 -2.01 115.11 114.84 1fty h GLN 96 Ca -0.07 -0.03 0.14 0.00 0.77 0.00 0.00 58.65 59.45 1fty h GLN 96 Cb 0.62 -0.06 -0.08 0.00 0.21 0.00 0.00 27.48 28.17 1fty h GLN 96 CO 0.12 0.26 0.59 -0.97 -1.93 0.00 0.00 178.83 176.90 1fty h ASN 97 N 0.27 0.74 -0.15 -0.69 -0.73 -1.84 0.13 115.58 113.31 1fty h ASN 97 Ca 0.08 0.05 -0.15 0.00 1.87 0.00 0.00 56.30 58.14 1fty h ASN 97 Cb 0.03 -0.10 -0.01 0.00 0.27 0.00 0.00 38.32 38.51 1fty h ASN 97 CO -0.01 0.38 -0.45 0.74 -0.37 0.00 0.00 177.43 177.71 1fty h THR 98 N 0.79 1.29 -0.51 -3.57 2.02 -1.10 -1.54 112.91 110.29 1fty h THR 98 Ca 0.47 -1.64 -0.07 0.00 0.77 0.00 0.00 66.41 65.94 1fty h THR 98 Cb 0.66 1.56 -0.02 0.00 -1.74 0.00 0.00 68.15 68.61 1fty h THR 98 CO -0.23 0.53 0.03 0.24 0.37 0.00 0.00 175.52 176.45 1fty h MET 99 N 0.56 0.88 -0.60 6.66 2.86 -0.47 -2.14 114.93 122.69 1fty h MET 99 Ca 0.04 -0.27 -0.05 0.00 -2.06 0.00 0.00 59.70 57.36 1fty h MET 99 Cb 1.00 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 32.54 1fty h MET 99 CO 0.09 0.90 0.17 0.28 1.06 0.00 0.00 176.91 179.41 1fty h VAL 100 N 0.75 1.25 0.00 -2.22 2.07 -0.64 0.41 116.25 117.87 1fty h VAL 100 Ca 0.15 -0.86 0.00 0.00 0.82 0.00 0.00 66.70 66.81 1fty h VAL 100 Cb 0.48 0.67 0.00 0.00 -1.52 0.00 0.00 31.29 30.92 1fty h VAL 100 CO 0.02 0.32 0.00 0.59 0.02 0.00 0.00 177.57 178.52 1fty n ASN 101 N -4.38 0.68 -0.62 0.57 4.13 -0.59 -3.00 115.26 112.04 1fty n ASN 101 Ca 0.03 0.58 0.06 0.00 1.68 0.00 0.00 54.58 56.94 1fty n ASN 101 Cb 0.22 -0.76 0.12 0.00 -1.54 0.00 0.00 39.78 37.83 1fty n ASN 101 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1fty n LEU 102 N -2.16 2.65 -3.70 3.41 4.32 -0.81 -1.10 117.00 119.61 1fty n LEU 102 Ca 0.05 -1.65 -0.25 0.00 -0.02 0.00 0.00 56.01 54.14 1fty n LEU 102 Cb 0.37 -0.16 0.06 0.00 -1.62 0.00 0.00 43.42 42.07 1fty n LEU 102 CO 0.27 0.62 0.14 0.00 -1.22 0.00 0.00 177.39 177.21 1fty n ALA 103 N 0.62 -1.49 0.41 -1.18 0.00 -0.39 -4.90 120.51 113.59 1fty n ALA 103 Ca 0.11 0.20 0.04 0.00 0.00 0.00 0.00 53.44 53.79 1fty n ALA 103 Cb 0.39 -4.32 -0.01 0.00 0.00 0.00 0.00 19.45 15.50 1fty n ALA 103 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1fty n LEU 104 N -4.70 0.96 -0.11 0.00 4.32 0.13 -4.55 117.00 113.05 1fty n LEU 104 Ca -0.06 -0.70 -0.05 0.00 -0.02 0.00 0.00 56.01 55.18 1fty n LEU 104 Cb 0.58 0.00 0.02 0.00 -1.62 0.00 0.00 43.42 42.40 1fty n LEU 104 CO 0.68 0.20 0.86 -0.08 -1.22 0.00 0.00 177.39 177.83 1fty h GLU 105 N 0.75 0.10 -0.30 3.23 4.81 -1.52 -1.01 114.58 120.65 1fty h GLU 105 Ca 0.00 -0.01 -0.15 0.00 -0.13 0.00 0.00 59.36 59.08 1fty h GLU 105 Cb 0.28 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.64 1fty h GLU 105 CO 0.00 0.07 -0.38 -0.91 -0.73 0.00 0.00 179.01 177.05 1fty h ASN 106 N 0.11 0.85 -0.46 1.04 2.35 -1.48 -0.89 115.58 117.10 1fty h ASN 106 Ca 0.18 -0.50 0.02 0.00 -0.55 0.00 0.00 56.30 55.45 1fty h ASN 106 Cb 0.24 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.34 1fty h ASN 106 CO -0.29 1.18 0.28 0.00 -1.65 0.00 0.00 177.43 176.94 1fty h ALA 107 N 0.70 0.58 -0.50 -0.83 0.00 -1.62 0.23 119.26 117.81 1fty h ALA 107 Ca 0.04 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.82 1fty h ALA 107 Cb 0.98 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 1fty h ALA 107 CO 0.09 -0.03 -0.12 0.00 0.00 0.00 0.00 179.25 179.20 1fty h ASP 109 N 0.84 0.59 0.71 0.00 1.82 -0.57 -0.93 116.42 118.88 1fty h ASP 109 Ca 0.13 -0.09 -0.03 0.00 -0.39 0.00 0.00 57.03 56.65 1fty h ASP 109 Cb 0.66 -0.15 0.01 0.00 0.68 0.00 0.00 39.33 40.52 1fty h ASP 109 CO 0.05 0.51 -0.34 -0.08 -1.61 0.00 0.00 179.24 177.77 1fty h GLU 110 N 0.62 -0.92 -0.69 0.28 4.57 -0.38 -2.18 114.58 115.89 1fty h GLU 110 Ca 0.17 0.06 0.14 0.00 -1.18 0.00 0.00 59.36 58.55 1fty h GLU 110 Cb 0.05 0.21 -0.10 0.00 -0.16 0.00 0.00 28.75 28.75 1fty h GLU 110 CO -0.03 -0.59 0.19 0.00 -1.18 0.00 0.00 179.01 177.41 1fty h ALA 111 N -1.05 0.88 -0.02 2.92 0.00 -1.09 0.10 119.26 121.01 1fty h ALA 111 Ca -0.10 0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.85 1fty h ALA 111 Cb 0.75 0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.70 1fty h ALA 111 CO 0.16 -0.29 -0.46 1.79 0.00 0.00 0.00 179.25 180.44 1fty h THR 112 N 0.31 1.34 -0.03 0.00 1.35 -1.23 -1.41 112.91 113.24 1fty h THR 112 Ca 0.38 -1.61 -0.00 0.00 -0.55 0.00 0.00 66.41 64.62 1fty h THR 112 Cb 0.59 1.84 -0.00 0.00 -1.73 0.00 0.00 68.15 68.85 1fty h THR 112 CO -0.44 0.47 0.01 0.22 -0.25 0.00 0.00 175.52 175.52 1fty h TYR 113 N 0.05 0.04 0.00 4.73 3.20 -0.29 0.63 116.97 125.33 1fty h TYR 113 Ca -0.00 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.85 1fty h TYR 113 Cb 0.84 -0.01 -0.00 0.00 1.54 0.00 0.00 36.73 39.10 1fty h TYR 113 CO 0.00 0.25 -0.06 1.96 -1.64 0.00 0.00 178.16 178.68 1fty h GLN 114 N -0.18 0.00 -0.01 1.82 4.20 -0.61 0.46 115.11 120.80 1fty h GLN 114 Ca 0.01 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.72 1fty h GLN 114 Cb 0.23 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.01 1fty h GLN 114 CO 0.00 0.06 -0.03 1.28 -0.67 0.00 0.00 178.83 179.47 1fty n LEU 115 N -3.83 0.66 -0.30 1.46 4.32 -0.56 -4.91 117.00 113.84 1fty n LEU 115 Ca -0.03 -0.18 -0.02 0.00 -0.02 0.00 0.00 56.01 55.77 1fty n LEU 115 Cb 0.15 -0.05 0.00 0.00 -1.62 0.00 0.00 43.42 41.90 1fty n LEU 115 CO 0.29 0.11 -0.02 0.61 -1.22 0.00 0.00 177.39 177.17 1fty n GLY 116 N 1.14 0.36 3.33 -0.72 0.00 0.16 -5.05 105.19 104.41 1fty n GLY 116 Ca 0.20 -0.78 -0.22 0.00 0.00 0.00 0.00 46.02 45.22 1fty n GLY 116 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fty s LEU 117 N -0.71 2.42 -0.40 0.99 1.43 0.21 -4.99 118.68 117.64 1fty s LEU 117 Ca 0.01 -0.84 -0.15 0.00 -1.03 0.00 0.00 54.13 52.12 1fty s LEU 117 Cb -0.00 -0.84 0.01 0.00 0.03 0.00 0.00 46.19 45.39 1fty s LEU 117 CO 0.01 -0.02 0.29 -0.62 0.23 0.00 0.00 176.35 176.24 1fty s ASP 118 N -2.58 6.10 0.21 2.29 3.68 -1.26 -3.34 116.67 121.77 1fty s ASP 118 Ca 0.15 -0.83 -0.10 0.00 2.13 0.00 0.00 52.55 53.90 1fty s ASP 118 Cb -0.06 -2.16 0.26 0.00 -1.45 0.00 0.00 42.92 39.51 1fty s ASP 118 CO 0.06 -0.42 1.77 -0.03 0.13 0.00 0.00 175.17 176.68 1fty h MET 119 N 8.61 0.49 -0.85 4.34 1.85 -1.90 -1.80 114.93 125.67 1fty h MET 119 Ca -0.28 -0.03 0.09 0.00 -0.61 0.00 0.00 59.70 58.87 1fty h MET 119 Cb 1.13 -0.11 -0.06 0.00 0.43 0.00 0.00 31.60 32.99 1fty h MET 119 CO 0.72 0.32 0.55 0.93 -0.40 0.00 0.00 176.91 179.03 1fty h GLU 120 N 0.51 0.82 -0.33 0.39 5.08 -1.99 0.28 114.58 119.33 1fty h GLU 120 Ca 0.30 -0.05 -0.10 0.00 -1.00 0.00 0.00 59.36 58.51 1fty h GLU 120 Cb 0.30 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.35 1fty h GLU 120 CO -0.25 0.55 -0.21 1.49 -1.00 0.00 0.00 179.01 179.58 1fty h GLU 121 N 0.85 0.63 -0.09 2.33 4.81 -1.76 -2.87 114.58 118.48 1fty h GLU 121 Ca 0.39 -0.24 -0.18 0.00 -0.13 0.00 0.00 59.36 59.20 1fty h GLU 121 Cb 0.38 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.71 1fty h GLU 121 CO -0.16 0.80 -0.72 -0.07 -0.73 0.00 0.00 179.01 178.14 1fty h LEU 122 N 0.56 0.51 -1.46 1.64 4.07 -0.82 -3.20 115.31 116.60 1fty h LEU 122 Ca 0.08 -0.33 -0.03 0.00 0.08 0.00 0.00 57.88 57.68 1fty h LEU 122 Cb 0.67 -0.15 -0.01 0.00 1.08 0.00 0.00 40.66 42.24 1fty h LEU 122 CO 0.05 1.07 0.02 -0.33 -1.08 0.00 0.00 178.44 178.16 1fty h GLU 123 N 0.30 0.37 0.00 1.13 5.08 -0.79 -2.35 114.58 118.32 1fty h GLU 123 Ca -0.03 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1fty h GLU 123 Cb 1.29 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.48 1fty h GLU 123 CO 0.12 0.38 0.00 0.93 -1.00 0.00 0.00 179.01 179.45 1fty h GLU 124 N 0.36 0.00 0.00 2.33 4.39 -1.51 -2.80 114.58 117.35 1fty h GLU 124 Ca 0.08 0.00 -0.07 0.00 0.34 0.00 0.00 59.36 59.72 1fty h GLU 124 Cb 0.22 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.86 1fty h GLU 124 CO 0.00 0.00 -0.45 0.82 -1.16 0.00 0.00 179.01 178.23 1fty h ILE 125 N 0.00 0.48 -2.80 3.13 2.04 -1.54 -3.45 117.51 115.37 1fty h ILE 125 Ca 0.00 -1.70 -0.53 0.00 1.00 0.00 0.00 64.86 63.62 1fty h ILE 125 Cb 0.30 2.18 0.02 0.00 -0.74 0.00 0.00 36.82 38.58 1fty h ILE 125 CO 0.00 0.27 0.91 -0.70 0.00 0.00 0.00 178.15 178.63 1fty s GLU 126 N -3.07 4.24 0.45 2.37 2.12 -1.06 -4.98 118.70 118.76 1fty s GLU 126 Ca 0.04 2.21 -0.22 0.00 0.36 0.00 0.00 54.97 57.36 1fty s GLU 126 Cb 0.07 -3.50 -0.08 0.00 0.26 0.00 0.00 34.13 30.88 1fty s GLU 126 CO 0.73 -0.64 1.07 -2.00 -0.54 0.00 0.00 175.26 173.88 1fty s GLU 127 N 2.22 3.90 0.31 4.30 2.56 -1.26 -4.88 118.70 125.84 1fty s GLU 127 Ca 0.70 1.52 -0.28 0.00 0.00 0.00 0.00 54.97 56.90 1fty s GLU 127 Cb -0.38 -2.32 -0.09 0.00 2.00 0.00 0.00 34.13 33.34 1fty s GLU 127 CO 0.30 -0.38 1.07 -0.51 -0.56 0.00 0.00 175.26 175.18 1fty s ASP 128 N -1.69 7.17 -1.19 -1.70 -0.00 -1.26 -4.48 116.67 113.53 1fty s ASP 128 Ca 0.63 2.17 -0.15 0.00 -0.00 0.00 0.00 52.55 55.20 1fty s ASP 128 Cb -0.21 -2.61 0.15 0.00 -0.00 0.00 0.00 42.92 40.24 1fty s ASP 128 CO 0.26 -0.20 1.45 0.00 -0.00 0.00 0.00 175.17 176.68 1fty s ALA 129 N -1.30 3.80 -0.66 5.23 0.00 -1.06 -4.86 121.76 122.92 1fty s ALA 129 Ca 0.48 -3.21 -0.07 0.00 0.00 0.00 0.00 51.96 49.16 1fty s ALA 129 Cb -0.28 -4.20 -0.13 0.00 0.00 0.00 0.00 23.12 18.50 1fty s ALA 129 CO 0.36 -2.89 3.19 0.41 0.00 0.00 0.00 175.76 176.83 1fty n GLY 130 N 4.51 3.78 2.26 0.00 0.00 -1.26 -2.63 105.19 111.85 1fty n GLY 130 Ca 0.37 -1.48 -0.23 0.00 0.00 0.00 0.00 46.02 44.68 1fty n GLY 130 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1fty n LEU 131 N 2.48 6.50 -3.75 0.99 4.77 -1.24 -0.64 117.00 126.11 1fty n LEU 131 Ca 0.56 -3.78 -0.07 0.00 -0.03 0.00 0.00 56.01 52.70 1fty n LEU 131 Cb 0.60 -1.16 -0.02 0.00 -2.33 0.00 0.00 43.42 40.51 1fty n LEU 131 CO 0.42 1.53 0.55 -0.83 -1.33 0.00 0.00 177.39 177.74 1fty s GLY 132 N 0.24 -0.22 -0.23 -0.72 0.00 -1.26 -0.25 107.32 104.87 1fty s GLY 132 Ca 0.49 0.01 -0.01 0.00 0.00 0.00 0.00 44.72 45.21 1fty s GLY 132 CO -0.13 -0.00 -0.22 0.70 0.00 0.00 0.00 173.10 173.44 1fty n ASN 133 N -0.44 2.14 0.00 1.64 3.02 -1.26 -4.37 115.26 115.98 1fty n ASN 133 Ca -0.07 -0.05 0.00 0.00 -0.03 0.00 0.00 54.58 54.44 1fty n ASN 133 Cb 0.60 -0.42 0.00 0.00 -0.61 0.00 0.00 39.78 39.35 1fty n ASN 133 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1fty n GLY 134 N 2.24 0.91 0.19 7.41 0.00 -1.26 -4.94 105.19 109.75 1fty n GLY 134 Ca -0.42 0.41 -0.07 0.00 0.00 0.00 0.00 46.02 45.94 1fty n GLY 134 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1fty h GLY 135 N 0.00 0.07 1.00 -0.02 0.00 -1.99 -1.30 103.07 100.84 1fty h GLY 135 Ca 0.00 0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.51 1fty h GLY 135 CO 0.00 -0.16 0.21 -2.00 0.00 0.00 0.00 176.54 174.60 1fty h LEU 136 N -0.11 0.39 -0.73 3.11 6.46 -1.99 0.98 115.31 123.42 1fty h LEU 136 Ca 0.14 -0.02 -0.10 0.00 -0.12 0.00 0.00 57.88 57.79 1fty h LEU 136 Cb 0.33 -0.10 -0.02 0.00 -0.73 0.00 0.00 40.66 40.14 1fty h LEU 136 CO -0.34 0.29 -0.08 1.23 -0.62 0.00 0.00 178.44 178.93 1fty h GLY 137 N 0.44 0.97 1.59 3.75 0.00 -1.77 -2.91 103.07 105.14 1fty h GLY 137 Ca 0.12 -0.73 -0.16 0.00 0.00 0.00 0.00 47.33 46.56 1fty h GLY 137 CO -0.03 0.67 -0.59 -0.09 0.00 0.00 0.00 176.54 176.51 1fty h ARG 138 N 0.81 0.43 -0.38 4.80 1.12 -1.05 0.14 114.38 120.25 1fty h ARG 138 Ca 0.14 -0.29 0.03 0.00 -1.11 0.00 0.00 59.98 58.76 1fty h ARG 138 Cb 0.59 0.04 -0.03 0.00 -0.01 0.00 0.00 29.97 30.56 1fty h ARG 138 CO 0.04 0.89 0.17 1.25 -3.11 0.00 0.00 179.97 179.21 1fty h LEU 139 N 0.32 0.24 -0.83 3.80 5.85 -0.65 -1.08 115.31 122.97 1fty h LEU 139 Ca -0.00 0.03 0.10 0.00 0.84 0.00 0.00 57.88 58.84 1fty h LEU 139 Cb 1.12 -0.01 -0.07 0.00 0.37 0.00 0.00 40.66 42.06 1fty h LEU 139 CO 0.10 0.18 0.47 0.00 -0.34 0.00 0.00 178.44 178.85 1fty h ALA 140 N 1.21 1.18 -0.40 1.25 0.00 -1.44 0.11 119.26 121.17 1fty h ALA 140 Ca 0.16 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.06 1fty h ALA 140 Cb 0.10 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1fty h ALA 140 CO -0.13 0.08 0.04 0.00 0.00 0.00 0.00 179.25 179.24 1fty h ALA 141 N 1.46 0.54 -0.44 0.00 0.00 -1.15 -1.89 119.26 117.79 1fty h ALA 141 Ca 0.40 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 1fty h ALA 141 Cb 0.39 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 1fty h ALA 141 CO -0.26 0.28 -0.07 0.00 0.00 0.00 0.00 179.25 179.20 1fty h PHE 143 N 0.70 0.39 -0.55 0.00 -1.00 -0.64 -1.92 116.94 113.93 1fty h PHE 143 Ca 0.13 -0.03 0.07 0.00 2.81 0.00 0.00 57.97 60.95 1fty h PHE 143 Cb 0.53 -0.12 -0.06 0.00 3.61 0.00 0.00 35.95 39.91 1fty h PHE 143 CO 0.03 0.39 0.21 -0.07 -1.61 0.00 0.00 178.31 177.26 1fty h LEU 144 N 0.27 0.23 -0.81 1.54 4.07 -1.16 0.28 115.31 119.74 1fty h LEU 144 Ca 0.09 0.06 -0.00 0.00 0.08 0.00 0.00 57.88 58.11 1fty h LEU 144 Cb 0.16 0.03 -0.04 0.00 1.08 0.00 0.00 40.66 41.89 1fty h LEU 144 CO -0.01 0.16 0.50 -0.78 -1.08 0.00 0.00 178.44 177.23 1fty h ASP 145 N 0.41 0.96 -0.33 -0.43 3.58 -1.30 -2.11 116.42 117.19 1fty h ASP 145 Ca 0.26 -0.06 -0.17 0.00 0.42 0.00 0.00 57.03 57.49 1fty h ASP 145 Cb 0.28 -0.24 -0.00 0.00 1.72 0.00 0.00 39.33 41.09 1fty h ASP 145 CO -0.25 0.73 -0.48 0.28 -2.88 0.00 0.00 179.24 176.64 1fty h SER 146 N 1.10 0.99 -0.10 2.28 0.02 -0.51 -1.53 113.55 115.80 1fty h SER 146 Ca 0.29 -0.51 -0.05 0.00 -0.84 0.00 0.00 61.79 60.68 1fty h SER 146 Cb -0.06 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.18 1fty h SER 146 CO -0.06 1.30 -0.07 0.24 -1.14 0.00 0.00 176.83 177.10 1fty h MET 147 N 0.70 0.37 -0.11 3.45 2.86 -0.31 0.10 114.93 121.99 1fty h MET 147 Ca 0.03 -0.08 -0.17 0.00 -2.06 0.00 0.00 59.70 57.41 1fty h MET 147 Cb 1.08 -0.05 0.01 0.00 0.06 0.00 0.00 31.60 32.70 1fty h MET 147 CO 0.11 0.46 -0.62 0.00 1.06 0.00 0.00 176.91 177.93 1fty h ALA 148 N 1.57 0.22 0.00 6.32 0.00 -1.27 -0.59 119.26 125.52 1fty h ALA 148 Ca 0.07 -0.55 -0.04 0.00 0.00 0.00 0.00 54.91 54.40 1fty h ALA 148 Cb 0.36 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1fty h ALA 148 CO 0.02 0.48 -0.19 1.15 0.00 0.00 0.00 179.25 180.71 1fty h THR 149 N 0.24 0.76 -0.64 0.00 2.02 -0.90 -2.41 112.91 111.98 1fty h THR 149 Ca -0.05 -0.75 0.00 0.00 0.77 0.00 0.00 66.41 66.38 1fty h THR 149 Cb 1.26 1.46 0.00 0.00 -1.74 0.00 0.00 68.15 69.13 1fty h THR 149 CO 0.13 0.18 0.00 0.18 0.37 0.00 0.00 175.52 176.38 1fty n LEU 150 N -3.77 4.35 -3.70 2.58 4.77 -0.01 -4.72 117.00 116.50 1fty n LEU 150 Ca -0.02 -2.19 -0.26 0.00 -0.03 0.00 0.00 56.01 53.52 1fty n LEU 150 Cb 0.29 -0.54 0.06 0.00 -2.33 0.00 0.00 43.42 40.90 1fty n LEU 150 CO 0.33 0.81 0.18 0.61 -1.33 0.00 0.00 177.39 177.99 1fty n GLY 151 N 1.24 -0.51 3.81 -0.72 0.00 -0.91 -0.89 105.19 107.21 1fty n GLY 151 Ca 0.24 0.22 -0.37 0.00 0.00 0.00 0.00 46.02 46.11 1fty n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1fty s LEU 152 N -7.23 4.39 -1.15 0.99 1.43 -0.24 -4.71 118.68 112.16 1fty s LEU 152 Ca 0.56 0.76 -0.19 0.00 -1.03 0.00 0.00 54.13 54.24 1fty s LEU 152 Cb -0.26 -2.45 -0.05 0.00 0.03 0.00 0.00 46.19 43.46 1fty s LEU 152 CO 0.77 0.26 2.01 0.00 0.23 0.00 0.00 176.35 179.62 1fty n ALA 153 N 2.38 3.95 -2.64 4.21 0.00 -1.26 -4.70 120.51 122.45 1fty n ALA 153 Ca -0.14 -3.56 -0.32 0.00 0.00 0.00 0.00 53.44 49.42 1fty n ALA 153 Cb 0.53 -3.58 -0.09 0.00 0.00 0.00 0.00 19.45 16.30 1fty n ALA 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fty s ALA 154 N 5.03 3.16 -0.07 0.00 0.00 -1.26 -1.21 121.76 127.41 1fty s ALA 154 Ca 0.55 -1.01 0.02 0.00 0.00 0.00 0.00 51.96 51.51 1fty s ALA 154 Cb 0.11 -1.22 0.01 0.00 0.00 0.00 0.00 23.12 22.03 1fty s ALA 154 CO 0.04 0.64 -0.12 0.71 0.00 0.00 0.00 175.76 177.03 1fty s TYR 155 N -1.08 1.47 -0.08 0.00 2.02 0.88 -4.11 117.35 116.44 1fty s TYR 155 Ca 0.19 -0.57 -0.18 0.00 -0.37 0.00 0.00 57.07 56.14 1fty s TYR 155 Cb -0.11 -1.09 -0.05 0.00 -0.40 0.00 0.00 41.96 40.31 1fty s TYR 155 CO 0.10 -0.31 0.50 0.20 -1.57 0.00 0.00 175.55 174.47 1fty s GLY 156 N 0.80 2.45 -0.10 0.71 0.00 -0.92 -1.19 107.32 109.07 1fty s GLY 156 Ca -0.12 -0.14 0.02 0.00 0.00 0.00 0.00 44.72 44.48 1fty s GLY 156 CO 0.02 0.73 -0.15 -0.19 0.00 0.00 0.00 173.10 173.51 1fty s TYR 157 N 0.32 1.87 0.00 1.90 2.02 -0.69 -0.10 117.35 122.68 1fty s TYR 157 Ca 0.27 -0.82 0.00 0.00 -0.37 0.00 0.00 57.07 56.15 1fty s TYR 157 Cb -0.16 -1.35 0.00 0.00 -0.40 0.00 0.00 41.96 40.06 1fty s TYR 157 CO 0.12 -0.41 0.00 0.41 -1.57 0.00 0.00 175.55 174.10 1fty n GLY 158 N 4.04 3.22 3.54 0.71 0.00 -0.80 -2.25 105.19 113.65 1fty n GLY 158 Ca -0.20 -0.75 -0.33 0.00 0.00 0.00 0.00 46.02 44.74 1fty n GLY 158 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1fty s ILE 159 N -2.53 3.43 -1.04 -0.61 1.01 -1.26 -1.56 121.20 118.65 1fty s ILE 159 Ca 0.00 -0.64 -0.14 0.00 0.00 0.00 0.00 60.65 59.87 1fty s ILE 159 Cb 0.00 -2.40 0.20 0.00 0.01 0.00 0.00 42.46 40.27 1fty s ILE 159 CO 0.00 0.55 1.14 -0.60 0.00 0.00 0.00 174.94 176.03 1fty s ARG 160 N -0.90 3.91 0.26 2.79 3.52 -0.27 -4.75 118.95 123.51 1fty s ARG 160 Ca 0.13 -2.54 -0.29 0.00 -0.13 0.00 0.00 55.73 52.90 1fty s ARG 160 Cb -0.11 -4.76 -0.09 0.00 -1.56 0.00 0.00 34.95 28.43 1fty s ARG 160 CO 0.02 -1.53 1.21 0.71 -0.81 0.00 0.00 175.30 174.91 1fty s TYR 161 N 0.79 3.34 -0.83 5.12 2.02 -1.25 -4.78 117.35 121.76 1fty s TYR 161 Ca 0.32 1.48 0.26 0.00 -0.37 0.00 0.00 57.07 58.76 1fty s TYR 161 Cb -0.07 -3.48 0.80 0.00 -0.40 0.00 0.00 41.96 38.81 1fty s TYR 161 CO -0.06 -1.28 1.68 -0.85 -1.57 0.00 0.00 175.55 173.46 1fty n GLU 162 N 1.59 0.16 -3.88 -0.62 0.28 -1.00 -4.54 120.64 112.62 1fty n GLU 162 Ca 0.02 0.10 -0.29 0.00 -0.16 0.00 0.00 57.16 56.82 1fty n GLU 162 Cb 0.44 -1.65 -0.16 0.00 1.43 0.00 0.00 31.44 31.49 1fty n GLU 162 CO 0.00 0.00 0.00 -0.06 -0.16 0.00 0.00 177.13 176.91 1fty s PHE 163 N -3.07 1.84 0.00 -1.84 0.40 -0.47 -4.28 117.98 110.57 1fty s PHE 163 Ca 0.11 -1.30 0.00 0.00 -0.60 0.00 0.00 56.93 55.13 1fty s PHE 163 Cb 0.15 -1.36 0.00 0.00 0.51 0.00 0.00 43.02 42.32 1fty s PHE 163 CO 0.62 -0.68 0.00 0.41 0.70 0.00 0.00 175.22 176.27 1fty n GLY 164 N 4.83 0.35 3.75 4.36 0.00 -1.22 -2.25 105.19 115.00 1fty n GLY 164 Ca -0.11 -1.65 -0.42 0.00 0.00 0.00 0.00 46.02 43.84 1fty n GLY 164 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1fty n ILE 165 N 0.00 1.02 -1.36 -0.61 0.13 0.19 -4.60 119.36 114.13 1fty n ILE 165 Ca 0.00 -0.26 -0.36 0.00 -1.10 0.00 0.00 62.75 61.04 1fty n ILE 165 Cb 0.00 -1.98 0.08 0.00 -0.84 0.00 0.00 39.64 36.90 1fty n ILE 165 CO 0.00 0.00 0.00 2.22 2.80 0.00 0.00 176.55 181.57 1fty n PHE 166 N 2.16 0.45 -3.06 9.51 1.16 -1.26 -4.59 117.46 121.83 1fty n PHE 166 Ca 0.08 0.39 -0.40 0.00 -1.87 0.00 0.00 57.45 55.66 1fty n PHE 166 Cb 0.37 -2.06 -0.05 0.00 -1.61 0.00 0.00 39.48 36.13 1fty n PHE 166 CO 0.00 0.00 0.00 -0.80 -1.87 0.00 0.00 176.76 174.09 1fty s ASN 167 N -1.59 6.99 -0.06 5.98 0.01 -0.52 -4.91 114.94 120.84 1fty s ASN 167 Ca 0.72 1.19 -0.18 0.00 -0.71 0.00 0.00 52.86 53.88 1fty s ASN 167 Cb -0.35 -2.41 -0.05 0.00 0.41 0.00 0.00 41.25 38.85 1fty s ASN 167 CO 0.51 -0.10 0.49 -1.58 -1.51 0.00 0.00 177.10 174.91 1fty s GLN 168 N 0.72 4.23 -0.04 -0.60 0.74 -1.26 -2.32 119.66 121.14 1fty s GLN 168 Ca 0.37 0.50 0.05 0.00 0.05 0.00 0.00 55.36 56.33 1fty s GLN 168 Cb -0.18 -3.36 -0.01 0.00 1.10 0.00 0.00 33.01 30.56 1fty s GLN 168 CO 0.18 0.34 -0.19 0.15 -0.55 0.00 0.00 175.29 175.22 1fty s LYS 169 N 0.00 1.83 -0.33 1.67 -0.14 0.50 -3.95 119.74 119.32 1fty s LYS 169 Ca 0.26 -0.69 -0.11 0.00 -1.36 0.00 0.00 55.97 54.07 1fty s LYS 169 Cb -0.16 -1.64 -0.01 0.00 -1.68 0.00 0.00 37.83 34.34 1fty s LYS 169 CO 0.13 0.33 0.20 0.42 -0.76 0.00 0.00 175.35 175.66 1fty s ILE 170 N -0.17 4.87 -0.20 2.17 -1.09 -1.26 0.22 121.20 125.74 1fty s ILE 170 Ca 0.00 -0.41 -0.00 0.00 -2.23 0.00 0.00 60.65 58.01 1fty s ILE 170 Cb -0.10 -3.53 0.02 0.00 -1.58 0.00 0.00 42.46 37.27 1fty s ILE 170 CO 0.01 -0.01 -0.15 0.00 -1.23 0.00 0.00 174.94 173.56 1fty n GLY 172 N 4.65 -0.50 2.17 0.00 0.00 -1.26 -0.64 105.19 109.61 1fty n GLY 172 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.83 1fty n GLY 172 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fty n GLY 173 N -0.95 1.10 3.76 -0.02 0.00 -1.26 -5.04 105.19 102.79 1fty n GLY 173 Ca -0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.50 1fty n GLY 173 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1fty s TRP 174 N -3.32 3.16 0.23 1.61 0.52 0.18 -3.86 118.94 117.47 1fty s TRP 174 Ca 0.00 0.06 -0.30 0.00 0.02 0.00 0.00 56.10 55.89 1fty s TRP 174 Cb 0.00 -1.61 -0.09 0.00 -1.15 0.00 0.00 33.47 30.62 1fty s TRP 174 CO 0.00 0.52 1.06 -1.14 0.02 0.00 0.00 176.95 177.40 1fty s GLN 175 N -2.36 4.68 -0.05 4.98 0.74 -1.26 0.49 119.66 126.87 1fty s GLN 175 Ca 0.29 1.69 0.05 0.00 0.05 0.00 0.00 55.36 57.43 1fty s GLN 175 Cb -0.12 -3.24 -0.00 0.00 1.10 0.00 0.00 33.01 30.74 1fty s GLN 175 CO 0.21 0.24 -0.19 -1.64 -0.55 0.00 0.00 175.29 173.36 1fty s MET 176 N -1.00 2.07 -0.10 1.67 -1.94 0.59 -4.86 119.30 115.73 1fty s MET 176 Ca 0.45 -0.69 -0.04 0.00 -1.71 0.00 0.00 55.69 53.70 1fty s MET 176 Cb -0.29 -1.75 -0.04 0.00 2.01 0.00 0.00 34.83 34.76 1fty s MET 176 CO 0.37 0.26 0.07 -1.21 -0.01 0.00 0.00 175.02 174.49 1fty s GLU 177 N 0.06 3.22 -0.06 2.03 8.01 -1.26 -0.37 118.70 130.33 1fty s GLU 177 Ca -0.06 -0.28 -0.04 0.00 0.01 0.00 0.00 54.97 54.60 1fty s GLU 177 Cb -0.13 -2.99 0.02 0.00 -4.31 0.00 0.00 34.13 26.73 1fty s GLU 177 CO 0.03 0.73 0.14 -1.83 0.01 0.00 0.00 175.26 174.34 1fty s GLU 178 N -0.91 0.14 0.20 1.61 -1.05 -0.98 -5.00 118.70 112.72 1fty s GLU 178 Ca 0.14 0.25 -0.30 0.00 -0.15 0.00 0.00 54.97 54.91 1fty s GLU 178 Cb -0.12 -0.00 -0.16 0.00 -0.44 0.00 0.00 34.13 33.41 1fty s GLU 178 CO 0.03 -0.07 0.91 0.00 0.95 0.00 0.00 175.26 177.09 1fty n ALA 179 N 3.39 -1.48 -3.30 -0.84 0.00 -1.26 -1.44 120.51 115.57 1fty n ALA 179 Ca -0.17 0.44 -0.46 0.00 0.00 0.00 0.00 53.44 53.25 1fty n ALA 179 Cb 0.57 -1.88 -0.01 0.00 0.00 0.00 0.00 19.45 18.13 1fty n ALA 179 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1fty s ASP 180 N -0.48 6.93 -1.41 0.00 3.68 -1.26 -4.67 116.67 119.45 1fty s ASP 180 Ca 0.67 -2.93 -0.12 0.00 2.13 0.00 0.00 52.55 52.31 1fty s ASP 180 Cb -0.86 -2.22 0.07 0.00 -1.45 0.00 0.00 42.92 38.45 1fty s ASP 180 CO 0.56 -0.52 2.20 -0.67 0.13 0.00 0.00 175.17 176.88 1fty n ASP 181 N 3.77 5.01 0.10 -0.34 -0.08 -1.26 -3.45 116.55 120.29 1fty n ASP 181 Ca 0.18 -2.92 0.09 0.00 -1.51 0.00 0.00 54.79 50.63 1fty n ASP 181 Cb 0.45 -1.57 0.42 0.00 2.34 0.00 0.00 41.12 42.75 1fty n ASP 181 CO 0.00 0.00 0.00 -2.67 0.12 0.00 0.00 177.20 174.65 1fty n TRP 182 N 4.86 0.53 0.97 -0.67 4.27 -1.26 -2.38 117.44 123.76 1fty n TRP 182 Ca 0.51 0.23 0.11 0.00 -3.89 0.00 0.00 57.50 54.47 1fty n TRP 182 Cb 0.36 -0.88 0.02 0.00 -1.36 0.00 0.00 31.31 29.45 1fty n TRP 182 CO 0.00 0.00 0.00 1.28 -2.29 0.00 0.00 177.69 176.68 1fty n LEU 183 N -2.01 2.18 -0.33 5.67 4.77 -1.26 -4.63 117.00 121.39 1fty n LEU 183 Ca 0.01 -0.81 0.09 0.00 -0.03 0.00 0.00 56.01 55.28 1fty n LEU 183 Cb 0.14 0.00 0.20 0.00 -2.33 0.00 0.00 43.42 41.43 1fty n LEU 183 CO 0.13 0.40 0.68 -1.14 -1.33 0.00 0.00 177.39 176.13 1fty n ARG 184 N 0.24 -0.08 -0.05 3.23 0.63 -1.00 0.00 116.66 119.63 1fty n ARG 184 Ca 0.10 1.44 0.12 0.00 -0.92 0.00 0.00 57.85 58.59 1fty n ARG 184 Cb 0.48 -2.22 0.13 0.00 0.45 0.00 0.00 32.46 31.30 1fty n ARG 184 CO 0.00 0.00 0.00 0.66 -2.51 0.00 0.00 177.63 175.78 1fty n TYR 185 N -5.47 0.13 0.00 -0.14 4.01 -1.26 -5.08 117.16 109.35 1fty n TYR 185 Ca 0.18 -0.06 0.00 0.00 -0.16 0.00 0.00 57.90 57.86 1fty n TYR 185 Cb 0.59 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.62 1fty n TYR 185 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1fty n GLY 186 N 1.38 1.95 2.87 2.72 0.00 0.10 -4.98 105.19 109.22 1fty n GLY 186 Ca 0.15 -1.94 -0.30 0.00 0.00 0.00 0.00 46.02 43.93 1fty n GLY 186 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1fty s ASN 187 N 0.00 3.99 0.00 1.61 3.84 -1.26 -4.83 114.94 118.29 1fty s ASN 187 Ca 0.00 -1.48 0.14 0.00 0.21 0.00 0.00 52.86 51.73 1fty s ASN 187 Cb 0.00 -1.11 0.63 0.00 -0.55 0.00 0.00 41.25 40.22 1fty s ASN 187 CO 0.00 -0.33 1.44 -0.81 -2.79 0.00 0.00 177.10 174.61 1fty n PRO 188 N 4.69 0.04 0.00 0.43 -0.04 -1.26 -3.49 135.00 135.37 1fty n PRO 188 Ca -0.05 0.23 -0.15 0.00 -0.04 0.00 0.00 63.50 63.49 1fty n PRO 188 Cb 0.43 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.25 1fty n PRO 188 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 1fty h TRP 189 N 0.00 0.27 -4.30 0.54 4.06 -1.95 -3.48 115.95 111.08 1fty h TRP 189 Ca 0.00 -0.20 -0.50 0.00 2.06 0.00 0.00 58.89 60.25 1fty h TRP 189 Cb 0.22 -0.01 0.06 0.00 -1.00 0.00 0.00 29.16 28.43 1fty h TRP 189 CO 0.00 1.39 0.39 -1.83 -3.56 0.00 0.00 178.44 174.83 1fty s GLU 190 N -2.58 3.39 -0.24 0.49 -1.05 -1.23 -4.41 118.70 113.08 1fty s GLU 190 Ca -0.13 0.92 -0.02 0.00 -0.15 0.00 0.00 54.97 55.59 1fty s GLU 190 Cb 0.07 -2.05 0.08 0.00 -0.44 0.00 0.00 34.13 31.79 1fty s GLU 190 CO 0.80 -0.73 0.06 0.21 0.95 0.00 0.00 175.26 176.55 1fty s LYS 191 N -4.79 0.67 0.34 -4.83 2.47 0.18 -4.95 119.74 108.83 1fty s LYS 191 Ca 0.58 -0.66 -0.29 0.00 -1.56 0.00 0.00 55.97 54.05 1fty s LYS 191 Cb -0.13 -2.01 -0.11 0.00 -1.46 0.00 0.00 37.83 34.13 1fty s LYS 191 CO 0.48 -0.78 1.47 0.00 0.16 0.00 0.00 175.35 176.68 1fty s ALA 192 N 1.79 3.60 -0.53 3.13 0.00 -1.26 -1.60 121.76 126.89 1fty s ALA 192 Ca 0.03 1.50 0.07 0.00 0.00 0.00 0.00 51.96 53.56 1fty s ALA 192 Cb -0.17 -3.59 0.29 0.00 0.00 0.00 0.00 23.12 19.65 1fty s ALA 192 CO -0.16 -0.94 0.75 0.54 0.00 0.00 0.00 175.76 175.95 1fty n ARG 193 N 1.03 2.08 0.14 0.00 5.12 0.06 -4.92 116.66 120.17 1fty n ARG 193 Ca 0.03 -4.20 0.18 0.00 -1.93 0.00 0.00 57.85 51.92 1fty n ARG 193 Cb 0.39 -1.94 0.76 0.00 -1.16 0.00 0.00 32.46 30.52 1fty n ARG 193 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 1fty h PRO 194 N 3.62 0.00 0.00 5.56 0.13 -1.93 -1.56 132.00 137.83 1fty h PRO 194 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 1fty h PRO 194 Cb 0.72 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.85 1fty h PRO 194 CO 0.70 0.00 0.00 -0.85 -0.23 0.00 0.00 178.00 177.62 1fty n GLU 195 N -4.01 0.03 -0.54 0.86 0.00 -1.26 -2.41 120.64 113.30 1fty n GLU 195 Ca 0.04 0.30 0.04 0.00 0.00 0.00 0.00 57.16 57.54 1fty n GLU 195 Cb 0.41 -1.55 0.23 0.00 0.00 0.00 0.00 31.44 30.53 1fty n GLU 195 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 1fty n PHE 196 N -1.60 0.94 -1.87 -1.84 0.99 -0.58 -5.03 117.46 108.45 1fty n PHE 196 Ca 0.03 -1.14 -0.40 0.00 -0.00 0.00 0.00 57.45 55.94 1fty n PHE 196 Cb 0.16 -0.37 0.00 0.00 -1.00 0.00 0.00 39.48 38.28 1fty n PHE 196 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.76 177.75 1fty s THR 197 N -2.98 2.21 0.12 4.37 2.01 -1.01 -4.63 115.64 115.73 1fty s THR 197 Ca 0.42 0.20 0.06 0.00 0.31 0.00 0.00 61.69 62.69 1fty s THR 197 Cb 0.36 -3.12 -0.04 0.00 0.01 0.00 0.00 72.50 69.71 1fty s THR 197 CO 0.05 0.04 -0.15 -0.76 -0.69 0.00 0.00 174.62 173.11 1fty s LEU 198 N -2.34 2.38 0.05 4.42 1.02 -0.29 -4.94 118.68 118.98 1fty s LEU 198 Ca 0.56 -0.78 -0.12 0.00 0.02 0.00 0.00 54.13 53.81 1fty s LEU 198 Cb -0.43 -0.62 -0.06 0.00 0.02 0.00 0.00 46.19 45.10 1fty s LEU 198 CO 0.57 -0.10 0.41 -2.16 0.02 0.00 0.00 176.35 175.09 1fty s PRO 199 N -2.47 3.83 -0.04 1.29 0.04 -1.26 0.52 135.00 136.90 1fty s PRO 199 Ca 0.08 0.28 0.03 0.00 0.04 0.00 0.00 61.00 61.43 1fty s PRO 199 Cb -0.06 -3.08 0.00 0.00 0.04 0.00 0.00 34.50 31.40 1fty s PRO 199 CO 0.03 0.61 -0.13 0.08 0.04 0.00 0.00 177.00 177.63 1fty s VAL 200 N -1.27 1.14 0.05 -0.36 1.01 0.94 -4.87 120.40 117.04 1fty s VAL 200 Ca 0.29 -0.54 0.00 0.00 0.00 0.00 0.00 61.98 61.74 1fty s VAL 200 Cb -0.15 -1.01 -0.04 0.00 0.00 0.00 0.00 36.38 35.18 1fty s VAL 200 CO 0.16 0.34 0.15 -1.00 0.00 0.00 0.00 175.10 174.75 1fty s HIS 201 N 0.25 3.40 0.04 5.22 3.76 -1.26 -1.17 115.29 125.53 1fty s HIS 201 Ca -0.06 0.21 0.00 0.00 -0.15 0.00 0.00 55.06 55.06 1fty s HIS 201 Cb -0.12 -1.73 -0.03 0.00 1.11 0.00 0.00 32.58 31.82 1fty s HIS 201 CO 0.02 0.57 -0.04 -0.06 -0.85 0.00 0.00 174.74 174.39 1fty s PHE 202 N -1.40 0.44 0.00 1.40 0.40 -0.36 -4.95 117.98 113.51 1fty s PHE 202 Ca 0.30 -0.71 0.00 0.00 -0.60 0.00 0.00 56.93 55.93 1fty s PHE 202 Cb -0.13 -0.30 0.00 0.00 0.51 0.00 0.00 43.02 43.10 1fty s PHE 202 CO 0.23 -0.23 0.00 0.66 0.70 0.00 0.00 175.22 176.58 1fty n TYR 203 N 1.03 0.00 -4.18 0.36 4.01 0.29 -0.41 117.16 118.26 1fty n TYR 203 Ca -0.20 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.54 1fty n TYR 203 Cb 0.57 0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.63 1fty n TYR 203 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1fty n GLY 204 N 0.00 -0.87 3.64 2.72 0.00 -1.19 -4.61 105.19 104.88 1fty n GLY 204 Ca 0.00 -1.18 -0.10 0.00 0.00 0.00 0.00 46.02 44.74 1fty n GLY 204 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1fty s ARG 205 N 0.00 1.78 -0.19 1.61 1.70 0.11 -4.88 118.95 119.07 1fty s ARG 205 Ca 0.00 -1.36 -0.04 0.00 -0.47 0.00 0.00 55.73 53.86 1fty s ARG 205 Cb 0.00 0.51 -0.02 0.00 -0.57 0.00 0.00 34.95 34.87 1fty s ARG 205 CO 0.00 -0.77 -0.04 0.08 -1.08 0.00 0.00 175.30 173.49 1fty s VAL 206 N -3.50 3.59 -0.17 4.99 1.01 -1.26 -0.12 120.40 124.94 1fty s VAL 206 Ca 0.22 -0.44 -0.06 0.00 0.00 0.00 0.00 61.98 61.70 1fty s VAL 206 Cb -0.02 -2.61 -0.04 0.00 0.00 0.00 0.00 36.38 33.72 1fty s VAL 206 CO 0.12 0.45 0.02 -1.61 0.00 0.00 0.00 175.10 174.07 1fty s GLU 207 N 1.03 3.85 -0.55 2.72 2.02 0.28 -4.90 118.70 123.15 1fty s GLU 207 Ca 0.01 -0.42 -0.12 0.00 0.02 0.00 0.00 54.97 54.46 1fty s GLU 207 Cb -0.15 -3.09 0.14 0.00 0.10 0.00 0.00 34.13 31.13 1fty s GLU 207 CO 0.01 0.25 0.47 -1.01 0.02 0.00 0.00 175.26 175.00 1fty s HIS 208 N 0.38 3.40 -0.07 1.61 3.76 -1.26 0.71 115.29 123.82 1fty s HIS 208 Ca 0.00 -1.69 0.05 0.00 -0.15 0.00 0.00 55.06 53.27 1fty s HIS 208 Cb -0.13 -3.65 -0.00 0.00 1.11 0.00 0.00 32.58 29.91 1fty s HIS 208 CO 0.01 -1.00 -0.22 0.95 -0.85 0.00 0.00 174.74 173.63 1fty s THR 209 N 1.24 1.89 0.00 1.30 -4.23 -0.67 -4.98 115.64 110.18 1fty s THR 209 Ca 0.07 -0.95 0.00 0.00 -1.18 0.00 0.00 61.69 59.63 1fty s THR 209 Cb -0.25 -1.62 0.00 0.00 1.34 0.00 0.00 72.50 71.97 1fty s THR 209 CO -0.00 0.53 0.00 -1.20 -0.54 0.00 0.00 174.62 173.40 1fty n SER 210 N 3.23 0.00 -3.35 3.99 7.64 -1.26 -1.70 113.62 122.17 1fty n SER 210 Ca -0.18 0.00 -0.36 0.00 1.01 0.00 0.00 58.87 59.34 1fty n SER 210 Cb 0.52 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.72 1fty n SER 210 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 1fty n GLN 211 N 0.00 4.57 0.00 1.43 -0.06 -1.26 -5.02 117.38 117.03 1fty n GLN 211 Ca 0.00 -4.68 0.00 0.00 -2.00 0.00 0.00 57.00 50.32 1fty n GLN 211 Cb 0.00 -2.38 0.00 0.00 -4.06 0.00 0.00 30.24 23.80 1fty n GLN 211 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1fty n GLY 212 N -0.15 3.00 3.88 1.69 0.00 -0.69 -5.08 105.19 107.84 1fty n GLY 212 Ca 0.42 -2.03 -0.30 0.00 0.00 0.00 0.00 46.02 44.11 1fty n GLY 212 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fty s ALA 213 N -2.68 3.32 -0.03 4.61 0.00 -1.26 -1.68 121.76 124.04 1fty s ALA 213 Ca 0.00 -0.22 0.01 0.00 0.00 0.00 0.00 51.96 51.75 1fty s ALA 213 Cb 0.00 -2.74 0.02 0.00 0.00 0.00 0.00 23.12 20.39 1fty s ALA 213 CO 0.00 -0.14 -0.04 0.15 0.00 0.00 0.00 175.76 175.72 1fty s LYS 214 N -4.13 0.70 -0.32 0.00 1.02 0.22 -4.92 119.74 112.30 1fty s LYS 214 Ca 0.51 -0.12 -0.21 0.00 0.02 0.00 0.00 55.97 56.18 1fty s LYS 214 Cb -0.10 -0.72 -0.00 0.00 -0.52 0.00 0.00 37.83 36.48 1fty s LYS 214 CO 0.36 -0.03 0.67 -0.46 -0.92 0.00 0.00 175.35 174.96 1fty s TRP 215 N 0.67 3.19 0.27 3.18 -0.00 -1.26 -0.55 118.94 124.43 1fty s TRP 215 Ca -0.09 0.55 0.07 0.00 -0.00 0.00 0.00 56.10 56.63 1fty s TRP 215 Cb -0.12 -3.10 -0.06 0.00 -0.00 0.00 0.00 33.47 30.20 1fty s TRP 215 CO -0.00 -0.55 -0.06 0.54 -0.00 0.00 0.00 176.95 176.88 1fty s VAL 216 N 2.72 1.64 -1.45 5.86 0.11 0.82 -4.84 120.40 125.28 1fty s VAL 216 Ca 0.26 -2.13 -0.05 0.00 -2.93 0.00 0.00 61.98 57.13 1fty s VAL 216 Cb -0.15 -2.42 0.04 0.00 -1.53 0.00 0.00 36.38 32.33 1fty s VAL 216 CO 0.13 -0.32 0.63 0.47 -3.33 0.00 0.00 175.10 172.67 1fty n ASP 217 N -0.56 -1.64 -4.93 3.54 8.00 -1.26 0.04 116.55 119.73 1fty n ASP 217 Ca -0.06 -0.93 -0.25 0.00 0.71 0.00 0.00 54.79 54.27 1fty n ASP 217 Cb 0.63 -3.38 0.00 0.00 -0.02 0.00 0.00 41.12 38.35 1fty n ASP 217 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1fty s THR 218 N -3.69 4.59 -0.18 -3.53 -4.23 -1.26 -3.20 115.64 104.15 1fty s THR 218 Ca 0.21 -0.23 -0.11 0.00 -1.18 0.00 0.00 61.69 60.38 1fty s THR 218 Cb -0.11 -3.72 -0.05 0.00 1.34 0.00 0.00 72.50 69.96 1fty s THR 218 CO 0.87 -0.58 0.19 -1.58 -0.54 0.00 0.00 174.62 172.99 1fty s GLN 219 N -4.58 4.17 -0.19 3.99 0.74 0.46 -4.88 119.66 119.36 1fty s GLN 219 Ca 0.46 -0.09 -0.09 0.00 0.05 0.00 0.00 55.36 55.68 1fty s GLN 219 Cb -0.10 -3.41 -0.05 0.00 1.10 0.00 0.00 33.01 30.56 1fty s GLN 219 CO 0.40 0.31 0.12 0.08 -0.55 0.00 0.00 175.29 175.65 1fty s VAL 220 N 0.30 5.29 -0.02 1.34 1.01 -1.26 -1.22 120.40 125.84 1fty s VAL 220 Ca 0.12 0.15 0.08 0.00 0.00 0.00 0.00 61.98 62.32 1fty s VAL 220 Cb -0.12 -3.41 -0.02 0.00 0.00 0.00 0.00 36.38 32.83 1fty s VAL 220 CO 0.01 0.45 -0.25 -0.69 0.00 0.00 0.00 175.10 174.61 1fty s VAL 221 N 0.33 2.00 0.04 2.92 1.01 -0.31 -4.43 120.40 121.95 1fty s VAL 221 Ca 0.07 -1.09 -0.05 0.00 0.00 0.00 0.00 61.98 60.91 1fty s VAL 221 Cb -0.11 -1.66 -0.05 0.00 0.00 0.00 0.00 36.38 34.56 1fty s VAL 221 CO -0.01 0.56 0.28 -0.76 0.00 0.00 0.00 175.10 175.16 1fty s LEU 222 N -0.62 4.35 -0.26 3.92 1.43 1.00 -0.04 118.68 128.46 1fty s LEU 222 Ca 0.10 0.53 -0.01 0.00 -1.03 0.00 0.00 54.13 53.72 1fty s LEU 222 Cb -0.10 -2.84 0.03 0.00 0.03 0.00 0.00 46.19 43.32 1fty s LEU 222 CO -0.01 0.20 -0.06 0.00 0.23 0.00 0.00 176.35 176.71 1fty s ALA 223 N -1.40 2.68 -0.23 4.21 0.00 0.18 -0.51 121.76 126.70 1fty s ALA 223 Ca 0.31 -1.54 -0.10 0.00 0.00 0.00 0.00 51.96 50.63 1fty s ALA 223 Cb -0.13 -1.69 -0.05 0.00 0.00 0.00 0.00 23.12 21.25 1fty s ALA 223 CO 0.19 -0.92 0.15 1.41 0.00 0.00 0.00 175.76 176.59 1fty s MET 224 N 1.28 4.07 0.36 0.00 1.75 0.80 -1.14 119.30 126.41 1fty s MET 224 Ca -0.02 -0.27 -0.12 0.00 -1.25 0.00 0.00 55.69 54.03 1fty s MET 224 Cb -0.17 -3.50 -0.07 0.00 2.84 0.00 0.00 34.83 33.92 1fty s MET 224 CO -0.04 0.10 0.73 -1.25 -0.65 0.00 0.00 175.02 173.91 1fty s PRO 225 N 0.94 3.85 -0.10 4.11 0.04 -1.26 -0.08 135.00 142.50 1fty s PRO 225 Ca 0.07 0.50 -0.01 0.00 0.04 0.00 0.00 61.00 61.60 1fty s PRO 225 Cb -0.13 -2.43 0.03 0.00 0.04 0.00 0.00 34.50 32.01 1fty s PRO 225 CO 0.03 0.06 -0.01 0.71 0.04 0.00 0.00 177.00 177.84 1fty s TYR 226 N -2.19 0.89 -0.10 0.56 1.51 -0.22 -0.76 117.35 117.04 1fty s TYR 226 Ca 0.52 -0.40 -0.12 0.00 -1.01 0.00 0.00 57.07 56.05 1fty s TYR 226 Cb -0.10 -0.93 -0.05 0.00 -0.11 0.00 0.00 41.96 40.77 1fty s TYR 226 CO 0.26 -0.42 0.27 -0.51 -1.11 0.00 0.00 175.55 174.05 1fty s ASP 227 N 1.90 6.52 -0.08 2.29 -0.00 -0.63 -1.38 116.67 125.30 1fty s ASP 227 Ca 0.04 0.62 0.04 0.00 -0.00 0.00 0.00 52.55 53.25 1fty s ASP 227 Cb -0.13 -2.17 0.00 0.00 -0.00 0.00 0.00 42.92 40.62 1fty s ASP 227 CO -0.06 0.26 -0.21 -0.89 -0.00 0.00 0.00 175.17 174.27 1fty s THR 228 N -0.44 1.79 0.33 -1.27 2.01 -0.34 -0.64 115.64 117.08 1fty s THR 228 Ca 0.18 -0.88 -0.28 0.00 0.31 0.00 0.00 61.69 61.03 1fty s THR 228 Cb -0.14 -1.56 -0.09 0.00 0.01 0.00 0.00 72.50 70.72 1fty s THR 228 CO 0.06 0.50 1.15 -2.16 -0.69 0.00 0.00 174.62 173.48 1fty s PRO 229 N 0.32 4.39 -0.40 4.92 0.04 -1.26 -0.85 135.00 142.17 1fty s PRO 229 Ca -0.15 1.85 0.02 0.00 0.04 0.00 0.00 61.00 62.76 1fty s PRO 229 Cb -0.16 -2.97 0.12 0.00 0.04 0.00 0.00 34.50 31.53 1fty s PRO 229 CO 0.07 -0.03 0.18 0.08 0.04 0.00 0.00 177.00 177.34 1fty s VAL 230 N -1.28 1.55 0.12 -0.36 1.01 0.50 -4.89 120.40 117.05 1fty s VAL 230 Ca 0.50 -2.33 -0.30 0.00 0.00 0.00 0.00 61.98 59.85 1fty s VAL 230 Cb -0.32 -2.11 -0.06 0.00 0.00 0.00 0.00 36.38 33.89 1fty s VAL 230 CO 0.41 -0.78 1.03 -2.16 0.00 0.00 0.00 175.10 173.60 1fty s PRO 231 N 0.67 4.63 0.97 2.72 0.04 -1.26 -0.18 135.00 142.59 1fty s PRO 231 Ca 0.15 1.58 -0.14 0.00 0.04 0.00 0.00 61.00 62.63 1fty s PRO 231 Cb -0.22 -3.34 0.17 0.00 0.04 0.00 0.00 34.50 31.15 1fty s PRO 231 CO -0.07 0.11 1.14 0.20 0.04 0.00 0.00 177.00 178.41 1fty s GLY 232 N 0.11 1.59 -0.54 0.56 0.00 0.20 -4.77 107.32 104.48 1fty s GLY 232 Ca 0.49 -0.62 -0.26 0.00 0.00 0.00 0.00 44.72 44.33 1fty s GLY 232 CO 0.31 0.02 1.06 -0.47 0.00 0.00 0.00 173.10 174.02 1fty s TYR 233 N -3.24 2.75 -1.35 1.90 6.14 -1.26 -4.28 117.35 118.01 1fty s TYR 233 Ca 0.66 0.30 -0.12 0.00 0.64 0.00 0.00 57.07 58.55 1fty s TYR 233 Cb -0.14 -4.27 0.10 0.00 0.42 0.00 0.00 41.96 38.07 1fty s TYR 233 CO 0.54 -1.39 0.55 0.54 0.64 0.00 0.00 175.55 176.43 1fty n ARG 234 N 7.83 -3.20 0.00 4.97 3.00 -0.26 -4.83 116.66 124.17 1fty n ARG 234 Ca 0.06 0.41 0.00 0.00 -0.01 0.00 0.00 57.85 58.31 1fty n ARG 234 Cb 0.48 -5.11 0.00 0.00 0.00 0.00 0.00 32.46 27.84 1fty n ARG 234 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 1fty n ASN 235 N -2.34 1.44 -0.61 0.55 2.04 -1.26 -4.94 115.26 110.13 1fty n ASN 235 Ca 0.02 -1.67 -0.08 0.00 -0.44 0.00 0.00 54.58 52.41 1fty n ASN 235 Cb 0.52 0.00 -0.03 0.00 -2.53 0.00 0.00 39.78 37.74 1fty n ASN 235 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 1fty n ASN 236 N -0.33 -4.91 -4.74 0.53 3.02 -1.26 -0.11 115.26 107.45 1fty n ASN 236 Ca 0.00 0.20 -0.35 0.00 -0.03 0.00 0.00 54.58 54.39 1fty n ASN 236 Cb 0.27 -3.11 -0.08 0.00 -0.61 0.00 0.00 39.78 36.25 1fty n ASN 236 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1fty s VAL 237 N -1.98 5.40 -0.25 2.41 1.01 -1.26 -4.70 120.40 121.01 1fty s VAL 237 Ca 0.00 0.27 -0.01 0.00 0.00 0.00 0.00 61.98 62.23 1fty s VAL 237 Cb 0.00 -3.50 0.08 0.00 0.00 0.00 0.00 36.38 32.96 1fty s VAL 237 CO 0.00 0.45 0.05 -0.69 0.00 0.00 0.00 175.10 174.90 1fty s VAL 238 N 0.24 0.89 0.81 2.92 1.01 -1.26 0.58 120.40 125.59 1fty s VAL 238 Ca 0.10 -1.07 -0.05 0.00 0.00 0.00 0.00 61.98 60.96 1fty s VAL 238 Cb -0.12 -1.47 0.17 0.00 0.00 0.00 0.00 36.38 34.96 1fty s VAL 238 CO -0.00 -0.40 1.11 0.59 0.00 0.00 0.00 175.10 176.40 1fty n ASN 239 N 4.88 0.96 -4.21 3.32 3.02 0.74 -4.65 115.26 119.32 1fty n ASN 239 Ca -0.06 -1.93 -0.29 0.00 -0.03 0.00 0.00 54.58 52.26 1fty n ASN 239 Cb 0.44 -0.77 -0.16 0.00 -0.61 0.00 0.00 39.78 38.68 1fty n ASN 239 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1fty s THR 240 N -3.36 1.77 -0.33 3.41 2.01 -1.26 -0.37 115.64 117.51 1fty s THR 240 Ca 0.69 -0.92 -0.05 0.00 0.31 0.00 0.00 61.69 61.73 1fty s THR 240 Cb -0.03 -1.50 0.05 0.00 0.01 0.00 0.00 72.50 71.03 1fty s THR 240 CO 0.47 0.50 0.08 -0.32 -0.69 0.00 0.00 174.62 174.66 1fty s MET 241 N -0.15 2.52 -0.31 4.92 1.75 -0.03 -2.17 119.30 125.84 1fty s MET 241 Ca -0.02 -1.25 -0.13 0.00 -1.25 0.00 0.00 55.69 53.04 1fty s MET 241 Cb -0.12 -3.38 -0.03 0.00 2.84 0.00 0.00 34.83 34.14 1fty s MET 241 CO 0.02 -0.68 0.26 0.50 -0.65 0.00 0.00 175.02 174.48 1fty s ARG 242 N 1.34 3.77 -0.19 4.11 3.52 0.86 -1.20 118.95 131.17 1fty s ARG 242 Ca -0.02 -0.36 -0.03 0.00 -0.13 0.00 0.00 55.73 55.18 1fty s ARG 242 Cb -0.20 -3.72 -0.02 0.00 -1.56 0.00 0.00 34.95 29.45 1fty s ARG 242 CO 0.01 -0.33 -0.05 -0.51 -0.81 0.00 0.00 175.30 173.61 1fty s LEU 243 N 1.85 2.99 0.13 -0.88 1.02 -0.48 -1.91 118.68 121.40 1fty s LEU 243 Ca 0.09 -0.29 -0.21 0.00 0.02 0.00 0.00 54.13 53.74 1fty s LEU 243 Cb -0.16 -1.74 -0.07 0.00 0.02 0.00 0.00 46.19 44.24 1fty s LEU 243 CO 0.11 0.07 0.66 0.26 0.02 0.00 0.00 176.35 177.46 1fty s TRP 244 N 0.94 3.81 -0.02 0.29 0.52 -0.60 -1.06 118.94 122.83 1fty s TRP 244 Ca -0.00 1.40 0.08 0.00 0.02 0.00 0.00 56.10 57.59 1fty s TRP 244 Cb -0.15 -2.60 -0.02 0.00 -1.15 0.00 0.00 33.47 29.56 1fty s TRP 244 CO 0.01 0.53 -0.25 0.45 0.02 0.00 0.00 176.95 177.70 1fty s SER 245 N -1.22 3.10 0.02 2.95 0.15 0.89 -1.11 113.70 118.49 1fty s SER 245 Ca 0.33 -0.46 -0.25 0.00 0.70 0.00 0.00 55.95 56.28 1fty s SER 245 Cb -0.20 -0.38 -0.05 0.00 -1.71 0.00 0.00 66.02 63.67 1fty s SER 245 CO 0.22 0.32 0.75 0.00 1.20 0.00 0.00 173.24 175.73 1fty s ALA 246 N -0.60 3.37 0.00 5.45 0.00 -1.26 -0.14 121.76 128.57 1fty s ALA 246 Ca 0.10 0.25 0.01 0.00 0.00 0.00 0.00 51.96 52.31 1fty s ALA 246 Cb -0.10 -2.98 -0.01 0.00 0.00 0.00 0.00 23.12 20.03 1fty s ALA 246 CO -0.01 0.04 -0.03 0.15 0.00 0.00 0.00 175.76 175.91 1fty s LYS 247 N 0.09 0.28 0.18 0.00 -0.14 0.34 -4.63 119.74 115.86 1fty s LYS 247 Ca 0.38 -0.19 -0.20 0.00 -1.36 0.00 0.00 55.97 54.60 1fty s LYS 247 Cb -0.20 -0.22 -0.08 0.00 -1.68 0.00 0.00 37.83 35.65 1fty s LYS 247 CO 0.22 0.06 0.69 0.00 -0.76 0.00 0.00 175.35 175.56 1fty s ALA 248 N -0.26 3.46 0.57 5.17 0.00 -1.26 -0.00 121.76 129.44 1fty s ALA 248 Ca -0.01 0.16 -0.18 0.00 0.00 0.00 0.00 51.96 51.93 1fty s ALA 248 Cb -0.02 -2.79 -0.05 0.00 0.00 0.00 0.00 23.12 20.26 1fty s ALA 248 CO -0.00 0.34 1.11 -1.25 0.00 0.00 0.00 175.76 175.96 1fty s PRO 249 N -1.67 3.27 0.00 0.00 0.04 -1.26 -4.88 135.00 130.50 1fty s PRO 249 Ca 0.39 1.50 0.27 0.00 0.04 0.00 0.00 61.00 63.19 1fty s PRO 249 Cb -0.18 -2.01 0.90 0.00 0.04 0.00 0.00 34.50 33.26 1fty s PRO 249 CO 0.22 -0.89 1.67 0.27 0.04 0.00 0.00 177.00 178.30 1fty n ASN 250 N -1.59 0.54 0.00 6.66 6.94 -1.26 -3.85 115.26 122.70 1fty n ASN 250 Ca 0.11 -0.40 0.00 0.00 -0.02 0.00 0.00 54.58 54.27 1fty n ASN 250 Cb 0.52 0.01 0.00 0.00 -2.36 0.00 0.00 39.78 37.94 1fty n ASN 250 CO 0.00 0.00 0.00 -0.90 -1.03 0.00 0.00 177.26 175.33 1fty n ASP 251 N -1.12 0.00 -0.39 0.53 5.75 -1.26 -4.51 116.55 115.55 1fty n ASP 251 Ca 0.10 0.00 0.33 0.00 -0.01 0.00 0.00 54.79 55.21 1fty n ASP 251 Cb 0.32 0.00 0.60 0.00 -1.03 0.00 0.00 41.12 41.01 1fty n ASP 251 CO 0.00 0.00 0.00 -0.26 -0.11 0.00 0.00 177.20 176.83 1fty h PHE 252 N 0.00 0.67 0.00 2.11 0.05 -1.90 2.28 116.94 120.14 1fty h PHE 252 Ca 0.00 0.03 -0.37 0.00 3.82 0.00 0.00 57.97 61.45 1fty h PHE 252 Cb 0.00 -0.17 -0.02 0.00 2.00 0.00 0.00 35.95 37.76 1fty h PHE 252 CO 0.00 -0.23 1.44 -1.71 -0.18 0.00 0.00 178.31 177.63 1fty n ASN 253 N -4.86 6.25 0.00 2.17 5.15 -1.25 -2.61 115.26 120.11 1fty n ASN 253 Ca 0.36 -2.45 0.00 0.00 -0.60 0.00 0.00 54.58 51.88 1fty n ASN 253 Cb 1.29 -1.38 0.00 0.00 -0.53 0.00 0.00 39.78 39.16 1fty n ASN 253 CO 0.00 0.00 0.00 -0.11 1.40 0.00 0.00 177.26 178.55 1fty n LEU 254 N 3.06 0.00 0.19 1.20 -0.00 0.11 -4.74 117.00 116.81 1fty n LEU 254 Ca 0.54 0.00 0.14 0.00 -0.00 0.00 0.00 56.01 56.69 1fty n LEU 254 Cb 0.56 0.00 0.41 0.00 -0.00 0.00 0.00 43.42 44.39 1fty n LEU 254 CO 0.44 0.00 0.88 0.07 -0.00 0.00 0.00 177.39 178.79 1fty h LYS 255 N 0.00 0.00 -5.90 1.96 2.10 0.38 -3.40 116.57 111.71 1fty h LYS 255 Ca 0.00 0.00 -0.42 0.00 -2.00 0.00 0.00 60.65 58.23 1fty h LYS 255 Cb 0.00 0.00 -0.06 0.00 -0.90 0.00 0.00 32.23 31.27 1fty h LYS 255 CO 0.00 0.00 1.05 0.34 -2.00 0.00 0.00 179.45 178.84 1fty s ASP 256 N -5.36 5.60 1.03 7.07 -1.08 -1.07 -4.88 116.67 117.98 1fty s ASP 256 Ca 0.06 -0.74 -0.17 0.00 -0.52 0.00 0.00 52.55 51.18 1fty s ASP 256 Cb 0.08 -2.56 0.23 0.00 -1.46 0.00 0.00 42.92 39.22 1fty s ASP 256 CO 0.57 -2.30 1.27 0.72 0.52 0.00 0.00 175.17 175.96 1fty s PHE 257 N 8.26 1.22 0.00 -5.34 -0.71 -1.26 -4.93 117.98 115.21 1fty s PHE 257 Ca 0.61 0.34 0.00 0.00 -1.04 0.00 0.00 56.93 56.83 1fty s PHE 257 Cb -0.06 -3.98 0.00 0.00 -1.21 0.00 0.00 43.02 37.77 1fty s PHE 257 CO 0.01 -3.03 0.00 0.09 -1.34 0.00 0.00 175.22 170.95 1fty n ASN 258 N -4.06 -0.37 -1.27 1.98 4.13 -1.26 -5.05 115.26 109.36 1fty n ASN 258 Ca 0.15 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.41 1fty n ASN 258 Cb 0.59 -0.13 0.00 0.00 -1.54 0.00 0.00 39.78 38.70 1fty n ASN 258 CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06 1fty n VAL 259 N -0.24 -4.06 0.00 2.41 0.31 -1.26 -5.04 118.33 110.45 1fty n VAL 259 Ca 0.00 1.78 0.00 0.00 -0.01 0.00 0.00 64.34 66.11 1fty n VAL 259 Cb 0.09 -2.52 0.00 0.00 -0.91 0.00 0.00 33.84 30.51 1fty n VAL 259 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1fty n GLY 260 N -1.19 1.73 0.00 2.92 0.00 -1.26 -5.11 105.19 102.28 1fty n GLY 260 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1fty n GLY 260 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1fty n GLY 261 N 0.00 3.93 0.18 -0.02 0.00 -1.26 -4.77 105.19 103.25 1fty n GLY 261 Ca 0.00 -1.30 -0.14 0.00 0.00 0.00 0.00 46.02 44.59 1fty n GLY 261 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1fty h TYR 262 N 0.00 0.69 0.09 1.61 3.20 -1.99 -2.16 116.97 118.41 1fty h TYR 262 Ca 0.00 -0.22 -0.00 0.00 3.14 0.00 0.00 58.73 61.64 1fty h TYR 262 Cb 0.00 -0.14 0.00 0.00 1.54 0.00 0.00 36.73 38.13 1fty h TYR 262 CO 0.00 0.93 -0.04 0.82 -1.64 0.00 0.00 178.16 178.23 1fty h ILE 263 N 0.24 0.92 -0.94 1.81 1.08 -2.00 -2.48 117.51 116.14 1fty h ILE 263 Ca 0.03 -0.02 0.05 0.00 -0.39 0.00 0.00 64.86 64.53 1fty h ILE 263 Cb 0.84 0.93 -0.06 0.00 -3.07 0.00 0.00 36.82 35.46 1fty h ILE 263 CO 0.06 0.00 0.61 1.56 -0.69 0.00 0.00 178.15 179.70 1fty h GLN 264 N -0.13 1.10 -0.62 2.37 1.08 -1.86 -0.94 115.11 116.12 1fty h GLN 264 Ca -0.01 -0.07 -0.02 0.00 -1.45 0.00 0.00 58.65 57.10 1fty h GLN 264 Cb 0.10 -0.25 -0.03 0.00 -0.05 0.00 0.00 27.48 27.25 1fty h GLN 264 CO 0.02 0.73 0.29 0.00 -0.95 0.00 0.00 178.83 178.92 1fty h ALA 265 N 1.47 1.34 -0.07 3.87 0.00 -1.12 0.74 119.26 125.49 1fty h ALA 265 Ca 0.39 -0.13 -0.25 0.00 0.00 0.00 0.00 54.91 54.92 1fty h ALA 265 Cb 0.09 -0.25 0.02 0.00 0.00 0.00 0.00 17.79 17.65 1fty h ALA 265 CO -0.13 0.51 -0.92 0.28 0.00 0.00 0.00 179.25 178.98 1fty h VAL 266 N 0.87 1.28 0.00 0.00 2.07 -0.92 -3.17 116.25 116.39 1fty h VAL 266 Ca 0.21 -2.14 -0.08 0.00 0.82 0.00 0.00 66.70 65.52 1fty h VAL 266 Cb 0.11 2.20 -0.01 0.00 -1.52 0.00 0.00 31.29 32.07 1fty h VAL 266 CO -0.03 0.67 -0.38 -0.07 0.02 0.00 0.00 177.57 177.78 1fty h LEU 267 N 0.45 0.00 0.00 2.57 3.38 -0.86 -2.76 115.31 118.09 1fty h LEU 267 Ca -0.09 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1fty h LEU 267 Cb 1.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.31 1fty h LEU 267 CO 0.18 0.38 0.00 0.47 0.09 0.00 0.00 178.44 179.56 1fty n ASP 268 N -3.87 0.00 0.20 -0.43 8.00 0.22 -3.01 116.55 117.66 1fty n ASP 268 Ca -0.01 -0.03 0.06 0.00 0.71 0.00 0.00 54.79 55.51 1fty n ASP 268 Cb 0.44 -0.29 0.55 0.00 -0.02 0.00 0.00 41.12 41.80 1fty n ASP 268 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 1fty h ARG 269 N 0.00 0.10 -3.98 -1.24 3.08 -1.53 -3.11 114.38 107.71 1fty h ARG 269 Ca 0.00 -0.01 -0.70 0.00 0.07 0.00 0.00 59.98 59.34 1fty h ARG 269 Cb 0.22 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.22 1fty h ARG 269 CO 0.00 0.14 3.12 0.09 -1.07 0.00 0.00 179.97 182.25 1fty n ASN 270 N -4.45 4.03 0.00 7.04 3.02 -1.17 -1.84 115.26 121.89 1fty n ASN 270 Ca -0.02 -2.81 0.00 0.00 -0.03 0.00 0.00 54.58 51.72 1fty n ASN 270 Cb 0.14 -1.62 0.00 0.00 -0.61 0.00 0.00 39.78 37.69 1fty n ASN 270 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1fty n LEU 271 N 6.06 0.00 0.02 3.41 7.94 -1.17 -4.75 117.00 128.50 1fty n LEU 271 Ca 0.53 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.43 1fty n LEU 271 Cb 0.38 0.00 -0.10 0.00 0.53 0.00 0.00 43.42 44.24 1fty n LEU 271 CO 0.91 0.00 -0.42 0.00 -1.11 0.00 0.00 177.39 176.76 1fty n ALA 272 N -0.89 1.98 1.10 1.96 0.00 -0.77 -3.95 120.51 119.94 1fty n ALA 272 Ca 0.00 -0.62 0.13 0.00 0.00 0.00 0.00 53.44 52.95 1fty n ALA 272 Cb 0.00 -0.86 0.41 0.00 0.00 0.00 0.00 19.45 19.00 1fty n ALA 272 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1fty n GLU 273 N -2.81 0.22 0.21 0.00 1.02 -1.15 -3.41 120.64 114.72 1fty n GLU 273 Ca -0.11 -0.10 0.15 0.00 -0.02 0.00 0.00 57.16 57.07 1fty n GLU 273 Cb 0.84 -1.50 0.58 0.00 -0.02 0.00 0.00 31.44 31.35 1fty n GLU 273 CO 0.00 0.00 0.00 -0.91 1.18 0.00 0.00 177.13 177.40 1fty h ASN 274 N 0.24 0.00 -0.96 1.62 2.35 -1.86 -3.17 115.58 113.80 1fty h ASN 274 Ca 0.00 0.00 0.13 0.00 -0.55 0.00 0.00 56.30 55.88 1fty h ASN 274 Cb 0.48 0.00 -0.08 0.00 0.05 0.00 0.00 38.32 38.77 1fty h ASN 274 CO 0.00 0.00 0.61 0.40 -1.65 0.00 0.00 177.43 176.79 1fty h ILE 275 N 0.00 0.88 -0.35 2.81 2.04 -1.79 -2.06 117.51 119.03 1fty h ILE 275 Ca 0.00 -0.30 -0.04 0.00 1.00 0.00 0.00 64.86 65.52 1fty h ILE 275 Cb 0.48 -0.07 -0.03 0.00 -0.74 0.00 0.00 36.82 36.46 1fty h ILE 275 CO 0.00 0.16 0.02 -1.54 0.00 0.00 0.00 178.15 176.79 1fty n SER 276 N -4.60 4.03 -0.00 1.72 3.41 -1.20 -4.69 113.62 112.28 1fty n SER 276 Ca 0.19 -3.12 -0.18 0.00 -0.26 0.00 0.00 58.87 55.50 1fty n SER 276 Cb 0.41 -0.59 -0.09 0.00 -0.26 0.00 0.00 64.21 63.67 1fty n SER 276 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1fty h ARG 277 N 2.03 0.63 -3.48 4.33 9.65 -1.48 -2.65 114.38 123.41 1fty h ARG 277 Ca 0.05 -0.58 -0.17 0.00 -1.10 0.00 0.00 59.98 58.18 1fty h ARG 277 Cb 1.62 0.14 -0.24 0.00 -1.39 0.00 0.00 29.97 30.10 1fty h ARG 277 CO 0.33 1.19 -0.54 0.54 2.80 0.00 0.00 179.97 184.29 1fty s VAL 278 N -3.52 0.04 0.26 0.20 0.11 -1.26 -1.36 120.40 114.86 1fty s VAL 278 Ca -0.11 -0.33 -0.28 0.00 -2.93 0.00 0.00 61.98 58.33 1fty s VAL 278 Cb 0.06 -0.30 -0.09 0.00 -1.53 0.00 0.00 36.38 34.53 1fty s VAL 278 CO 0.87 -0.18 0.92 -0.22 -3.33 0.00 0.00 175.10 173.16 1fty s LEU 279 N -0.59 4.53 -0.13 2.54 2.96 -0.95 -5.00 118.68 122.03 1fty s LEU 279 Ca -0.07 1.86 -0.29 0.00 -0.22 0.00 0.00 54.13 55.41 1fty s LEU 279 Cb -0.04 -3.72 -0.02 0.00 0.50 0.00 0.00 46.19 42.92 1fty s LEU 279 CO 0.01 0.08 1.17 -0.31 -1.32 0.00 0.00 176.35 175.98 1fty s TYR 280 N -1.34 3.13 0.00 5.38 1.51 -1.26 -4.88 117.35 119.89 1fty s TYR 280 Ca 0.44 1.23 0.00 0.00 -1.01 0.00 0.00 57.07 57.72 1fty s TYR 280 Cb -0.23 -3.40 0.00 0.00 -0.11 0.00 0.00 41.96 38.22 1fty s TYR 280 CO 0.28 -1.19 1.12 -0.35 -1.11 0.00 0.00 175.55 174.30 1fty n PRO 281 N 5.88 0.90 -3.55 -1.71 -0.04 -1.26 -4.87 135.00 130.35 1fty n PRO 281 Ca 0.12 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.21 1fty n PRO 281 Cb 0.46 -1.05 -0.08 0.00 -0.04 0.00 0.00 33.50 32.79 1fty n PRO 281 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1fty s ASN 282 N 1.23 6.30 -0.21 3.54 0.01 -1.26 -4.43 114.94 120.12 1fty s ASN 282 Ca 0.00 0.34 -0.03 0.00 -0.71 0.00 0.00 52.86 52.45 1fty s ASN 282 Cb 0.00 -2.16 -0.01 0.00 0.41 0.00 0.00 41.25 39.49 1fty s ASN 282 CO 0.00 0.03 -0.05 -0.62 -1.51 0.00 0.00 177.10 174.95 1fty s ASP 283 N 0.87 4.32 -1.40 -1.22 2.15 -1.26 -4.62 116.67 115.51 1fty s ASP 283 Ca 0.13 -0.36 -0.07 0.00 0.43 0.00 0.00 52.55 52.68 1fty s ASP 283 Cb -0.14 -1.73 0.04 0.00 -0.30 0.00 0.00 42.92 40.79 1fty s ASP 283 CO 0.05 0.01 0.87 0.59 -0.17 0.00 0.00 175.17 176.52 1fty n ASN 284 N 4.57 -3.14 -3.67 -0.34 3.02 -1.26 -4.97 115.26 109.46 1fty n ASN 284 Ca -0.18 -0.77 -0.12 0.00 -0.03 0.00 0.00 54.58 53.48 1fty n ASN 284 Cb 0.51 -4.10 -0.08 0.00 -0.61 0.00 0.00 39.78 35.50 1fty n ASN 284 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1fty s PHE 285 N -3.48 -0.74 -0.17 3.10 5.36 -1.26 -4.34 117.98 116.46 1fty s PHE 285 Ca 0.33 1.66 -0.06 0.00 -0.96 0.00 0.00 56.93 57.90 1fty s PHE 285 Cb -0.16 0.32 -0.04 0.00 -0.34 0.00 0.00 43.02 42.80 1fty s PHE 285 CO 0.81 -0.37 0.03 0.12 -1.46 0.00 0.00 175.22 174.36 1fty s PHE 286 N 0.79 3.19 -0.22 10.12 2.19 0.16 -4.87 117.98 129.33 1fty s PHE 286 Ca -0.04 -0.02 0.02 0.00 0.33 0.00 0.00 56.93 57.23 1fty s PHE 286 Cb -0.05 -2.04 0.05 0.00 -1.31 0.00 0.00 43.02 39.67 1fty s PHE 286 CO -0.06 0.12 -0.13 -1.21 1.83 0.00 0.00 175.22 175.77 1fty s GLU 287 N 0.31 2.36 -1.52 10.12 2.02 -1.26 -4.96 118.70 125.77 1fty s GLU 287 Ca 0.01 -1.07 -0.12 0.00 0.02 0.00 0.00 54.97 53.81 1fty s GLU 287 Cb -0.13 -2.68 -0.01 0.00 0.10 0.00 0.00 34.13 31.42 1fty s GLU 287 CO 0.01 -0.44 2.54 0.41 0.02 0.00 0.00 175.26 177.80 1fty n GLY 288 N 4.55 4.39 3.91 -1.39 0.00 -1.26 -4.94 105.19 110.45 1fty n GLY 288 Ca -0.16 -1.59 -0.31 0.00 0.00 0.00 0.00 46.02 43.96 1fty n GLY 288 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fty s LYS 289 N 2.50 3.54 0.17 1.61 -0.14 -1.26 -5.01 119.74 121.14 1fty s LYS 289 Ca 0.57 -0.25 -0.12 0.00 -1.36 0.00 0.00 55.97 54.81 1fty s LYS 289 Cb 0.16 -2.94 0.08 0.00 -1.68 0.00 0.00 37.83 33.44 1fty s LYS 289 CO -0.07 0.54 1.75 1.49 -0.76 0.00 0.00 175.35 178.29 1fty h GLU 290 N 2.98 0.87 -0.97 1.68 4.81 -2.00 -2.75 114.58 119.20 1fty h GLU 290 Ca -0.46 -0.14 0.13 0.00 -0.13 0.00 0.00 59.36 58.76 1fty h GLU 290 Cb 1.16 -0.15 -0.08 0.00 0.63 0.00 0.00 28.75 30.31 1fty h GLU 290 CO 0.74 0.72 0.62 1.25 -0.73 0.00 0.00 179.01 181.60 1fty h LEU 291 N 0.81 0.86 0.05 1.64 5.85 -1.99 -0.30 115.31 122.24 1fty h LEU 291 Ca 0.20 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.96 1fty h LEU 291 Cb 0.15 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.05 1fty h LEU 291 CO -0.02 0.45 -0.03 -0.09 -0.34 0.00 0.00 178.44 178.41 1fty h ARG 292 N 0.92 -0.07 -0.62 1.25 1.12 -1.86 -1.41 114.38 113.71 1fty h ARG 292 Ca 0.48 0.00 0.08 0.00 -1.11 0.00 0.00 59.98 59.43 1fty h ARG 292 Cb 0.54 0.02 -0.04 0.00 -0.01 0.00 0.00 29.97 30.48 1fty h ARG 292 CO -0.25 0.17 0.41 1.25 -3.11 0.00 0.00 179.97 178.44 1fty h LEU 293 N -0.30 0.49 -0.46 3.80 5.85 -1.11 0.29 115.31 123.88 1fty h LEU 293 Ca -0.01 0.01 -0.15 0.00 0.84 0.00 0.00 57.88 58.57 1fty h LEU 293 Cb 0.27 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.19 1fty h LEU 293 CO 0.01 0.31 -0.32 0.11 -0.34 0.00 0.00 178.44 178.21 1fty h LYS 294 N 0.55 0.94 -0.76 1.25 1.57 -0.84 -1.86 116.57 117.42 1fty h LYS 294 Ca 0.28 -0.45 -0.05 0.00 -1.87 0.00 0.00 60.65 58.56 1fty h LYS 294 Cb 0.38 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.65 1fty h LYS 294 CO -0.08 1.12 0.29 1.96 -0.57 0.00 0.00 179.45 182.16 1fty h GLN 295 N 0.79 1.14 -0.49 3.15 4.20 -0.04 -0.56 115.11 123.29 1fty h GLN 295 Ca 0.08 -0.21 -0.10 0.00 0.06 0.00 0.00 58.65 58.48 1fty h GLN 295 Cb 0.90 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 28.48 1fty h GLN 295 CO 0.08 0.93 -0.11 0.93 -0.67 0.00 0.00 178.83 179.99 1fty h GLU 296 N 1.11 0.91 0.08 1.46 5.08 -0.72 -2.64 114.58 119.86 1fty h GLU 296 Ca 0.25 -0.32 -0.26 0.00 -1.00 0.00 0.00 59.36 58.03 1fty h GLU 296 Cb 0.23 -0.07 0.01 0.00 0.50 0.00 0.00 28.75 29.42 1fty h GLU 296 CO -0.02 0.97 -1.14 -0.92 -1.00 0.00 0.00 179.01 176.90 1fty h TYR 297 N 0.81 0.65 -0.00 4.33 3.20 -1.19 -3.19 116.97 121.58 1fty h TYR 297 Ca 0.13 -0.41 0.03 0.00 3.14 0.00 0.00 58.73 61.62 1fty h TYR 297 Cb 0.64 -0.05 -0.05 0.00 1.54 0.00 0.00 36.73 38.81 1fty h TYR 297 CO 0.04 1.28 -0.26 0.35 -1.64 0.00 0.00 178.16 177.92 1fty h PHE 298 N 0.17 -0.70 -0.31 -3.82 3.57 -1.02 0.29 116.94 115.12 1fty h PHE 298 Ca -0.13 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.33 1fty h PHE 298 Cb 1.82 0.31 -0.02 0.00 2.79 0.00 0.00 35.95 40.85 1fty h PHE 298 CO 0.07 -0.35 -0.07 -0.24 -2.23 0.00 0.00 178.31 175.49 1fty h VAL 299 N -0.40 1.22 -0.00 1.41 3.04 -1.60 -2.48 116.25 117.44 1fty h VAL 299 Ca 0.06 -0.91 -0.00 0.00 -1.01 0.00 0.00 66.70 64.84 1fty h VAL 299 Cb 0.49 1.06 0.00 0.00 -2.01 0.00 0.00 31.29 30.83 1fty h VAL 299 CO -0.23 0.30 -0.00 0.58 -1.01 0.00 0.00 177.57 177.21 1fty h VAL 300 N 0.48 1.46 -0.39 1.51 2.07 -1.43 -2.49 116.25 117.46 1fty h VAL 300 Ca 0.09 -1.36 -0.00 0.00 0.82 0.00 0.00 66.70 66.26 1fty h VAL 300 Cb 0.42 2.38 -0.02 0.00 -1.52 0.00 0.00 31.29 32.55 1fty h VAL 300 CO 0.02 0.35 0.24 0.00 0.02 0.00 0.00 177.57 178.20 1fty h ALA 301 N 0.42 0.50 -0.09 1.67 0.00 -0.43 -1.37 119.26 119.96 1fty h ALA 301 Ca 0.00 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 1fty h ALA 301 Cb 0.58 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 1fty h ALA 301 CO 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 179.25 179.24 1fty h ALA 302 N 1.11 0.12 -0.39 0.00 0.00 -1.56 -3.09 119.26 115.45 1fty h ALA 302 Ca 0.14 -0.19 0.02 0.00 0.00 0.00 0.00 54.91 54.89 1fty h ALA 302 Cb -0.00 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1fty h ALA 302 CO -0.03 -0.18 0.21 1.15 0.00 0.00 0.00 179.25 180.40 1fty h THR 303 N -0.13 1.00 -0.74 0.00 2.02 -1.39 -2.80 112.91 110.88 1fty h THR 303 Ca 0.03 -0.15 0.01 0.00 0.77 0.00 0.00 66.41 67.07 1fty h THR 303 Cb 0.37 0.54 -0.04 0.00 -1.74 0.00 0.00 68.15 67.29 1fty h THR 303 CO 0.01 0.08 0.49 -0.07 0.37 0.00 0.00 175.52 176.39 1fty h LEU 304 N 0.42 0.85 -0.97 2.58 3.38 -1.29 0.42 115.31 120.71 1fty h LEU 304 Ca 0.16 -0.02 -0.08 0.00 0.09 0.00 0.00 57.88 58.03 1fty h LEU 304 Cb 0.04 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1fty h LEU 304 CO -0.10 0.61 -0.10 1.56 0.09 0.00 0.00 178.44 180.51 1fty h GLN 305 N 1.00 0.64 -0.31 1.13 4.20 -1.42 -0.59 115.11 119.75 1fty h GLN 305 Ca 0.27 -0.19 -0.15 0.00 0.06 0.00 0.00 58.65 58.64 1fty h GLN 305 Cb -0.12 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 27.59 1fty h GLN 305 CO -0.06 0.73 -0.41 0.22 -0.67 0.00 0.00 178.83 178.65 1fty h ASP 306 N 0.59 0.82 -0.31 1.46 -0.00 -1.07 -1.75 116.42 116.17 1fty h ASP 306 Ca 0.11 -0.38 -0.07 0.00 -0.00 0.00 0.00 57.03 56.69 1fty h ASP 306 Cb 0.52 -0.23 -0.01 0.00 -0.00 0.00 0.00 39.33 39.61 1fty h ASP 306 CO 0.03 1.12 -0.10 0.40 -0.00 0.00 0.00 179.24 180.69 1fty h ILE 307 N 0.63 1.28 -0.20 2.25 2.04 -0.49 -2.71 117.51 120.31 1fty h ILE 307 Ca 0.05 -1.16 -0.13 0.00 1.00 0.00 0.00 64.86 64.62 1fty h ILE 307 Cb 0.96 1.40 -0.01 0.00 -0.74 0.00 0.00 36.82 38.43 1fty h ILE 307 CO 0.09 0.37 -0.44 0.40 0.00 0.00 0.00 178.15 178.58 1fty h ILE 308 N 0.38 1.31 -0.25 -0.67 2.04 -1.10 -2.14 117.51 117.07 1fty h ILE 308 Ca 0.08 -1.62 -0.00 0.00 1.00 0.00 0.00 64.86 64.32 1fty h ILE 308 Cb 0.60 1.64 -0.01 0.00 -0.74 0.00 0.00 36.82 38.30 1fty h ILE 308 CO 0.04 0.50 0.14 -0.09 0.00 0.00 0.00 178.15 178.74 1fty h ARG 309 N 0.39 0.35 -0.74 2.37 2.43 -1.29 0.70 114.38 118.59 1fty h ARG 309 Ca 0.03 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 1fty h ARG 309 Cb 0.92 -0.07 -0.04 0.00 -0.42 0.00 0.00 29.97 30.37 1fty h ARG 309 CO 0.08 0.31 0.43 -0.09 -1.51 0.00 0.00 179.97 179.18 1fty h ARG 310 N 0.30 1.02 -0.44 0.20 2.43 -1.40 -2.36 114.38 114.13 1fty h ARG 310 Ca 0.09 -0.10 -0.13 0.00 -0.81 0.00 0.00 59.98 59.03 1fty h ARG 310 Cb 0.06 -0.21 -0.01 0.00 -0.42 0.00 0.00 29.97 29.39 1fty h ARG 310 CO -0.01 0.73 -0.24 0.35 -1.51 0.00 0.00 179.97 179.28 1fty h PHE 311 N 1.03 1.10 0.00 2.20 3.57 -0.87 -1.96 116.94 122.00 1fty h PHE 311 Ca 0.26 -0.28 -0.01 0.00 3.53 0.00 0.00 57.97 61.47 1fty h PHE 311 Cb -0.01 -0.25 -0.00 0.00 2.79 0.00 0.00 35.95 38.48 1fty h PHE 311 CO 0.01 1.10 -0.05 0.87 -2.23 0.00 0.00 178.31 178.00 1fty h LYS 312 N 0.78 0.00 0.00 1.11 1.57 -0.37 -3.19 116.57 116.48 1fty h LYS 312 Ca 0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1fty h LYS 312 Cb 0.82 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.13 1fty h LYS 312 CO 0.07 0.05 0.00 0.43 -0.57 0.00 0.00 179.45 179.43 1fty n SER 313 N -3.98 0.00 0.00 0.86 7.64 -1.00 -2.12 113.62 115.02 1fty n SER 313 Ca -0.03 0.36 0.00 0.00 1.01 0.00 0.00 58.87 60.21 1fty n SER 313 Cb 0.14 -0.45 0.00 0.00 -1.01 0.00 0.00 64.21 62.89 1fty n SER 313 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1fty n SER 314 N -1.96 0.00 0.00 6.43 7.64 -0.75 0.92 113.62 125.90 1fty n SER 314 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1fty n SER 314 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1fty n SER 314 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1fty n LYS 315 N 5.23 0.82 -0.05 1.43 4.01 -1.26 -4.58 118.16 123.76 1fty n LYS 315 Ca 0.00 -0.76 -0.10 0.00 -0.51 0.00 0.00 58.31 56.94 1fty n LYS 315 Cb 0.00 -0.77 -0.15 0.00 -0.51 0.00 0.00 35.03 33.60 1fty n LYS 315 CO 0.00 0.00 0.00 1.19 -1.11 0.00 0.00 177.40 177.48 1fty n PHE 316 N -0.17 0.68 -0.93 2.13 3.72 -1.09 -2.76 117.46 119.03 1fty n PHE 316 Ca 0.00 0.24 -0.13 0.00 -0.05 0.00 0.00 57.45 57.50 1fty n PHE 316 Cb 0.27 -1.12 -0.03 0.00 -0.94 0.00 0.00 39.48 37.65 1fty n PHE 316 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1fty n GLY 317 N 1.66 3.50 2.22 1.37 0.00 0.26 -3.20 105.19 111.00 1fty n GLY 317 Ca -0.23 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 44.80 1fty n GLY 317 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fty n ARG 319 N -3.49 0.00 0.00 0.00 0.00 -1.11 -5.07 116.66 106.99 1fty n ARG 319 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 1fty n ARG 319 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 32.46 32.46 1fty n ARG 319 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1fty n ASP 320 N 0.00 0.00 0.30 2.89 8.00 -1.24 -2.60 116.55 123.90 1fty n ASP 320 Ca 0.00 0.00 0.18 0.00 0.71 0.00 0.00 54.79 55.68 1fty n ASP 320 Cb 0.00 0.00 0.92 0.00 -0.02 0.00 0.00 41.12 42.02 1fty n ASP 320 CO 0.00 0.00 0.00 1.55 -0.39 0.00 0.00 177.20 178.36 1fty h PRO 321 N 0.00 0.00 -3.97 -0.24 0.13 -1.94 -3.48 132.00 122.49 1fty h PRO 321 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1fty h PRO 321 Cb 0.00 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 31.07 1fty h PRO 321 CO 0.00 0.03 -0.83 0.28 -0.23 0.00 0.00 178.00 177.25 1fty n VAL 322 N -3.27 -8.74 0.00 1.56 0.31 -1.07 -5.07 118.33 102.05 1fty n VAL 322 Ca -0.02 1.69 0.00 0.00 -0.01 0.00 0.00 64.34 66.00 1fty n VAL 322 Cb 0.18 -5.14 0.00 0.00 -0.91 0.00 0.00 33.84 27.97 1fty n VAL 322 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1fty n ARG 323 N 1.01 0.00 -1.43 5.55 3.00 -1.26 -4.98 116.66 118.55 1fty n ARG 323 Ca -0.18 0.00 -0.11 0.00 -0.00 0.00 0.00 57.85 57.56 1fty n ARG 323 Cb 0.28 0.00 -0.09 0.00 0.00 0.00 0.00 32.46 32.64 1fty n ARG 323 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.63 180.04 1fty n THR 324 N 0.00 0.00 -3.19 5.15 -1.04 -1.26 -4.81 114.28 109.14 1fty n THR 324 Ca 0.00 -0.22 -0.42 0.00 -2.04 0.00 0.00 64.05 61.37 1fty n THR 324 Cb 0.00 -1.41 -0.07 0.00 -1.82 0.00 0.00 70.33 67.03 1fty n THR 324 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 1fty s ASN 325 N 6.36 6.32 0.00 8.00 0.02 -1.26 -4.90 114.94 129.48 1fty s ASN 325 Ca 0.67 -0.19 0.00 0.00 -1.02 0.00 0.00 52.86 52.32 1fty s ASN 325 Cb -0.10 -2.29 0.00 0.00 0.02 0.00 0.00 41.25 38.88 1fty s ASN 325 CO 0.15 -0.61 0.99 0.49 0.02 0.00 0.00 177.10 178.14 1fty n PHE 326 N 5.95 0.00 0.23 2.20 3.72 -1.26 -3.69 117.46 124.61 1fty n PHE 326 Ca -0.03 0.00 0.08 0.00 -0.05 0.00 0.00 57.45 57.45 1fty n PHE 326 Cb 0.48 -0.00 0.54 0.00 -0.94 0.00 0.00 39.48 39.56 1fty n PHE 326 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 1fty h ASP 327 N 0.00 0.00 -0.04 4.37 5.19 -1.97 -1.78 116.42 122.18 1fty h ASP 327 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1fty h ASP 327 Cb 0.01 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.52 1fty h ASP 327 CO 0.00 0.23 0.00 0.00 -3.12 0.00 0.00 179.24 176.35 1fty n ALA 328 N -2.34 2.52 -0.05 3.45 0.00 -1.24 -4.40 120.51 118.44 1fty n ALA 328 Ca -0.01 -0.58 -0.08 0.00 0.00 0.00 0.00 53.44 52.77 1fty n ALA 328 Cb 0.33 -1.00 -0.01 0.00 0.00 0.00 0.00 19.45 18.77 1fty n ALA 328 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1fty h PHE 329 N 3.46 -0.52 0.00 0.00 3.04 -1.56 -0.71 116.94 120.64 1fty h PHE 329 Ca 0.00 0.03 -0.00 0.00 3.98 0.00 0.00 57.97 61.98 1fty h PHE 329 Cb 0.74 0.27 -0.00 0.00 2.56 0.00 0.00 35.95 39.51 1fty h PHE 329 CO 0.01 -0.28 -0.02 -1.35 -2.02 0.00 0.00 178.31 174.65 1fty h PRO 330 N -0.20 0.00 0.00 6.41 0.11 -1.78 0.43 132.00 136.97 1fty h PRO 330 Ca 0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.25 1fty h PRO 330 Cb 0.41 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.52 1fty h PRO 330 CO -0.36 0.02 -0.18 -0.44 -0.21 0.00 0.00 178.00 176.83 1fty h ASP 331 N 0.00 0.00 0.00 -2.05 3.32 -1.43 -3.31 116.42 112.95 1fty h ASP 331 Ca -0.00 -0.05 0.00 0.00 0.02 0.00 0.00 57.03 57.00 1fty h ASP 331 Cb 0.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.72 1fty h ASP 331 CO 0.00 0.02 -0.66 0.29 -1.72 0.00 0.00 179.24 177.17 1fty n LYS 332 N -2.39 3.09 -4.30 3.56 4.76 -0.33 -4.58 118.16 117.98 1fty n LYS 332 Ca 0.05 -0.02 -0.18 0.00 -2.87 0.00 0.00 58.31 55.29 1fty n LYS 332 Cb 0.45 -0.89 -0.14 0.00 -1.84 0.00 0.00 35.03 32.62 1fty n LYS 332 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1fty s VAL 333 N -1.82 0.84 -0.11 -0.18 1.01 0.14 -1.04 120.40 119.24 1fty s VAL 333 Ca 0.00 -0.75 -0.04 0.00 0.00 0.00 0.00 61.98 61.19 1fty s VAL 333 Cb 0.03 -0.76 0.06 0.00 0.00 0.00 0.00 36.38 35.71 1fty s VAL 333 CO 0.18 0.02 0.22 0.00 0.00 0.00 0.00 175.10 175.53 1fty s ALA 334 N -0.67 -0.41 -0.16 5.51 0.00 -0.65 -4.48 121.76 120.90 1fty s ALA 334 Ca 0.00 0.80 0.01 0.00 0.00 0.00 0.00 51.96 52.78 1fty s ALA 334 Cb -0.06 -0.91 0.01 0.00 0.00 0.00 0.00 23.12 22.15 1fty s ALA 334 CO 0.00 -0.57 -0.18 0.96 0.00 0.00 0.00 175.76 175.97 1fty s ILE 335 N 2.26 2.35 -0.23 0.00 -4.36 -0.38 0.05 121.20 120.89 1fty s ILE 335 Ca 0.01 -0.87 -0.11 0.00 -0.26 0.00 0.00 60.65 59.42 1fty s ILE 335 Cb -0.12 -1.97 -0.05 0.00 1.25 0.00 0.00 42.46 41.57 1fty s ILE 335 CO -0.07 0.53 0.16 -1.58 0.24 0.00 0.00 174.94 174.22 1fty s GLN 336 N 0.92 4.11 -0.47 0.37 2.00 0.17 -2.22 119.66 124.54 1fty s GLN 336 Ca -0.04 -0.23 -0.19 0.00 -2.00 0.00 0.00 55.36 52.90 1fty s GLN 336 Cb -0.15 -3.51 0.04 0.00 0.80 0.00 0.00 33.01 30.20 1fty s GLN 336 CO -0.03 0.12 0.57 -0.51 -0.50 0.00 0.00 175.29 174.95 1fty s LEU 337 N 0.87 4.85 -0.95 3.68 1.02 0.80 -2.05 118.68 126.90 1fty s LEU 337 Ca 0.08 -0.73 -0.24 0.00 0.02 0.00 0.00 54.13 53.26 1fty s LEU 337 Cb -0.13 -2.49 0.02 0.00 0.02 0.00 0.00 46.19 43.61 1fty s LEU 337 CO 0.03 -0.78 1.59 0.21 0.02 0.00 0.00 176.35 177.42 1fty s ASN 338 N 2.30 6.04 0.14 2.29 2.47 -0.89 -1.70 114.94 125.60 1fty s ASN 338 Ca 0.16 -1.09 0.00 0.00 0.42 0.00 0.00 52.86 52.35 1fty s ASN 338 Cb -0.18 -2.56 0.00 0.00 -1.45 0.00 0.00 41.25 37.06 1fty s ASN 338 CO 0.14 -1.92 0.00 -0.67 -3.72 0.00 0.00 177.10 170.93 1fty n ASP 339 N 10.52 -0.82 -0.33 -4.21 4.64 -0.69 -4.28 116.55 121.39 1fty n ASP 339 Ca 0.32 0.00 0.14 0.00 -1.38 0.00 0.00 54.79 53.87 1fty n ASP 339 Cb 0.50 0.00 0.52 0.00 -1.04 0.00 0.00 41.12 41.10 1fty n ASP 339 CO 0.00 0.00 0.00 0.35 -0.82 0.00 0.00 177.20 176.73 1fty n THR 340 N -0.26 0.00 -0.27 5.18 -2.24 -1.26 -4.37 114.28 111.06 1fty n THR 340 Ca 0.00 -0.17 0.04 0.00 -2.27 0.00 0.00 64.05 61.65 1fty n THR 340 Cb 0.00 0.32 0.18 0.00 -2.10 0.00 0.00 70.33 68.73 1fty n THR 340 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 1fty h HIS 341 N 1.63 0.67 -0.78 4.78 3.86 -1.96 -0.19 115.15 123.18 1fty h HIS 341 Ca 0.00 0.03 -0.31 0.00 -1.16 0.00 0.00 60.37 58.93 1fty h HIS 341 Cb 0.45 -0.18 -0.18 0.00 1.06 0.00 0.00 27.41 28.55 1fty h HIS 341 CO 0.00 0.19 0.39 -0.35 0.86 0.00 0.00 177.93 179.02 1fty n PRO 342 N -4.88 2.99 0.30 2.45 -0.04 -1.26 -4.58 135.00 129.97 1fty n PRO 342 Ca 0.14 -2.79 0.17 0.00 -0.04 0.00 0.00 63.50 60.98 1fty n PRO 342 Cb 0.36 -2.12 0.97 0.00 -0.04 0.00 0.00 33.50 32.67 1fty n PRO 342 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1fty h SER 343 N 1.86 0.00 0.30 3.54 4.64 -1.29 -1.91 113.55 120.70 1fty h SER 343 Ca 0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.70 1fty h SER 343 Cb 2.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.50 1fty h SER 343 CO 0.82 0.00 0.00 0.18 -0.87 0.00 0.00 176.83 176.96 1fty n LEU 344 N -3.70 0.00 -0.12 5.97 4.77 -1.26 -2.17 117.00 120.49 1fty n LEU 344 Ca -0.03 0.40 0.04 0.00 -0.03 0.00 0.00 56.01 56.40 1fty n LEU 344 Cb 0.09 -0.40 0.36 0.00 -2.33 0.00 0.00 43.42 41.13 1fty n LEU 344 CO 0.26 -0.25 1.20 0.00 -1.33 0.00 0.00 177.39 177.27 1fty h ALA 345 N 2.45 1.66 0.70 -1.18 0.00 -1.71 -0.80 119.26 120.38 1fty h ALA 345 Ca 0.00 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 1fty h ALA 345 Cb 0.15 -0.21 0.01 0.00 0.00 0.00 0.00 17.79 17.74 1fty h ALA 345 CO 0.00 0.28 -0.34 0.82 0.00 0.00 0.00 179.25 180.01 1fty h ILE 346 N 0.73 0.00 0.00 0.00 2.04 -1.68 0.75 117.51 119.36 1fty h ILE 346 Ca 0.24 -0.10 -0.02 0.00 1.00 0.00 0.00 64.86 65.98 1fty h ILE 346 Cb 0.06 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.14 1fty h ILE 346 CO -0.06 0.00 -0.09 1.55 0.00 0.00 0.00 178.15 179.55 1fty h PRO 347 N -1.04 0.00 -0.09 2.37 0.13 -1.74 -2.41 132.00 129.22 1fty h PRO 347 Ca -0.10 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.81 1fty h PRO 347 Cb 0.72 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.86 1fty h PRO 347 CO 0.16 0.09 -0.83 1.49 -0.23 0.00 0.00 178.00 178.68 1fty h GLU 348 N 0.00 0.62 -0.44 0.86 4.57 -1.07 -0.41 114.58 118.72 1fty h GLU 348 Ca -0.00 -0.55 -0.08 0.00 -1.18 0.00 0.00 59.36 57.54 1fty h GLU 348 Cb 0.36 0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 29.06 1fty h GLU 348 CO 0.01 1.17 -0.06 1.25 -1.18 0.00 0.00 179.01 180.20 1fty h LEU 349 N 0.41 0.73 -0.24 1.64 5.85 -0.44 -1.71 115.31 121.56 1fty h LEU 349 Ca -0.06 -0.20 -0.06 0.00 0.84 0.00 0.00 57.88 58.40 1fty h LEU 349 Cb 1.45 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 42.28 1fty h LEU 349 CO 0.16 0.84 -0.08 0.24 -0.34 0.00 0.00 178.44 179.26 1fty h MET 350 N 0.70 0.47 -0.32 1.25 2.86 -1.36 -1.91 114.93 116.62 1fty h MET 350 Ca 0.13 -0.19 0.06 0.00 -2.06 0.00 0.00 59.70 57.64 1fty h MET 350 Cb 0.51 -0.02 -0.05 0.00 0.06 0.00 0.00 31.60 32.10 1fty h MET 350 CO 0.03 0.72 -0.03 -0.09 1.06 0.00 0.00 176.91 178.60 1fty h ARG 351 N 0.20 0.06 0.22 1.72 2.43 -0.76 0.37 114.38 118.62 1fty h ARG 351 Ca 0.06 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.21 1fty h ARG 351 Cb 0.56 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 1fty h ARG 351 CO 0.03 0.04 -0.11 0.28 -1.51 0.00 0.00 179.97 178.70 1fty h VAL 352 N 0.06 0.84 -0.36 0.20 2.07 -1.31 0.20 116.25 117.95 1fty h VAL 352 Ca 0.15 -0.30 0.03 0.00 0.82 0.00 0.00 66.70 67.40 1fty h VAL 352 Cb 0.22 1.01 -0.03 0.00 -1.52 0.00 0.00 31.29 30.97 1fty h VAL 352 CO -0.28 0.07 0.17 -0.07 0.02 0.00 0.00 177.57 177.48 1fty h LEU 353 N -0.44 0.25 0.12 2.57 3.38 -1.06 0.10 115.31 120.23 1fty h LEU 353 Ca -0.03 0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 1fty h LEU 353 Cb 0.34 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1fty h LEU 353 CO 0.05 0.18 -0.06 0.58 0.09 0.00 0.00 178.44 179.29 1fty h VAL 354 N 0.36 0.27 -0.21 1.22 2.07 -0.27 0.22 116.25 119.89 1fty h VAL 354 Ca 0.15 -1.05 -0.06 0.00 0.82 0.00 0.00 66.70 66.56 1fty h VAL 354 Cb 0.07 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 1fty h VAL 354 CO -0.11 0.08 -0.11 0.44 0.02 0.00 0.00 177.57 177.89 1fty h ASP 355 N -1.02 0.47 0.00 0.57 3.45 -0.68 -2.72 116.42 116.49 1fty h ASP 355 Ca -0.02 -0.42 -0.30 0.00 0.43 0.00 0.00 57.03 56.73 1fty h ASP 355 Cb 0.26 -0.13 -0.04 0.00 -0.56 0.00 0.00 39.33 38.85 1fty h ASP 355 CO 0.03 0.78 -1.64 0.18 -1.57 0.00 0.00 179.24 177.02 1fty n LEU 356 N -4.53 1.93 0.10 1.55 4.77 -0.19 -4.41 117.00 116.21 1fty n LEU 356 Ca -0.05 0.39 0.13 0.00 -0.03 0.00 0.00 56.01 56.45 1fty n LEU 356 Cb 0.34 -0.93 0.34 0.00 -2.33 0.00 0.00 43.42 40.84 1fty n LEU 356 CO 0.40 0.38 0.77 -0.33 -1.33 0.00 0.00 177.39 177.28 1fty h GLU 357 N -0.95 0.00 -4.40 3.23 4.39 -0.83 -3.48 114.58 112.53 1fty h GLU 357 Ca -0.45 0.00 -0.26 0.00 0.34 0.00 0.00 59.36 58.99 1fty h GLU 357 Cb 1.42 0.00 0.10 0.00 -0.10 0.00 0.00 28.75 30.17 1fty h GLU 357 CO -0.26 0.00 -0.49 0.54 -1.16 0.00 0.00 179.01 177.65 1fty n ARG 358 N -2.27 -5.25 -2.92 2.33 1.74 -0.28 -4.97 116.66 105.05 1fty n ARG 358 Ca 0.05 0.58 -0.29 0.00 -0.77 0.00 0.00 57.85 57.42 1fty n ARG 358 Cb 0.44 -4.84 -0.02 0.00 -1.02 0.00 0.00 32.46 27.01 1fty n ARG 358 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1fty s LEU 359 N -5.26 3.84 0.60 0.55 1.02 -0.10 -4.98 118.68 114.36 1fty s LEU 359 Ca 0.28 0.99 -0.16 0.00 0.02 0.00 0.00 54.13 55.27 1fty s LEU 359 Cb -0.13 -3.88 -0.03 0.00 0.02 0.00 0.00 46.19 42.18 1fty s LEU 359 CO 0.50 -0.39 1.07 1.51 0.02 0.00 0.00 176.35 179.06 1fty s ASP 360 N -3.36 5.69 0.15 2.29 -4.77 -1.26 -4.45 116.67 110.96 1fty s ASP 360 Ca 0.49 1.85 -0.27 0.00 -3.30 0.00 0.00 52.55 51.32 1fty s ASP 360 Cb -0.10 -2.54 -0.00 0.00 -1.09 0.00 0.00 42.92 39.19 1fty s ASP 360 CO 0.34 -1.23 1.57 -0.25 0.70 0.00 0.00 175.17 176.30 1fty h TRP 361 N 0.40 -1.26 -0.91 2.11 2.91 -1.97 -1.81 115.95 115.42 1fty h TRP 361 Ca -0.47 0.07 0.05 0.00 1.13 0.00 0.00 58.89 59.67 1fty h TRP 361 Cb 1.22 0.61 -0.06 0.00 -0.51 0.00 0.00 29.16 30.43 1fty h TRP 361 CO 0.58 -0.44 0.59 -0.44 -1.03 0.00 0.00 178.44 177.70 1fty h ASP 362 N -0.32 0.94 -0.32 2.65 3.45 -1.99 0.16 116.42 120.99 1fty h ASP 362 Ca 0.14 -0.00 -0.16 0.00 0.43 0.00 0.00 57.03 57.44 1fty h ASP 362 Cb 0.58 -0.20 -0.01 0.00 -0.56 0.00 0.00 39.33 39.14 1fty h ASP 362 CO -0.58 0.62 -0.39 0.50 -1.57 0.00 0.00 179.24 177.82 1fty h LYS 363 N 1.08 0.88 -0.35 3.56 3.11 -1.85 -2.04 116.57 120.96 1fty h LYS 363 Ca 0.38 -0.46 -0.03 0.00 -2.81 0.00 0.00 60.65 57.72 1fty h LYS 363 Cb 0.13 0.02 -0.01 0.00 -1.00 0.00 0.00 32.23 31.36 1fty h LYS 363 CO -0.13 1.11 0.09 0.00 -2.81 0.00 0.00 179.45 177.71 1fty h ALA 364 N 0.83 0.46 -0.50 5.00 0.00 -0.67 -1.98 119.26 122.39 1fty h ALA 364 Ca 0.06 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1fty h ALA 364 Cb 0.98 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.61 1fty h ALA 364 CO 0.09 0.12 0.30 2.35 0.00 0.00 0.00 179.25 182.11 1fty h TRP 365 N 0.41 0.67 -0.85 0.00 2.91 -0.66 -0.18 115.95 118.25 1fty h TRP 365 Ca 0.11 -0.00 0.05 0.00 1.13 0.00 0.00 58.89 60.18 1fty h TRP 365 Cb 0.28 -0.22 -0.06 0.00 -0.51 0.00 0.00 29.16 28.66 1fty h TRP 365 CO 0.01 0.47 0.53 1.49 -1.03 0.00 0.00 178.44 179.91 1fty h GLU 366 N 0.67 0.97 -0.03 2.65 4.81 -1.21 -0.46 114.58 121.99 1fty h GLU 366 Ca 0.18 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.35 1fty h GLU 366 Cb -0.00 -0.22 -0.00 0.00 0.63 0.00 0.00 28.75 29.16 1fty h GLU 366 CO -0.03 0.64 -0.00 0.28 -0.73 0.00 0.00 179.01 179.17 1fty h VAL 367 N 1.00 1.27 0.01 0.32 2.07 -0.81 -2.54 116.25 117.56 1fty h VAL 367 Ca 0.36 -0.82 0.03 0.00 0.82 0.00 0.00 66.70 67.08 1fty h VAL 367 Cb 0.10 1.76 -0.04 0.00 -1.52 0.00 0.00 31.29 31.59 1fty h VAL 367 CO -0.15 0.22 -0.22 0.74 0.02 0.00 0.00 177.57 178.19 1fty h THR 368 N -0.26 0.49 -0.69 2.57 2.02 -0.59 -1.88 112.91 114.57 1fty h THR 368 Ca 0.01 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.22 1fty h THR 368 Cb 0.36 0.49 -0.04 0.00 -1.74 0.00 0.00 68.15 67.22 1fty h THR 368 CO 0.00 0.00 0.46 0.58 0.37 0.00 0.00 175.52 176.93 1fty h VAL 369 N -0.35 1.11 0.00 3.16 2.07 -1.16 -1.71 116.25 119.37 1fty h VAL 369 Ca 0.06 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.29 1fty h VAL 369 Cb 0.42 0.19 0.00 0.00 -1.52 0.00 0.00 31.29 30.39 1fty h VAL 369 CO -0.20 0.15 0.00 0.11 0.02 0.00 0.00 177.57 177.66 1fty h LYS 370 N 0.84 0.00 0.00 1.57 1.57 -0.96 -2.21 116.57 117.38 1fty h LYS 370 Ca 0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.05 1fty h LYS 370 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1fty h LYS 370 CO -0.08 0.00 -1.78 0.25 -0.57 0.00 0.00 179.45 177.28 1fty n THR 371 N -2.82 0.00 -3.63 -0.16 -2.24 -0.76 -4.89 114.28 99.79 1fty n THR 371 Ca 0.03 -0.40 -0.36 0.00 -2.27 0.00 0.00 64.05 61.05 1fty n THR 371 Cb 0.38 0.13 -0.06 0.00 -2.10 0.00 0.00 70.33 68.68 1fty n THR 371 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1fty s ALA 373 N -1.27 -0.17 -0.06 0.00 0.00 -0.94 -1.66 121.76 117.66 1fty s ALA 373 Ca 0.28 0.13 0.05 0.00 0.00 0.00 0.00 51.96 52.42 1fty s ALA 373 Cb -0.14 -0.09 -0.02 0.00 0.00 0.00 0.00 23.12 22.87 1fty s ALA 373 CO 0.15 -0.05 -0.21 -0.47 0.00 0.00 0.00 175.76 175.18 1fty s TYR 374 N -0.14 2.53 -0.17 0.00 6.04 -0.54 -0.14 117.35 124.93 1fty s TYR 374 Ca -0.02 -0.53 -0.02 0.00 0.04 0.00 0.00 57.07 56.55 1fty s TYR 374 Cb -0.02 -1.62 -0.01 0.00 -1.04 0.00 0.00 41.96 39.28 1fty s TYR 374 CO 0.00 -0.09 -0.10 0.99 -1.54 0.00 0.00 175.55 174.81 1fty s THR 375 N -0.31 3.07 -0.06 4.34 2.01 -0.69 -1.97 115.64 122.03 1fty s THR 375 Ca 0.01 -0.62 -0.11 0.00 0.31 0.00 0.00 61.69 61.28 1fty s THR 375 Cb -0.13 -2.34 -0.05 0.00 0.01 0.00 0.00 72.50 70.00 1fty s THR 375 CO 0.02 0.48 0.29 0.21 -0.69 0.00 0.00 174.62 174.93 1fty s ASN 376 N 0.94 6.60 0.00 3.53 3.84 -0.47 -1.71 114.94 127.68 1fty s ASN 376 Ca -0.02 0.72 0.00 0.00 0.21 0.00 0.00 52.86 53.77 1fty s ASN 376 Cb -0.15 -2.17 0.00 0.00 -0.55 0.00 0.00 41.25 38.38 1fty s ASN 376 CO -0.01 0.34 0.42 1.41 -2.79 0.00 0.00 177.10 176.47 1fty n HIS 377 N 2.05 0.00 -3.47 0.43 8.25 -1.26 -4.10 115.22 117.12 1fty n HIS 377 Ca -0.16 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.18 1fty n HIS 377 Cb 0.53 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.61 1fty n HIS 377 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 1fty s THR 378 N -0.18 0.00 -0.42 1.59 -1.32 -1.26 -4.52 115.64 109.53 1fty s THR 378 Ca 0.00 0.00 0.04 0.00 -1.21 0.00 0.00 61.69 60.52 1fty s THR 378 Cb 0.00 -1.00 0.01 0.00 -1.51 0.00 0.00 72.50 70.00 1fty s THR 378 CO 0.00 0.00 0.48 1.33 -2.21 0.00 0.00 174.62 174.22 1fty n VAL 379 N -0.04 0.00 -2.45 5.08 0.24 -1.26 -5.00 118.33 114.89 1fty n VAL 379 Ca -0.15 -0.47 -0.41 0.00 -2.04 0.00 0.00 64.34 61.27 1fty n VAL 379 Cb 0.62 1.06 -0.03 0.00 -1.47 0.00 0.00 33.84 34.02 1fty n VAL 379 CO 0.00 0.00 0.00 0.27 -2.14 0.00 0.00 176.83 174.96 1fty s ILE 380 N -0.69 3.91 0.34 1.34 -4.36 -1.26 -4.94 121.20 115.54 1fty s ILE 380 Ca 0.04 1.50 0.06 0.00 -0.26 0.00 0.00 60.65 61.99 1fty s ILE 380 Cb 0.03 -3.96 0.30 0.00 1.25 0.00 0.00 42.46 40.09 1fty s ILE 380 CO 0.09 0.19 1.91 1.55 0.24 0.00 0.00 174.94 178.91 1fty h PRO 381 N 5.94 0.78 0.00 0.37 0.13 -1.98 -2.31 132.00 134.93 1fty h PRO 381 Ca -0.43 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1fty h PRO 381 Cb 1.21 -0.18 0.00 0.00 0.13 0.00 0.00 31.00 32.17 1fty h PRO 381 CO 0.77 0.52 0.00 -0.85 -0.23 0.00 0.00 178.00 178.20 1fty n GLU 382 N -4.52 0.03 0.02 0.86 0.00 -1.26 -2.45 120.64 113.32 1fty n GLU 382 Ca 0.14 0.23 0.11 0.00 0.00 0.00 0.00 57.16 57.65 1fty n GLU 382 Cb 0.32 -1.55 0.02 0.00 0.00 0.00 0.00 31.44 30.23 1fty n GLU 382 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1fty n ALA 383 N -1.54 3.63 -2.21 -1.84 0.00 -0.87 -0.67 120.51 117.01 1fty n ALA 383 Ca 0.04 -0.43 -0.42 0.00 0.00 0.00 0.00 53.44 52.63 1fty n ALA 383 Cb 0.21 -0.95 -0.03 0.00 0.00 0.00 0.00 19.45 18.68 1fty n ALA 383 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1fty s LEU 384 N -3.67 4.39 -0.35 0.00 2.01 -1.02 -4.37 118.68 115.67 1fty s LEU 384 Ca 0.05 2.21 -0.27 0.00 0.01 0.00 0.00 54.13 56.13 1fty s LEU 384 Cb 0.15 -3.59 0.01 0.00 0.01 0.00 0.00 46.19 42.77 1fty s LEU 384 CO 0.80 -0.51 0.96 -1.61 1.01 0.00 0.00 176.35 177.01 1fty s GLU 385 N 0.61 3.92 -0.37 1.70 2.02 -1.26 -4.78 118.70 120.53 1fty s GLU 385 Ca 0.59 0.72 0.01 0.00 0.02 0.00 0.00 54.97 56.31 1fty s GLU 385 Cb -0.33 -3.78 0.12 0.00 0.10 0.00 0.00 34.13 30.24 1fty s GLU 385 CO 0.32 -0.92 0.17 1.03 0.02 0.00 0.00 175.26 175.88 1fty s ARG 386 N 3.51 1.00 -0.08 1.61 0.52 -1.26 -2.08 118.95 122.17 1fty s ARG 386 Ca 0.40 -1.56 -0.29 0.00 -0.52 0.00 0.00 55.73 53.76 1fty s ARG 386 Cb -0.12 -2.15 -0.02 0.00 0.52 0.00 0.00 34.95 33.18 1fty s ARG 386 CO 0.18 -1.08 0.96 -1.58 0.02 0.00 0.00 175.30 173.80 1fty s TRP 387 N 0.96 3.55 0.29 -0.53 0.52 -0.89 -4.69 118.94 118.16 1fty s TRP 387 Ca 0.14 1.58 -0.30 0.00 0.02 0.00 0.00 56.10 57.54 1fty s TRP 387 Cb -0.21 -3.13 -0.12 0.00 -1.15 0.00 0.00 33.47 28.86 1fty s TRP 387 CO -0.11 -0.14 1.52 -2.30 0.02 0.00 0.00 176.95 175.94 1fty n PRO 388 N 4.62 2.51 -0.15 4.98 -0.02 -1.26 -0.79 135.00 144.89 1fty n PRO 388 Ca 0.07 0.89 0.02 0.00 -2.02 0.00 0.00 63.50 62.46 1fty n PRO 388 Cb 0.50 -2.63 0.30 0.00 -0.02 0.00 0.00 33.50 31.65 1fty n PRO 388 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1fty h VAL 389 N 3.18 1.16 0.00 -1.45 2.07 -1.45 -1.86 116.25 117.90 1fty h VAL 389 Ca -0.47 -0.30 -0.00 0.00 0.82 0.00 0.00 66.70 66.75 1fty h VAL 389 Cb 1.24 0.22 -0.00 0.00 -1.52 0.00 0.00 31.29 31.23 1fty h VAL 389 CO 0.76 0.16 -0.02 1.12 0.02 0.00 0.00 177.57 179.61 1fty h HIS 390 N 0.87 0.00 0.02 1.57 2.07 -1.90 0.20 115.15 117.97 1fty h HIS 390 Ca 0.24 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.76 1fty h HIS 390 Cb -0.09 0.00 0.00 0.00 2.57 0.00 0.00 27.41 29.89 1fty h HIS 390 CO -0.00 0.02 -0.01 -0.07 -3.07 0.00 0.00 177.93 174.80 1fty h LEU 391 N 0.00 -0.02 -1.22 6.12 3.38 -1.71 -2.96 115.31 118.90 1fty h LEU 391 Ca -0.00 -0.72 0.01 0.00 0.09 0.00 0.00 57.88 57.26 1fty h LEU 391 Cb 0.16 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 1fty h LEU 391 CO 0.00 0.81 0.53 -0.07 0.09 0.00 0.00 178.44 179.80 1fty h LEU 392 N -0.95 0.91 -0.61 1.67 3.38 -1.36 -0.88 115.31 117.48 1fty h LEU 392 Ca -0.00 -0.02 0.04 0.00 0.09 0.00 0.00 57.88 57.99 1fty h LEU 392 Cb 0.74 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 41.22 1fty h LEU 392 CO 0.00 0.66 0.34 -0.08 0.09 0.00 0.00 178.44 179.46 1fty h GLU 393 N 1.08 0.63 0.02 1.13 4.81 -0.71 0.20 114.58 121.75 1fty h GLU 393 Ca 0.29 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.44 1fty h GLU 393 Cb -0.12 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.12 1fty h GLU 393 CO -0.06 0.42 -0.19 1.15 -0.73 0.00 0.00 179.01 179.60 1fty h THR 394 N 0.65 1.68 0.12 0.32 2.02 -1.26 -3.30 112.91 113.14 1fty h THR 394 Ca 0.26 -2.23 -0.21 0.00 0.77 0.00 0.00 66.41 65.00 1fty h THR 394 Cb 0.12 3.17 0.02 0.00 -1.74 0.00 0.00 68.15 69.72 1fty h THR 394 CO -0.15 0.59 -0.89 0.25 0.37 0.00 0.00 175.52 175.70 1fty h LEU 395 N -0.76 0.57 -6.10 2.58 5.85 -1.20 -3.38 115.31 112.87 1fty h LEU 395 Ca -0.03 -0.90 -0.57 0.00 0.84 0.00 0.00 57.88 57.22 1fty h LEU 395 Cb 1.08 -0.18 -0.40 0.00 0.37 0.00 0.00 40.66 41.53 1fty h LEU 395 CO 0.04 1.42 -0.94 0.18 -0.34 0.00 0.00 178.44 178.80 1fty n LEU 396 N -4.06 1.29 -0.27 2.25 4.77 0.69 -0.55 117.00 121.11 1fty n LEU 396 Ca -0.13 -4.91 0.04 0.00 -0.03 0.00 0.00 56.01 50.97 1fty n LEU 396 Cb 0.84 0.21 0.18 0.00 -2.33 0.00 0.00 43.42 42.32 1fty n LEU 396 CO 0.51 2.05 1.06 1.55 -1.33 0.00 0.00 177.39 181.23 1fty h PRO 397 N 4.16 0.55 -0.15 3.23 0.13 -1.61 -2.55 132.00 135.77 1fty h PRO 397 Ca 0.12 -0.03 -0.15 0.00 -0.87 0.00 0.00 66.00 65.07 1fty h PRO 397 Cb 0.81 -0.12 -0.01 0.00 0.13 0.00 0.00 31.00 31.81 1fty h PRO 397 CO 0.58 0.37 -0.53 -0.09 -0.23 0.00 0.00 178.00 178.09 1fty h ARG 398 N 0.57 0.44 -0.20 0.86 9.65 -1.91 -2.88 114.38 120.90 1fty h ARG 398 Ca 0.41 -0.27 -0.07 0.00 -1.10 0.00 0.00 59.98 58.95 1fty h ARG 398 Cb 0.53 0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 29.13 1fty h ARG 398 CO -0.34 0.86 -0.18 0.45 2.80 0.00 0.00 179.97 183.56 1fty h HIS 399 N 0.34 0.38 -0.40 2.20 3.86 -1.83 -1.25 115.15 118.45 1fty h HIS 399 Ca 0.01 -0.06 -0.06 0.00 -1.16 0.00 0.00 60.37 59.10 1fty h HIS 399 Cb 1.04 -0.10 -0.01 0.00 1.06 0.00 0.00 27.41 29.40 1fty h HIS 399 CO 0.03 0.52 0.00 1.25 0.86 0.00 0.00 177.93 180.60 1fty h LEU 400 N 0.32 0.68 -0.74 2.43 6.46 -1.32 -0.34 115.31 122.80 1fty h LEU 400 Ca 0.06 -0.30 0.00 0.00 -0.12 0.00 0.00 57.88 57.52 1fty h LEU 400 Cb 0.51 -0.18 -0.04 0.00 -0.73 0.00 0.00 40.66 40.22 1fty h LEU 400 CO 0.03 0.82 0.47 1.56 -0.62 0.00 0.00 178.44 180.70 1fty h GLN 401 N 0.52 0.98 -0.59 1.25 4.20 -1.24 -0.76 115.11 119.47 1fty h GLN 401 Ca 0.11 -0.07 -0.07 0.00 0.06 0.00 0.00 58.65 58.68 1fty h GLN 401 Cb 0.47 -0.22 -0.02 0.00 0.30 0.00 0.00 27.48 28.01 1fty h GLN 401 CO 0.02 0.67 0.09 0.82 -0.67 0.00 0.00 178.83 179.76 1fty h ILE 402 N 1.00 1.26 -0.66 2.54 2.04 -1.00 -2.07 117.51 120.61 1fty h ILE 402 Ca 0.27 -0.99 -0.05 0.00 1.00 0.00 0.00 64.86 65.08 1fty h ILE 402 Cb -0.08 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 36.72 1fty h ILE 402 CO -0.05 0.37 0.20 0.40 0.00 0.00 0.00 178.15 179.06 1fty h ILE 403 N 0.89 1.25 -0.75 -0.67 2.04 -0.61 0.19 117.51 119.86 1fty h ILE 403 Ca 0.18 -0.87 -0.03 0.00 1.00 0.00 0.00 64.86 65.14 1fty h ILE 403 Cb 0.43 0.57 -0.03 0.00 -0.74 0.00 0.00 36.82 37.04 1fty h ILE 403 CO 0.01 0.34 0.34 1.88 0.00 0.00 0.00 178.15 180.72 1fty h TYR 404 N 0.96 1.10 -0.29 1.37 0.05 -0.97 0.14 116.97 119.33 1fty h TYR 404 Ca 0.21 -0.06 -0.12 0.00 0.05 0.00 0.00 58.73 58.80 1fty h TYR 404 Cb 0.30 -0.34 -0.01 0.00 1.01 0.00 0.00 36.73 37.70 1fty h TYR 404 CO 0.02 0.82 -0.33 1.49 -1.05 0.00 0.00 178.16 179.11 1fty h GLU 405 N 1.06 0.62 -0.34 4.88 4.57 -1.00 0.71 114.58 125.09 1fty h GLU 405 Ca 0.25 -0.29 -0.05 0.00 -1.18 0.00 0.00 59.36 58.10 1fty h GLU 405 Cb 0.15 -0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.72 1fty h GLU 405 CO -0.03 0.87 0.03 0.82 -1.18 0.00 0.00 179.01 179.53 1fty h ILE 406 N 0.53 1.25 -0.28 2.32 2.04 -0.56 -2.53 117.51 120.27 1fty h ILE 406 Ca 0.06 -0.88 0.02 0.00 1.00 0.00 0.00 64.86 65.06 1fty h ILE 406 Cb 0.83 1.16 -0.03 0.00 -0.74 0.00 0.00 36.82 38.05 1fty h ILE 406 CO 0.07 0.29 0.13 -1.13 0.00 0.00 0.00 178.15 177.51 1fty h ASN 407 N 0.40 0.18 -0.22 1.72 -1.24 -0.72 -1.02 115.58 114.68 1fty h ASN 407 Ca 0.10 0.02 0.06 0.00 0.71 0.00 0.00 56.30 57.19 1fty h ASN 407 Cb 0.39 -0.01 -0.06 0.00 0.73 0.00 0.00 38.32 39.36 1fty h ASN 407 CO 0.01 0.14 -0.20 -0.61 -1.29 0.00 0.00 177.43 175.48 1fty h GLN 408 N 0.27 -0.20 -0.17 6.67 4.15 -0.69 0.18 115.11 125.32 1fty h GLN 408 Ca 0.12 0.01 -0.13 0.00 0.77 0.00 0.00 58.65 59.43 1fty h GLN 408 Cb 0.05 0.05 -0.01 0.00 0.21 0.00 0.00 27.48 27.78 1fty h GLN 408 CO -0.09 -0.14 -0.43 0.00 -1.93 0.00 0.00 178.83 176.24 1fty h ARG 409 N -0.21 0.41 0.16 1.69 3.08 -1.33 -2.61 114.38 115.58 1fty h ARG 409 Ca 0.13 -0.21 -0.01 0.00 0.07 0.00 0.00 59.98 59.96 1fty h ARG 409 Cb 0.41 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.47 1fty h ARG 409 CO -0.35 0.77 -0.08 0.35 -1.07 0.00 0.00 179.97 179.60 1fty h PHE 410 N 0.34 -0.21 -0.44 3.04 3.57 -0.67 -2.57 116.94 120.00 1fty h PHE 410 Ca 0.03 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.58 1fty h PHE 410 Cb 0.90 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.69 1fty h PHE 410 CO 0.03 0.11 0.29 -0.07 -2.23 0.00 0.00 178.31 176.45 1fty h LEU 411 N -0.54 0.32 -1.28 0.59 3.38 -0.98 0.24 115.31 117.05 1fty h LEU 411 Ca -0.02 -0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.89 1fty h LEU 411 Cb 0.41 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1fty h LEU 411 CO 0.04 0.21 -0.16 0.78 0.09 0.00 0.00 178.44 179.40 1fty h ASN 412 N 0.37 0.27 -0.28 -0.43 -0.26 -1.28 0.61 115.58 114.59 1fty h ASN 412 Ca 0.19 -0.07 -0.04 0.00 -0.56 0.00 0.00 56.30 55.83 1fty h ASN 412 Cb 0.28 -0.07 -0.01 0.00 -1.06 0.00 0.00 38.32 37.46 1fty h ASN 412 CO -0.04 0.46 0.03 0.03 -1.06 0.00 0.00 177.43 176.85 1fty h ARG 413 N 0.27 0.47 0.25 0.81 3.08 -0.15 -1.93 114.38 117.17 1fty h ARG 413 Ca 0.05 -0.14 -0.01 0.00 0.07 0.00 0.00 59.98 59.95 1fty h ARG 413 Cb 0.45 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.45 1fty h ARG 413 CO 0.03 0.60 -0.12 0.28 -1.07 0.00 0.00 179.97 179.69 1fty h VAL 414 N 0.28 0.78 -0.71 2.04 2.07 -0.64 -1.47 116.25 118.60 1fty h VAL 414 Ca 0.08 -0.17 0.14 0.00 0.82 0.00 0.00 66.70 67.57 1fty h VAL 414 Cb 0.37 0.88 -0.10 0.00 -1.52 0.00 0.00 31.29 30.93 1fty h VAL 414 CO 0.01 0.04 0.23 0.00 0.02 0.00 0.00 177.57 177.86 1fty h ALA 415 N 0.32 0.94 0.00 1.67 0.00 -0.87 0.68 119.26 121.99 1fty h ALA 415 Ca -0.03 0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.95 1fty h ALA 415 Cb 0.32 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1fty h ALA 415 CO 0.06 -0.26 -0.25 0.00 0.00 0.00 0.00 179.25 178.79 1fty h ALA 416 N 1.54 1.37 0.05 0.00 0.00 -1.10 -2.00 119.26 119.12 1fty h ALA 416 Ca 0.39 -0.23 -0.30 0.00 0.00 0.00 0.00 54.91 54.76 1fty h ALA 416 Cb 0.60 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 1fty h ALA 416 CO -0.43 0.32 -1.66 0.00 0.00 0.00 0.00 179.25 177.48 1fty h ALA 417 N 1.75 0.56 -2.40 0.00 0.00 0.59 -3.40 119.26 116.35 1fty h ALA 417 Ca -0.00 -1.32 -0.59 0.00 0.00 0.00 0.00 54.91 52.99 1fty h ALA 417 Cb 0.52 0.43 -0.41 0.00 0.00 0.00 0.00 17.79 18.33 1fty h ALA 417 CO 0.03 1.40 -0.78 1.19 0.00 0.00 0.00 179.25 181.10 1fty n PHE 418 N -3.25 1.79 -1.68 0.00 3.72 0.20 -5.09 117.46 113.15 1fty n PHE 418 Ca -0.18 -3.90 -0.46 0.00 -0.05 0.00 0.00 57.45 52.86 1fty n PHE 418 Cb 1.04 -0.38 -0.04 0.00 -0.94 0.00 0.00 39.48 39.16 1fty n PHE 418 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 1fty n PRO 419 N 1.61 2.33 0.00 -1.08 -0.02 -0.77 -1.98 135.00 135.09 1fty n PRO 419 Ca 0.25 0.85 0.00 0.00 -2.02 0.00 0.00 63.50 62.58 1fty n PRO 419 Cb 0.44 -2.67 0.00 0.00 -0.02 0.00 0.00 33.50 31.24 1fty n PRO 419 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1fty n GLY 420 N 3.93 2.40 3.34 -1.23 0.00 -1.26 -4.95 105.19 107.42 1fty n GLY 420 Ca 0.19 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.81 1fty n GLY 420 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1fty n ASP 421 N 0.00 4.04 0.22 1.61 4.64 -0.84 -4.75 116.55 121.47 1fty n ASP 421 Ca 0.00 -2.83 0.06 0.00 -1.38 0.00 0.00 54.79 50.65 1fty n ASP 421 Cb 0.00 -1.66 0.49 0.00 -1.04 0.00 0.00 41.12 38.91 1fty n ASP 421 CO 0.00 0.00 0.00 1.62 -0.82 0.00 0.00 177.20 178.00 1fty h VAL 422 N 5.22 0.98 0.03 5.18 3.04 -1.92 -2.90 116.25 125.87 1fty h VAL 422 Ca 0.43 -0.98 -0.23 0.00 -1.01 0.00 0.00 66.70 64.91 1fty h VAL 422 Cb 0.81 1.56 -0.00 0.00 -2.01 0.00 0.00 31.29 31.65 1fty h VAL 422 CO 1.56 0.26 -0.99 -0.78 -1.01 0.00 0.00 177.57 176.61 1fty h ASP 423 N 0.00 0.38 -0.76 3.17 3.58 -2.00 -3.16 116.42 117.63 1fty h ASP 423 Ca -0.00 -0.33 0.04 0.00 0.42 0.00 0.00 57.03 57.15 1fty h ASP 423 Cb 0.54 -0.12 -0.05 0.00 1.72 0.00 0.00 39.33 41.42 1fty h ASP 423 CO 0.03 1.16 0.48 -0.09 -2.88 0.00 0.00 179.24 177.95 1fty h ARG 424 N 0.14 0.90 -0.09 0.28 2.43 -1.92 -1.34 114.38 114.78 1fty h ARG 424 Ca -0.08 -0.05 0.04 0.00 -0.81 0.00 0.00 59.98 59.08 1fty h ARG 424 Cb 1.65 -0.20 -0.04 0.00 -0.42 0.00 0.00 29.97 30.95 1fty h ARG 424 CO 0.16 0.60 -0.16 -0.07 -1.51 0.00 0.00 179.97 178.98 1fty h LEU 425 N 0.93 -0.50 -0.94 3.80 4.07 -1.48 -0.42 115.31 120.77 1fty h LEU 425 Ca 0.31 0.09 -0.08 0.00 0.08 0.00 0.00 57.88 58.27 1fty h LEU 425 Cb 0.04 0.23 -0.02 0.00 1.08 0.00 0.00 40.66 41.99 1fty h LEU 425 CO -0.12 -0.22 -0.12 0.08 -1.08 0.00 0.00 178.44 176.99 1fty h ARG 426 N -0.23 0.65 -0.43 1.13 -0.00 -1.51 -2.06 114.38 111.94 1fty h ARG 426 Ca 0.08 -0.20 -0.08 0.00 -0.00 0.00 0.00 59.98 59.78 1fty h ARG 426 Cb 0.34 -0.06 -0.02 0.00 -0.00 0.00 0.00 29.97 30.23 1fty h ARG 426 CO -0.22 0.75 -0.06 0.00 -0.00 0.00 0.00 179.97 180.44 1fty h ARG 427 N 0.59 0.73 0.00 0.08 3.08 -0.81 -3.13 114.38 114.92 1fty h ARG 427 Ca 0.10 -0.21 0.00 0.00 0.07 0.00 0.00 59.98 59.94 1fty h ARG 427 Cb 0.55 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.52 1fty h ARG 427 CO 0.03 0.78 -0.59 -1.33 -1.07 0.00 0.00 179.97 177.80 1fty n MET 428 N -4.20 0.24 -1.55 0.04 2.81 -0.21 -4.96 117.12 109.30 1fty n MET 428 Ca 0.02 0.07 -0.40 0.00 -1.81 0.00 0.00 57.70 55.58 1fty n MET 428 Cb 0.33 -1.65 0.02 0.00 -0.71 0.00 0.00 33.22 31.20 1fty n MET 428 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 1fty n SER 429 N -2.01 0.31 0.16 7.83 2.88 -0.79 -4.86 113.62 117.14 1fty n SER 429 Ca 0.04 0.92 0.12 0.00 -1.33 0.00 0.00 58.87 58.62 1fty n SER 429 Cb 0.42 -1.28 0.26 0.00 -0.75 0.00 0.00 64.21 62.86 1fty n SER 429 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1fty h LEU 430 N 0.97 0.00 -8.86 2.46 3.38 -1.91 -3.43 115.31 107.91 1fty h LEU 430 Ca -0.44 -0.01 -0.64 0.00 0.09 0.00 0.00 57.88 56.88 1fty h LEU 430 Cb 1.37 0.00 -0.19 0.00 0.09 0.00 0.00 40.66 41.93 1fty h LEU 430 CO 0.53 0.01 -0.58 -0.69 0.09 0.00 0.00 178.44 177.80 1fty s VAL 431 N -3.17 4.74 -0.23 1.22 1.01 -1.26 -0.13 120.40 122.58 1fty s VAL 431 Ca 0.08 -0.03 -0.08 0.00 0.00 0.00 0.00 61.98 61.95 1fty s VAL 431 Cb 0.09 -3.20 -0.04 0.00 0.00 0.00 0.00 36.38 33.23 1fty s VAL 431 CO 0.65 0.35 0.10 -1.61 0.00 0.00 0.00 175.10 174.59 1fty s GLU 432 N 1.25 3.87 0.47 2.72 2.02 -0.34 -4.97 118.70 123.72 1fty s GLU 432 Ca 0.05 -0.38 -0.03 0.00 0.02 0.00 0.00 54.97 54.64 1fty s GLU 432 Cb -0.14 -3.36 -0.02 0.00 0.10 0.00 0.00 34.13 30.71 1fty s GLU 432 CO 0.04 0.01 0.74 -2.00 0.02 0.00 0.00 175.26 174.08 1fty s GLU 433 N 1.11 3.24 0.00 1.61 2.56 -1.26 -1.61 118.70 124.35 1fty s GLU 433 Ca 0.05 -0.15 0.00 0.00 0.00 0.00 0.00 54.97 54.87 1fty s GLU 433 Cb -0.14 -2.46 0.00 0.00 2.00 0.00 0.00 34.13 33.53 1fty s GLU 433 CO 0.04 -0.28 0.00 0.41 -0.56 0.00 0.00 175.26 174.87 1fty n GLY 434 N -2.20 0.74 0.00 -1.50 0.00 -1.26 -4.91 105.19 96.06 1fty n GLY 434 Ca 0.01 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.38 1fty n GLY 434 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fty n ALA 435 N -0.94 0.00 -2.47 4.61 0.00 -1.26 -4.30 120.51 116.15 1fty n ALA 435 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.18 1fty n ALA 435 Cb 0.00 0.34 -0.14 0.00 0.00 0.00 0.00 19.45 19.65 1fty n ALA 435 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1fty s VAL 436 N -2.87 1.73 0.34 0.00 -7.23 -1.26 -5.11 120.40 106.00 1fty s VAL 436 Ca 0.00 -1.26 -0.27 0.00 -1.81 0.00 0.00 61.98 58.64 1fty s VAL 436 Cb 0.00 -1.51 -0.09 0.00 0.56 0.00 0.00 36.38 35.34 1fty s VAL 436 CO 0.00 0.20 1.11 -0.54 -0.31 0.00 0.00 175.10 175.56 1fty s LYS 437 N -1.27 4.39 0.20 4.82 1.02 -1.26 -4.78 119.74 122.86 1fty s LYS 437 Ca 0.08 1.76 0.02 0.00 0.02 0.00 0.00 55.97 57.85 1fty s LYS 437 Cb -0.09 -2.92 -0.05 0.00 -0.52 0.00 0.00 37.83 34.26 1fty s LYS 437 CO 0.02 -0.00 0.01 1.03 -0.92 0.00 0.00 175.35 175.49 1fty s ARG 438 N -1.90 1.23 -0.17 1.68 0.52 -0.63 -1.16 118.95 118.52 1fty s ARG 438 Ca 0.51 -1.61 -0.01 0.00 -0.52 0.00 0.00 55.73 54.10 1fty s ARG 438 Cb -0.30 -0.38 -0.00 0.00 0.52 0.00 0.00 34.95 34.79 1fty s ARG 438 CO 0.38 -0.14 -0.13 0.42 0.02 0.00 0.00 175.30 175.84 1fty s ILE 439 N -3.60 2.82 -0.73 1.52 -1.09 0.03 -1.20 121.20 118.96 1fty s ILE 439 Ca 0.27 -0.71 -0.24 0.00 -2.23 0.00 0.00 60.65 57.74 1fty s ILE 439 Cb 0.06 -2.21 0.06 0.00 -1.58 0.00 0.00 42.46 38.79 1fty s ILE 439 CO 0.07 0.50 1.13 0.21 -1.23 0.00 0.00 174.94 175.62 1fty s ASN 440 N 0.91 6.22 0.39 3.58 3.84 0.82 -2.09 114.94 128.60 1fty s ASN 440 Ca -0.03 -0.87 0.10 0.00 0.21 0.00 0.00 52.86 52.27 1fty s ASN 440 Cb -0.15 -2.48 0.87 0.00 -0.55 0.00 0.00 41.25 38.94 1fty s ASN 440 CO -0.01 -1.58 1.93 0.24 -2.79 0.00 0.00 177.10 174.89 1fty h MET 441 N 9.72 0.59 -0.76 0.43 2.86 -1.72 -1.47 114.93 124.58 1fty h MET 441 Ca -0.23 -0.04 -0.04 0.00 -2.06 0.00 0.00 59.70 57.34 1fty h MET 441 Cb 1.06 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 32.55 1fty h MET 441 CO 1.23 0.39 0.32 0.00 1.06 0.00 0.00 176.91 179.91 1fty h ALA 442 N 1.63 0.99 -0.26 6.32 0.00 -1.91 -1.68 119.26 124.36 1fty h ALA 442 Ca 0.36 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 1fty h ALA 442 Cb 0.56 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1fty h ALA 442 CO -0.13 0.61 -0.17 0.45 0.00 0.00 0.00 179.25 180.00 1fty h HIS 443 N 1.10 0.49 -0.19 0.00 3.86 -1.65 -2.14 115.15 116.62 1fty h HIS 443 Ca 0.26 -0.08 -0.01 0.00 -1.16 0.00 0.00 60.37 59.37 1fty h HIS 443 Cb 0.20 -0.13 -0.01 0.00 1.06 0.00 0.00 27.41 28.53 1fty h HIS 443 CO 0.02 0.61 0.08 1.25 0.86 0.00 0.00 177.93 180.74 1fty h LEU 444 N 0.41 0.25 -0.65 2.43 6.46 -1.04 -2.42 115.31 120.75 1fty h LEU 444 Ca 0.07 -0.14 -0.02 0.00 -0.12 0.00 0.00 57.88 57.67 1fty h LEU 444 Cb 0.54 -0.06 -0.03 0.00 -0.73 0.00 0.00 40.66 40.38 1fty h LEU 444 CO 0.04 0.32 0.33 0.00 -0.62 0.00 0.00 178.44 178.51 1fty h ILE 446 N 0.90 1.18 -0.78 0.00 2.04 -1.33 -2.58 117.51 116.94 1fty h ILE 446 Ca 0.23 -0.54 -0.05 0.00 1.00 0.00 0.00 64.86 65.49 1fty h ILE 446 Cb 0.10 0.86 -0.03 0.00 -0.74 0.00 0.00 36.82 37.00 1fty h ILE 446 CO -0.03 0.20 0.29 0.00 0.00 0.00 0.00 178.15 178.60 1fty h ALA 447 N 1.01 1.03 -0.58 1.87 0.00 -1.25 -3.19 119.26 118.15 1fty h ALA 447 Ca 0.12 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1fty h ALA 447 Cb 0.16 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1fty h ALA 447 CO -0.01 0.67 0.00 0.41 0.00 0.00 0.00 179.25 180.32 1fty n GLY 448 N -0.84 2.67 3.28 0.00 0.00 -0.65 -4.93 105.19 104.72 1fty n GLY 448 Ca 0.07 -0.82 -0.23 0.00 0.00 0.00 0.00 46.02 45.04 1fty n GLY 448 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1fty s SER 449 N -0.80 2.46 0.00 1.61 0.01 -0.98 -3.81 113.70 112.20 1fty s SER 449 Ca 0.49 -0.68 0.27 0.00 1.31 0.00 0.00 55.95 57.34 1fty s SER 449 Cb 0.34 -0.13 0.82 0.00 0.21 0.00 0.00 66.02 67.26 1fty s SER 449 CO 0.20 0.05 1.61 0.00 0.41 0.00 0.00 173.24 175.50 1fty n HIS 450 N 1.12 0.00 -3.68 2.43 1.44 -0.66 -4.86 115.22 111.00 1fty n HIS 450 Ca -0.20 0.00 -0.13 0.00 -2.01 0.00 0.00 57.72 55.39 1fty n HIS 450 Cb 0.54 -0.04 -0.09 0.00 0.12 0.00 0.00 29.99 30.52 1fty n HIS 450 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1fty s ALA 451 N -2.17 -1.42 -0.07 1.59 0.00 -1.26 -4.55 121.76 113.88 1fty s ALA 451 Ca 0.32 1.68 0.02 0.00 0.00 0.00 0.00 51.96 53.98 1fty s ALA 451 Cb 0.20 -0.98 0.02 0.00 0.00 0.00 0.00 23.12 22.36 1fty s ALA 451 CO 0.40 -0.28 -0.10 0.08 0.00 0.00 0.00 175.76 175.85 1fty s VAL 452 N 0.55 1.02 0.07 0.00 1.01 0.58 -1.47 120.40 122.16 1fty s VAL 452 Ca -0.02 -0.40 0.03 0.00 0.00 0.00 0.00 61.98 61.59 1fty s VAL 452 Cb -0.05 -0.95 -0.03 0.00 0.00 0.00 0.00 36.38 35.35 1fty s VAL 452 CO -0.03 0.33 -0.09 0.54 0.00 0.00 0.00 175.10 175.85 1fty s ASN 453 N 0.79 1.20 0.64 3.32 4.22 -0.83 -0.31 114.94 123.97 1fty s ASN 453 Ca -0.12 -0.72 0.05 0.00 -2.14 0.00 0.00 52.86 49.93 1fty s ASN 453 Cb -0.15 0.03 0.10 0.00 1.28 0.00 0.00 41.25 42.51 1fty s ASN 453 CO 0.02 -0.25 0.88 -0.83 -2.04 0.00 0.00 177.10 174.88 1fty s GLY 454 N -2.12 1.75 0.00 0.45 0.00 -1.07 -1.36 107.32 104.96 1fty s GLY 454 Ca -0.00 -1.95 0.09 0.00 0.00 0.00 0.00 44.72 42.86 1fty s GLY 454 CO -0.00 -1.45 1.09 3.33 0.00 0.00 0.00 173.10 176.07 1fty n VAL 455 N -2.50 0.69 -3.54 1.40 0.24 -1.26 -2.54 118.33 110.82 1fty n VAL 455 Ca 0.15 -0.85 -0.14 0.00 -2.04 0.00 0.00 64.34 61.46 1fty n VAL 455 Cb 0.61 0.72 -0.05 0.00 -1.47 0.00 0.00 33.84 33.64 1fty n VAL 455 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1fty s ALA 456 N -0.94 -1.84 0.21 2.33 0.00 -1.26 -1.51 121.76 118.75 1fty s ALA 456 Ca 0.17 1.41 -0.11 0.00 0.00 0.00 0.00 51.96 53.44 1fty s ALA 456 Cb 0.10 -0.29 0.27 0.00 0.00 0.00 0.00 23.12 23.20 1fty s ALA 456 CO 0.13 -0.36 1.68 -0.09 0.00 0.00 0.00 175.76 177.12 1fty h ARG 457 N 2.75 0.17 -0.36 0.00 2.43 -1.90 0.10 114.38 117.57 1fty h ARG 457 Ca -0.23 -0.01 -0.15 0.00 -0.81 0.00 0.00 59.98 58.78 1fty h ARG 457 Cb 1.16 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.66 1fty h ARG 457 CO 0.35 0.11 -0.36 0.97 -1.51 0.00 0.00 179.97 179.53 1fty h ILE 458 N 0.17 1.28 -0.38 1.20 2.10 -1.91 -1.94 117.51 118.03 1fty h ILE 458 Ca 0.30 -1.53 0.00 0.00 1.08 0.00 0.00 64.86 64.71 1fty h ILE 458 Cb 0.47 1.39 -0.02 0.00 -1.09 0.00 0.00 36.82 37.57 1fty h ILE 458 CO -0.45 0.51 0.24 -0.74 -1.08 0.00 0.00 178.15 176.63 1fty h HIS 459 N 0.70 0.49 -0.86 2.19 2.76 -1.58 -0.22 115.15 118.63 1fty h HIS 459 Ca 0.06 0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.22 1fty h HIS 459 Cb 0.93 -0.16 -0.04 0.00 1.55 0.00 0.00 27.41 29.69 1fty h HIS 459 CO 0.05 0.33 0.46 0.77 -1.30 0.00 0.00 177.93 178.24 1fty h SER 460 N 0.51 1.08 -0.54 3.26 0.02 -0.74 -1.90 113.55 115.25 1fty h SER 460 Ca 0.14 -0.10 -0.10 0.00 -0.84 0.00 0.00 61.79 60.88 1fty h SER 460 Cb -0.03 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 62.21 1fty h SER 460 CO -0.03 0.88 -0.07 -0.33 -1.14 0.00 0.00 176.83 176.14 1fty h GLU 461 N 1.21 0.99 -0.73 3.45 4.39 -0.89 -2.76 114.58 120.25 1fty h GLU 461 Ca 0.30 -0.35 0.03 0.00 0.34 0.00 0.00 59.36 59.68 1fty h GLU 461 Cb 0.04 -0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 28.58 1fty h GLU 461 CO -0.05 1.03 0.48 0.82 -1.16 0.00 0.00 179.01 180.13 1fty h ILE 462 N 0.87 1.12 -0.59 3.13 2.04 -0.53 0.35 117.51 123.90 1fty h ILE 462 Ca 0.14 -0.31 -0.03 0.00 1.00 0.00 0.00 64.86 65.67 1fty h ILE 462 Cb 0.63 0.14 -0.03 0.00 -0.74 0.00 0.00 36.82 36.82 1fty h ILE 462 CO 0.04 0.16 0.26 -0.07 0.00 0.00 0.00 178.15 178.54 1fty h LEU 463 N 0.90 0.80 -0.52 1.44 3.38 -1.08 0.46 115.31 120.69 1fty h LEU 463 Ca 0.29 -0.15 -0.16 0.00 0.09 0.00 0.00 57.88 57.94 1fty h LEU 463 Cb 0.02 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1fty h LEU 463 CO -0.08 0.73 -0.55 0.11 0.09 0.00 0.00 178.44 178.74 1fty h LYS 464 N 0.81 0.55 0.03 1.13 1.57 -1.15 0.17 116.57 119.68 1fty h LYS 464 Ca 0.20 -0.35 -0.27 0.00 -1.87 0.00 0.00 60.65 58.36 1fty h LYS 464 Cb 0.17 0.04 -0.03 0.00 0.08 0.00 0.00 32.23 32.49 1fty h LYS 464 CO -0.02 0.96 -1.42 0.87 -0.57 0.00 0.00 179.45 179.27 1fty h LYS 465 N 0.42 0.07 0.00 3.15 1.57 -0.79 -3.32 116.57 117.66 1fty h LYS 465 Ca 0.01 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.67 1fty h LYS 465 Cb 1.10 0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.45 1fty h LYS 465 CO 0.10 0.84 0.00 2.41 -0.57 0.00 0.00 179.45 182.23 1fty n THR 466 N -3.26 0.00 -0.34 -0.16 -1.04 0.16 -4.68 114.28 104.95 1fty n THR 466 Ca -0.11 0.00 0.07 0.00 -2.04 0.00 0.00 64.05 61.97 1fty n THR 466 Cb 1.01 -0.03 0.17 0.00 -1.82 0.00 0.00 70.33 69.66 1fty n THR 466 CO 0.00 0.00 0.00 -0.29 -0.64 0.00 0.00 175.07 174.14 1fty h ILE 467 N 0.00 0.04 -0.41 12.58 6.09 -1.65 -1.87 117.51 132.29 1fty h ILE 467 Ca 0.00 -0.00 -0.24 0.00 -1.37 0.00 0.00 64.86 63.24 1fty h ILE 467 Cb 0.00 0.04 -0.15 0.00 0.47 0.00 0.00 36.82 37.18 1fty h ILE 467 CO 0.00 0.00 -0.19 0.49 -3.07 0.00 0.00 178.15 175.38 1fty n PHE 468 N -5.58 1.32 -0.04 2.19 0.99 0.59 -4.78 117.46 112.15 1fty n PHE 468 Ca 0.17 -1.78 -0.08 0.00 -0.00 0.00 0.00 57.45 55.75 1fty n PHE 468 Cb 0.54 -0.50 -0.02 0.00 -1.00 0.00 0.00 39.48 38.50 1fty n PHE 468 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.76 176.54 1fty h LYS 469 N 1.23 -0.22 -0.98 -1.08 3.64 -1.28 -0.85 116.57 117.03 1fty h LYS 469 Ca 0.24 0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.70 1fty h LYS 469 Cb 1.51 0.05 -0.06 0.00 -0.41 0.00 0.00 32.23 33.31 1fty h LYS 469 CO 0.47 -0.14 0.64 -0.44 -2.27 0.00 0.00 179.45 177.70 1fty h ASP 470 N -0.22 1.01 0.35 4.20 3.32 -1.86 -1.28 116.42 121.94 1fty h ASP 470 Ca 0.13 0.01 -0.11 0.00 0.02 0.00 0.00 57.03 57.08 1fty h ASP 470 Cb 0.42 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 1fty h ASP 470 CO -0.36 0.65 -0.48 -0.26 -1.72 0.00 0.00 179.24 177.07 1fty h PHE 471 N 1.15 0.18 -0.25 4.55 0.04 -1.79 -2.52 116.94 118.30 1fty h PHE 471 Ca 0.42 -0.06 -0.17 0.00 2.80 0.00 0.00 57.97 60.96 1fty h PHE 471 Cb 0.16 -0.04 -0.00 0.00 2.20 0.00 0.00 35.95 38.27 1fty h PHE 471 CO -0.00 0.60 -0.53 -0.92 -0.60 0.00 0.00 178.31 176.87 1fty h TYR 472 N 0.12 0.92 -0.24 -0.55 3.20 -0.27 -1.98 116.97 118.17 1fty h TYR 472 Ca 0.01 -0.32 -0.09 0.00 3.14 0.00 0.00 58.73 61.47 1fty h TYR 472 Cb 0.90 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.97 1fty h TYR 472 CO 0.01 1.11 -0.22 0.93 -1.64 0.00 0.00 178.16 178.34 1fty h GLU 473 N 0.57 0.45 0.13 1.82 5.08 -1.10 -1.60 114.58 119.93 1fty h GLU 473 Ca 0.02 -0.16 -0.01 0.00 -1.00 0.00 0.00 59.36 58.22 1fty h GLU 473 Cb 1.10 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.32 1fty h GLU 473 CO 0.11 0.65 -0.06 1.25 -1.00 0.00 0.00 179.01 179.95 1fty h LEU 474 N 0.40 -0.15 -6.56 1.33 6.46 -1.33 -3.40 115.31 112.06 1fty h LEU 474 Ca 0.06 -0.38 -0.60 0.00 -0.12 0.00 0.00 57.88 56.85 1fty h LEU 474 Cb 0.61 0.04 -0.39 0.00 -0.73 0.00 0.00 40.66 40.19 1fty h LEU 474 CO 0.04 0.35 -0.87 -1.61 -0.62 0.00 0.00 178.44 175.73 1fty s GLU 475 N -3.97 1.24 0.57 1.25 2.02 -0.76 -4.97 118.70 114.08 1fty s GLU 475 Ca -0.14 -2.33 0.25 0.00 0.02 0.00 0.00 54.97 52.78 1fty s GLU 475 Cb 0.01 -1.89 1.64 0.00 0.10 0.00 0.00 34.13 33.99 1fty s GLU 475 CO 0.57 -1.35 2.21 -1.00 0.02 0.00 0.00 175.26 175.71 1fty h PRO 476 N 5.72 0.00 0.00 0.39 0.13 -1.52 -2.65 132.00 134.07 1fty h PRO 476 Ca 0.22 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.31 1fty h PRO 476 Cb 0.88 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.00 1fty h PRO 476 CO 0.44 0.00 -0.19 1.12 -0.23 0.00 0.00 178.00 179.15 1fty h HIS 477 N 0.00 0.00 -0.13 1.56 2.07 -1.93 -3.16 115.15 113.56 1fty h HIS 477 Ca 0.01 0.00 -0.12 0.00 -2.85 0.00 0.00 60.37 57.41 1fty h HIS 477 Cb 0.06 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.03 1fty h HIS 477 CO 0.00 0.19 -0.45 0.87 -3.07 0.00 0.00 177.93 175.47 1fty h LYS 478 N 0.00 0.32 -6.22 5.12 1.57 -1.71 -3.45 116.57 112.20 1fty h LYS 478 Ca -0.00 -0.17 -0.56 0.00 -1.87 0.00 0.00 60.65 58.05 1fty h LYS 478 Cb 0.44 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.71 1fty h LYS 478 CO 0.02 0.71 0.63 -0.06 -0.57 0.00 0.00 179.45 180.18 1fty s PHE 479 N -4.08 3.47 0.17 -1.35 0.08 -1.19 -0.30 117.98 114.76 1fty s PHE 479 Ca -0.05 1.56 0.03 0.00 0.12 0.00 0.00 56.93 58.58 1fty s PHE 479 Cb 0.13 -3.21 -0.01 0.00 -0.57 0.00 0.00 43.02 39.36 1fty s PHE 479 CO 0.79 -0.31 0.10 1.04 -0.10 0.00 0.00 175.22 176.74 1fty n GLN 480 N 5.33 0.49 -3.97 0.44 6.02 0.58 -4.95 117.38 121.33 1fty n GLN 480 Ca 0.10 -1.54 -0.10 0.00 -0.01 0.00 0.00 57.00 55.44 1fty n GLN 480 Cb 0.48 1.04 -0.12 0.00 1.02 0.00 0.00 30.24 32.66 1fty n GLN 480 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 177.06 177.26 1fty s ASN 481 N -2.10 0.25 -0.37 1.08 3.84 -1.26 -2.61 114.94 113.76 1fty s ASN 481 Ca 0.13 -0.39 0.04 0.00 0.21 0.00 0.00 52.86 52.85 1fty s ASN 481 Cb 0.01 0.07 0.16 0.00 -0.55 0.00 0.00 41.25 40.94 1fty s ASN 481 CO 0.10 -0.22 0.42 -0.54 -2.79 0.00 0.00 177.10 174.06 1fty s LYS 482 N -1.14 0.66 0.24 0.43 -0.14 -1.05 -4.90 119.74 113.83 1fty s LYS 482 Ca -0.12 -0.75 -0.31 0.00 -1.36 0.00 0.00 55.97 53.43 1fty s LYS 482 Cb -0.08 -0.59 -0.13 0.00 -1.68 0.00 0.00 37.83 35.36 1fty s LYS 482 CO -0.01 -1.19 1.53 2.41 -0.76 0.00 0.00 175.35 177.34 1fty n THR 483 N 4.30 0.69 -0.63 2.17 -1.04 -1.26 -4.38 114.28 114.13 1fty n THR 483 Ca 0.11 -0.17 -0.29 0.00 -2.04 0.00 0.00 64.05 61.65 1fty n THR 483 Cb 0.47 -1.70 0.22 0.00 -1.82 0.00 0.00 70.33 67.50 1fty n THR 483 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 1fty s ASN 484 N 0.57 1.74 0.37 8.00 0.02 -0.57 -4.64 114.94 120.43 1fty s ASN 484 Ca 0.70 1.75 -0.11 0.00 -1.02 0.00 0.00 52.86 54.18 1fty s ASN 484 Cb -0.59 -2.39 0.04 0.00 0.02 0.00 0.00 41.25 38.32 1fty s ASN 484 CO 0.45 -3.77 0.68 -0.83 0.02 0.00 0.00 177.10 173.65 1fty s GLY 485 N -2.61 0.76 0.10 0.66 0.00 -1.26 -4.81 107.32 100.16 1fty s GLY 485 Ca 0.68 -1.01 0.02 0.00 0.00 0.00 0.00 44.72 44.40 1fty s GLY 485 CO 0.62 -0.55 -0.07 -0.26 0.00 0.00 0.00 173.10 172.84 1fty s ILE 486 N -2.62 0.75 -0.19 0.90 -4.36 0.60 -4.46 121.20 111.81 1fty s ILE 486 Ca 0.21 -1.95 -0.25 0.00 -0.26 0.00 0.00 60.65 58.40 1fty s ILE 486 Cb -0.03 -1.70 -0.01 0.00 1.25 0.00 0.00 42.46 41.97 1fty s ILE 486 CO 0.14 -0.86 0.85 0.28 0.24 0.00 0.00 174.94 175.60 1fty s THR 487 N -3.58 4.85 -0.45 8.37 -1.32 -1.26 -0.34 115.64 121.90 1fty s THR 487 Ca 0.12 1.65 0.21 0.00 -1.21 0.00 0.00 61.69 62.47 1fty s THR 487 Cb 0.05 -4.15 0.22 0.00 -1.51 0.00 0.00 72.50 67.11 1fty s THR 487 CO -0.04 -0.02 1.64 -0.81 -2.21 0.00 0.00 174.62 173.18 1fty n PRO 488 N 5.51 0.15 0.13 7.08 -0.04 -1.26 -1.62 135.00 144.96 1fty n PRO 488 Ca 0.05 0.48 -0.06 0.00 -0.04 0.00 0.00 63.50 63.94 1fty n PRO 488 Cb 0.48 -1.86 -0.03 0.00 -0.04 0.00 0.00 33.50 32.06 1fty n PRO 488 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1fty h ARG 489 N 0.00 -0.37 -0.19 0.54 -0.00 -1.92 -2.02 114.38 110.43 1fty h ARG 489 Ca 0.00 0.03 -0.07 0.00 -0.50 0.00 0.00 59.98 59.44 1fty h ARG 489 Cb 0.22 0.08 -0.00 0.00 0.00 0.00 0.00 29.97 30.27 1fty h ARG 489 CO 0.00 -0.25 -0.14 -0.09 0.00 0.00 0.00 179.97 179.49 1fty h ARG 490 N -0.78 0.43 -0.38 0.04 2.43 -1.96 0.23 114.38 114.39 1fty h ARG 490 Ca -0.04 -0.21 0.00 0.00 -0.81 0.00 0.00 59.98 58.92 1fty h ARG 490 Cb 0.30 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 1fty h ARG 490 CO 0.06 0.76 0.00 0.91 -1.51 0.00 0.00 179.97 180.19 1fty n TRP 491 N -4.52 0.13 0.00 2.20 7.02 -0.64 -2.66 117.44 118.96 1fty n TRP 491 Ca -0.05 -0.05 0.00 0.00 -1.02 0.00 0.00 57.50 56.37 1fty n TRP 491 Cb 0.36 -0.05 0.00 0.00 -2.42 0.00 0.00 31.31 29.20 1fty n TRP 491 CO 0.00 0.00 0.00 -0.11 -2.02 0.00 0.00 177.69 175.56 1fty n LEU 492 N -0.17 0.00 -0.29 -0.99 7.94 -0.97 -4.80 117.00 117.72 1fty n LEU 492 Ca 0.02 0.00 0.05 0.00 -1.11 0.00 0.00 56.01 54.97 1fty n LEU 492 Cb 0.16 0.12 0.19 0.00 0.53 0.00 0.00 43.42 44.41 1fty n LEU 492 CO 0.02 -0.23 1.12 0.58 -1.11 0.00 0.00 177.39 177.77 1fty h VAL 493 N 0.00 0.83 0.13 1.96 2.07 -1.10 0.33 116.25 120.46 1fty h VAL 493 Ca 0.00 -0.24 -0.01 0.00 0.82 0.00 0.00 66.70 67.27 1fty h VAL 493 Cb 0.00 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 29.83 1fty h VAL 493 CO 0.00 0.13 -0.06 0.25 0.02 0.00 0.00 177.57 177.90 1fty h LEU 494 N 0.70 -0.15 0.00 2.57 6.46 -0.63 -3.27 115.31 120.99 1fty h LEU 494 Ca 0.42 -0.37 0.00 0.00 -0.12 0.00 0.00 57.88 57.81 1fty h LEU 494 Cb 0.49 0.04 0.00 0.00 -0.73 0.00 0.00 40.66 40.46 1fty h LEU 494 CO -0.30 0.45 -0.21 0.00 -0.62 0.00 0.00 178.44 177.75 1fty n ASN 496 N -2.23 0.57 0.05 0.00 2.85 0.11 -4.86 115.26 111.75 1fty n ASN 496 Ca 0.05 -2.88 0.05 0.00 -0.11 0.00 0.00 54.58 51.69 1fty n ASN 496 Cb 0.44 -0.63 0.46 0.00 1.24 0.00 0.00 39.78 41.29 1fty n ASN 496 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1fty h PRO 497 N 3.44 0.45 -0.11 1.20 0.13 -1.67 -1.78 132.00 133.66 1fty h PRO 497 Ca 0.09 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.19 1fty h PRO 497 Cb 0.93 -0.10 -0.01 0.00 0.13 0.00 0.00 31.00 31.95 1fty h PRO 497 CO 0.49 0.30 0.07 0.78 -0.23 0.00 0.00 178.00 179.40 1fty h GLY 498 N 0.47 0.15 1.14 1.56 0.00 -1.92 0.12 103.07 104.59 1fty h GLY 498 Ca 0.12 -0.06 -0.14 0.00 0.00 0.00 0.00 47.33 47.26 1fty h GLY 498 CO -0.03 0.06 -0.27 -2.00 0.00 0.00 0.00 176.54 174.30 1fty h LEU 499 N 0.14 1.00 -1.22 3.11 5.85 -1.85 -2.88 115.31 119.46 1fty h LEU 499 Ca 0.04 -0.40 -0.04 0.00 0.84 0.00 0.00 57.88 58.32 1fty h LEU 499 Cb -0.01 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.72 1fty h LEU 499 CO -0.01 1.20 0.10 0.00 -0.34 0.00 0.00 178.44 179.39 1fty h ALA 500 N 0.86 1.37 -0.01 1.25 0.00 -1.06 -2.44 119.26 119.23 1fty h ALA 500 Ca 0.09 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1fty h ALA 500 Cb 0.85 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 1fty h ALA 500 CO 0.08 0.45 0.00 1.49 0.00 0.00 0.00 179.25 181.27 1fty h GLU 501 N 0.63 0.03 0.00 0.00 4.57 -0.58 -1.47 114.58 117.75 1fty h GLU 501 Ca 0.14 -0.01 -0.04 0.00 -1.18 0.00 0.00 59.36 58.27 1fty h GLU 501 Cb 0.24 -0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.82 1fty h GLU 501 CO -0.00 0.30 -0.21 -0.84 -1.18 0.00 0.00 179.01 177.08 1fty h ILE 502 N -0.25 0.89 -0.20 2.32 3.07 -1.42 0.54 117.51 122.47 1fty h ILE 502 Ca 0.00 -0.79 -0.17 0.00 1.55 0.00 0.00 64.86 65.45 1fty h ILE 502 Cb 0.29 1.46 0.00 0.00 -0.27 0.00 0.00 36.82 38.30 1fty h ILE 502 CO 0.00 0.20 -0.54 0.40 -1.05 0.00 0.00 178.15 177.16 1fty h ILE 503 N 0.00 1.31 -0.13 0.16 2.04 -1.34 -3.15 117.51 116.39 1fty h ILE 503 Ca -0.00 -1.76 -0.07 0.00 1.00 0.00 0.00 64.86 64.02 1fty h ILE 503 Cb 0.44 1.87 -0.01 0.00 -0.74 0.00 0.00 36.82 38.38 1fty h ILE 503 CO 0.03 0.56 -0.25 0.00 0.00 0.00 0.00 178.15 178.48 1fty h ALA 504 N 0.59 1.33 -0.36 1.87 0.00 -0.38 -0.79 119.26 121.52 1fty h ALA 504 Ca -0.01 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 1fty h ALA 504 Cb 1.16 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 1fty h ALA 504 CO 0.12 0.46 0.20 0.93 0.00 0.00 0.00 179.25 180.96 1fty h GLU 505 N 0.21 0.49 0.01 0.00 5.08 -0.89 -0.01 114.58 119.47 1fty h GLU 505 Ca 0.03 -0.04 -0.32 0.00 -1.00 0.00 0.00 59.36 58.03 1fty h GLU 505 Cb 0.57 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.67 1fty h GLU 505 CO 0.04 0.36 -1.77 0.54 -1.00 0.00 0.00 179.01 177.17 1fty n ARG 506 N -4.45 0.60 -0.07 2.33 5.12 -1.00 -4.71 116.66 114.48 1fty n ARG 506 Ca 0.02 0.43 0.05 0.00 -1.93 0.00 0.00 57.85 56.43 1fty n ARG 506 Cb 0.09 -1.66 0.08 0.00 -1.16 0.00 0.00 32.46 29.82 1fty n ARG 506 CO 0.00 0.00 0.00 0.44 -1.93 0.00 0.00 177.63 176.14 1fty n ILE 507 N -4.21 0.42 -1.39 0.55 -5.35 -0.33 -5.12 119.36 103.93 1fty n ILE 507 Ca -0.39 -0.71 0.00 0.00 -0.27 0.00 0.00 62.75 61.38 1fty n ILE 507 Cb 0.80 0.91 0.00 0.00 -1.74 0.00 0.00 39.64 39.61 1fty n ILE 507 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1fty n GLY 508 N 0.52 -1.82 0.00 3.28 0.00 -0.02 -4.69 105.19 102.47 1fty n GLY 508 Ca 0.08 -1.83 0.07 0.00 0.00 0.00 0.00 46.02 44.33 1fty n GLY 508 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1fty n GLU 509 N 0.00 2.14 0.10 1.61 1.02 -1.26 -4.01 120.64 120.24 1fty n GLU 509 Ca 0.00 -0.01 0.07 0.00 -0.02 0.00 0.00 57.16 57.20 1fty n GLU 509 Cb 0.00 -1.19 0.37 0.00 -0.02 0.00 0.00 31.44 30.61 1fty n GLU 509 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1fty n GLU 510 N -1.40 0.09 0.23 3.49 0.00 -1.26 -2.32 120.64 119.47 1fty n GLU 510 Ca 0.02 0.54 0.15 0.00 0.00 0.00 0.00 57.16 57.87 1fty n GLU 510 Cb 0.24 -1.77 0.47 0.00 0.00 0.00 0.00 31.44 30.37 1fty n GLU 510 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 177.13 177.23 1fty h TYR 511 N 0.00 0.00 0.00 4.31 -0.00 -1.81 -2.84 116.97 116.63 1fty h TYR 511 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 58.73 58.72 1fty h TYR 511 Cb 0.06 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 36.79 1fty h TYR 511 CO 0.00 0.00 -0.03 0.82 -0.00 0.00 0.00 178.16 178.95 1fty h ILE 512 N 0.00 0.85 0.00 -0.90 1.08 -1.82 -0.92 117.51 115.80 1fty h ILE 512 Ca 0.00 -0.10 0.00 0.00 -0.39 0.00 0.00 64.86 64.37 1fty h ILE 512 Cb 0.69 1.06 0.00 0.00 -3.07 0.00 0.00 36.82 35.49 1fty h ILE 512 CO 0.00 0.03 -0.00 -1.54 -0.69 0.00 0.00 178.15 175.95 1fty n SER 513 N -4.26 2.12 -2.86 1.72 3.41 -1.20 -4.68 113.62 107.86 1fty n SER 513 Ca -0.03 -2.42 -0.12 0.00 -0.26 0.00 0.00 58.87 56.04 1fty n SER 513 Cb 0.11 -0.17 0.03 0.00 -0.26 0.00 0.00 64.21 63.92 1fty n SER 513 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1fty n ASP 514 N -0.87 -1.96 0.27 4.04 4.64 -0.74 -5.02 116.55 116.92 1fty n ASP 514 Ca 0.06 -3.23 0.18 0.00 -1.38 0.00 0.00 54.79 50.42 1fty n ASP 514 Cb 0.41 1.20 0.87 0.00 -1.04 0.00 0.00 41.12 42.56 1fty n ASP 514 CO 0.00 0.00 0.00 -0.07 -0.82 0.00 0.00 177.20 176.31 1fty h LEU 515 N 3.78 0.00 -1.95 -2.67 3.38 -1.48 -2.04 115.31 114.33 1fty h LEU 515 Ca -0.08 0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.92 1fty h LEU 515 Cb 1.01 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 1fty h LEU 515 CO 0.33 0.00 0.11 0.44 0.09 0.00 0.00 178.44 179.42 1fty h ASP 516 N 0.00 0.06 0.00 -0.43 3.32 -1.85 -1.34 116.42 116.19 1fty h ASP 516 Ca 0.05 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.10 1fty h ASP 516 Cb 0.59 -0.01 0.00 0.00 0.22 0.00 0.00 39.33 40.13 1fty h ASP 516 CO -0.00 0.04 0.03 0.00 -1.72 0.00 0.00 179.24 177.60 1fty n GLN 517 N -4.50 0.04 0.28 3.56 6.02 -0.77 -1.85 117.38 120.16 1fty n GLN 517 Ca 0.00 0.52 0.14 0.00 -0.01 0.00 0.00 57.00 57.66 1fty n GLN 517 Cb 0.19 -1.67 0.80 0.00 1.02 0.00 0.00 30.24 30.58 1fty n GLN 517 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1fty h LEU 518 N 0.00 0.00 -1.67 1.08 4.07 -1.47 -2.34 115.31 114.99 1fty h LEU 518 Ca 0.00 0.00 0.19 0.00 0.08 0.00 0.00 57.88 58.15 1fty h LEU 518 Cb 0.07 0.00 -0.05 0.00 1.08 0.00 0.00 40.66 41.76 1fty h LEU 518 CO 0.00 0.08 0.55 0.03 -1.08 0.00 0.00 178.44 178.02 1fty h ARG 519 N 0.00 0.29 0.00 1.13 3.08 -0.68 0.18 114.38 118.37 1fty h ARG 519 Ca -0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1fty h ARG 519 Cb 0.25 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.23 1fty h ARG 519 CO 0.01 0.19 0.02 0.87 -1.07 0.00 0.00 179.97 179.99 1fty h LYS 520 N 0.30 0.00 0.00 0.04 1.57 -1.67 0.11 116.57 116.93 1fty h LYS 520 Ca 0.40 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.18 1fty h LYS 520 Cb 1.13 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.44 1fty h LYS 520 CO -0.11 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.05 1fty n LEU 521 N -2.42 0.50 -0.17 2.94 4.77 0.62 -2.99 117.00 120.27 1fty n LEU 521 Ca -0.02 0.59 0.01 0.00 -0.03 0.00 0.00 56.01 56.56 1fty n LEU 521 Cb 0.06 -0.47 0.27 0.00 -2.33 0.00 0.00 43.42 40.95 1fty n LEU 521 CO 0.11 -0.31 1.19 -0.07 -1.33 0.00 0.00 177.39 176.99 1fty h LEU 522 N 0.00 0.78 0.00 2.23 4.07 -0.93 -1.82 115.31 119.64 1fty h LEU 522 Ca 0.00 -0.04 0.00 0.00 0.08 0.00 0.00 57.88 57.92 1fty h LEU 522 Cb 0.48 -0.20 0.00 0.00 1.08 0.00 0.00 40.66 42.03 1fty h LEU 522 CO 0.00 0.59 0.00 -1.54 -1.08 0.00 0.00 178.44 176.41 1fty n SER 523 N -4.41 0.00 -0.26 -0.43 3.41 -1.16 -2.13 113.62 108.64 1fty n SER 523 Ca 0.07 -0.79 0.02 0.00 -0.26 0.00 0.00 58.87 57.91 1fty n SER 523 Cb 0.06 0.00 0.06 0.00 -0.26 0.00 0.00 64.21 64.07 1fty n SER 523 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1fty n TYR 524 N -0.88 0.16 0.26 7.33 4.01 -0.69 -4.65 117.16 122.70 1fty n TYR 524 Ca 0.12 -0.41 0.15 0.00 -0.16 0.00 0.00 57.90 57.60 1fty n TYR 524 Cb 0.05 -0.03 0.78 0.00 -0.31 0.00 0.00 39.34 39.83 1fty n TYR 524 CO 0.00 0.00 0.00 -0.24 -0.46 0.00 0.00 176.86 176.16 1fty h VAL 525 N 0.88 0.00 -0.03 -0.72 3.04 -1.46 -0.45 116.25 117.50 1fty h VAL 525 Ca 0.00 -0.08 0.00 0.00 -1.01 0.00 0.00 66.70 65.61 1fty h VAL 525 Cb 0.53 0.80 0.00 0.00 -2.01 0.00 0.00 31.29 30.60 1fty h VAL 525 CO 0.00 0.00 0.00 0.47 -1.01 0.00 0.00 177.57 177.03 1fty n ASP 526 N -2.58 1.59 -4.67 3.17 10.43 -1.26 -4.89 116.55 118.34 1fty n ASP 526 Ca -0.01 -1.42 -0.42 0.00 2.57 0.00 0.00 54.79 55.50 1fty n ASP 526 Cb 0.10 -0.02 -0.03 0.00 1.84 0.00 0.00 41.12 43.01 1fty n ASP 526 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 1fty s ASP 527 N -0.50 6.86 0.17 -2.24 3.68 -0.18 -4.92 116.67 119.53 1fty s ASP 527 Ca 0.04 1.96 -0.11 0.00 2.13 0.00 0.00 52.55 56.57 1fty s ASP 527 Cb 0.03 -2.54 0.06 0.00 -1.45 0.00 0.00 42.92 39.02 1fty s ASP 527 CO 0.04 -0.77 1.68 -0.08 0.13 0.00 0.00 175.17 176.16 1fty h GLU 528 N 8.36 0.95 -0.23 4.34 4.57 -1.94 -2.24 114.58 128.39 1fty h GLU 528 Ca -0.33 -0.23 -0.04 0.00 -1.18 0.00 0.00 59.36 57.57 1fty h GLU 528 Cb 1.15 -0.12 -0.01 0.00 -0.16 0.00 0.00 28.75 29.61 1fty h GLU 528 CO 0.94 0.88 -0.02 0.00 -1.18 0.00 0.00 179.01 179.63 1fty h ALA 529 N 1.03 0.31 0.04 2.92 0.00 -1.95 -2.66 119.26 118.96 1fty h ALA 529 Ca 0.18 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1fty h ALA 529 Cb 0.36 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 1fty h ALA 529 CO 0.00 0.06 -0.03 0.35 0.00 0.00 0.00 179.25 179.63 1fty h PHE 530 N 0.17 -0.08 -0.77 0.00 -0.00 -1.86 -0.59 116.94 113.82 1fty h PHE 530 Ca 0.06 -0.00 0.13 0.00 -0.00 0.00 0.00 57.97 58.16 1fty h PHE 530 Cb 0.45 0.03 -0.09 0.00 -0.00 0.00 0.00 35.95 36.34 1fty h PHE 530 CO 0.04 -0.05 0.35 0.82 -0.00 0.00 0.00 178.31 179.47 1fty h ILE 531 N -0.07 0.72 -0.72 1.41 2.04 -1.43 0.22 117.51 119.67 1fty h ILE 531 Ca -0.00 -0.18 -0.06 0.00 1.00 0.00 0.00 64.86 65.61 1fty h ILE 531 Cb 0.07 0.15 -0.03 0.00 -0.74 0.00 0.00 36.82 36.27 1fty h ILE 531 CO 0.00 0.10 0.20 -0.09 0.00 0.00 0.00 178.15 178.36 1fty h ARG 532 N 0.52 1.14 0.11 2.37 2.43 -1.09 -1.69 114.38 118.18 1fty h ARG 532 Ca 0.41 -0.26 -0.01 0.00 -0.81 0.00 0.00 59.98 59.32 1fty h ARG 532 Cb 0.57 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.97 1fty h ARG 532 CO -0.36 0.98 -0.05 -0.44 -1.51 0.00 0.00 179.97 178.59 1fty h ASP 533 N 1.08 -0.13 -0.64 -3.80 3.32 0.19 -0.27 116.42 116.17 1fty h ASP 533 Ca 0.23 -0.39 0.13 0.00 0.02 0.00 0.00 57.03 57.02 1fty h ASP 533 Cb 0.34 0.03 -0.09 0.00 0.22 0.00 0.00 39.33 39.83 1fty h ASP 533 CO -0.00 0.36 0.14 0.58 -1.72 0.00 0.00 179.24 178.60 1fty h VAL 534 N -0.66 0.60 -0.03 -1.35 2.07 -0.64 0.35 116.25 116.59 1fty h VAL 534 Ca -0.02 -0.09 -0.06 0.00 0.82 0.00 0.00 66.70 67.35 1fty h VAL 534 Cb 0.51 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.58 1fty h VAL 534 CO 0.03 0.05 -0.29 0.00 0.02 0.00 0.00 177.57 177.38 1fty h ALA 535 N 1.52 1.47 -0.08 1.67 0.00 -1.26 -2.88 119.26 119.70 1fty h ALA 535 Ca 0.35 -0.28 -0.07 0.00 0.00 0.00 0.00 54.91 54.91 1fty h ALA 535 Cb 0.54 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.27 1fty h ALA 535 CO -0.44 0.39 -0.22 -0.22 0.00 0.00 0.00 179.25 178.76 1fty h LYS 536 N 0.04 0.30 -0.70 0.00 3.64 0.15 -2.77 116.57 117.22 1fty h LYS 536 Ca 0.00 -0.21 -0.01 0.00 -1.27 0.00 0.00 60.65 59.16 1fty h LYS 536 Cb 0.53 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.35 1fty h LYS 536 CO 0.04 0.82 0.39 -0.39 -2.27 0.00 0.00 179.45 178.04 1fty h VAL 537 N -0.18 1.22 -0.65 2.00 -1.51 -1.01 0.12 116.25 116.25 1fty h VAL 537 Ca -0.00 -0.53 0.02 0.00 -1.23 0.00 0.00 66.70 64.95 1fty h VAL 537 Cb 0.83 0.28 -0.03 0.00 -2.13 0.00 0.00 31.29 30.24 1fty h VAL 537 CO 0.05 0.24 0.43 0.50 -1.23 0.00 0.00 177.57 177.55 1fty h LYS 538 N 0.97 0.82 -0.28 5.19 1.63 -1.55 0.30 116.57 123.65 1fty h LYS 538 Ca 0.25 -0.05 -0.17 0.00 -0.85 0.00 0.00 60.65 59.83 1fty h LYS 538 Cb 0.03 -0.18 -0.00 0.00 -0.60 0.00 0.00 32.23 31.47 1fty h LYS 538 CO -0.04 0.54 -0.50 0.37 -3.45 0.00 0.00 179.45 176.37 1fty h GLN 539 N 0.84 0.78 -0.49 1.90 5.75 -1.02 -1.07 115.11 121.80 1fty h GLN 539 Ca 0.25 -0.46 -0.07 0.00 -0.15 0.00 0.00 58.65 58.21 1fty h GLN 539 Cb -0.04 0.04 -0.02 0.00 1.07 0.00 0.00 27.48 28.54 1fty h GLN 539 CO -0.06 1.09 0.04 0.93 -2.65 0.00 0.00 178.83 178.18 1fty h GLU 540 N 0.61 0.83 -0.54 1.69 5.08 0.01 -1.71 114.58 120.56 1fty h GLU 540 Ca 0.03 -0.25 -0.00 0.00 -1.00 0.00 0.00 59.36 58.14 1fty h GLU 540 Cb 1.08 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 30.22 1fty h GLU 540 CO 0.11 0.86 0.32 -0.91 -1.00 0.00 0.00 179.01 178.38 1fty h ASN 541 N 0.70 0.65 -0.47 1.42 2.35 -0.24 -1.64 115.58 118.33 1fty h ASN 541 Ca 0.14 -0.06 -0.05 0.00 -0.55 0.00 0.00 56.30 55.77 1fty h ASN 541 Cb 0.45 -0.16 -0.02 0.00 0.05 0.00 0.00 38.32 38.64 1fty h ASN 541 CO 0.02 0.52 0.11 0.11 -1.65 0.00 0.00 177.43 176.54 1fty h LYS 542 N 0.72 0.83 -0.53 0.81 1.57 -1.01 -1.88 116.57 117.07 1fty h LYS 542 Ca 0.19 -0.18 -0.12 0.00 -1.87 0.00 0.00 60.65 58.68 1fty h LYS 542 Cb -0.00 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.17 1fty h LYS 542 CO -0.03 0.76 -0.13 -0.07 -0.57 0.00 0.00 179.45 179.40 1fty h LEU 543 N 0.79 1.02 -0.67 2.94 3.38 -0.91 -0.52 115.31 121.33 1fty h LEU 543 Ca 0.17 -0.35 -0.11 0.00 0.09 0.00 0.00 57.88 57.68 1fty h LEU 543 Cb 0.32 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1fty h LEU 543 CO 0.00 1.14 -0.16 0.50 0.09 0.00 0.00 178.44 180.01 1fty h LYS 544 N 0.89 0.86 -0.09 1.13 3.11 -1.07 -1.86 116.57 119.55 1fty h LYS 544 Ca 0.13 -0.32 -0.18 0.00 -2.81 0.00 0.00 60.65 57.47 1fty h LYS 544 Cb 0.70 -0.05 0.01 0.00 -1.00 0.00 0.00 32.23 31.89 1fty h LYS 544 CO 0.05 0.96 -0.65 0.35 -2.81 0.00 0.00 179.45 177.36 1fty h PHE 545 N 0.76 0.82 -0.10 1.91 3.57 -1.25 -0.72 116.94 121.94 1fty h PHE 545 Ca 0.12 -0.38 0.03 0.00 3.53 0.00 0.00 57.97 61.26 1fty h PHE 545 Cb 0.68 -0.12 -0.00 0.00 2.79 0.00 0.00 35.95 39.30 1fty h PHE 545 CO 0.04 1.19 0.08 0.00 -2.23 0.00 0.00 178.31 177.39 1fty h ALA 546 N 0.46 2.05 0.05 2.41 0.00 -1.02 -0.34 119.26 122.86 1fty h ALA 546 Ca -0.06 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1fty h ALA 546 Cb 1.30 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.10 1fty h ALA 546 CO 0.13 -0.13 -0.02 0.00 0.00 0.00 0.00 179.25 179.23 1fty h ALA 547 N 1.94 -0.06 -0.82 0.00 0.00 -1.16 -3.20 119.26 115.95 1fty h ALA 547 Ca 0.05 -0.31 0.19 0.00 0.00 0.00 0.00 54.91 54.84 1fty h ALA 547 Cb 0.20 0.03 -0.12 0.00 0.00 0.00 0.00 17.79 17.90 1fty h ALA 547 CO -0.00 -0.12 0.28 -0.92 0.00 0.00 0.00 179.25 178.49 1fty h TYR 548 N -0.89 0.45 -0.30 0.00 5.03 -0.58 0.84 116.97 121.53 1fty h TYR 548 Ca -0.01 0.04 0.07 0.00 2.58 0.00 0.00 58.73 61.41 1fty h TYR 548 Cb 0.65 -0.07 -0.07 0.00 1.55 0.00 0.00 36.73 38.78 1fty h TYR 548 CO 0.16 -0.07 -0.21 1.25 -1.32 0.00 0.00 178.16 177.96 1fty h LEU 549 N 0.33 -0.69 -0.74 2.82 5.85 -1.14 -0.13 115.31 121.61 1fty h LEU 549 Ca 0.49 0.14 -0.13 0.00 0.84 0.00 0.00 57.88 59.22 1fty h LEU 549 Cb 0.89 0.35 -0.01 0.00 0.37 0.00 0.00 40.66 42.26 1fty h LEU 549 CO -0.53 -0.25 -0.53 -0.33 -0.34 0.00 0.00 178.44 176.46 1fty h GLU 550 N -0.19 0.27 0.00 1.25 5.08 -1.14 0.14 114.58 119.99 1fty h GLU 550 Ca 0.16 -0.16 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1fty h GLU 550 Cb 0.43 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.69 1fty h GLU 550 CO -0.41 0.73 0.00 0.54 -1.00 0.00 0.00 179.01 178.88 1fty n ARG 551 N -3.93 0.00 0.13 2.33 1.74 0.14 -2.91 116.66 114.15 1fty n ARG 551 Ca -0.02 0.52 0.05 0.00 -0.77 0.00 0.00 57.85 57.63 1fty n ARG 551 Cb 0.57 -1.49 0.03 0.00 -1.02 0.00 0.00 32.46 30.54 1fty n ARG 551 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 1fty h GLU 552 N 0.00 0.00 0.00 5.56 3.07 -1.16 -3.41 114.58 118.64 1fty h GLU 552 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1fty h GLU 552 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 1fty h GLU 552 CO 0.00 0.30 -0.74 0.66 -1.40 0.00 0.00 179.01 177.83 1fty n TYR 553 N -3.06 0.00 -2.71 4.33 4.01 0.05 -5.08 117.16 114.70 1fty n TYR 553 Ca -0.00 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.72 1fty n TYR 553 Cb 0.70 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.71 1fty n TYR 553 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1fty n LYS 554 N -1.26 -3.72 0.00 -0.72 4.76 0.29 -4.95 118.16 112.55 1fty n LYS 554 Ca 0.00 2.93 0.00 0.00 -2.87 0.00 0.00 58.31 58.37 1fty n LYS 554 Cb 0.00 -5.04 0.00 0.00 -1.84 0.00 0.00 35.03 28.15 1fty n LYS 554 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 1fty n VAL 555 N 1.10 0.00 -0.97 -0.18 0.24 -1.26 -5.01 118.33 112.25 1fty n VAL 555 Ca -0.14 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.16 1fty n VAL 555 Cb 0.24 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.61 1fty n VAL 555 CO 0.00 0.00 0.00 1.57 -2.14 0.00 0.00 176.83 176.26 1fty n HIS 556 N 0.00 0.00 -4.05 6.34 -0.00 -1.26 -5.08 115.22 111.17 1fty n HIS 556 Ca 0.00 0.00 -0.10 0.00 0.46 0.00 0.00 57.72 58.08 1fty n HIS 556 Cb 0.00 -0.26 -0.08 0.00 -0.12 0.00 0.00 29.99 29.53 1fty n HIS 556 CO 0.00 0.00 0.00 0.96 0.46 0.00 0.00 176.34 177.76 1fty s ILE 557 N -3.35 0.05 -0.29 3.57 -4.36 -1.26 -5.10 121.20 110.46 1fty s ILE 557 Ca 0.00 -1.61 -0.06 0.00 -0.26 0.00 0.00 60.65 58.72 1fty s ILE 557 Cb 0.00 -2.04 0.01 0.00 1.25 0.00 0.00 42.46 41.68 1fty s ILE 557 CO 0.00 -0.25 0.06 0.21 0.24 0.00 0.00 174.94 175.21 1fty s ASN 558 N -3.02 5.03 0.00 4.36 2.47 -1.26 -4.98 114.94 117.54 1fty s ASN 558 Ca 0.23 -0.71 0.08 0.00 0.42 0.00 0.00 52.86 52.88 1fty s ASN 558 Cb 0.04 -1.86 0.37 0.00 -1.45 0.00 0.00 41.25 38.36 1fty s ASN 558 CO 0.04 -0.18 1.14 -2.65 -3.72 0.00 0.00 177.10 171.73 1fty n PRO 559 N 4.85 0.08 0.07 0.43 -0.02 -1.26 -2.42 135.00 136.73 1fty n PRO 559 Ca -0.15 0.25 0.10 0.00 -2.02 0.00 0.00 63.50 61.68 1fty n PRO 559 Cb 0.48 -1.50 -0.05 0.00 -0.02 0.00 0.00 33.50 32.41 1fty n PRO 559 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1fty n ASN 560 N -1.34 0.66 -4.44 2.55 5.03 -1.26 -4.89 115.26 111.56 1fty n ASN 560 Ca 0.03 0.26 -0.29 0.00 0.87 0.00 0.00 54.58 55.45 1fty n ASN 560 Cb 0.07 0.77 0.20 0.00 -1.02 0.00 0.00 39.78 39.79 1fty n ASN 560 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 1fty s SER 561 N -5.22 2.12 -0.07 6.41 1.04 -1.02 -4.97 113.70 112.00 1fty s SER 561 Ca -0.02 1.00 -0.28 0.00 0.48 0.00 0.00 55.95 57.13 1fty s SER 561 Cb 0.10 -1.54 -0.02 0.00 0.10 0.00 0.00 66.02 64.66 1fty s SER 561 CO 0.82 -3.42 0.91 -0.22 0.98 0.00 0.00 173.24 172.31 1fty s LEU 562 N -6.59 4.30 -0.68 2.42 0.20 -0.11 -4.84 118.68 113.38 1fty s LEU 562 Ca 0.67 1.46 -0.22 0.00 0.69 0.00 0.00 54.13 56.73 1fty s LEU 562 Cb -0.16 -3.42 0.08 0.00 -0.43 0.00 0.00 46.19 42.26 1fty s LEU 562 CO 0.57 -0.30 0.96 -0.36 -0.29 0.00 0.00 176.35 176.93 1fty s PHE 563 N 1.41 2.72 -0.51 5.38 2.99 -1.26 -0.84 117.98 127.87 1fty s PHE 563 Ca 0.46 -0.64 -0.18 0.00 0.00 0.00 0.00 56.93 56.57 1fty s PHE 563 Cb -0.19 -4.28 0.07 0.00 0.00 0.00 0.00 43.02 38.62 1fty s PHE 563 CO 0.21 -1.62 0.60 0.34 -0.00 0.00 0.00 175.22 174.74 1fty s ASP 564 N 3.69 6.20 -0.03 1.36 3.68 0.28 -1.28 116.67 130.58 1fty s ASP 564 Ca 0.22 -1.07 0.04 0.00 2.13 0.00 0.00 52.55 53.88 1fty s ASP 564 Cb -0.16 -2.27 -0.01 0.00 -1.45 0.00 0.00 42.92 39.03 1fty s ASP 564 CO 0.08 -0.88 -0.16 0.54 0.13 0.00 0.00 175.17 174.89 1fty s VAL 565 N 2.45 1.27 -0.29 1.11 0.11 -0.72 0.85 120.40 125.18 1fty s VAL 565 Ca 0.12 -0.66 0.01 0.00 -2.93 0.00 0.00 61.98 58.52 1fty s VAL 565 Cb -0.21 -1.08 0.09 0.00 -1.53 0.00 0.00 36.38 33.65 1fty s VAL 565 CO 0.10 0.37 0.04 -1.58 -3.33 0.00 0.00 175.10 170.70 1fty s GLN 566 N -0.16 1.18 -0.15 1.54 0.74 0.01 -2.41 119.66 120.41 1fty s GLN 566 Ca 0.01 -1.24 0.00 0.00 0.05 0.00 0.00 55.36 54.19 1fty s GLN 566 Cb -0.08 -2.50 0.03 0.00 1.10 0.00 0.00 33.01 31.55 1fty s GLN 566 CO 0.01 -0.85 -0.13 0.14 -0.55 0.00 0.00 175.29 173.91 1fty s VAL 567 N 1.37 1.54 -0.07 1.34 -7.23 -1.26 -1.95 120.40 114.13 1fty s VAL 567 Ca 0.05 -0.66 -0.32 0.00 -1.81 0.00 0.00 61.98 59.24 1fty s VAL 567 Cb -0.18 -1.48 0.14 0.00 0.56 0.00 0.00 36.38 35.42 1fty s VAL 567 CO -0.14 0.41 1.40 -1.59 -0.31 0.00 0.00 175.10 174.87 1fty s LYS 568 N 1.49 0.12 0.61 4.82 0.00 -0.89 -4.99 119.74 120.90 1fty s LYS 568 Ca 0.04 -0.07 -0.19 0.00 0.00 0.00 0.00 55.97 55.76 1fty s LYS 568 Cb -0.13 0.04 -0.04 0.00 0.00 0.00 0.00 37.83 37.70 1fty s LYS 568 CO -0.10 -0.06 1.11 0.54 0.00 0.00 0.00 175.35 176.84 1fty n ARG 569 N -0.49 1.04 -2.57 1.78 5.12 -1.26 -3.98 116.66 116.30 1fty n ARG 569 Ca -0.10 0.40 -0.43 0.00 -1.93 0.00 0.00 57.85 55.80 1fty n ARG 569 Cb 0.64 -2.32 -0.02 0.00 -1.16 0.00 0.00 32.46 29.59 1fty n ARG 569 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1fty s ILE 570 N -1.45 4.52 0.06 0.55 -1.09 -0.64 -4.87 121.20 118.29 1fty s ILE 570 Ca 0.78 1.83 -0.09 0.00 -2.23 0.00 0.00 60.65 60.94 1fty s ILE 570 Cb -0.41 -4.18 -0.00 0.00 -1.58 0.00 0.00 42.46 36.29 1fty s ILE 570 CO 0.45 -0.12 0.18 -1.00 -1.23 0.00 0.00 174.94 173.22 1fty s HIS 571 N 3.05 0.11 0.23 3.97 3.76 -1.26 -4.77 115.29 120.37 1fty s HIS 571 Ca 0.49 -0.44 0.08 0.00 -0.15 0.00 0.00 55.06 55.05 1fty s HIS 571 Cb -0.19 -0.05 0.19 0.00 1.11 0.00 0.00 32.58 33.64 1fty s HIS 571 CO 0.12 -0.48 1.51 0.93 -0.85 0.00 0.00 174.74 175.97 1fty h GLU 572 N 3.14 0.04 0.00 1.40 5.08 -1.98 -3.08 114.58 119.17 1fty h GLU 572 Ca -0.33 -0.04 -0.03 0.00 -1.00 0.00 0.00 59.36 57.96 1fty h GLU 572 Cb 1.19 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.45 1fty h GLU 572 CO 0.52 0.75 -0.16 0.10 -1.00 0.00 0.00 179.01 179.22 1fty h TYR 573 N 0.03 0.00 0.00 4.33 -0.00 -1.97 -2.78 116.97 116.58 1fty h TYR 573 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.72 1fty h TYR 573 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 36.73 38.01 1fty h TYR 573 CO 0.01 0.16 0.00 0.87 -0.00 0.00 0.00 178.16 179.19 1fty h LYS 574 N 0.00 0.00 -5.84 0.10 1.79 -1.88 -3.05 116.57 107.69 1fty h LYS 574 Ca -0.00 0.00 -0.38 0.00 -2.18 0.00 0.00 60.65 58.09 1fty h LYS 574 Cb 0.95 0.00 0.12 0.00 -1.58 0.00 0.00 32.23 31.72 1fty h LYS 574 CO 0.02 0.00 -0.76 0.54 -1.08 0.00 0.00 179.45 178.17 1fty n ARG 575 N -2.63 -6.44 0.29 3.15 1.74 -1.05 -4.07 116.66 107.65 1fty n ARG 575 Ca 0.04 0.77 0.14 0.00 -0.77 0.00 0.00 57.85 58.04 1fty n ARG 575 Cb 0.43 -5.69 0.86 0.00 -1.02 0.00 0.00 32.46 27.04 1fty n ARG 575 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1fty h GLN 576 N -2.07 0.00 -0.63 5.56 7.50 -1.86 0.32 115.11 123.93 1fty h GLN 576 Ca -0.59 0.00 -0.04 0.00 0.50 0.00 0.00 58.65 58.52 1fty h GLN 576 Cb 1.35 0.00 -0.03 0.00 0.05 0.00 0.00 27.48 28.85 1fty h GLN 576 CO 0.54 0.02 0.22 -0.07 -1.50 0.00 0.00 178.83 178.05 1fty h LEU 577 N 0.00 0.87 -0.95 1.46 3.38 -1.89 0.29 115.31 118.47 1fty h LEU 577 Ca -0.00 -0.13 -0.08 0.00 0.09 0.00 0.00 57.88 57.76 1fty h LEU 577 Cb 0.06 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1fty h LEU 577 CO 0.00 0.80 -0.07 0.25 0.09 0.00 0.00 178.44 179.52 1fty h LEU 578 N 0.92 0.67 -0.71 1.67 5.85 -1.31 -0.36 115.31 122.05 1fty h LEU 578 Ca 0.21 -0.17 -0.08 0.00 0.84 0.00 0.00 57.88 58.67 1fty h LEU 578 Cb 0.23 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 1fty h LEU 578 CO -0.01 0.78 0.06 -1.13 -0.34 0.00 0.00 178.44 177.80 1fty h ASN 579 N 0.64 1.02 -0.34 1.25 -0.00 -1.12 -2.70 115.58 114.32 1fty h ASN 579 Ca 0.12 -0.26 -0.00 0.00 -0.00 0.00 0.00 56.30 56.16 1fty h ASN 579 Cb 0.50 -0.27 -0.02 0.00 -0.00 0.00 0.00 38.32 38.53 1fty h ASN 579 CO 0.03 1.03 0.20 0.00 -0.00 0.00 0.00 177.43 178.69 1fty h LEU 581 N 0.44 0.99 -0.13 0.00 3.38 -0.85 -1.29 115.31 117.84 1fty h LEU 581 Ca 0.12 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 1fty h LEU 581 Cb 0.02 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 1fty h LEU 581 CO -0.02 0.61 -0.00 -0.74 0.09 0.00 0.00 178.44 178.38 1fty h HIS 582 N 1.11 0.26 -0.49 1.13 2.76 -1.16 -1.67 115.15 117.09 1fty h HIS 582 Ca 0.43 -0.04 0.07 0.00 -2.20 0.00 0.00 60.37 58.63 1fty h HIS 582 Cb 0.23 -0.07 -0.06 0.00 1.55 0.00 0.00 27.41 29.07 1fty h HIS 582 CO -0.00 0.47 0.17 0.28 -1.30 0.00 0.00 177.93 177.54 1fty h VAL 583 N -0.03 0.82 -0.62 5.26 2.07 -0.68 -0.21 116.25 122.86 1fty h VAL 583 Ca 0.04 -0.11 -0.05 0.00 0.82 0.00 0.00 66.70 67.39 1fty h VAL 583 Cb 0.37 0.45 -0.03 0.00 -1.52 0.00 0.00 31.29 30.56 1fty h VAL 583 CO 0.01 0.06 0.19 0.40 0.02 0.00 0.00 177.57 178.24 1fty h ILE 584 N 0.33 1.23 -0.39 4.57 2.04 -1.22 -1.78 117.51 122.30 1fty h ILE 584 Ca 0.24 -0.81 0.00 0.00 1.00 0.00 0.00 64.86 65.29 1fty h ILE 584 Cb 0.26 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 36.89 1fty h ILE 584 CO -0.25 0.31 0.25 0.74 0.00 0.00 0.00 178.15 179.20 1fty h THR 585 N 0.91 1.11 -0.50 -0.27 2.02 -0.20 -0.00 112.91 115.97 1fty h THR 585 Ca 0.20 -0.22 0.03 0.00 0.77 0.00 0.00 66.41 67.20 1fty h THR 585 Cb 0.27 0.56 -0.04 0.00 -1.74 0.00 0.00 68.15 67.20 1fty h THR 585 CO -0.01 0.11 0.28 -0.07 0.37 0.00 0.00 175.52 176.20 1fty h LEU 586 N 0.52 0.44 -0.05 2.58 4.07 -0.74 -1.08 115.31 121.05 1fty h LEU 586 Ca 0.14 0.01 0.02 0.00 0.08 0.00 0.00 57.88 58.13 1fty h LEU 586 Cb -0.04 -0.08 -0.02 0.00 1.08 0.00 0.00 40.66 41.60 1fty h LEU 586 CO -0.03 0.31 -0.06 0.22 -1.08 0.00 0.00 178.44 177.79 1fty h TYR 587 N 0.56 -0.16 -0.27 1.13 5.03 -0.76 -2.11 116.97 120.38 1fty h TYR 587 Ca 0.21 0.01 -0.03 0.00 2.58 0.00 0.00 58.73 61.50 1fty h TYR 587 Cb 0.06 0.08 -0.01 0.00 1.55 0.00 0.00 36.73 38.41 1fty h TYR 587 CO -0.08 -0.10 0.04 -0.91 -1.32 0.00 0.00 178.16 175.79 1fty h ASN 588 N -0.09 0.36 -0.31 -2.11 2.35 -0.65 -1.36 115.58 113.77 1fty h ASN 588 Ca 0.04 -0.04 -0.18 0.00 -0.55 0.00 0.00 56.30 55.57 1fty h ASN 588 Cb 0.15 -0.09 -0.00 0.00 0.05 0.00 0.00 38.32 38.43 1fty h ASN 588 CO -0.10 0.39 -0.51 0.03 -1.65 0.00 0.00 177.43 175.58 1fty h ARG 589 N 0.39 0.90 -0.53 0.81 3.08 -0.93 -2.31 114.38 115.79 1fty h ARG 589 Ca 0.09 -0.55 -0.04 0.00 0.07 0.00 0.00 59.98 59.56 1fty h ARG 589 Cb 0.19 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.27 1fty h ARG 589 CO -0.00 1.19 0.19 0.82 -1.07 0.00 0.00 179.97 181.10 1fty h ILE 590 N 0.70 1.22 0.00 2.04 2.04 -0.92 -1.18 117.51 121.42 1fty h ILE 590 Ca 0.02 -0.72 -0.00 0.00 1.00 0.00 0.00 64.86 65.16 1fty h ILE 590 Cb 1.12 0.71 -0.00 0.00 -0.74 0.00 0.00 36.82 37.91 1fty h ILE 590 CO 0.12 0.27 -0.01 0.11 0.00 0.00 0.00 178.15 178.64 1fty h LYS 591 N 0.72 0.00 0.10 2.37 1.79 -1.21 -0.62 116.57 119.72 1fty h LYS 591 Ca 0.17 0.00 -0.17 0.00 -2.18 0.00 0.00 60.65 58.48 1fty h LYS 591 Cb 0.23 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.89 1fty h LYS 591 CO -0.01 0.01 -0.79 -0.22 -1.08 0.00 0.00 179.45 177.36 1fty h LYS 592 N 0.00 0.21 -2.68 3.15 1.63 -0.79 -3.40 116.57 114.68 1fty h LYS 592 Ca -0.00 -0.35 -0.60 0.00 -0.85 0.00 0.00 60.65 58.84 1fty h LYS 592 Cb 0.39 0.13 -0.40 0.00 -0.60 0.00 0.00 32.23 31.75 1fty h LYS 592 CO 0.00 1.17 -0.78 0.39 -3.45 0.00 0.00 179.45 176.78 1fty n GLU 593 N -4.21 1.08 -0.26 1.90 1.02 -0.51 -4.99 120.64 114.67 1fty n GLU 593 Ca -0.16 -3.86 0.03 0.00 -0.02 0.00 0.00 57.16 53.15 1fty n GLU 593 Cb 0.76 -1.97 0.16 0.00 -0.02 0.00 0.00 31.44 30.37 1fty n GLU 593 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 1fty h PRO 594 N 5.39 0.58 -0.93 3.49 0.11 -1.34 -2.92 132.00 136.38 1fty h PRO 594 Ca 0.20 -0.04 -0.19 0.00 0.11 0.00 0.00 66.00 66.09 1fty h PRO 594 Cb 0.82 -0.13 -0.11 0.00 0.11 0.00 0.00 31.00 31.69 1fty h PRO 594 CO 0.56 0.39 0.24 0.09 -0.21 0.00 0.00 178.00 179.06 1fty n ASN 595 N -4.87 3.43 -4.72 -2.05 4.13 -1.26 -4.86 115.26 105.06 1fty n ASN 595 Ca 0.13 -2.73 -0.35 0.00 1.68 0.00 0.00 54.58 53.31 1fty n ASN 595 Cb 0.32 -0.65 -0.09 0.00 -1.54 0.00 0.00 39.78 37.82 1fty n ASN 595 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 1fty s LYS 596 N -1.80 3.03 0.18 3.52 2.20 -1.11 -5.09 119.74 120.68 1fty s LYS 596 Ca 0.30 -0.40 -0.30 0.00 -0.36 0.00 0.00 55.97 55.21 1fty s LYS 596 Cb 0.24 -2.84 -0.08 0.00 -1.51 0.00 0.00 37.83 33.64 1fty s LYS 596 CO 0.07 0.70 0.97 0.12 -0.36 0.00 0.00 175.35 176.85 1fty s PHE 597 N -0.96 3.86 0.01 4.03 5.36 -1.26 -5.05 117.98 123.97 1fty s PHE 597 Ca 0.15 1.83 -0.00 0.00 -0.96 0.00 0.00 56.93 57.95 1fty s PHE 597 Cb -0.11 -3.05 -0.01 0.00 -0.34 0.00 0.00 43.02 39.50 1fty s PHE 597 CO 0.05 0.21 -0.01 0.14 -1.46 0.00 0.00 175.22 174.15 1fty s VAL 598 N -0.62 0.05 0.08 3.12 -7.23 -1.26 -5.12 120.40 109.43 1fty s VAL 598 Ca 0.44 -0.41 -0.31 0.00 -1.81 0.00 0.00 61.98 59.90 1fty s VAL 598 Cb -0.26 -0.13 -0.09 0.00 0.56 0.00 0.00 36.38 36.46 1fty s VAL 598 CO 0.32 -0.22 1.80 -0.69 -0.31 0.00 0.00 175.10 175.99 1fty s VAL 599 N -0.66 2.81 0.56 1.32 1.01 -1.26 -4.94 120.40 119.24 1fty s VAL 599 Ca -0.07 0.20 -0.20 0.00 0.00 0.00 0.00 61.98 61.91 1fty s VAL 599 Cb -0.05 -3.13 -0.04 0.00 0.00 0.00 0.00 36.38 33.16 1fty s VAL 599 CO -0.00 -0.00 1.24 -2.84 0.00 0.00 0.00 175.10 173.49 1fty s PRO 600 N 3.08 3.11 -0.03 2.72 0.02 -1.26 -4.92 135.00 137.72 1fty s PRO 600 Ca 0.80 1.92 -0.07 0.00 0.02 0.00 0.00 61.00 63.67 1fty s PRO 600 Cb -0.43 -2.07 0.01 0.00 0.02 0.00 0.00 34.50 32.03 1fty s PRO 600 CO 0.36 -1.12 0.17 1.03 -0.33 0.00 0.00 177.00 177.10 1fty s ARG 601 N -3.14 0.39 -0.25 5.54 0.52 -0.66 -0.94 118.95 120.43 1fty s ARG 601 Ca 0.74 -0.14 0.02 0.00 -0.52 0.00 0.00 55.73 55.84 1fty s ARG 601 Cb -0.33 0.17 0.06 0.00 0.52 0.00 0.00 34.95 35.37 1fty s ARG 601 CO 0.37 -0.09 -0.10 0.99 0.02 0.00 0.00 175.30 176.49 1fty s THR 602 N -0.82 1.99 -0.26 0.02 2.01 -0.02 -2.22 115.64 116.33 1fty s THR 602 Ca -0.09 -1.48 -0.10 0.00 0.31 0.00 0.00 61.69 60.33 1fty s THR 602 Cb -0.05 -2.12 -0.04 0.00 0.01 0.00 0.00 72.50 70.29 1fty s THR 602 CO 0.01 -0.01 0.15 0.68 -0.69 0.00 0.00 174.62 174.76 1fty s VAL 603 N 1.19 5.05 -0.21 3.82 -7.23 -0.44 -0.55 120.40 122.02 1fty s VAL 603 Ca -0.07 0.08 -0.03 0.00 -1.81 0.00 0.00 61.98 60.14 1fty s VAL 603 Cb -0.19 -3.38 -0.01 0.00 0.56 0.00 0.00 36.38 33.36 1fty s VAL 603 CO -0.06 0.30 -0.06 -0.04 -0.31 0.00 0.00 175.10 174.94 1fty s MET 604 N 1.49 3.37 -0.14 4.82 -1.94 0.25 -1.69 119.30 125.45 1fty s MET 604 Ca 0.07 -0.64 0.02 0.00 -1.71 0.00 0.00 55.69 53.43 1fty s MET 604 Cb -0.15 -2.96 0.01 0.00 2.01 0.00 0.00 34.83 33.74 1fty s MET 604 CO 0.07 -0.16 -0.21 0.42 -0.01 0.00 0.00 175.02 175.14 1fty s ILE 605 N 1.36 2.18 0.01 2.53 1.01 -0.40 -0.81 121.20 127.08 1fty s ILE 605 Ca 0.04 -0.94 -0.07 0.00 0.00 0.00 0.00 60.65 59.69 1fty s ILE 605 Cb -0.14 -1.88 -0.00 0.00 0.01 0.00 0.00 42.46 40.45 1fty s ILE 605 CO -0.03 0.54 0.13 -0.83 0.00 0.00 0.00 174.94 174.75 1fty s GLY 606 N 0.83 0.06 0.00 6.18 0.00 -0.82 -0.97 107.32 112.60 1fty s GLY 606 Ca -0.06 -0.19 0.00 0.00 0.00 0.00 0.00 44.72 44.47 1fty s GLY 606 CO -0.02 -0.33 0.00 0.61 0.00 0.00 0.00 173.10 173.37 1fty n GLY 607 N 1.40 2.99 3.87 0.20 0.00 -1.26 -2.10 105.19 110.29 1fty n GLY 607 Ca -0.23 -0.81 -0.32 0.00 0.00 0.00 0.00 46.02 44.66 1fty n GLY 607 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1fty s LYS 608 N -2.00 3.31 -0.12 1.61 1.02 -1.26 -4.69 119.74 117.61 1fty s LYS 608 Ca 0.00 -0.41 -0.01 0.00 0.02 0.00 0.00 55.97 55.57 1fty s LYS 608 Cb 0.00 -3.00 -0.02 0.00 -0.52 0.00 0.00 37.83 34.28 1fty s LYS 608 CO 0.00 0.65 -0.08 0.00 -0.92 0.00 0.00 175.35 175.00 1fty s ALA 609 N -1.34 2.88 0.34 5.17 0.00 -1.26 -1.62 121.76 125.93 1fty s ALA 609 Ca 0.28 -0.87 -0.28 0.00 0.00 0.00 0.00 51.96 51.09 1fty s ALA 609 Cb -0.13 -1.34 -0.12 0.00 0.00 0.00 0.00 23.12 21.54 1fty s ALA 609 CO 0.20 0.35 1.36 0.00 0.00 0.00 0.00 175.76 177.67 1fty n ALA 610 N 3.07 1.61 -0.32 0.00 0.00 -1.26 -4.86 120.51 118.73 1fty n ALA 610 Ca -0.18 0.36 0.25 0.00 0.00 0.00 0.00 53.44 53.87 1fty n ALA 610 Cb 0.53 -2.31 0.54 0.00 0.00 0.00 0.00 19.45 18.21 1fty n ALA 610 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1fty h PRO 611 N 2.89 0.32 -0.02 0.00 0.11 -1.99 -2.05 132.00 131.26 1fty h PRO 611 Ca -0.47 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1fty h PRO 611 Cb 1.27 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1fty h PRO 611 CO 0.65 0.21 -0.06 0.41 -0.21 0.00 0.00 178.00 179.00 1fty n GLY 612 N -1.51 0.41 3.50 -0.55 0.00 -1.26 -4.77 105.19 101.00 1fty n GLY 612 Ca 0.26 -0.57 -0.43 0.00 0.00 0.00 0.00 46.02 45.28 1fty n GLY 612 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1fty s TYR 613 N -2.08 2.83 0.14 1.61 6.04 -0.77 -4.89 117.35 120.21 1fty s TYR 613 Ca 0.31 -1.10 -0.19 0.00 0.04 0.00 0.00 57.07 56.13 1fty s TYR 613 Cb 0.20 -4.48 -0.00 0.00 -1.04 0.00 0.00 41.96 36.64 1fty s TYR 613 CO 0.36 -1.71 1.71 1.25 -1.54 0.00 0.00 175.55 175.62 1fty h HIS 614 N 9.31 -0.04 -0.10 4.97 -0.00 -1.86 -2.39 115.15 125.04 1fty h HIS 614 Ca 0.16 0.02 0.02 0.00 -0.00 0.00 0.00 60.37 60.56 1fty h HIS 614 Cb 1.02 0.05 -0.02 0.00 -0.00 0.00 0.00 27.41 28.47 1fty h HIS 614 CO 1.21 -0.05 -0.01 1.98 -0.00 0.00 0.00 177.93 181.06 1fty h MET 615 N 0.06 0.02 -0.87 5.26 1.85 -1.98 -1.42 114.93 117.84 1fty h MET 615 Ca 0.12 -0.00 0.15 0.00 -0.61 0.00 0.00 59.70 59.35 1fty h MET 615 Cb 0.15 -0.00 -0.09 0.00 0.43 0.00 0.00 31.60 32.09 1fty h MET 615 CO -0.21 0.01 0.47 0.00 -0.40 0.00 0.00 176.91 176.79 1fty h ALA 616 N 1.09 1.33 0.00 0.39 0.00 -1.86 0.11 119.26 120.32 1fty h ALA 616 Ca 0.05 0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.97 1fty h ALA 616 Cb 0.06 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1fty h ALA 616 CO -0.09 -0.05 -0.29 0.87 0.00 0.00 0.00 179.25 179.69 1fty h LYS 617 N 0.67 0.00 -0.10 0.00 1.57 -1.00 -2.76 116.57 114.95 1fty h LYS 617 Ca 0.47 0.00 -0.20 0.00 -1.87 0.00 0.00 60.65 59.06 1fty h LYS 617 Cb 0.65 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.96 1fty h LYS 617 CO -0.35 0.29 -0.75 0.52 -0.57 0.00 0.00 179.45 178.59 1fty h MET 618 N 0.00 0.54 -0.46 3.15 2.86 0.24 -2.93 114.93 118.33 1fty h MET 618 Ca -0.00 -0.44 -0.11 0.00 -2.06 0.00 0.00 59.70 57.09 1fty h MET 618 Cb 0.83 0.09 -0.02 0.00 0.06 0.00 0.00 31.60 32.57 1fty h MET 618 CO 0.04 1.07 -0.14 0.82 1.06 0.00 0.00 176.91 179.76 1fty h ILE 619 N 0.37 1.26 -0.78 -1.22 2.04 -0.92 -1.54 117.51 116.72 1fty h ILE 619 Ca -0.04 -1.25 -0.03 0.00 1.00 0.00 0.00 64.86 64.54 1fty h ILE 619 Cb 1.35 1.06 -0.04 0.00 -0.74 0.00 0.00 36.82 38.45 1fty h ILE 619 CO 0.14 0.43 0.37 0.40 0.00 0.00 0.00 178.15 179.49 1fty h ILE 620 N 0.77 1.25 -0.18 -0.67 2.04 -1.47 -0.96 117.51 118.29 1fty h ILE 620 Ca 0.12 -0.71 -0.08 0.00 1.00 0.00 0.00 64.86 65.19 1fty h ILE 620 Cb 0.66 0.27 -0.01 0.00 -0.74 0.00 0.00 36.82 37.00 1fty h ILE 620 CO 0.05 0.30 -0.24 0.50 0.00 0.00 0.00 178.15 178.76 1fty h LYS 621 N 1.11 0.33 -0.05 2.37 1.63 -1.30 -2.52 116.57 118.14 1fty h LYS 621 Ca 0.27 -0.11 -0.01 0.00 -0.85 0.00 0.00 60.65 59.94 1fty h LYS 621 Cb 0.13 -0.03 -0.00 0.00 -0.60 0.00 0.00 32.23 31.73 1fty h LYS 621 CO -0.03 0.56 -0.01 1.25 -3.45 0.00 0.00 179.45 177.77 1fty h LEU 622 N 0.30 0.10 -0.59 5.20 6.46 -0.53 -1.30 115.31 124.95 1fty h LEU 622 Ca 0.05 -0.34 0.08 0.00 -0.12 0.00 0.00 57.88 57.55 1fty h LEU 622 Cb 0.59 -0.03 -0.06 0.00 -0.73 0.00 0.00 40.66 40.44 1fty h LEU 622 CO 0.04 0.41 0.25 0.40 -0.62 0.00 0.00 178.44 178.93 1fty h ILE 623 N -0.22 0.85 0.00 4.05 2.04 -1.00 0.57 117.51 123.80 1fty h ILE 623 Ca 0.01 -0.16 -0.10 0.00 1.00 0.00 0.00 64.86 65.61 1fty h ILE 623 Cb 0.37 0.34 -0.01 0.00 -0.74 0.00 0.00 36.82 36.77 1fty h ILE 623 CO 0.00 0.09 -0.50 0.71 0.00 0.00 0.00 178.15 178.45 1fty h THR 624 N 0.47 1.35 -0.38 -0.27 1.35 -1.42 -2.19 112.91 111.82 1fty h THR 624 Ca 0.28 -1.71 -0.10 0.00 -0.55 0.00 0.00 66.41 64.33 1fty h THR 624 Cb 0.29 1.92 -0.01 0.00 -1.73 0.00 0.00 68.15 68.62 1fty h THR 624 CO -0.25 0.49 -0.15 0.00 -0.25 0.00 0.00 175.52 175.36 1fty h ALA 625 N 1.50 0.53 -0.58 6.62 0.00 0.08 -1.18 119.26 126.23 1fty h ALA 625 Ca -0.00 -0.34 -0.03 0.00 0.00 0.00 0.00 54.91 54.54 1fty h ALA 625 Cb 0.89 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.52 1fty h ALA 625 CO 0.06 0.44 0.26 0.82 0.00 0.00 0.00 179.25 180.83 1fty h ILE 626 N 0.57 1.22 -0.53 0.00 2.04 -0.75 -2.54 117.51 117.51 1fty h ILE 626 Ca 0.09 -0.63 -0.03 0.00 1.00 0.00 0.00 64.86 65.29 1fty h ILE 626 Cb 0.69 0.56 -0.03 0.00 -0.74 0.00 0.00 36.82 37.30 1fty h ILE 626 CO 0.05 0.25 0.21 1.23 0.00 0.00 0.00 178.15 179.89 1fty h GLY 627 N 0.79 0.82 0.96 5.37 0.00 -1.18 0.73 103.07 110.55 1fty h GLY 627 Ca 0.20 -0.40 0.01 0.00 0.00 0.00 0.00 47.33 47.14 1fty h GLY 627 CO -0.02 0.38 0.40 -0.55 0.00 0.00 0.00 176.54 176.75 1fty h ASP 628 N 0.76 0.68 0.22 0.19 3.45 -0.81 0.57 116.42 121.48 1fty h ASP 628 Ca 0.18 -0.01 -0.01 0.00 0.43 0.00 0.00 57.03 57.62 1fty h ASP 628 Cb 0.15 -0.16 0.00 0.00 -0.56 0.00 0.00 39.33 38.76 1fty h ASP 628 CO -0.02 0.49 -0.11 0.58 -1.57 0.00 0.00 179.24 178.61 1fty h VAL 629 N 0.81 0.48 -0.32 -1.35 2.07 -1.17 -3.30 116.25 113.48 1fty h VAL 629 Ca 0.24 -0.98 0.02 0.00 0.82 0.00 0.00 66.70 66.80 1fty h VAL 629 Cb -0.06 0.82 -0.03 0.00 -1.52 0.00 0.00 31.29 30.51 1fty h VAL 629 CO -0.07 0.13 0.16 0.58 0.02 0.00 0.00 177.57 178.39 1fty h VAL 630 N -0.98 0.99 0.00 2.57 2.07 -0.87 -2.78 116.25 117.25 1fty h VAL 630 Ca -0.03 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.37 1fty h VAL 630 Cb 0.44 0.63 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 1fty h VAL 630 CO 0.05 0.06 0.00 0.59 0.02 0.00 0.00 177.57 178.29 1fty n ASN 631 N -4.95 0.00 -0.04 0.57 3.02 0.19 -2.90 115.26 111.15 1fty n ASN 631 Ca -0.00 0.30 0.03 0.00 -0.03 0.00 0.00 54.58 54.88 1fty n ASN 631 Cb 0.07 -0.40 0.04 0.00 -0.61 0.00 0.00 39.78 38.89 1fty n ASN 631 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1fty n HIS 632 N -1.40 0.00 -3.08 3.10 8.25 -1.06 -4.96 115.22 116.07 1fty n HIS 632 Ca 0.05 -0.62 -0.42 0.00 -0.26 0.00 0.00 57.72 56.48 1fty n HIS 632 Cb 0.14 -0.08 -0.06 0.00 1.12 0.00 0.00 29.99 31.11 1fty n HIS 632 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1fty s ASP 633 N -1.53 6.49 0.42 0.41 -1.08 -1.12 -4.94 116.67 115.31 1fty s ASP 633 Ca 0.10 0.34 0.09 0.00 -0.52 0.00 0.00 52.55 52.56 1fty s ASP 633 Cb 0.09 -2.34 0.88 0.00 -1.46 0.00 0.00 42.92 40.09 1fty s ASP 633 CO 0.01 -0.56 2.03 -0.65 0.52 0.00 0.00 175.17 176.51 1fty h PRO 634 N 8.31 0.39 -0.09 4.34 0.11 -1.93 -2.43 132.00 140.71 1fty h PRO 634 Ca -0.26 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 65.73 1fty h PRO 634 Cb 1.11 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.13 1fty h PRO 634 CO 0.83 0.32 -0.29 0.28 -0.21 0.00 0.00 178.00 178.93 1fty h VAL 635 N 0.40 1.25 -0.33 3.15 2.07 -1.97 -2.80 116.25 118.02 1fty h VAL 635 Ca 0.10 -1.17 -0.16 0.00 0.82 0.00 0.00 66.70 66.30 1fty h VAL 635 Cb 0.07 1.51 -0.00 0.00 -1.52 0.00 0.00 31.29 31.35 1fty h VAL 635 CO -0.01 0.35 -0.42 0.58 0.02 0.00 0.00 177.57 178.08 1fty h VAL 636 N 0.14 1.28 0.00 2.57 2.07 -1.78 -3.48 116.25 117.05 1fty h VAL 636 Ca 0.02 -1.60 0.00 0.00 0.82 0.00 0.00 66.70 65.94 1fty h VAL 636 Cb 0.60 1.53 0.00 0.00 -1.52 0.00 0.00 31.29 31.90 1fty h VAL 636 CO 0.04 0.53 0.00 0.61 0.02 0.00 0.00 177.57 178.77 1fty n GLY 637 N 0.24 2.20 1.57 2.17 0.00 -1.06 -2.59 105.19 107.72 1fty n GLY 637 Ca -0.03 -0.44 0.10 0.00 0.00 0.00 0.00 46.02 45.64 1fty n GLY 637 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1fty n ASP 638 N 4.09 4.74 0.19 1.61 5.75 -1.26 -4.40 116.55 127.28 1fty n ASP 638 Ca 0.00 -2.44 0.08 0.00 -0.01 0.00 0.00 54.79 52.43 1fty n ASP 638 Cb 0.00 -0.58 0.16 0.00 -1.03 0.00 0.00 41.12 39.67 1fty n ASP 638 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 1fty h ARG 639 N 4.07 0.00 -2.56 0.11 3.08 -1.84 -3.43 114.38 113.80 1fty h ARG 639 Ca 0.00 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.94 1fty h ARG 639 Cb 1.44 0.00 -0.28 0.00 0.08 0.00 0.00 29.97 31.21 1fty h ARG 639 CO 0.22 0.21 -0.39 -1.17 -1.07 0.00 0.00 179.97 177.77 1fty s LEU 640 N -6.34 -0.57 -0.02 3.04 2.96 -1.26 -1.65 118.68 114.84 1fty s LEU 640 Ca 0.05 0.94 0.05 0.00 -0.22 0.00 0.00 54.13 54.95 1fty s LEU 640 Cb 0.06 1.27 -0.01 0.00 0.50 0.00 0.00 46.19 48.01 1fty s LEU 640 CO 0.69 -0.23 -0.18 -0.13 -1.32 0.00 0.00 176.35 175.18 1fty s ARG 641 N 2.52 1.51 -0.26 1.98 1.81 -0.94 -4.61 118.95 120.95 1fty s ARG 641 Ca -0.02 -0.62 0.02 0.00 -1.72 0.00 0.00 55.73 53.38 1fty s ARG 641 Cb -0.12 -1.42 0.05 0.00 -0.45 0.00 0.00 34.95 33.01 1fty s ARG 641 CO -0.12 0.35 -0.09 0.08 -0.68 0.00 0.00 175.30 174.83 1fty s VAL 642 N -0.31 2.36 -0.07 3.52 1.01 -1.26 -1.33 120.40 124.32 1fty s VAL 642 Ca 0.04 -1.51 0.05 0.00 0.00 0.00 0.00 61.98 60.56 1fty s VAL 642 Cb -0.08 -2.35 -0.00 0.00 0.00 0.00 0.00 36.38 33.95 1fty s VAL 642 CO -0.00 0.00 -0.23 -0.63 0.00 0.00 0.00 175.10 174.24 1fty s ILE 643 N 1.15 1.94 -0.34 2.22 1.09 -0.68 -4.54 121.20 122.04 1fty s ILE 643 Ca -0.07 -0.98 -0.14 0.00 -1.10 0.00 0.00 60.65 58.36 1fty s ILE 643 Cb -0.19 -1.66 -0.02 0.00 -1.06 0.00 0.00 42.46 39.53 1fty s ILE 643 CO -0.05 0.54 0.31 0.12 -0.10 0.00 0.00 174.94 175.76 1fty s PHE 644 N 0.08 3.22 -0.39 3.97 2.19 -1.26 -1.27 117.98 124.52 1fty s PHE 644 Ca -0.10 -0.07 -0.29 0.00 0.33 0.00 0.00 56.93 56.81 1fty s PHE 644 Cb -0.15 -2.59 0.01 0.00 -1.31 0.00 0.00 43.02 38.98 1fty s PHE 644 CO 0.05 -0.39 1.34 -0.51 1.83 0.00 0.00 175.22 177.54 1fty s LEU 645 N 1.90 3.68 0.42 6.12 1.02 -0.14 -4.95 118.68 126.73 1fty s LEU 645 Ca 0.10 0.89 -0.24 0.00 0.02 0.00 0.00 54.13 54.90 1fty s LEU 645 Cb -0.17 -3.54 -0.08 0.00 0.02 0.00 0.00 46.19 42.42 1fty s LEU 645 CO 0.11 -1.30 1.11 -0.70 0.02 0.00 0.00 176.35 175.60 1fty s GLU 646 N 4.63 4.00 -1.35 1.70 2.12 -1.26 -4.04 118.70 124.50 1fty s GLU 646 Ca 0.58 1.67 -0.10 0.00 0.36 0.00 0.00 54.97 57.48 1fty s GLU 646 Cb -0.14 -2.52 0.01 0.00 0.26 0.00 0.00 34.13 31.74 1fty s GLU 646 CO 0.29 -0.32 0.45 -1.71 -0.54 0.00 0.00 175.26 173.43 1fty n ASN 647 N -0.18 -1.66 -4.72 -1.70 5.15 -1.25 -4.86 115.26 106.04 1fty n ASN 647 Ca 0.06 -1.12 -0.42 0.00 -0.60 0.00 0.00 54.58 52.50 1fty n ASN 647 Cb 0.48 -2.56 -0.03 0.00 -0.53 0.00 0.00 39.78 37.14 1fty n ASN 647 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 1fty s TYR 648 N -3.88 2.79 0.35 1.20 5.04 -1.26 -4.85 117.35 116.74 1fty s TYR 648 Ca 0.18 0.28 -0.13 0.00 -2.44 0.00 0.00 57.07 54.96 1fty s TYR 648 Cb -0.08 -4.15 0.03 0.00 0.35 0.00 0.00 41.96 38.11 1fty s TYR 648 CO 0.92 -4.42 0.68 -0.98 -1.34 0.00 0.00 175.55 170.41 1fty s ARG 649 N 1.41 2.04 0.13 4.97 1.70 -1.26 -4.78 118.95 123.14 1fty s ARG 649 Ca 0.76 -1.43 -0.32 0.00 -0.47 0.00 0.00 55.73 54.27 1fty s ARG 649 Cb -0.49 0.57 -0.09 0.00 -0.57 0.00 0.00 34.95 34.36 1fty s ARG 649 CO 0.33 -0.92 1.56 0.28 -1.08 0.00 0.00 175.30 175.47 1fty h VAL 650 N 2.05 0.06 -0.72 4.99 2.07 -1.96 0.20 116.25 122.93 1fty h VAL 650 Ca -0.29 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.37 1fty h VAL 650 Cb 1.25 0.06 -0.05 0.00 -1.52 0.00 0.00 31.29 31.03 1fty h VAL 650 CO 0.37 0.00 0.48 0.77 0.02 0.00 0.00 177.57 179.21 1fty h SER 651 N -0.53 0.38 0.28 0.57 4.64 -1.97 0.11 113.55 117.03 1fty h SER 651 Ca 0.06 0.02 -0.22 0.00 -0.47 0.00 0.00 61.79 61.18 1fty h SER 651 Cb 0.66 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 62.69 1fty h SER 651 CO -0.45 0.20 -0.90 0.25 -0.87 0.00 0.00 176.83 175.07 1fty h LEU 652 N 0.41 0.56 -0.91 5.97 5.85 -1.61 -3.19 115.31 122.39 1fty h LEU 652 Ca 0.35 -0.43 0.01 0.00 0.84 0.00 0.00 57.88 58.65 1fty h LEU 652 Cb 0.79 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 41.60 1fty h LEU 652 CO -0.11 1.22 0.60 0.00 -0.34 0.00 0.00 178.44 179.82 1fty h ALA 653 N 0.75 1.16 0.00 1.25 0.00 0.18 -0.78 119.26 121.81 1fty h ALA 653 Ca -0.07 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1fty h ALA 653 Cb 1.53 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1fty h ALA 653 CO 0.16 0.54 0.00 0.39 0.00 0.00 0.00 179.25 180.34 1fty n GLU 654 N -4.46 0.05 -0.13 0.00 1.02 -0.28 -2.23 120.64 114.61 1fty n GLU 654 Ca 0.10 0.46 -0.25 0.00 -0.02 0.00 0.00 57.16 57.46 1fty n GLU 654 Cb 0.02 -1.64 -0.11 0.00 -0.02 0.00 0.00 31.44 29.70 1fty n GLU 654 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1fty n LYS 655 N -1.74 0.62 -0.03 3.49 5.02 -0.36 -4.57 118.16 120.59 1fty n LYS 655 Ca 0.01 0.22 -0.15 0.00 -2.02 0.00 0.00 58.31 56.38 1fty n LYS 655 Cb 0.08 -1.52 -0.10 0.00 -0.02 0.00 0.00 35.03 33.47 1fty n LYS 655 CO 0.00 0.00 0.00 -0.39 -0.52 0.00 0.00 177.40 176.49 1fty h VAL 656 N -0.55 1.47 -0.55 -0.18 -1.51 -1.28 -3.33 116.25 110.33 1fty h VAL 656 Ca -0.64 -1.72 0.11 0.00 -1.23 0.00 0.00 66.70 63.23 1fty h VAL 656 Cb 1.74 2.47 -0.09 0.00 -2.13 0.00 0.00 31.29 33.28 1fty h VAL 656 CO -0.27 0.48 -0.01 0.40 -1.23 0.00 0.00 177.57 176.93 1fty h ILE 657 N -0.36 0.55 0.00 7.19 2.04 -1.72 0.13 117.51 125.34 1fty h ILE 657 Ca -0.02 -0.04 -0.00 0.00 1.00 0.00 0.00 64.86 65.81 1fty h ILE 657 Cb 0.89 0.44 -0.00 0.00 -0.74 0.00 0.00 36.82 37.41 1fty h ILE 657 CO 0.05 0.02 -0.00 -0.65 0.00 0.00 0.00 178.15 177.56 1fty h PRO 658 N 0.10 0.00 -0.43 2.37 0.11 -1.80 -2.16 132.00 130.19 1fty h PRO 658 Ca 0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.39 1fty h PRO 658 Cb 0.43 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.54 1fty h PRO 658 CO -0.47 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 177.32 1fty n ALA 659 N -2.09 2.42 -2.18 -0.75 0.00 0.37 -4.74 120.51 113.54 1fty n ALA 659 Ca -0.02 -1.02 -0.35 0.00 0.00 0.00 0.00 53.44 52.06 1fty n ALA 659 Cb 0.16 -0.90 -0.06 0.00 0.00 0.00 0.00 19.45 18.65 1fty n ALA 659 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1fty s ALA 660 N -1.44 3.43 -0.19 0.00 0.00 -0.74 -4.65 121.76 118.17 1fty s ALA 660 Ca 0.40 0.05 -0.03 0.00 0.00 0.00 0.00 51.96 52.38 1fty s ALA 660 Cb 0.23 -2.73 -0.10 0.00 0.00 0.00 0.00 23.12 20.52 1fty s ALA 660 CO 0.32 0.36 -0.20 -0.25 0.00 0.00 0.00 175.76 176.00 1fty n ASP 661 N 0.39 2.10 -4.22 0.00 8.00 -0.62 -4.17 116.55 118.03 1fty n ASP 661 Ca -0.01 0.04 -0.33 0.00 0.71 0.00 0.00 54.79 55.20 1fty n ASP 661 Cb 0.52 -0.40 -0.16 0.00 -0.02 0.00 0.00 41.12 41.06 1fty n ASP 661 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1fty s LEU 662 N -6.45 2.23 -0.21 0.64 0.20 -0.41 -0.08 118.68 114.61 1fty s LEU 662 Ca -0.25 -0.54 -0.08 0.00 0.69 0.00 0.00 54.13 53.95 1fty s LEU 662 Cb 0.08 -1.47 -0.04 0.00 -0.43 0.00 0.00 46.19 44.32 1fty s LEU 662 CO 0.39 0.11 0.09 -0.55 -0.29 0.00 0.00 176.35 176.09 1fty s SER 663 N 0.64 5.67 -0.42 3.68 0.15 0.34 -1.76 113.70 122.01 1fty s SER 663 Ca -0.10 0.05 -0.15 0.00 0.70 0.00 0.00 55.95 56.45 1fty s SER 663 Cb -0.16 -1.99 0.03 0.00 -1.71 0.00 0.00 66.02 62.18 1fty s SER 663 CO 0.02 0.12 0.31 -1.61 1.20 0.00 0.00 173.24 173.28 1fty s GLU 664 N 0.71 2.96 -0.55 5.44 0.41 -1.01 -1.67 118.70 124.99 1fty s GLU 664 Ca 0.04 -1.07 0.07 0.00 -0.41 0.00 0.00 54.97 53.60 1fty s GLU 664 Cb -0.13 -3.98 0.25 0.00 -1.78 0.00 0.00 34.13 28.49 1fty s GLU 664 CO 0.02 -0.79 0.67 1.04 -0.49 0.00 0.00 175.26 175.71 1fty n GLN 665 N 5.15 1.87 -1.60 1.61 1.13 -0.96 -4.78 117.38 119.80 1fty n GLN 665 Ca -0.11 -4.14 -0.33 0.00 -1.94 0.00 0.00 57.00 50.48 1fty n GLN 665 Cb 0.46 -1.87 0.06 0.00 0.11 0.00 0.00 30.24 29.00 1fty n GLN 665 CO 0.00 0.00 0.00 0.44 -1.44 0.00 0.00 177.06 176.06 1fty n ILE 666 N 1.03 3.32 -1.61 5.09 -5.35 -1.26 -2.56 119.36 118.02 1fty n ILE 666 Ca 0.27 -3.46 -0.31 0.00 -0.27 0.00 0.00 62.75 58.98 1fty n ILE 666 Cb 0.46 -1.17 0.05 0.00 -1.74 0.00 0.00 39.64 37.24 1fty n ILE 666 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1fty s SER 667 N -2.25 5.29 0.12 7.28 1.04 -1.26 -4.58 113.70 119.34 1fty s SER 667 Ca 0.60 1.70 -0.31 0.00 0.48 0.00 0.00 55.95 58.42 1fty s SER 667 Cb 0.47 -2.51 -0.08 0.00 0.10 0.00 0.00 66.02 64.00 1fty s SER 667 CO -0.05 -1.50 1.46 -0.89 0.98 0.00 0.00 173.24 173.24 1fty s THR 668 N -2.89 3.12 -0.17 2.02 2.01 -1.15 -4.69 115.64 113.88 1fty s THR 668 Ca 0.60 0.78 -0.40 0.00 0.31 0.00 0.00 61.69 62.97 1fty s THR 668 Cb -0.15 -3.50 -0.17 0.00 0.01 0.00 0.00 72.50 68.69 1fty s THR 668 CO 0.52 0.05 1.49 0.00 -0.69 0.00 0.00 174.62 175.99 1fty n ALA 669 N 4.15 -1.18 -0.13 7.40 0.00 -1.26 -1.60 120.51 127.90 1fty n ALA 669 Ca 0.13 0.48 0.00 0.00 0.00 0.00 0.00 53.44 54.04 1fty n ALA 669 Cb 0.41 -2.05 0.00 0.00 0.00 0.00 0.00 19.45 17.81 1fty n ALA 669 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fty n GLY 670 N 3.24 0.56 0.08 0.00 0.00 -1.26 -4.69 105.19 103.12 1fty n GLY 670 Ca 0.24 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.16 1fty n GLY 670 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1fty n THR 671 N -2.00 1.08 -2.94 2.61 -2.24 -0.62 -4.88 114.28 105.29 1fty n THR 671 Ca 0.00 -0.58 -0.43 0.00 -2.27 0.00 0.00 64.05 60.77 1fty n THR 671 Cb 0.00 -0.79 -0.05 0.00 -2.10 0.00 0.00 70.33 67.39 1fty n THR 671 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1fty s GLU 672 N -2.38 3.33 0.23 -0.78 2.56 -1.26 -4.71 118.70 115.69 1fty s GLU 672 Ca -0.14 -0.28 -0.10 0.00 0.00 0.00 0.00 54.97 54.45 1fty s GLU 672 Cb 0.05 -4.01 0.36 0.00 2.00 0.00 0.00 34.13 32.53 1fty s GLU 672 CO 0.57 -1.28 1.63 0.00 -0.56 0.00 0.00 175.26 175.62 1fty h ALA 673 N 9.12 0.63 0.00 6.30 0.00 -1.90 -2.95 119.26 130.47 1fty h ALA 673 Ca -0.26 0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1fty h ALA 673 Cb 1.08 0.46 0.00 0.00 0.00 0.00 0.00 17.79 19.33 1fty h ALA 673 CO 1.01 -0.42 0.00 0.45 0.00 0.00 0.00 179.25 180.29 1fty n SER 674 N -5.40 -1.89 0.00 0.00 2.88 -1.26 -4.12 113.62 103.84 1fty n SER 674 Ca 0.11 0.54 0.00 0.00 -1.33 0.00 0.00 58.87 58.20 1fty n SER 674 Cb 0.42 1.90 0.00 0.00 -0.75 0.00 0.00 64.21 65.78 1fty n SER 674 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1fty n GLY 675 N -0.24 -0.24 0.00 0.46 0.00 -1.26 -1.86 105.19 102.05 1fty n GLY 675 Ca 0.00 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.41 1fty n GLY 675 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1fty n THR 676 N 0.11 0.00 -0.24 2.61 -2.24 -1.26 -4.78 114.28 108.48 1fty n THR 676 Ca 0.00 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 61.72 1fty n THR 676 Cb 0.00 0.00 0.05 0.00 -2.10 0.00 0.00 70.33 68.28 1fty n THR 676 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1fty h GLY 677 N 0.00 0.99 0.11 3.38 0.00 -1.94 -1.57 103.07 104.04 1fty h GLY 677 Ca 0.00 -0.43 0.15 0.00 0.00 0.00 0.00 47.33 47.06 1fty h GLY 677 CO 0.00 0.41 0.34 3.45 0.00 0.00 0.00 176.54 180.74 1fty h ASN 678 N 0.92 0.33 -0.58 0.19 -0.00 -1.94 0.39 115.58 114.89 1fty h ASN 678 Ca 0.24 0.11 -0.09 0.00 -0.00 0.00 0.00 56.30 56.57 1fty h ASN 678 Cb -0.00 0.08 -0.02 0.00 -0.00 0.00 0.00 38.32 38.38 1fty h ASN 678 CO -0.04 0.11 0.02 0.24 -0.00 0.00 0.00 177.43 177.76 1fty h MET 679 N 0.47 1.01 -0.92 4.14 2.86 -1.64 -2.29 114.93 118.57 1fty h MET 679 Ca 0.44 -0.31 0.05 0.00 -2.06 0.00 0.00 59.70 57.82 1fty h MET 679 Cb 0.69 -0.10 -0.06 0.00 0.06 0.00 0.00 31.60 32.19 1fty h MET 679 CO -0.41 0.99 0.59 0.87 1.06 0.00 0.00 176.91 180.01 1fty h LYS 680 N 0.90 1.07 -0.41 1.72 1.57 -0.04 -2.53 116.57 118.86 1fty h LYS 680 Ca 0.17 -0.06 -0.15 0.00 -1.87 0.00 0.00 60.65 58.73 1fty h LYS 680 Cb 0.52 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 1fty h LYS 680 CO 0.03 0.71 -0.35 0.74 -0.57 0.00 0.00 179.45 180.01 1fty h PHE 681 N 1.11 1.13 -0.84 -1.35 0.04 -1.10 -3.09 116.94 112.83 1fty h PHE 681 Ca 0.38 -0.32 -0.02 0.00 2.80 0.00 0.00 57.97 60.81 1fty h PHE 681 Cb 0.09 -0.24 -0.04 0.00 2.20 0.00 0.00 35.95 37.96 1fty h PHE 681 CO -0.02 1.15 0.46 1.98 -0.60 0.00 0.00 178.31 181.29 1fty h MET 682 N 0.79 1.17 0.00 1.51 4.05 -1.02 -2.37 114.93 119.06 1fty h MET 682 Ca 0.07 -0.13 0.00 0.00 -0.28 0.00 0.00 59.70 59.36 1fty h MET 682 Cb 0.94 -0.23 0.00 0.00 -0.80 0.00 0.00 31.60 31.51 1fty h MET 682 CO 0.09 0.86 -0.06 -0.11 0.23 0.00 0.00 176.91 177.91 1fty n LEU 683 N -4.34 0.10 -1.02 3.39 7.94 -0.99 -3.67 117.00 118.40 1fty n LEU 683 Ca 0.09 0.44 0.06 0.00 -1.11 0.00 0.00 56.01 55.49 1fty n LEU 683 Cb 0.10 -0.46 0.26 0.00 0.53 0.00 0.00 43.42 43.85 1fty n LEU 683 CO 0.38 0.01 0.73 0.59 -1.11 0.00 0.00 177.39 177.99 1fty n ASN 684 N -1.54 3.83 -0.92 1.96 3.02 -0.99 -4.93 115.26 115.69 1fty n ASN 684 Ca 0.07 -3.12 -0.05 0.00 -0.03 0.00 0.00 54.58 51.45 1fty n ASN 684 Cb 0.34 -0.57 0.01 0.00 -0.61 0.00 0.00 39.78 38.95 1fty n ASN 684 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1fty n GLY 685 N -0.54 0.46 3.49 7.41 0.00 -1.18 -4.77 105.19 110.07 1fty n GLY 685 Ca 0.24 -0.56 -0.27 0.00 0.00 0.00 0.00 46.02 45.43 1fty n GLY 685 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fty s ALA 686 N -2.75 2.73 0.06 4.61 0.00 -0.93 -4.76 121.76 120.73 1fty s ALA 686 Ca 0.08 -1.55 -0.04 0.00 0.00 0.00 0.00 51.96 50.45 1fty s ALA 686 Cb -0.03 -0.53 -0.05 0.00 0.00 0.00 0.00 23.12 22.51 1fty s ALA 686 CO 0.10 0.45 0.27 -0.51 0.00 0.00 0.00 175.76 176.07 1fty s LEU 687 N -2.72 4.34 -0.21 0.00 1.02 0.89 -4.46 118.68 117.53 1fty s LEU 687 Ca 0.23 0.46 -0.07 0.00 0.02 0.00 0.00 54.13 54.76 1fty s LEU 687 Cb -0.08 -2.95 -0.03 0.00 0.02 0.00 0.00 46.19 43.14 1fty s LEU 687 CO 0.12 0.17 0.05 -0.89 0.02 0.00 0.00 176.35 175.82 1fty s THR 688 N -1.48 4.45 -0.23 5.49 2.01 -1.26 -0.50 115.64 124.12 1fty s THR 688 Ca 0.34 -0.14 -0.05 0.00 0.31 0.00 0.00 61.69 62.15 1fty s THR 688 Cb -0.13 -3.03 -0.02 0.00 0.01 0.00 0.00 72.50 69.33 1fty s THR 688 CO 0.23 0.40 -0.00 -0.51 -0.69 0.00 0.00 174.62 174.04 1fty s ILE 689 N 0.99 3.71 0.14 1.82 2.07 -0.67 -1.41 121.20 127.85 1fty s ILE 689 Ca 0.03 -0.38 -0.20 0.00 -1.41 0.00 0.00 60.65 58.70 1fty s ILE 689 Cb -0.14 -2.70 0.07 0.00 0.13 0.00 0.00 42.46 39.82 1fty s ILE 689 CO 0.03 0.40 0.93 0.61 -1.91 0.00 0.00 174.94 175.00 1fty n GLY 690 N 4.78 0.63 3.96 1.50 0.00 -0.29 -2.25 105.19 113.52 1fty n GLY 690 Ca -0.17 -1.11 -0.22 0.00 0.00 0.00 0.00 46.02 44.52 1fty n GLY 690 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1fty s THR 691 N -2.11 4.49 -1.33 2.61 -4.23 -1.06 -1.98 115.64 112.03 1fty s THR 691 Ca 0.21 -0.72 -0.15 0.00 -1.18 0.00 0.00 61.69 59.85 1fty s THR 691 Cb -0.02 -3.61 -0.02 0.00 1.34 0.00 0.00 72.50 70.19 1fty s THR 691 CO 0.04 -0.33 2.27 0.23 -0.54 0.00 0.00 174.62 176.29 1fty n MET 692 N -1.77 2.68 -4.26 3.99 2.81 -1.26 -4.68 117.12 114.62 1fty n MET 692 Ca -0.02 -2.36 -0.21 0.00 -1.81 0.00 0.00 57.70 53.30 1fty n MET 692 Cb 0.57 -3.12 -0.12 0.00 -0.71 0.00 0.00 33.22 29.84 1fty n MET 692 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1fty s ASP 693 N 3.40 2.06 0.62 7.83 3.68 -1.26 -4.64 116.67 128.36 1fty s ASP 693 Ca 0.52 -0.62 0.00 0.00 2.13 0.00 0.00 52.55 54.57 1fty s ASP 693 Cb 0.14 -0.10 0.00 0.00 -1.45 0.00 0.00 42.92 41.52 1fty s ASP 693 CO -0.05 0.00 0.00 0.61 0.13 0.00 0.00 175.17 175.87 1fty n GLY 694 N 1.30 2.33 0.00 2.66 0.00 -1.11 -1.41 105.19 108.96 1fty n GLY 694 Ca -0.20 -0.27 0.10 0.00 0.00 0.00 0.00 46.02 45.65 1fty n GLY 694 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1fty n ALA 695 N 7.56 1.96 -0.27 4.61 0.00 -0.78 -3.35 120.51 130.24 1fty n ALA 695 Ca 0.00 -0.08 0.12 0.00 0.00 0.00 0.00 53.44 53.48 1fty n ALA 695 Cb 0.00 -1.33 0.37 0.00 0.00 0.00 0.00 19.45 18.50 1fty n ALA 695 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1fty h ASN 696 N 0.00 0.66 -0.53 0.00 2.35 -1.46 -0.30 115.58 116.30 1fty h ASN 696 Ca 0.00 0.04 -0.00 0.00 -0.55 0.00 0.00 56.30 55.78 1fty h ASN 696 Cb 0.30 -0.09 -0.03 0.00 0.05 0.00 0.00 38.32 38.55 1fty h ASN 696 CO 0.00 0.34 0.32 0.58 -1.65 0.00 0.00 177.43 177.02 1fty h VAL 697 N 0.70 1.16 0.00 2.81 2.07 -1.68 -1.03 116.25 120.29 1fty h VAL 697 Ca 0.44 -0.37 -0.11 0.00 0.82 0.00 0.00 66.70 67.48 1fty h VAL 697 Cb 0.69 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 30.89 1fty h VAL 697 CO -0.20 0.17 -0.54 -0.33 0.02 0.00 0.00 177.57 176.69 1fty h GLU 698 N 0.71 0.00 -0.10 1.57 5.08 -1.34 -1.61 114.58 118.90 1fty h GLU 698 Ca 0.19 0.00 -0.09 0.00 -1.00 0.00 0.00 59.36 58.46 1fty h GLU 698 Cb -0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1fty h GLU 698 CO -0.04 0.54 -0.28 0.52 -1.00 0.00 0.00 179.01 178.75 1fty h MET 699 N 0.00 0.36 -0.26 2.33 2.86 -0.88 -0.66 114.93 118.68 1fty h MET 699 Ca -0.01 -0.26 -0.09 0.00 -2.06 0.00 0.00 59.70 57.29 1fty h MET 699 Cb 1.11 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.80 1fty h MET 699 CO 0.07 0.88 -0.21 0.00 1.06 0.00 0.00 176.91 178.70 1fty h ALA 700 N 0.48 1.16 -0.54 6.32 0.00 -1.19 -0.59 119.26 124.90 1fty h ALA 700 Ca -0.01 -0.32 -0.09 0.00 0.00 0.00 0.00 54.91 54.49 1fty h ALA 700 Cb 0.90 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.54 1fty h ALA 700 CO 0.06 0.53 -0.02 1.49 0.00 0.00 0.00 179.25 181.31 1fty h GLU 701 N 0.42 0.94 0.00 0.00 4.81 -1.23 0.53 114.58 120.05 1fty h GLU 701 Ca 0.07 -0.29 -0.24 0.00 -0.13 0.00 0.00 59.36 58.77 1fty h GLU 701 Cb 0.61 -0.09 0.01 0.00 0.63 0.00 0.00 28.75 29.91 1fty h GLU 701 CO 0.04 0.95 -0.96 0.93 -0.73 0.00 0.00 179.01 179.23 1fty h GLU 702 N 0.86 0.48 0.00 1.92 4.39 -0.56 -3.32 114.58 118.35 1fty h GLU 702 Ca 0.15 -0.51 0.00 0.00 0.34 0.00 0.00 59.36 59.34 1fty h GLU 702 Cb 0.54 0.15 0.00 0.00 -0.10 0.00 0.00 28.75 29.34 1fty h GLU 702 CO 0.03 1.16 -1.16 0.00 -1.16 0.00 0.00 179.01 177.87 1fty n ALA 703 N -2.56 3.14 0.00 3.43 0.00 -0.28 -4.91 120.51 119.33 1fty n ALA 703 Ca -0.08 -0.39 0.00 0.00 0.00 0.00 0.00 53.44 52.98 1fty n ALA 703 Cb 0.85 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 19.33 1fty n ALA 703 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1fty n GLY 704 N 1.32 1.56 0.33 0.00 0.00 0.18 -4.52 105.19 104.06 1fty n GLY 704 Ca 0.01 -1.39 0.20 0.00 0.00 0.00 0.00 46.02 44.83 1fty n GLY 704 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1fty h GLU 705 N 0.00 0.00 0.00 1.61 5.08 -1.84 -0.36 114.58 119.07 1fty h GLU 705 Ca 0.00 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 1fty h GLU 705 Cb 0.00 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1fty h GLU 705 CO 0.00 0.00 -0.21 0.93 -1.00 0.00 0.00 179.01 178.73 1fty h GLU 706 N 0.00 0.00 -0.56 2.33 3.07 -1.89 -2.60 114.58 114.93 1fty h GLU 706 Ca 0.01 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 1fty h GLU 706 Cb 0.09 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.00 1fty h GLU 706 CO -0.00 0.21 0.00 0.09 -1.40 0.00 0.00 179.01 177.91 1fty n ASN 707 N -3.45 5.43 -4.12 1.42 3.02 -0.15 -4.92 115.26 112.49 1fty n ASN 707 Ca -0.00 -2.86 -0.15 0.00 -0.03 0.00 0.00 54.58 51.54 1fty n ASN 707 Cb 0.39 -0.66 -0.11 0.00 -0.61 0.00 0.00 39.78 38.79 1fty n ASN 707 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1fty s PHE 708 N -2.61 0.93 -0.96 3.10 5.36 -0.98 -4.80 117.98 118.01 1fty s PHE 708 Ca 0.53 -0.54 -0.04 0.00 -0.96 0.00 0.00 56.93 55.92 1fty s PHE 708 Cb 0.40 -0.53 0.24 0.00 -0.34 0.00 0.00 43.02 42.78 1fty s PHE 708 CO 0.17 -0.03 0.88 -0.06 -1.46 0.00 0.00 175.22 174.72 1fty s PHE 709 N -1.67 4.01 0.03 10.12 0.08 -0.50 -4.94 117.98 125.10 1fty s PHE 709 Ca -0.03 -2.89 -0.17 0.00 0.12 0.00 0.00 56.93 53.96 1fty s PHE 709 Cb -0.08 -3.45 -0.06 0.00 -0.57 0.00 0.00 43.02 38.86 1fty s PHE 709 CO 0.01 -0.82 0.49 0.42 -0.10 0.00 0.00 175.22 175.22 1fty s ILE 710 N -1.25 4.90 0.33 0.64 1.09 -1.26 -1.13 121.20 124.51 1fty s ILE 710 Ca 0.28 1.02 -0.05 0.00 -1.10 0.00 0.00 60.65 60.80 1fty s ILE 710 Cb -0.09 -3.80 0.01 0.00 -1.06 0.00 0.00 42.46 37.52 1fty s ILE 710 CO -0.11 0.56 0.50 0.72 -0.10 0.00 0.00 174.94 176.51 1fty s PHE 711 N -1.05 0.86 0.14 3.97 -0.71 -0.84 -4.96 117.98 115.40 1fty s PHE 711 Ca 0.26 -1.16 0.00 0.00 -1.04 0.00 0.00 56.93 54.99 1fty s PHE 711 Cb -0.18 0.04 0.00 0.00 -1.21 0.00 0.00 43.02 41.67 1fty s PHE 711 CO 0.16 -1.15 0.00 0.41 -1.34 0.00 0.00 175.22 173.30 1fty n GLY 712 N -0.53 -2.07 3.74 1.99 0.00 -1.26 -4.35 105.19 102.72 1fty n GLY 712 Ca -0.00 -1.35 -0.37 0.00 0.00 0.00 0.00 46.02 44.29 1fty n GLY 712 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1fty s MET 713 N -1.46 2.65 0.61 1.61 -1.94 -1.26 -4.89 119.30 114.62 1fty s MET 713 Ca 0.00 2.05 0.09 0.00 -1.71 0.00 0.00 55.69 56.12 1fty s MET 713 Cb 0.00 -1.89 0.10 0.00 2.01 0.00 0.00 34.83 35.06 1fty s MET 713 CO 0.00 -1.51 0.85 1.03 -0.01 0.00 0.00 175.02 175.37 1fty s ARG 714 N -3.34 2.15 0.20 2.03 1.81 -1.26 -4.55 118.95 115.99 1fty s ARG 714 Ca 0.81 -1.66 -0.11 0.00 -1.72 0.00 0.00 55.73 53.05 1fty s ARG 714 Cb -0.37 -2.60 0.15 0.00 -0.45 0.00 0.00 34.95 31.68 1fty s ARG 714 CO 0.39 -1.02 1.84 0.28 -0.68 0.00 0.00 175.30 176.12 1fty h VAL 715 N 0.03 1.10 -0.46 3.52 2.07 -1.84 -2.63 116.25 118.04 1fty h VAL 715 Ca -0.29 -0.28 0.07 0.00 0.82 0.00 0.00 66.70 67.02 1fty h VAL 715 Cb 1.29 0.22 -0.06 0.00 -1.52 0.00 0.00 31.29 31.22 1fty h VAL 715 CO 0.40 0.15 0.14 -0.33 0.02 0.00 0.00 177.57 177.95 1fty h GLU 716 N 0.81 0.29 -0.84 1.57 4.39 -1.95 -1.79 114.58 117.06 1fty h GLU 716 Ca 0.25 -0.02 0.01 0.00 0.34 0.00 0.00 59.36 59.95 1fty h GLU 716 Cb -0.01 -0.07 -0.04 0.00 -0.10 0.00 0.00 28.75 28.53 1fty h GLU 716 CO -0.09 0.19 0.55 -0.44 -1.16 0.00 0.00 179.01 178.07 1fty h ASP 717 N 0.30 0.96 -0.18 1.42 5.19 -1.87 -0.51 116.42 121.72 1fty h ASP 717 Ca 0.22 -0.02 -0.00 0.00 -0.62 0.00 0.00 57.03 56.61 1fty h ASP 717 Cb 0.25 -0.24 -0.01 0.00 0.18 0.00 0.00 39.33 39.51 1fty h ASP 717 CO -0.25 0.69 0.10 0.58 -3.12 0.00 0.00 179.24 177.25 1fty h VAL 718 N 1.13 1.09 -0.74 -1.35 2.07 -0.99 -1.47 116.25 115.99 1fty h VAL 718 Ca 0.31 -0.22 -0.06 0.00 0.82 0.00 0.00 66.70 67.54 1fty h VAL 718 Cb -0.13 0.91 -0.03 0.00 -1.52 0.00 0.00 31.29 30.53 1fty h VAL 718 CO -0.07 0.08 0.23 0.44 0.02 0.00 0.00 177.57 178.28 1fty h ASP 719 N 0.20 1.08 -0.29 0.57 3.32 -0.96 -1.42 116.42 118.92 1fty h ASP 719 Ca 0.06 -0.20 0.03 0.00 0.02 0.00 0.00 57.03 56.94 1fty h ASP 719 Cb 0.04 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.28 1fty h ASP 719 CO -0.01 1.00 0.11 -0.09 -1.72 0.00 0.00 179.24 178.53 1fty h ARG 720 N 1.10 0.24 -0.65 3.56 2.43 -0.84 -0.80 114.38 119.42 1fty h ARG 720 Ca 0.24 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.40 1fty h ARG 720 Cb 0.31 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.77 1fty h ARG 720 CO -0.01 0.16 0.41 1.25 -1.51 0.00 0.00 179.97 180.28 1fty h LEU 721 N 0.25 0.76 -0.57 3.80 6.46 -0.89 -1.53 115.31 123.59 1fty h LEU 721 Ca 0.13 -0.03 -0.16 0.00 -0.12 0.00 0.00 57.88 57.70 1fty h LEU 721 Cb 0.09 -0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 39.82 1fty h LEU 721 CO -0.12 0.56 -0.59 0.44 -0.62 0.00 0.00 178.44 178.11 1fty h ASP 722 N 0.89 0.46 0.48 1.25 3.32 -0.48 0.78 116.42 123.11 1fty h ASP 722 Ca 0.24 -0.26 -0.02 0.00 0.02 0.00 0.00 57.03 57.00 1fty h ASP 722 Cb -0.07 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.35 1fty h ASP 722 CO -0.05 0.95 -0.23 1.56 -1.72 0.00 0.00 179.24 179.75 1fty h GLN 723 N 0.31 -0.61 -0.20 3.56 1.08 -0.56 -3.05 115.11 115.64 1fty h GLN 723 Ca -0.00 0.04 0.05 0.00 -1.45 0.00 0.00 58.65 57.29 1fty h GLN 723 Cb 1.12 0.14 -0.05 0.00 -0.05 0.00 0.00 27.48 28.64 1fty h GLN 723 CO 0.10 -0.38 -0.10 -0.09 -0.95 0.00 0.00 178.83 177.41 1fty h ARG 724 N -0.70 -0.08 0.00 1.46 2.43 -1.17 -3.49 114.38 112.84 1fty h ARG 724 Ca -0.07 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 1fty h ARG 724 Cb 0.52 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.09 1fty h ARG 724 CO 0.11 -0.05 0.00 0.41 -1.51 0.00 0.00 179.97 178.93 1fty n GLY 725 N -1.25 3.15 3.63 2.80 0.00 0.27 -5.04 105.19 108.74 1fty n GLY 725 Ca -0.02 -1.20 -0.42 0.00 0.00 0.00 0.00 46.02 44.38 1fty n GLY 725 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1fty s TYR 726 N 0.00 3.25 -0.27 1.61 5.04 -1.22 -4.86 117.35 120.89 1fty s TYR 726 Ca 0.00 1.03 0.03 0.00 -2.44 0.00 0.00 57.07 55.69 1fty s TYR 726 Cb 0.00 -3.21 0.07 0.00 0.35 0.00 0.00 41.96 39.16 1fty s TYR 726 CO 0.00 -0.52 -0.08 1.21 -1.34 0.00 0.00 175.55 174.82 1fty s ASN 727 N 1.48 4.43 0.38 4.32 3.84 -1.26 -4.99 114.94 123.15 1fty s ASN 727 Ca 0.36 -1.50 0.14 0.00 0.21 0.00 0.00 52.86 52.07 1fty s ASN 727 Cb -0.14 -1.52 0.75 0.00 -0.55 0.00 0.00 41.25 39.79 1fty s ASN 727 CO 0.10 -0.23 1.82 0.00 -2.79 0.00 0.00 177.10 176.01 1fty h ALA 728 N 7.77 1.30 -0.74 1.71 0.00 -1.88 -3.16 119.26 124.26 1fty h ALA 728 Ca -0.16 -0.34 0.14 0.00 0.00 0.00 0.00 54.91 54.55 1fty h ALA 728 Cb 1.04 -0.06 -0.09 0.00 0.00 0.00 0.00 17.79 18.68 1fty h ALA 728 CO 0.46 0.46 0.28 0.37 0.00 0.00 0.00 179.25 180.83 1fty h GLN 729 N 0.00 0.41 -0.52 0.00 5.75 -1.93 -1.56 115.11 117.27 1fty h GLN 729 Ca -0.00 -0.02 0.10 0.00 -0.15 0.00 0.00 58.65 58.57 1fty h GLN 729 Cb 0.69 -0.09 -0.11 0.00 1.07 0.00 0.00 27.48 29.04 1fty h GLN 729 CO 0.05 0.27 -0.25 1.49 -2.65 0.00 0.00 178.83 177.74 1fty h GLU 730 N 0.43 -0.12 -0.67 1.69 4.81 -1.98 0.46 114.58 119.20 1fty h GLU 730 Ca 0.41 0.01 -0.07 0.00 -0.13 0.00 0.00 59.36 59.58 1fty h GLU 730 Cb 0.62 0.03 -0.03 0.00 0.63 0.00 0.00 28.75 30.00 1fty h GLU 730 CO -0.41 -0.08 0.15 1.88 -0.73 0.00 0.00 179.01 179.82 1fty h TYR 731 N -0.13 1.11 -0.55 0.92 -1.99 -1.49 -1.18 116.97 113.67 1fty h TYR 731 Ca 0.24 -0.13 -0.04 0.00 2.00 0.00 0.00 58.73 60.79 1fty h TYR 731 Cb 0.50 -0.31 -0.03 0.00 2.00 0.00 0.00 36.73 38.89 1fty h TYR 731 CO -0.54 0.91 0.17 -0.92 -0.00 0.00 0.00 178.16 177.79 1fty h TYR 732 N 1.01 0.83 -0.24 4.88 5.03 -0.29 -1.87 116.97 126.32 1fty h TYR 732 Ca 0.21 -0.06 -0.19 0.00 2.58 0.00 0.00 58.73 61.27 1fty h TYR 732 Cb 0.37 -0.25 0.00 0.00 1.55 0.00 0.00 36.73 38.40 1fty h TYR 732 CO 0.03 0.68 -0.59 -0.44 -1.32 0.00 0.00 178.16 176.51 1fty h ASP 733 N 0.80 0.90 0.32 -2.11 3.32 0.48 -3.34 116.42 116.79 1fty h ASP 733 Ca 0.18 -0.50 0.00 0.00 0.02 0.00 0.00 57.03 56.73 1fty h ASP 733 Cb 0.23 -0.26 0.00 0.00 0.22 0.00 0.00 39.33 39.52 1fty h ASP 733 CO -0.01 1.29 -0.57 0.54 -1.72 0.00 0.00 179.24 178.77 1fty n ARG 734 N -3.98 0.20 -4.02 3.56 5.12 -0.50 -4.77 116.66 112.26 1fty n ARG 734 Ca -0.05 -0.13 -0.31 0.00 -1.93 0.00 0.00 57.85 55.43 1fty n ARG 734 Cb 0.65 -1.50 -0.15 0.00 -1.16 0.00 0.00 32.46 30.30 1fty n ARG 734 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1fty s ILE 735 N -2.89 2.17 0.23 0.55 1.01 -0.72 -4.99 121.20 116.55 1fty s ILE 735 Ca 0.13 -2.07 -0.08 0.00 0.00 0.00 0.00 60.65 58.63 1fty s ILE 735 Cb 0.17 -2.50 0.19 0.00 0.01 0.00 0.00 42.46 40.34 1fty s ILE 735 CO 0.70 -0.42 1.88 -0.65 0.00 0.00 0.00 174.94 176.45 1fty h PRO 736 N 7.69 1.03 -0.92 2.79 0.11 -1.86 -0.81 132.00 140.02 1fty h PRO 736 Ca -0.09 -0.06 0.01 0.00 0.11 0.00 0.00 66.00 65.96 1fty h PRO 736 Cb 1.03 -0.23 -0.05 0.00 0.11 0.00 0.00 31.00 31.86 1fty h PRO 736 CO 0.50 0.68 0.61 0.93 -0.21 0.00 0.00 178.00 180.51 1fty h GLU 737 N 1.06 1.21 -0.29 1.05 5.08 -1.96 0.15 114.58 120.89 1fty h GLU 737 Ca 0.33 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.56 1fty h GLU 737 Cb -0.02 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 28.95 1fty h GLU 737 CO -0.10 0.80 -0.03 1.25 -1.00 0.00 0.00 179.01 179.93 1fty h LEU 738 N 1.25 0.52 -0.16 1.33 5.85 -1.82 -2.76 115.31 119.51 1fty h LEU 738 Ca 0.34 -0.33 0.03 0.00 0.84 0.00 0.00 57.88 58.76 1fty h LEU 738 Cb -0.14 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 40.71 1fty h LEU 738 CO -0.07 0.73 -0.03 -0.09 -0.34 0.00 0.00 178.44 178.63 1fty h ARG 739 N 0.30 0.01 -0.95 1.25 2.43 -0.62 -2.11 114.38 114.69 1fty h ARG 739 Ca 0.08 -0.00 0.14 0.00 -0.81 0.00 0.00 59.98 59.39 1fty h ARG 739 Cb 0.48 -0.00 -0.08 0.00 -0.42 0.00 0.00 29.97 29.95 1fty h ARG 739 CO 0.02 0.01 0.60 0.37 -1.51 0.00 0.00 179.97 179.46 1fty h GLN 740 N 0.01 0.79 -0.16 0.20 4.15 -0.64 -1.21 115.11 118.25 1fty h GLN 740 Ca 0.08 -0.05 -0.06 0.00 0.77 0.00 0.00 58.65 59.39 1fty h GLN 740 Cb 0.11 -0.18 -0.00 0.00 0.21 0.00 0.00 27.48 27.62 1fty h GLN 740 CO -0.16 0.52 -0.13 0.82 -1.93 0.00 0.00 178.83 177.95 1fty h ILE 741 N 0.81 1.34 -0.56 2.39 2.04 -1.14 -2.25 117.51 120.14 1fty h ILE 741 Ca 0.48 -1.26 -0.02 0.00 1.00 0.00 0.00 64.86 65.06 1fty h ILE 741 Cb 0.65 1.82 -0.03 0.00 -0.74 0.00 0.00 36.82 38.53 1fty h ILE 741 CO -0.25 0.37 0.27 0.40 0.00 0.00 0.00 178.15 178.95 1fty h ILE 742 N 0.01 1.19 0.00 -0.67 5.03 -0.76 -1.03 117.51 121.27 1fty h ILE 742 Ca 0.03 -0.53 0.00 0.00 -0.12 0.00 0.00 64.86 64.24 1fty h ILE 742 Cb 0.65 0.47 0.00 0.00 -3.03 0.00 0.00 36.82 34.91 1fty h ILE 742 CO 0.03 0.22 0.00 -0.33 -0.68 0.00 0.00 178.15 177.39 1fty h GLU 743 N 0.79 0.00 -0.06 2.37 5.08 -1.21 -1.23 114.58 120.32 1fty h GLU 743 Ca 0.20 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.31 1fty h GLU 743 Cb 0.09 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.35 1fty h GLU 743 CO -0.03 0.00 -0.94 1.96 -1.00 0.00 0.00 179.01 179.00 1fty h GLN 744 N 0.00 0.74 -0.36 2.33 4.20 -0.60 -2.24 115.11 119.19 1fty h GLN 744 Ca 0.00 -0.72 -0.16 0.00 0.06 0.00 0.00 58.65 57.83 1fty h GLN 744 Cb 0.83 0.19 -0.01 0.00 0.30 0.00 0.00 27.48 28.79 1fty h GLN 744 CO 0.00 1.30 -0.42 -0.07 -0.67 0.00 0.00 178.83 178.97 1fty h LEU 745 N 0.45 0.97 -1.07 1.46 3.38 -1.16 -1.11 115.31 118.25 1fty h LEU 745 Ca -0.10 -0.46 -0.09 0.00 0.09 0.00 0.00 57.88 57.31 1fty h LEU 745 Cb 1.59 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 42.05 1fty h LEU 745 CO 0.19 1.26 -0.37 0.28 0.09 0.00 0.00 178.44 179.89 1fty h SER 746 N 0.73 0.18 0.06 -0.43 0.02 -1.24 -3.22 113.55 109.65 1fty h SER 746 Ca 0.05 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1fty h SER 746 Cb 1.01 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.50 1fty h SER 746 CO 0.10 0.54 -0.21 -1.54 -1.14 0.00 0.00 176.83 174.58 1fty n SER 747 N -4.07 1.81 0.00 3.07 3.41 -0.84 -4.78 113.62 112.22 1fty n SER 747 Ca -0.01 -1.42 0.00 0.00 -0.26 0.00 0.00 58.87 57.17 1fty n SER 747 Cb 0.44 0.17 0.00 0.00 -0.26 0.00 0.00 64.21 64.56 1fty n SER 747 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1fty n GLY 748 N 1.33 0.73 0.35 5.00 0.00 -1.16 -4.87 105.19 106.57 1fty n GLY 748 Ca 0.13 -0.36 0.05 0.00 0.00 0.00 0.00 46.02 45.84 1fty n GLY 748 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1fty h PHE 749 N 0.00 0.78 -0.03 1.61 3.04 -1.47 -1.79 116.94 119.08 1fty h PHE 749 Ca 0.00 0.02 0.00 0.00 3.98 0.00 0.00 57.97 61.97 1fty h PHE 749 Cb 0.00 -0.26 0.00 0.00 2.56 0.00 0.00 35.95 38.25 1fty h PHE 749 CO 0.00 0.44 -0.03 1.19 -2.02 0.00 0.00 178.31 177.89 1fty n PHE 750 N -4.46 0.00 -3.00 0.41 3.72 -1.26 -4.60 117.46 108.27 1fty n PHE 750 Ca 0.09 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.34 1fty n PHE 750 Cb 0.16 -0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.68 1fty n PHE 750 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1fty n SER 751 N 1.08 -1.64 0.20 4.37 3.41 -0.71 -4.80 113.62 115.53 1fty n SER 751 Ca 0.14 -2.87 -0.16 0.00 -0.26 0.00 0.00 58.87 55.72 1fty n SER 751 Cb 0.55 0.64 -0.08 0.00 -0.26 0.00 0.00 64.21 65.06 1fty n SER 751 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1fty h PRO 752 N 4.49 -0.72 -0.50 4.33 0.11 -1.71 -2.26 132.00 135.74 1fty h PRO 752 Ca 0.03 0.05 0.01 0.00 0.11 0.00 0.00 66.00 66.20 1fty h PRO 752 Cb 0.98 0.16 -0.02 0.00 0.11 0.00 0.00 31.00 32.23 1fty h PRO 752 CO 0.32 -0.48 0.33 0.87 -0.21 0.00 0.00 178.00 178.82 1fty h LYS 753 N -0.75 0.65 -2.89 1.05 1.57 -1.96 -3.29 116.57 110.94 1fty h LYS 753 Ca -0.01 -0.04 -0.61 0.00 -1.87 0.00 0.00 60.65 58.11 1fty h LYS 753 Cb 0.70 -0.15 -0.41 0.00 0.08 0.00 0.00 32.23 32.46 1fty h LYS 753 CO -0.12 0.43 -0.69 -0.65 -0.57 0.00 0.00 179.45 177.85 1fty s GLN 754 N -5.58 1.96 0.55 3.15 -0.21 -1.12 -4.99 119.66 113.42 1fty s GLN 754 Ca -0.09 -2.91 0.27 0.00 0.02 0.00 0.00 55.36 52.65 1fty s GLN 754 Cb 0.18 -2.82 1.47 0.00 1.00 0.00 0.00 33.01 32.84 1fty s GLN 754 CO 0.74 -1.30 1.99 -1.35 -2.12 0.00 0.00 175.29 173.25 1fty h PRO 755 N 5.58 0.00 -0.73 2.91 0.11 -1.49 -1.57 132.00 136.81 1fty h PRO 755 Ca 0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.27 1fty h PRO 755 Cb 0.81 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.92 1fty h PRO 755 CO 0.61 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.00 1fty n ASP 756 N -4.12 4.12 -0.33 -2.05 5.68 -1.26 -3.50 116.55 115.10 1fty n ASP 756 Ca 0.08 -2.08 0.15 0.00 -0.50 0.00 0.00 54.79 52.45 1fty n ASP 756 Cb 0.58 -0.51 0.34 0.00 -1.14 0.00 0.00 41.12 40.39 1fty n ASP 756 CO 0.00 0.00 0.00 0.25 -1.33 0.00 0.00 177.20 176.12 1fty h LEU 757 N 4.32 0.61 -3.87 -2.12 5.85 -1.61 -2.09 115.31 116.41 1fty h LEU 757 Ca 0.00 0.13 -0.46 0.00 0.84 0.00 0.00 57.88 58.39 1fty h LEU 757 Cb 1.07 0.04 -0.27 0.00 0.37 0.00 0.00 40.66 41.87 1fty h LEU 757 CO 0.04 0.12 0.51 0.49 -0.34 0.00 0.00 178.44 179.26 1fty n PHE 758 N -4.90 2.68 0.08 1.25 3.01 -1.26 -4.57 117.46 113.76 1fty n PHE 758 Ca 0.24 -1.89 -0.01 0.00 1.01 0.00 0.00 57.45 56.81 1fty n PHE 758 Cb 0.67 -0.89 0.28 0.00 -0.01 0.00 0.00 39.48 39.53 1fty n PHE 758 CO 0.00 0.00 0.00 1.57 1.01 0.00 0.00 176.76 179.34 1fty h LYS 759 N 1.08 0.30 -0.49 -1.08 2.10 -1.70 -2.54 116.57 114.23 1fty h LYS 759 Ca 0.55 -0.10 -0.07 0.00 -2.00 0.00 0.00 60.65 59.03 1fty h LYS 759 Cb 2.47 -0.02 -0.02 0.00 -0.90 0.00 0.00 32.23 33.76 1fty h LYS 759 CO 0.99 0.54 0.03 -0.44 -2.00 0.00 0.00 179.45 178.58 1fty h ASP 760 N 0.26 0.82 -0.17 7.07 3.32 -1.83 0.33 116.42 126.23 1fty h ASP 760 Ca 0.04 -0.29 -0.02 0.00 0.02 0.00 0.00 57.03 56.78 1fty h ASP 760 Cb 0.61 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.93 1fty h ASP 760 CO 0.04 0.91 0.03 0.40 -1.72 0.00 0.00 179.24 178.90 1fty h ILE 761 N 0.71 1.21 -0.09 0.35 2.04 -1.87 -0.42 117.51 119.45 1fty h ILE 761 Ca 0.14 -0.69 -0.00 0.00 1.00 0.00 0.00 64.86 65.31 1fty h ILE 761 Cb 0.46 1.36 -0.00 0.00 -0.74 0.00 0.00 36.82 37.90 1fty h ILE 761 CO 0.02 0.21 0.04 0.58 0.00 0.00 0.00 178.15 179.00 1fty h VAL 762 N 0.06 1.12 -0.26 1.67 2.07 -1.42 0.40 116.25 119.90 1fty h VAL 762 Ca 0.05 -0.36 0.06 0.00 0.82 0.00 0.00 66.70 67.27 1fty h VAL 762 Cb 0.29 1.20 -0.06 0.00 -1.52 0.00 0.00 31.29 31.20 1fty h VAL 762 CO 0.00 0.11 -0.12 -1.13 0.02 0.00 0.00 177.57 176.45 1fty h ASN 763 N 0.01 -0.41 -0.07 0.57 -0.00 -0.87 -0.57 115.58 114.24 1fty h ASN 763 Ca 0.03 0.10 0.00 0.00 -0.00 0.00 0.00 56.30 56.43 1fty h ASN 763 Cb 0.13 0.23 -0.00 0.00 -0.00 0.00 0.00 38.32 38.68 1fty h ASN 763 CO -0.00 -0.15 0.05 -0.03 -0.00 0.00 0.00 177.43 177.29 1fty h MET 764 N -0.08 0.10 -0.91 6.67 4.05 -0.91 0.93 114.93 124.77 1fty h MET 764 Ca 0.14 -0.01 0.09 0.00 -0.28 0.00 0.00 59.70 59.64 1fty h MET 764 Cb 0.29 -0.02 -0.07 0.00 -0.80 0.00 0.00 31.60 31.00 1fty h MET 764 CO -0.32 0.07 0.59 -0.07 0.23 0.00 0.00 176.91 177.40 1fty h LEU 765 N 0.10 0.84 0.05 3.39 4.07 -0.39 0.16 115.31 123.52 1fty h LEU 765 Ca 0.03 0.02 -0.28 0.00 0.08 0.00 0.00 57.88 57.73 1fty h LEU 765 Cb -0.01 -0.15 -0.03 0.00 1.08 0.00 0.00 40.66 41.55 1fty h LEU 765 CO -0.01 0.50 -1.45 0.24 -1.08 0.00 0.00 178.44 176.65 1fty h MET 766 N 0.93 0.11 0.00 1.13 2.86 -0.85 -3.41 114.93 115.70 1fty h MET 766 Ca 0.42 -0.19 -0.04 0.00 -2.06 0.00 0.00 59.70 57.83 1fty h MET 766 Cb 0.38 0.07 -0.01 0.00 0.06 0.00 0.00 31.60 32.10 1fty h MET 766 CO -0.18 0.91 -1.18 0.72 1.06 0.00 0.00 176.91 178.24 1fty n HIS 767 N -3.31 0.00 -2.68 -0.22 8.25 0.30 -4.38 115.22 113.18 1fty n HIS 767 Ca -0.12 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.21 1fty n HIS 767 Cb 1.02 -0.12 0.02 0.00 1.12 0.00 0.00 29.99 32.03 1fty n HIS 767 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1fty n HIS 768 N -1.96 1.44 -2.79 4.41 8.25 0.50 -5.03 115.22 120.03 1fty n HIS 768 Ca -0.03 -2.94 -0.43 0.00 -0.26 0.00 0.00 57.72 54.06 1fty n HIS 768 Cb 0.45 -0.34 -0.04 0.00 1.12 0.00 0.00 29.99 31.18 1fty n HIS 768 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1fty s ASP 769 N -3.13 6.21 0.42 0.41 3.68 -0.81 -4.83 116.67 118.63 1fty s ASP 769 Ca 0.31 -0.73 0.29 0.00 2.13 0.00 0.00 52.55 54.55 1fty s ASP 769 Cb 0.44 -2.45 1.11 0.00 -1.45 0.00 0.00 42.92 40.57 1fty s ASP 769 CO -0.01 -1.47 1.85 0.03 0.13 0.00 0.00 175.17 175.70 1fty h ARG 770 N 9.59 0.00 -0.23 4.34 3.08 -1.96 -3.16 114.38 126.04 1fty h ARG 770 Ca -0.28 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.69 1fty h ARG 770 Cb 1.07 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 31.07 1fty h ARG 770 CO 1.18 0.00 -0.10 1.19 -1.07 0.00 0.00 179.97 181.17 1fty n PHE 771 N -2.75 0.75 -2.81 3.04 3.72 -1.26 -5.02 117.46 113.13 1fty n PHE 771 Ca 0.02 -1.30 -0.06 0.00 -0.05 0.00 0.00 57.45 56.06 1fty n PHE 771 Cb 0.31 -0.36 0.00 0.00 -0.94 0.00 0.00 39.48 38.49 1fty n PHE 771 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 176.76 177.07 1fty n LYS 772 N -1.01 -0.37 0.06 -1.08 2.85 -1.20 -4.81 118.16 112.61 1fty n LYS 772 Ca 0.26 0.18 -0.13 0.00 -1.05 0.00 0.00 58.31 57.57 1fty n LYS 772 Cb 0.90 -0.53 -0.08 0.00 -0.65 0.00 0.00 35.03 34.67 1fty n LYS 772 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63 1fty h VAL 773 N 0.69 1.03 -0.94 0.58 2.07 -1.93 -3.07 116.25 114.68 1fty h VAL 773 Ca -0.15 -0.35 0.12 0.00 0.82 0.00 0.00 66.70 67.13 1fty h VAL 773 Cb 0.34 1.26 -0.08 0.00 -1.52 0.00 0.00 31.29 31.29 1fty h VAL 773 CO 0.09 0.09 0.60 -0.26 0.02 0.00 0.00 177.57 178.11 1fty h PHE 774 N -0.26 1.01 -0.22 1.57 0.05 -1.91 -2.54 116.94 114.64 1fty h PHE 774 Ca -0.01 0.03 0.07 0.00 3.82 0.00 0.00 57.97 61.87 1fty h PHE 774 Cb 0.22 -0.32 -0.01 0.00 2.00 0.00 0.00 35.95 37.84 1fty h PHE 774 CO -0.02 0.41 0.20 0.00 -0.18 0.00 0.00 178.31 178.72 1fty h ALA 775 N 1.56 2.00 -0.02 2.45 0.00 -1.91 -2.25 119.26 121.09 1fty h ALA 775 Ca 0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.36 1fty h ALA 775 Cb 0.52 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1fty h ALA 775 CO -0.22 -0.31 -0.08 -0.25 0.00 0.00 0.00 179.25 178.38 1fty n ASP 776 N -4.08 2.21 0.20 0.00 8.00 -0.97 -4.73 116.55 117.18 1fty n ASP 776 Ca 0.03 -1.61 -0.13 0.00 0.71 0.00 0.00 54.79 53.79 1fty n ASP 776 Cb 0.34 0.11 -0.07 0.00 -0.02 0.00 0.00 41.12 41.48 1fty n ASP 776 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1fty h TYR 777 N 2.93 -1.07 -0.37 1.24 5.03 -1.29 -1.13 116.97 122.32 1fty h TYR 777 Ca 0.00 0.01 0.08 0.00 2.58 0.00 0.00 58.73 61.40 1fty h TYR 777 Cb 0.66 0.42 -0.09 0.00 1.55 0.00 0.00 36.73 39.28 1fty h TYR 777 CO 0.00 -0.49 -0.25 0.93 -1.32 0.00 0.00 178.16 177.03 1fty h GLU 778 N -0.72 -0.18 0.00 1.82 5.08 -1.85 -1.08 114.58 117.65 1fty h GLU 778 Ca -0.04 0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 1fty h GLU 778 Cb 0.64 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.93 1fty h GLU 778 CO -0.07 -0.12 -0.12 1.49 -1.00 0.00 0.00 179.01 179.18 1fty h GLU 779 N -0.19 0.00 0.08 2.33 4.81 -1.87 -2.36 114.58 117.38 1fty h GLU 779 Ca 0.18 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.41 1fty h GLU 779 Cb 0.47 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.85 1fty h GLU 779 CO -0.48 0.12 -0.04 -0.92 -0.73 0.00 0.00 179.01 176.96 1fty h TYR 780 N 0.00 -0.09 -0.10 0.92 3.20 0.06 -2.24 116.97 118.72 1fty h TYR 780 Ca -0.00 -0.00 -0.11 0.00 3.14 0.00 0.00 58.73 61.75 1fty h TYR 780 Cb 0.39 0.03 -0.01 0.00 1.54 0.00 0.00 36.73 38.68 1fty h TYR 780 CO 0.00 0.45 -0.44 -0.39 -1.64 0.00 0.00 178.16 176.14 1fty h VAL 781 N -0.74 1.32 -0.06 1.81 -1.51 -1.38 0.69 116.25 116.39 1fty h VAL 781 Ca -0.01 -1.60 0.00 0.00 -1.23 0.00 0.00 66.70 63.86 1fty h VAL 781 Cb 0.59 1.74 -0.00 0.00 -2.13 0.00 0.00 31.29 31.49 1fty h VAL 781 CO 0.02 0.47 0.04 0.11 -1.23 0.00 0.00 177.57 176.98 1fty h LYS 782 N 0.18 0.09 -0.52 5.19 6.56 -1.50 -1.45 116.57 125.12 1fty h LYS 782 Ca 0.01 -0.01 -0.05 0.00 -1.06 0.00 0.00 60.65 59.55 1fty h LYS 782 Cb 0.86 -0.02 -0.02 0.00 -0.57 0.00 0.00 32.23 32.48 1fty h LYS 782 CO 0.07 0.08 0.12 0.00 -2.06 0.00 0.00 179.45 177.66 1fty h GLN 784 N 0.76 0.12 -0.37 0.00 1.08 -0.34 -1.66 115.11 114.70 1fty h GLN 784 Ca 0.17 -0.02 -0.10 0.00 -1.45 0.00 0.00 58.65 57.25 1fty h GLN 784 Cb 0.29 -0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.69 1fty h GLN 784 CO -0.00 0.21 -0.19 0.93 -0.95 0.00 0.00 178.83 178.83 1fty h GLU 785 N 0.12 0.70 -0.13 1.46 5.08 -0.62 -2.59 114.58 118.61 1fty h GLU 785 Ca 0.03 -0.26 -0.10 0.00 -1.00 0.00 0.00 59.36 58.03 1fty h GLU 785 Cb 0.22 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 1fty h GLU 785 CO 0.01 0.84 -0.35 0.00 -1.00 0.00 0.00 179.01 178.52 1fty h ARG 786 N 0.62 0.26 -0.03 2.33 3.08 -1.18 -1.60 114.38 117.86 1fty h ARG 786 Ca 0.10 -0.11 -0.18 0.00 0.07 0.00 0.00 59.98 59.86 1fty h ARG 786 Cb 0.66 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.69 1fty h ARG 786 CO 0.05 0.58 -0.78 -0.39 -1.07 0.00 0.00 179.97 178.36 1fty h VAL 787 N 0.22 1.44 -0.57 2.04 -1.51 -1.25 -2.56 116.25 114.06 1fty h VAL 787 Ca 0.03 -2.36 -0.08 0.00 -1.23 0.00 0.00 66.70 63.06 1fty h VAL 787 Cb 0.72 2.28 -0.02 0.00 -2.13 0.00 0.00 31.29 32.14 1fty h VAL 787 CO 0.05 0.69 0.03 0.28 -1.23 0.00 0.00 177.57 177.40 1fty h SER 788 N 0.15 0.93 -0.15 4.19 0.02 -1.20 -1.00 113.55 116.49 1fty h SER 788 Ca -0.03 -0.23 -0.00 0.00 -0.84 0.00 0.00 61.79 60.68 1fty h SER 788 Cb 1.36 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 63.65 1fty h SER 788 CO 0.12 0.96 0.09 0.00 -1.14 0.00 0.00 176.83 176.87 1fty h ALA 789 N 1.14 0.19 0.00 3.77 0.00 -1.19 -2.78 119.26 120.39 1fty h ALA 789 Ca 0.17 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.99 1fty h ALA 789 Cb 0.48 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1fty h ALA 789 CO 0.02 -0.30 -0.29 1.25 0.00 0.00 0.00 179.25 179.93 1fty h LEU 790 N 0.18 0.00 -1.03 0.00 6.46 -1.24 -2.84 115.31 116.84 1fty h LEU 790 Ca 0.05 0.00 -0.06 0.00 -0.12 0.00 0.00 57.88 57.76 1fty h LEU 790 Cb 0.02 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 39.94 1fty h LEU 790 CO -0.01 0.29 -0.28 0.22 -0.62 0.00 0.00 178.44 178.04 1fty h TYR 791 N 0.00 0.00 0.00 1.25 3.20 -0.92 -2.43 116.97 118.07 1fty h TYR 791 Ca -0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 1fty h TYR 791 Cb 0.71 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.98 1fty h TYR 791 CO 0.00 0.28 0.00 1.63 -1.64 0.00 0.00 178.16 178.43 1fty n LYS 792 N -3.44 0.13 -3.57 1.82 5.02 -1.07 -3.73 118.16 113.32 1fty n LYS 792 Ca 0.00 0.37 -0.29 0.00 -2.02 0.00 0.00 58.31 56.36 1fty n LYS 792 Cb 0.46 -1.74 -0.08 0.00 -0.02 0.00 0.00 35.03 33.65 1fty n LYS 792 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1fty n ASN 793 N -1.98 3.78 -0.30 4.39 2.85 -0.91 -4.98 115.26 118.10 1fty n ASN 793 Ca 0.03 -3.34 0.11 0.00 -0.11 0.00 0.00 54.58 51.26 1fty n ASN 793 Cb 0.20 -0.78 0.21 0.00 1.24 0.00 0.00 39.78 40.66 1fty n ASN 793 CO 0.00 0.00 0.00 -2.65 -2.11 0.00 0.00 177.26 172.50 1fty n PRO 794 N 1.37 -0.07 -0.27 1.20 -0.02 -1.24 -1.17 135.00 134.79 1fty n PRO 794 Ca 0.26 1.31 -0.05 0.00 -2.02 0.00 0.00 63.50 63.00 1fty n PRO 794 Cb 0.38 -2.05 0.09 0.00 -0.02 0.00 0.00 33.50 31.91 1fty n PRO 794 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 1fty h ARG 795 N 0.00 1.15 0.03 -0.52 2.43 -1.93 -1.41 114.38 114.13 1fty h ARG 795 Ca 0.49 -0.20 -0.23 0.00 -0.81 0.00 0.00 59.98 59.24 1fty h ARG 795 Cb 0.94 -0.19 -0.02 0.00 -0.42 0.00 0.00 29.97 30.28 1fty h ARG 795 CO -0.84 0.92 -1.07 0.93 -1.51 0.00 0.00 179.97 178.40 1fty h GLU 796 N 1.13 0.06 0.06 0.20 4.39 -1.47 -2.56 114.58 116.39 1fty h GLU 796 Ca 0.26 -0.10 -0.00 0.00 0.34 0.00 0.00 59.36 59.86 1fty h GLU 796 Cb 0.19 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.88 1fty h GLU 796 CO -0.02 1.04 -0.03 2.35 -1.16 0.00 0.00 179.01 181.19 1fty h TRP 797 N 0.02 -0.07 -0.08 4.33 2.91 -1.12 -1.76 115.95 120.18 1fty h TRP 797 Ca -0.04 -0.00 -0.03 0.00 1.13 0.00 0.00 58.89 59.94 1fty h TRP 797 Cb 1.82 0.02 -0.01 0.00 -0.51 0.00 0.00 29.16 30.49 1fty h TRP 797 CO 0.01 0.12 -0.09 1.15 -1.03 0.00 0.00 178.44 178.61 1fty h THR 798 N -0.25 1.11 -0.09 2.65 2.02 -1.31 -1.09 112.91 115.96 1fty h THR 798 Ca -0.01 -0.50 -0.18 0.00 0.77 0.00 0.00 66.41 66.49 1fty h THR 798 Cb 0.22 1.15 -0.00 0.00 -1.74 0.00 0.00 68.15 67.78 1fty h THR 798 CO 0.01 0.15 -0.71 0.03 0.37 0.00 0.00 175.52 175.38 1fty h ARG 799 N 0.12 0.43 -0.29 6.66 3.08 -1.25 -1.04 114.38 122.09 1fty h ARG 799 Ca 0.03 -0.34 -0.12 0.00 0.07 0.00 0.00 59.98 59.61 1fty h ARG 799 Cb 0.23 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 1fty h ARG 799 CO 0.01 0.98 -0.33 1.98 -1.07 0.00 0.00 179.97 181.53 1fty h MET 800 N 0.30 0.62 0.15 0.04 4.05 -0.67 -2.26 114.93 117.16 1fty h MET 800 Ca -0.03 -0.29 -0.00 0.00 -0.28 0.00 0.00 59.70 59.10 1fty h MET 800 Cb 1.28 -0.01 -0.00 0.00 -0.80 0.00 0.00 31.60 32.07 1fty h MET 800 CO 0.12 0.87 -0.09 0.28 0.23 0.00 0.00 176.91 178.33 1fty h VAL 801 N 0.52 0.82 -0.60 -5.77 2.07 -1.00 -1.82 116.25 110.48 1fty h VAL 801 Ca 0.06 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.71 1fty h VAL 801 Cb 0.83 0.82 -0.03 0.00 -1.52 0.00 0.00 31.29 31.38 1fty h VAL 801 CO 0.07 0.00 0.41 0.40 0.02 0.00 0.00 177.57 178.47 1fty h ILE 802 N -0.22 0.81 0.00 4.57 2.04 -0.96 0.14 117.51 123.89 1fty h ILE 802 Ca -0.01 -0.09 -0.11 0.00 1.00 0.00 0.00 64.86 65.65 1fty h ILE 802 Cb 0.19 0.54 -0.02 0.00 -0.74 0.00 0.00 36.82 36.79 1fty h ILE 802 CO 0.02 0.05 -0.50 -0.09 0.00 0.00 0.00 178.15 177.62 1fty h ARG 803 N 0.25 0.00 0.05 2.37 9.65 -0.76 -1.51 114.38 124.43 1fty h ARG 803 Ca 0.28 0.00 -0.00 0.00 -1.10 0.00 0.00 59.98 59.16 1fty h ARG 803 Cb 0.77 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.35 1fty h ARG 803 CO -0.06 0.50 -0.02 -0.91 2.80 0.00 0.00 179.97 182.28 1fty h ASN 804 N 0.00 -0.05 -0.34 -3.80 2.35 -0.19 -3.17 115.58 110.38 1fty h ASN 804 Ca -0.01 -0.42 0.07 0.00 -0.55 0.00 0.00 56.30 55.39 1fty h ASN 804 Cb 0.90 0.01 -0.06 0.00 0.05 0.00 0.00 38.32 39.22 1fty h ASN 804 CO 0.07 0.63 -0.06 0.40 -1.65 0.00 0.00 177.43 176.82 1fty h ILE 805 N -0.98 0.69 0.00 2.81 2.04 -1.16 -0.86 117.51 120.04 1fty h ILE 805 Ca -0.01 -0.01 0.00 0.00 1.00 0.00 0.00 64.86 65.84 1fty h ILE 805 Cb 0.47 0.65 0.00 0.00 -0.74 0.00 0.00 36.82 37.21 1fty h ILE 805 CO 0.01 0.01 0.00 0.00 0.00 0.00 0.00 178.15 178.17 1fty h ALA 806 N 1.33 1.00 -0.22 1.87 0.00 -1.42 -2.73 119.26 119.09 1fty h ALA 806 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1fty h ALA 806 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1fty h ALA 806 CO -0.33 0.00 0.00 -2.37 0.00 0.00 0.00 179.25 176.55 1fty n THR 807 N -2.60 1.23 1.22 0.00 5.66 -0.40 -1.94 114.28 117.46 1fty n THR 807 Ca -0.01 -1.20 0.13 0.00 -3.05 0.00 0.00 64.05 59.92 1fty n THR 807 Cb 0.12 0.35 0.39 0.00 -1.55 0.00 0.00 70.33 69.64 1fty n THR 807 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 1fty n SER 808 N -0.04 0.84 -0.32 1.09 3.41 -0.80 -4.44 113.62 113.36 1fty n SER 808 Ca 0.10 -0.71 0.22 0.00 -0.26 0.00 0.00 58.87 58.22 1fty n SER 808 Cb 0.45 0.12 0.43 0.00 -0.26 0.00 0.00 64.21 64.96 1fty n SER 808 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1fty h GLY 809 N 4.95 1.81 1.80 5.00 0.00 -1.78 0.38 103.07 115.22 1fty h GLY 809 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.26 1fty h GLY 809 CO 0.00 -0.59 0.09 1.70 0.00 0.00 0.00 176.54 177.75 1fty h LYS 810 N 0.11 0.00 -0.77 4.80 3.64 -1.87 -2.93 116.57 119.54 1fty h LYS 810 Ca 0.71 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 60.05 1fty h LYS 810 Cb 1.66 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.46 1fty h LYS 810 CO -0.75 0.00 0.05 1.19 -2.27 0.00 0.00 179.45 177.67 1fty n PHE 811 N -3.12 1.38 -3.15 1.91 3.01 0.12 -4.82 117.46 112.79 1fty n PHE 811 Ca -0.02 -0.56 -0.39 0.00 1.01 0.00 0.00 57.45 57.49 1fty n PHE 811 Cb 0.16 -0.40 -0.06 0.00 -0.01 0.00 0.00 39.48 39.17 1fty n PHE 811 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 1fty s SER 812 N -0.48 7.20 0.03 4.37 0.15 -1.11 -0.29 113.70 123.57 1fty s SER 812 Ca 0.34 1.42 0.11 0.00 0.70 0.00 0.00 55.95 58.52 1fty s SER 812 Cb 0.27 -2.42 0.47 0.00 -1.71 0.00 0.00 66.02 62.63 1fty s SER 812 CO 0.10 0.25 1.34 -1.54 1.20 0.00 0.00 173.24 174.58 1fty n SER 813 N 1.65 0.07 -0.07 5.45 3.41 0.53 -1.80 113.62 122.87 1fty n SER 813 Ca -0.08 0.52 -0.10 0.00 -0.26 0.00 0.00 58.87 58.95 1fty n SER 813 Cb 0.50 -0.54 0.04 0.00 -0.26 0.00 0.00 64.21 63.95 1fty n SER 813 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1fty h ASP 814 N 0.00 0.81 -0.07 4.04 3.32 -1.92 0.35 116.42 122.95 1fty h ASP 814 Ca 0.00 -0.37 -0.01 0.00 0.02 0.00 0.00 57.03 56.67 1fty h ASP 814 Cb 0.17 -0.23 -0.00 0.00 0.22 0.00 0.00 39.33 39.49 1fty h ASP 814 CO 0.00 1.11 0.01 -0.09 -1.72 0.00 0.00 179.24 178.55 1fty h ARG 815 N 0.62 0.12 0.01 3.56 1.12 -1.69 -0.26 114.38 117.86 1fty h ARG 815 Ca 0.05 -0.03 0.03 0.00 -1.11 0.00 0.00 59.98 58.91 1fty h ARG 815 Cb 0.95 -0.01 -0.03 0.00 -0.01 0.00 0.00 29.97 30.86 1fty h ARG 815 CO 0.09 0.36 -0.18 1.15 -3.11 0.00 0.00 179.97 178.28 1fty h THR 816 N -0.15 0.57 -0.82 0.20 2.02 -1.50 -1.85 112.91 111.39 1fty h THR 816 Ca 0.02 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.17 1fty h THR 816 Cb 0.31 0.57 -0.04 0.00 -1.74 0.00 0.00 68.15 67.25 1fty h THR 816 CO 0.00 0.00 0.38 0.40 0.37 0.00 0.00 175.52 176.67 1fty h ILE 817 N -0.29 1.26 -0.64 3.11 1.08 -0.89 -1.09 117.51 120.04 1fty h ILE 817 Ca 0.05 -0.75 0.01 0.00 -0.39 0.00 0.00 64.86 63.79 1fty h ILE 817 Cb 0.36 0.22 -0.03 0.00 -3.07 0.00 0.00 36.82 34.30 1fty h ILE 817 CO -0.16 0.32 0.43 0.00 -0.69 0.00 0.00 178.15 178.04 1fty h ALA 818 N 1.23 1.56 -0.23 1.87 0.00 -0.68 0.18 119.26 123.19 1fty h ALA 818 Ca 0.28 -0.04 -0.17 0.00 0.00 0.00 0.00 54.91 54.97 1fty h ALA 818 Cb 0.14 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1fty h ALA 818 CO -0.03 0.41 -0.54 1.96 0.00 0.00 0.00 179.25 181.05 1fty h GLN 819 N 0.86 0.77 0.02 0.00 4.20 -0.58 -1.95 115.11 118.42 1fty h GLN 819 Ca 0.24 -0.52 -0.00 0.00 0.06 0.00 0.00 58.65 58.43 1fty h GLN 819 Cb -0.08 0.07 0.00 0.00 0.30 0.00 0.00 27.48 27.78 1fty h GLN 819 CO -0.05 1.14 -0.01 1.88 -0.67 0.00 0.00 178.83 181.12 1fty h TYR 820 N 0.50 -0.02 -0.35 2.96 0.05 -0.66 0.29 116.97 119.75 1fty h TYR 820 Ca -0.00 -0.00 0.08 0.00 0.05 0.00 0.00 58.73 58.85 1fty h TYR 820 Cb 1.15 0.01 -0.08 0.00 1.01 0.00 0.00 36.73 38.81 1fty h TYR 820 CO 0.08 0.04 -0.24 0.00 -1.05 0.00 0.00 178.16 176.99 1fty h ALA 821 N 0.91 -0.04 0.00 3.88 0.00 -0.63 0.35 119.26 123.74 1fty h ALA 821 Ca -0.00 0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1fty h ALA 821 Cb 0.07 0.53 0.00 0.00 0.00 0.00 0.00 17.79 18.39 1fty h ALA 821 CO 0.00 -0.63 -0.08 0.00 0.00 0.00 0.00 179.25 178.54 1fty h ARG 822 N -0.19 0.05 -0.00 0.00 3.08 -1.24 0.50 114.38 116.58 1fty h ARG 822 Ca 0.17 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.16 1fty h ARG 822 Cb 0.46 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.53 1fty h ARG 822 CO -0.46 0.85 -0.25 0.39 -1.07 0.00 0.00 179.97 179.43 1fty n GLU 823 N -4.63 0.21 0.02 0.04 1.02 0.08 -4.01 120.64 113.37 1fty n GLU 823 Ca -0.10 -0.09 0.00 0.00 -0.02 0.00 0.00 57.16 56.96 1fty n GLU 823 Cb 0.43 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.36 1fty n GLU 823 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1fty n ILE 824 N -1.32 0.11 0.11 -3.67 5.41 -0.05 -4.89 119.36 115.06 1fty n ILE 824 Ca 0.08 0.04 -0.01 0.00 1.00 0.00 0.00 62.75 63.86 1fty n ILE 824 Cb 0.32 -0.98 -0.03 0.00 -0.71 0.00 0.00 39.64 38.25 1fty n ILE 824 CO 0.00 0.00 0.00 -0.50 0.00 0.00 0.00 176.55 176.05 1fty h TRP 825 N 0.00 0.00 -1.87 1.39 6.55 -1.05 -3.48 115.95 117.48 1fty h TRP 825 Ca 0.00 0.00 -0.07 0.00 0.95 0.00 0.00 58.89 59.77 1fty h TRP 825 Cb 0.38 0.00 0.03 0.00 -0.86 0.00 0.00 29.16 28.71 1fty h TRP 825 CO 0.00 0.66 -0.12 0.41 -1.05 0.00 0.00 178.44 178.34 1fty n GLY 826 N 1.27 0.69 3.21 1.49 0.00 0.15 -4.98 105.19 107.02 1fty n GLY 826 Ca 0.01 -0.51 -0.14 0.00 0.00 0.00 0.00 46.02 45.37 1fty n GLY 826 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1fty s VAL 827 N -3.06 1.06 -0.24 1.61 -7.23 -0.01 -5.00 120.40 107.54 1fty s VAL 827 Ca 0.11 -1.85 -0.07 0.00 -1.81 0.00 0.00 61.98 58.36 1fty s VAL 827 Cb -0.05 -1.61 -0.03 0.00 0.56 0.00 0.00 36.38 35.26 1fty s VAL 827 CO 0.13 -0.64 0.05 -1.61 -0.31 0.00 0.00 175.10 172.72 1fty s GLU 828 N -3.25 3.64 0.95 4.82 0.41 -1.26 -3.48 118.70 120.53 1fty s GLU 828 Ca 0.11 -0.49 -0.11 0.00 -0.41 0.00 0.00 54.97 54.08 1fty s GLU 828 Cb -0.00 -3.27 0.17 0.00 -1.78 0.00 0.00 34.13 29.25 1fty s GLU 828 CO 0.00 -0.15 1.12 -1.25 -0.49 0.00 0.00 175.26 174.50 1fty s PRO 829 N 1.48 0.72 -0.19 0.39 0.04 -1.26 -4.97 135.00 131.21 1fty s PRO 829 Ca 0.06 1.41 -0.10 0.00 0.04 0.00 0.00 61.00 62.41 1fty s PRO 829 Cb -0.15 -1.70 0.07 0.00 0.04 0.00 0.00 34.50 32.76 1fty s PRO 829 CO 0.03 -2.79 0.45 0.45 0.04 0.00 0.00 177.00 175.18 1fty s SER 830 N -2.67 -0.54 -0.57 6.66 0.15 -0.07 -5.03 113.70 111.63 1fty s SER 830 Ca 0.67 0.99 -0.00 0.00 0.70 0.00 0.00 55.95 58.31 1fty s SER 830 Cb -0.23 0.95 0.48 0.00 -1.71 0.00 0.00 66.02 65.51 1fty s SER 830 CO 0.59 -0.21 1.99 0.54 1.20 0.00 0.00 173.24 177.35 1fty n ARG 831 N 4.46 2.46 -3.22 5.44 5.12 -1.26 -3.31 116.66 126.34 1fty n ARG 831 Ca -0.21 -3.00 -0.39 0.00 -1.93 0.00 0.00 57.85 52.32 1fty n ARG 831 Cb 0.55 -2.18 -0.06 0.00 -1.16 0.00 0.00 32.46 29.61 1fty n ARG 831 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 1fty s GLN 832 N -3.44 4.26 0.15 5.56 -0.21 -1.26 -5.03 119.66 119.69 1fty s GLN 832 Ca 0.59 0.51 -0.31 0.00 0.02 0.00 0.00 55.36 56.16 1fty s GLN 832 Cb 0.47 -3.52 -0.10 0.00 1.00 0.00 0.00 33.01 30.86 1fty s GLN 832 CO 0.02 -0.06 1.65 1.03 -2.12 0.00 0.00 175.29 175.81 1fty s ARG 833 N 1.31 4.19 0.44 2.91 3.00 -1.26 -4.96 118.95 124.58 1fty s ARG 833 Ca 0.27 2.43 -0.24 0.00 0.00 0.00 0.00 55.73 58.19 1fty s ARG 833 Cb -0.16 -3.29 -0.08 0.00 0.00 0.00 0.00 34.95 31.43 1fty s ARG 833 CO 0.11 -0.69 1.18 -1.17 0.00 0.00 0.00 175.30 174.73 1fty s LEU 834 N 1.67 4.07 -0.13 2.53 2.96 0.84 -4.78 118.68 125.84 1fty s LEU 834 Ca 0.73 2.36 -0.14 0.00 -0.22 0.00 0.00 54.13 56.86 1fty s LEU 834 Cb -0.44 -4.15 -0.16 0.00 0.50 0.00 0.00 46.19 41.94 1fty s LEU 834 CO 0.32 -0.86 1.13 -0.81 -1.32 0.00 0.00 176.35 174.81 1fty n PRO 835 N -0.30 0.01 -0.81 0.98 -0.04 -1.26 -4.73 135.00 128.85 1fty n PRO 835 Ca 0.06 -0.54 0.08 0.00 -0.04 0.00 0.00 63.50 63.06 1fty n PRO 835 Cb 0.47 -1.86 -0.03 0.00 -0.04 0.00 0.00 33.50 32.04 1fty n PRO 835 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1fty n ALA 836 N 7.52 -2.77 0.06 0.55 0.00 -1.26 -4.63 120.51 119.98 1fty n ALA 836 Ca 0.21 0.26 0.11 0.00 0.00 0.00 0.00 53.44 54.02 1fty n ALA 836 Cb 0.37 -0.89 -0.11 0.00 0.00 0.00 0.00 19.45 18.82 1fty n ALA 836 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1fty n PRO 837 N -2.68 0.62 0.00 0.00 -0.04 -1.26 -4.94 135.00 126.71 1fty n PRO 837 Ca -0.01 -0.09 0.00 0.00 -0.04 0.00 0.00 63.50 63.36 1fty n PRO 837 Cb 0.58 -1.62 0.00 0.00 -0.04 0.00 0.00 33.50 32.42 1fty n PRO 837 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1fty n ASP 838 N -2.37 0.00 0.00 3.54 -0.08 -1.26 -4.54 116.55 111.84 1fty n ASP 838 Ca -0.02 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.26 1fty n ASP 838 Cb 0.56 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.02 1fty n ASP 838 CO 0.00 0.00 0.00 1.21 0.12 0.00 0.00 177.20 178.53 1fty n GLU 839 N 0.00 0.00 -1.68 -0.67 0.00 -1.26 -4.96 120.64 112.07 1fty n GLU 839 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 1fty n GLU 839 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.44 1fty n GLU 839 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.13 177.49 1fty n LYS 840 N 0.00 -3.74 -3.15 5.31 -0.00 -1.26 -5.03 118.16 110.29 1fty n LYS 840 Ca 0.00 2.74 -0.11 0.00 -0.00 0.00 0.00 58.31 60.93 1fty n LYS 840 Cb 0.00 -3.19 -0.04 0.00 -0.00 0.00 0.00 35.03 31.80 1fty n LYS 840 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.40 175.90 1fty s ILE 841 N -2.53 -0.55 -2.00 0.58 -1.16 -1.26 -5.15 121.20 109.13 1fty s ILE 841 Ca 0.00 -1.10 0.27 0.00 -0.51 0.00 0.00 60.65 59.31 1fty s ILE 841 Cb 0.00 -0.43 0.77 0.00 0.61 0.00 0.00 42.46 43.41 1fty s ILE 841 CO 0.00 -0.41 1.96 -2.65 -2.81 0.00 0.00 174.94 171.04