#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gpy n VAL 15 N 0.00 1.06 -1.88 2.46 3.14 -1.26 -3.93 118.33 117.92 1gpy n VAL 15 Ca 0.00 -1.04 0.00 0.00 -2.96 0.00 0.00 64.34 60.34 1gpy n VAL 15 Cb 0.00 -2.12 0.00 0.00 -1.06 0.00 0.00 33.84 30.66 1gpy n VAL 15 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 1gpy n ARG 16 N 7.95 0.00 0.00 1.45 5.12 -1.26 -4.99 116.66 124.92 1gpy n ARG 16 Ca 0.45 -0.70 0.00 0.00 -1.93 0.00 0.00 57.85 55.67 1gpy n ARG 16 Cb 0.45 -0.38 0.00 0.00 -1.16 0.00 0.00 32.46 31.37 1gpy n ARG 16 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1gpy n GLY 17 N 0.00 -0.74 3.75 -0.13 0.00 -1.25 -2.43 105.19 104.39 1gpy n GLY 17 Ca 0.00 -1.70 -0.41 0.00 0.00 0.00 0.00 46.02 43.92 1gpy n GLY 17 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1gpy s LEU 18 N -2.71 4.50 -0.28 0.99 2.01 -1.26 -4.75 118.68 117.18 1gpy s LEU 18 Ca 0.00 2.31 0.12 0.00 0.01 0.00 0.00 54.13 56.57 1gpy s LEU 18 Cb 0.00 -3.62 0.67 0.00 0.01 0.00 0.00 46.19 43.25 1gpy s LEU 18 CO 0.00 -0.27 1.67 0.00 1.01 0.00 0.00 176.35 178.76 1gpy n ALA 19 N 1.58 4.08 -0.61 4.21 0.00 -1.26 -4.36 120.51 124.16 1gpy n ALA 19 Ca 0.01 -2.40 -0.23 0.00 0.00 0.00 0.00 53.44 50.82 1gpy n ALA 19 Cb 0.44 -1.04 0.02 0.00 0.00 0.00 0.00 19.45 18.88 1gpy n ALA 19 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gpy n GLY 20 N -0.29 -2.36 0.14 0.00 0.00 -1.26 -4.75 105.19 96.67 1gpy n GLY 20 Ca 0.34 -0.28 -0.12 0.00 0.00 0.00 0.00 46.02 45.96 1gpy n GLY 20 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1gpy h VAL 21 N -0.61 0.87 0.11 1.61 3.04 -2.00 -1.92 116.25 117.36 1gpy h VAL 21 Ca -0.25 -1.02 -0.01 0.00 -1.01 0.00 0.00 66.70 64.41 1gpy h VAL 21 Cb 0.83 1.41 0.00 0.00 -2.01 0.00 0.00 31.29 31.52 1gpy h VAL 21 CO 0.13 0.21 -0.06 -0.33 -1.01 0.00 0.00 177.57 176.52 1gpy h GLU 22 N -0.80 -0.15 0.00 4.17 3.07 -2.00 -3.01 114.58 115.86 1gpy h GLU 22 Ca -0.02 0.01 -0.03 0.00 -0.50 0.00 0.00 59.36 58.82 1gpy h GLU 22 Cb 0.52 0.03 -0.00 0.00 -0.84 0.00 0.00 28.75 28.46 1gpy h GLU 22 CO 0.04 -0.05 -0.13 -0.91 -1.40 0.00 0.00 179.01 176.57 1gpy h ASN 23 N -0.21 0.00 -0.14 1.42 4.21 -1.90 0.19 115.58 119.15 1gpy h ASN 23 Ca -0.02 0.00 -0.22 0.00 1.21 0.00 0.00 56.30 57.28 1gpy h ASN 23 Cb 0.17 0.00 0.01 0.00 -1.12 0.00 0.00 38.32 37.38 1gpy h ASN 23 CO 0.03 0.13 -0.76 0.58 -1.29 0.00 0.00 177.43 176.11 1gpy h VAL 24 N 0.00 1.28 -0.59 2.81 2.07 -1.35 -1.63 116.25 118.84 1gpy h VAL 24 Ca -0.00 -1.96 -0.01 0.00 0.82 0.00 0.00 66.70 65.55 1gpy h VAL 24 Cb 0.33 1.96 -0.03 0.00 -1.52 0.00 0.00 31.29 32.03 1gpy h VAL 24 CO 0.02 0.62 0.34 0.74 0.02 0.00 0.00 177.57 179.31 1gpy h THR 25 N 0.54 1.18 0.26 2.57 2.02 -1.03 -0.46 112.91 117.99 1gpy h THR 25 Ca -0.05 -0.44 -0.01 0.00 0.77 0.00 0.00 66.41 66.68 1gpy h THR 25 Cb 1.38 0.41 -0.00 0.00 -1.74 0.00 0.00 68.15 68.20 1gpy h THR 25 CO 0.16 0.20 -0.15 -0.08 0.37 0.00 0.00 175.52 176.01 1gpy h GLU 26 N 0.80 -0.38 -0.39 6.66 4.22 -0.68 -2.08 114.58 122.73 1gpy h GLU 26 Ca 0.21 0.03 -0.14 0.00 0.08 0.00 0.00 59.36 59.53 1gpy h GLU 26 Cb 0.02 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.34 1gpy h GLU 26 CO -0.04 -0.26 -0.33 -0.07 -2.18 0.00 0.00 179.01 176.14 1gpy h LEU 27 N -0.40 0.93 -1.31 1.64 3.38 -1.11 -2.95 115.31 115.50 1gpy h LEU 27 Ca -0.03 -0.39 0.06 0.00 0.09 0.00 0.00 57.88 57.60 1gpy h LEU 27 Cb 0.33 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.77 1gpy h LEU 27 CO 0.03 1.17 0.51 0.50 0.09 0.00 0.00 178.44 180.73 1gpy h LYS 28 N 0.74 0.83 -0.11 1.13 3.64 -1.03 -1.29 116.57 120.48 1gpy h LYS 28 Ca 0.07 -0.05 -0.13 0.00 -1.27 0.00 0.00 60.65 59.28 1gpy h LYS 28 Cb 0.90 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.53 1gpy h LYS 28 CO 0.08 0.55 -0.43 -0.22 -2.27 0.00 0.00 179.45 177.16 1gpy h LYS 29 N 0.86 0.49 0.01 1.90 3.64 -1.26 -2.77 116.57 119.43 1gpy h LYS 29 Ca 0.32 -0.38 -0.25 0.00 -1.27 0.00 0.00 60.65 59.08 1gpy h LYS 29 Cb 0.19 0.07 0.01 0.00 -0.41 0.00 0.00 32.23 32.09 1gpy h LYS 29 CO -0.11 1.01 -1.01 -0.91 -2.27 0.00 0.00 179.45 176.16 1gpy h ASN 30 N 0.09 0.73 -0.38 4.20 4.21 -1.32 -1.41 115.58 121.70 1gpy h ASN 30 Ca -0.02 -0.59 0.08 0.00 1.21 0.00 0.00 56.30 56.98 1gpy h ASN 30 Cb 1.07 -0.22 -0.07 0.00 -1.12 0.00 0.00 38.32 37.97 1gpy h ASN 30 CO 0.09 1.39 -0.12 0.15 -1.29 0.00 0.00 177.43 177.65 1gpy h PHE 31 N 0.31 -0.27 -0.66 1.19 3.04 -1.32 -1.03 116.94 118.20 1gpy h PHE 31 Ca -0.11 0.04 0.06 0.00 3.98 0.00 0.00 57.97 61.94 1gpy h PHE 31 Cb 1.65 0.18 -0.06 0.00 2.56 0.00 0.00 35.95 40.28 1gpy h PHE 31 CO 0.08 -0.19 0.35 -0.91 -2.02 0.00 0.00 178.31 175.63 1gpy h ASN 32 N -0.03 0.51 -0.27 0.41 2.35 -1.41 -2.25 115.58 114.88 1gpy h ASN 32 Ca 0.18 0.04 -0.00 0.00 -0.55 0.00 0.00 56.30 55.97 1gpy h ASN 32 Cb 0.31 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.61 1gpy h ASN 32 CO -0.41 0.33 0.15 0.03 -1.65 0.00 0.00 177.43 175.88 1gpy h ARG 33 N 0.65 0.38 -0.92 0.81 3.08 -0.67 -2.86 114.38 114.84 1gpy h ARG 33 Ca 0.30 -0.04 0.02 0.00 0.07 0.00 0.00 59.98 60.32 1gpy h ARG 33 Cb 0.22 -0.08 -0.05 0.00 0.08 0.00 0.00 29.97 30.14 1gpy h ARG 33 CO -0.20 0.33 0.61 0.45 -1.07 0.00 0.00 179.97 180.09 1gpy h HIS 34 N 0.33 1.15 -0.57 3.04 3.86 -1.16 0.69 115.15 122.48 1gpy h HIS 34 Ca 0.10 0.03 0.07 0.00 -1.16 0.00 0.00 60.37 59.40 1gpy h HIS 34 Cb 0.05 -0.39 -0.06 0.00 1.06 0.00 0.00 27.41 28.08 1gpy h HIS 34 CO -0.03 0.71 0.26 1.25 0.86 0.00 0.00 177.93 180.97 1gpy h LEU 35 N 1.22 0.34 0.11 2.43 5.85 -1.28 0.08 115.31 124.07 1gpy h LEU 35 Ca 0.34 0.05 -0.01 0.00 0.84 0.00 0.00 57.88 59.11 1gpy h LEU 35 Cb -0.10 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 40.92 1gpy h LEU 35 CO -0.08 0.23 -0.05 -0.74 -0.34 0.00 0.00 178.44 177.45 1gpy h HIS 36 N 0.49 -0.14 -0.08 1.25 2.76 -1.06 -1.69 115.15 116.69 1gpy h HIS 36 Ca 0.27 -0.00 -0.24 0.00 -2.20 0.00 0.00 60.37 58.19 1gpy h HIS 36 Cb 0.23 0.04 0.01 0.00 1.55 0.00 0.00 27.41 29.25 1gpy h HIS 36 CO -0.12 -0.08 -0.90 0.74 -1.30 0.00 0.00 177.93 176.26 1gpy h PHE 37 N -0.80 1.02 0.08 5.26 0.04 0.24 -1.50 116.94 121.29 1gpy h PHE 37 Ca -0.01 -0.50 -0.36 0.00 2.80 0.00 0.00 57.97 59.89 1gpy h PHE 37 Cb 0.11 -0.14 -0.03 0.00 2.20 0.00 0.00 35.95 38.09 1gpy h PHE 37 CO 0.01 1.33 -2.08 0.25 -0.60 0.00 0.00 178.31 177.22 1gpy n THR 38 N -3.89 1.68 0.15 -1.55 -2.24 -0.11 -4.21 114.28 104.12 1gpy n THR 38 Ca -0.09 -0.57 0.08 0.00 -2.27 0.00 0.00 64.05 61.20 1gpy n THR 38 Cb 0.81 -1.69 0.07 0.00 -2.10 0.00 0.00 70.33 67.42 1gpy n THR 38 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1gpy h LEU 39 N -0.08 0.00 -2.84 3.22 3.38 -1.24 -3.48 115.31 114.27 1gpy h LEU 39 Ca -0.47 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.23 1gpy h LEU 39 Cb 1.92 0.00 0.09 0.00 0.09 0.00 0.00 40.66 42.76 1gpy h LEU 39 CO -0.00 0.19 -0.69 0.52 0.09 0.00 0.00 178.44 178.55 1gpy n VAL 40 N -3.01 -7.67 -3.97 1.22 0.31 -0.56 -4.99 118.33 99.65 1gpy n VAL 40 Ca 0.01 -0.78 -0.09 0.00 -0.01 0.00 0.00 64.34 63.47 1gpy n VAL 40 Cb 0.62 -5.49 -0.08 0.00 -0.91 0.00 0.00 33.84 27.98 1gpy n VAL 40 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1gpy s LYS 41 N -4.64 1.01 0.29 5.55 -0.14 -0.83 -5.01 119.74 115.97 1gpy s LYS 41 Ca 0.30 -1.16 0.08 0.00 -1.36 0.00 0.00 55.97 53.82 1gpy s LYS 41 Cb -0.08 0.34 -0.04 0.00 -1.68 0.00 0.00 37.83 36.37 1gpy s LYS 41 CO 0.80 -0.34 0.16 0.34 -0.76 0.00 0.00 175.35 175.55 1gpy s ASP 42 N -2.95 5.07 0.27 2.83 -1.08 -1.26 -4.07 116.67 115.47 1gpy s ASP 42 Ca 0.15 -0.51 -0.03 0.00 -0.52 0.00 0.00 52.55 51.64 1gpy s ASP 42 Cb 0.05 -1.03 0.39 0.00 -1.46 0.00 0.00 42.92 40.87 1gpy s ASP 42 CO -0.03 -0.16 1.90 0.03 0.52 0.00 0.00 175.17 177.43 1gpy h ARG 43 N 1.53 1.17 -0.05 4.34 2.47 -1.96 -1.21 114.38 120.66 1gpy h ARG 43 Ca -0.46 -0.07 0.01 0.00 -1.26 0.00 0.00 59.98 58.21 1gpy h ARG 43 Cb 1.25 -0.26 -0.00 0.00 -1.65 0.00 0.00 29.97 29.30 1gpy h ARG 43 CO 0.61 0.77 0.09 -0.91 0.56 0.00 0.00 179.97 181.09 1gpy h ASN 44 N 1.20 0.00 0.00 7.04 2.35 -2.06 -3.20 115.58 120.91 1gpy h ASN 44 Ca 0.40 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.15 1gpy h ASN 44 Cb 0.07 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.44 1gpy h ASN 44 CO -0.14 0.00 -0.05 0.55 -1.65 0.00 0.00 177.43 176.14 1gpy n VAL 45 N -3.50 0.36 -2.65 2.81 3.14 -0.71 -5.07 118.33 112.71 1gpy n VAL 45 Ca -0.02 -0.38 -0.41 0.00 -2.96 0.00 0.00 64.34 60.57 1gpy n VAL 45 Cb 0.18 0.75 -0.04 0.00 -1.06 0.00 0.00 33.84 33.67 1gpy n VAL 45 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1gpy s ALA 46 N -0.41 3.27 0.38 1.55 0.00 -0.54 -4.87 121.76 121.14 1gpy s ALA 46 Ca 0.02 0.65 -0.12 0.00 0.00 0.00 0.00 51.96 52.50 1gpy s ALA 46 Cb 0.01 -3.32 -0.07 0.00 0.00 0.00 0.00 23.12 19.74 1gpy s ALA 46 CO 0.00 -0.14 0.76 0.99 0.00 0.00 0.00 175.76 177.37 1gpy s THR 47 N 0.22 4.75 0.39 0.00 2.01 -1.26 -4.90 115.64 116.85 1gpy s THR 47 Ca 0.49 0.74 0.19 0.00 0.31 0.00 0.00 61.69 63.42 1gpy s THR 47 Cb -0.25 -3.69 0.39 0.00 0.01 0.00 0.00 72.50 68.96 1gpy s THR 47 CO 0.31 -0.41 1.73 -0.65 -0.69 0.00 0.00 174.62 174.91 1gpy h PRO 48 N 1.60 0.34 -0.12 4.92 0.11 -1.99 0.87 132.00 137.73 1gpy h PRO 48 Ca -0.47 -0.02 -0.12 0.00 0.11 0.00 0.00 66.00 65.49 1gpy h PRO 48 Cb 1.18 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1gpy h PRO 48 CO 0.64 0.23 -0.41 0.00 -0.21 0.00 0.00 178.00 178.25 1gpy h ARG 49 N 0.35 0.49 -0.46 1.05 3.08 -1.97 -0.84 114.38 116.08 1gpy h ARG 49 Ca 0.65 -0.36 0.09 0.00 0.07 0.00 0.00 59.98 60.43 1gpy h ARG 49 Cb 1.68 0.06 -0.09 0.00 0.08 0.00 0.00 29.97 31.70 1gpy h ARG 49 CO -0.37 0.99 -0.20 -0.44 -1.07 0.00 0.00 179.97 178.88 1gpy h ASP 50 N 0.09 -0.70 -0.09 7.04 3.32 -1.52 -0.67 116.42 123.89 1gpy h ASP 50 Ca -0.02 0.17 0.04 0.00 0.02 0.00 0.00 57.03 57.24 1gpy h ASP 50 Cb 1.03 0.39 -0.06 0.00 0.22 0.00 0.00 39.33 40.91 1gpy h ASP 50 CO 0.09 -0.23 -0.32 1.88 -1.72 0.00 0.00 179.24 178.94 1gpy h TYR 51 N -0.11 -0.87 -0.50 4.55 0.05 -0.78 -1.89 116.97 117.42 1gpy h TYR 51 Ca 0.22 0.03 0.08 0.00 0.05 0.00 0.00 58.73 59.11 1gpy h TYR 51 Cb 0.44 0.40 -0.07 0.00 1.01 0.00 0.00 36.73 38.52 1gpy h TYR 51 CO -0.47 -0.40 0.12 -0.92 -1.05 0.00 0.00 178.16 175.44 1gpy h TYR 52 N -0.42 0.20 -1.00 4.88 3.20 -1.05 -2.49 116.97 120.29 1gpy h TYR 52 Ca 0.08 0.03 0.06 0.00 3.14 0.00 0.00 58.73 62.05 1gpy h TYR 52 Cb 0.55 -0.01 -0.07 0.00 1.54 0.00 0.00 36.73 38.74 1gpy h TYR 52 CO -0.38 0.02 0.65 0.74 -1.64 0.00 0.00 178.16 177.54 1gpy h PHE 53 N 0.26 1.20 -0.32 -3.82 0.04 -0.75 0.97 116.94 114.52 1gpy h PHE 53 Ca 0.25 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 61.03 1gpy h PHE 53 Cb 0.32 -0.39 -0.01 0.00 2.20 0.00 0.00 35.95 38.06 1gpy h PHE 53 CO -0.21 0.63 0.14 0.00 -0.60 0.00 0.00 178.31 178.27 1gpy h ALA 54 N 1.46 0.41 -0.43 2.45 0.00 -1.14 -1.70 119.26 120.31 1gpy h ALA 54 Ca 0.43 -0.12 -0.13 0.00 0.00 0.00 0.00 54.91 55.09 1gpy h ALA 54 Cb 0.15 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1gpy h ALA 54 CO -0.16 -0.00 -0.25 1.25 0.00 0.00 0.00 179.25 180.08 1gpy h LEU 55 N 0.37 0.92 -1.49 0.00 7.12 -1.23 0.66 115.31 121.67 1gpy h LEU 55 Ca 0.11 -0.36 -0.05 0.00 0.13 0.00 0.00 57.88 57.70 1gpy h LEU 55 Cb 0.16 -0.26 -0.01 0.00 -0.53 0.00 0.00 40.66 40.03 1gpy h LEU 55 CO -0.01 1.12 -0.26 0.00 -0.13 0.00 0.00 178.44 179.17 1gpy h ALA 56 N 0.94 1.58 0.07 1.25 0.00 -0.75 -1.05 119.26 121.29 1gpy h ALA 56 Ca 0.09 -0.23 -0.24 0.00 0.00 0.00 0.00 54.91 54.53 1gpy h ALA 56 Cb 0.81 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1gpy h ALA 56 CO 0.07 0.32 -1.10 0.45 0.00 0.00 0.00 179.25 178.99 1gpy h HIS 57 N 0.00 0.30 -0.50 0.00 3.86 -1.01 -2.35 115.15 115.46 1gpy h HIS 57 Ca -0.00 -0.21 -0.09 0.00 -1.16 0.00 0.00 60.37 58.90 1gpy h HIS 57 Cb 0.45 -0.02 -0.02 0.00 1.06 0.00 0.00 27.41 28.89 1gpy h HIS 57 CO 0.00 1.14 -0.06 1.15 0.86 0.00 0.00 177.93 181.02 1gpy h THR 58 N 0.06 1.26 -0.00 2.45 2.02 0.10 -1.55 112.91 117.24 1gpy h THR 58 Ca -0.08 -1.15 -0.00 0.00 0.77 0.00 0.00 66.41 65.95 1gpy h THR 58 Cb 1.83 0.95 -0.00 0.00 -1.74 0.00 0.00 68.15 69.19 1gpy h THR 58 CO 0.17 0.40 -0.00 0.58 0.37 0.00 0.00 175.52 177.04 1gpy h VAL 59 N 0.80 1.41 -0.05 3.16 2.07 -1.31 -3.18 116.25 119.14 1gpy h VAL 59 Ca 0.14 -1.21 -0.04 0.00 0.82 0.00 0.00 66.70 66.41 1gpy h VAL 59 Cb 0.57 2.23 -0.01 0.00 -1.52 0.00 0.00 31.29 32.56 1gpy h VAL 59 CO 0.03 0.31 -0.14 0.08 0.02 0.00 0.00 177.57 177.88 1gpy h ARG 60 N -0.51 0.07 -0.63 1.57 -0.00 -1.42 -0.96 114.38 112.50 1gpy h ARG 60 Ca 0.00 -0.01 0.12 0.00 -0.00 0.00 0.00 59.98 60.09 1gpy h ARG 60 Cb 0.52 -0.01 -0.04 0.00 -0.00 0.00 0.00 29.97 30.44 1gpy h ARG 60 CO 0.00 0.21 0.43 -0.44 -0.00 0.00 0.00 179.97 180.17 1gpy h ASP 61 N 0.07 0.33 0.38 0.08 3.32 -1.26 -2.47 116.42 116.86 1gpy h ASP 61 Ca 0.01 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.08 1gpy h ASP 61 Cb 0.29 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.78 1gpy h ASP 61 CO 0.02 0.19 0.00 1.41 -1.72 0.00 0.00 179.24 179.13 1gpy n HIS 62 N -4.46 0.00 -0.01 4.55 8.25 -0.36 -3.42 115.22 119.76 1gpy n HIS 62 Ca 0.11 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.59 1gpy n HIS 62 Cb 0.45 -0.41 0.05 0.00 1.12 0.00 0.00 29.99 31.20 1gpy n HIS 62 CO 0.00 0.00 0.00 1.47 0.64 0.00 0.00 176.34 178.45 1gpy n LEU 63 N -1.41 2.15 0.09 2.41 -0.00 -0.93 -4.62 117.00 114.70 1gpy n LEU 63 Ca 0.05 -1.77 -0.13 0.00 -0.00 0.00 0.00 56.01 54.15 1gpy n LEU 63 Cb 0.14 -0.07 -0.11 0.00 -0.00 0.00 0.00 43.42 43.37 1gpy n LEU 63 CO 0.12 0.53 0.04 0.58 -0.00 0.00 0.00 177.39 178.65 1gpy h VAL 64 N 0.85 1.53 -0.02 1.47 2.07 -1.61 -0.03 116.25 120.51 1gpy h VAL 64 Ca 0.00 -3.02 -0.16 0.00 0.82 0.00 0.00 66.70 64.35 1gpy h VAL 64 Cb 0.50 2.83 -0.02 0.00 -1.52 0.00 0.00 31.29 33.09 1gpy h VAL 64 CO 0.00 0.88 -0.70 1.23 0.02 0.00 0.00 177.57 179.00 1gpy h GLY 65 N 1.81 0.12 1.21 2.17 0.00 -1.82 -2.73 103.07 103.84 1gpy h GLY 65 Ca -0.10 -0.17 -0.29 0.00 0.00 0.00 0.00 47.33 46.77 1gpy h GLY 65 CO 0.18 0.15 -1.16 3.21 0.00 0.00 0.00 176.54 178.92 1gpy h ARG 66 N 0.07 0.65 -0.20 4.80 -0.00 -1.70 -2.78 114.38 115.24 1gpy h ARG 66 Ca -0.01 -0.81 -0.01 0.00 -0.50 0.00 0.00 59.98 58.65 1gpy h ARG 66 Cb 1.24 0.25 -0.01 0.00 0.00 0.00 0.00 29.97 31.46 1gpy h ARG 66 CO 0.10 1.36 0.10 2.35 0.00 0.00 0.00 179.97 183.88 1gpy h TRP 67 N 0.31 0.28 -0.87 3.04 7.01 -0.97 0.12 115.95 124.87 1gpy h TRP 67 Ca -0.17 -0.01 0.01 0.00 2.11 0.00 0.00 58.89 60.83 1gpy h TRP 67 Cb 1.83 -0.09 -0.05 0.00 -2.10 0.00 0.00 29.16 28.76 1gpy h TRP 67 CO 0.11 0.29 0.57 0.82 -2.79 0.00 0.00 178.44 177.44 1gpy h ILE 68 N 0.19 1.20 -0.07 2.65 2.04 -1.60 -1.17 117.51 120.75 1gpy h ILE 68 Ca 0.07 -0.40 -0.14 0.00 1.00 0.00 0.00 64.86 65.39 1gpy h ILE 68 Cb 0.11 -0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.12 1gpy h ILE 68 CO -0.01 0.21 -0.59 0.03 0.00 0.00 0.00 178.15 177.80 1gpy h ARG 69 N 1.16 0.21 0.02 2.37 2.47 -1.17 -1.03 114.38 118.41 1gpy h ARG 69 Ca 0.33 -0.14 -0.12 0.00 -1.26 0.00 0.00 59.98 58.78 1gpy h ARG 69 Cb -0.10 0.02 0.01 0.00 -1.65 0.00 0.00 29.97 28.25 1gpy h ARG 69 CO -0.08 0.74 -0.50 1.15 0.56 0.00 0.00 179.97 181.84 1gpy h THR 70 N 0.16 1.50 -0.26 2.04 2.02 -0.05 -2.75 112.91 115.56 1gpy h THR 70 Ca -0.00 -2.13 -0.17 0.00 0.77 0.00 0.00 66.41 64.88 1gpy h THR 70 Cb 1.08 2.79 -0.00 0.00 -1.74 0.00 0.00 68.15 70.28 1gpy h THR 70 CO 0.09 0.60 -0.53 1.56 0.37 0.00 0.00 175.52 177.62 1gpy h GLN 71 N -0.32 0.76 -0.73 6.66 1.08 -1.24 -1.78 115.11 119.54 1gpy h GLN 71 Ca -0.07 -0.47 -0.00 0.00 -1.45 0.00 0.00 58.65 56.66 1gpy h GLN 71 Cb 1.26 0.05 -0.04 0.00 -0.05 0.00 0.00 27.48 28.70 1gpy h GLN 71 CO 0.10 1.09 0.44 0.37 -0.95 0.00 0.00 178.83 179.88 1gpy h GLN 72 N 0.59 1.00 -0.32 1.46 5.75 -1.31 -3.08 115.11 119.20 1gpy h GLN 72 Ca 0.02 -0.09 -0.05 0.00 -0.15 0.00 0.00 58.65 58.38 1gpy h GLN 72 Cb 1.11 -0.21 -0.02 0.00 1.07 0.00 0.00 27.48 29.43 1gpy h GLN 72 CO 0.11 0.71 0.00 1.25 -2.65 0.00 0.00 178.83 178.25 1gpy h HIS 73 N 1.00 0.51 0.00 3.99 2.76 -1.10 0.39 115.15 122.70 1gpy h HIS 73 Ca 0.26 -0.05 -0.05 0.00 -2.20 0.00 0.00 60.37 58.34 1gpy h HIS 73 Cb -0.03 -0.15 -0.01 0.00 1.55 0.00 0.00 27.41 28.77 1gpy h HIS 73 CO -0.01 0.51 -0.23 1.88 -1.30 0.00 0.00 177.93 178.77 1gpy h TYR 74 N 0.48 0.00 0.03 5.26 0.05 -1.32 -1.30 116.97 120.18 1gpy h TYR 74 Ca 0.10 0.00 -0.16 0.00 0.05 0.00 0.00 58.73 58.73 1gpy h TYR 74 Cb 0.31 0.00 0.01 0.00 1.01 0.00 0.00 36.73 38.07 1gpy h TYR 74 CO 0.01 0.23 -0.63 -0.92 -1.05 0.00 0.00 178.16 175.80 1gpy h TYR 75 N 0.00 0.58 0.33 4.88 3.20 -0.31 0.25 116.97 125.90 1gpy h TYR 75 Ca -0.00 -0.34 -0.01 0.00 3.14 0.00 0.00 58.73 61.52 1gpy h TYR 75 Cb 0.65 -0.06 -0.02 0.00 1.54 0.00 0.00 36.73 38.85 1gpy h TYR 75 CO 0.00 1.18 -0.34 0.93 -1.64 0.00 0.00 178.16 178.29 1gpy h GLU 76 N -0.18 -0.64 0.00 1.82 3.07 -0.52 -3.29 114.58 114.84 1gpy h GLU 76 Ca -0.09 0.04 -0.02 0.00 -0.50 0.00 0.00 59.36 58.79 1gpy h GLU 76 Cb 1.38 0.15 -0.00 0.00 -0.84 0.00 0.00 28.75 29.43 1gpy h GLU 76 CO 0.12 -0.43 -0.12 -0.22 -1.40 0.00 0.00 179.01 176.97 1gpy h LYS 77 N -0.66 0.00 -6.27 2.33 3.11 -1.33 -3.48 116.57 110.27 1gpy h LYS 77 Ca -0.04 0.00 -0.45 0.00 -2.81 0.00 0.00 60.65 57.35 1gpy h LYS 77 Cb 0.58 0.00 0.02 0.00 -1.00 0.00 0.00 32.23 31.82 1gpy h LYS 77 CO -0.04 0.12 -0.87 -3.47 -2.81 0.00 0.00 179.45 172.37 1gpy n ASP 78 N -4.30 -1.50 -4.73 4.20 2.03 0.88 -5.00 116.55 108.14 1gpy n ASP 78 Ca -0.03 -0.93 -0.33 0.00 0.52 0.00 0.00 54.79 54.03 1gpy n ASP 78 Cb 0.19 -3.54 0.10 0.00 -0.72 0.00 0.00 41.12 37.15 1gpy n ASP 78 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1gpy s PRO 79 N -6.20 2.01 -0.10 -0.67 0.05 -1.26 -4.94 135.00 123.90 1gpy s PRO 79 Ca 0.08 1.57 -0.33 0.00 0.05 0.00 0.00 61.00 62.38 1gpy s PRO 79 Cb -0.03 -1.84 -0.10 0.00 0.05 0.00 0.00 34.50 32.58 1gpy s PRO 79 CO 0.85 -1.89 1.97 1.17 0.05 0.00 0.00 177.00 179.15 1gpy n LYS 80 N -3.12 2.23 -3.53 4.56 4.81 -1.26 -4.94 118.16 116.91 1gpy n LYS 80 Ca 0.12 0.79 -0.32 0.00 -0.87 0.00 0.00 58.31 58.03 1gpy n LYS 80 Cb 0.51 -2.79 -0.05 0.00 0.02 0.00 0.00 35.03 32.73 1gpy n LYS 80 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1gpy s ARG 81 N 4.63 3.73 -0.13 1.64 0.52 0.50 -4.63 118.95 125.21 1gpy s ARG 81 Ca 0.94 0.13 -0.01 0.00 -0.52 0.00 0.00 55.73 56.27 1gpy s ARG 81 Cb -0.60 -2.76 -0.02 0.00 0.52 0.00 0.00 34.95 32.09 1gpy s ARG 81 CO 0.47 0.40 -0.11 0.42 0.02 0.00 0.00 175.30 176.50 1gpy s ILE 82 N -1.71 3.23 -0.19 1.52 1.09 -0.82 -1.14 121.20 123.18 1gpy s ILE 82 Ca 0.43 -0.60 -0.01 0.00 -1.10 0.00 0.00 60.65 59.37 1gpy s ILE 82 Cb -0.12 -2.36 0.01 0.00 -1.06 0.00 0.00 42.46 38.93 1gpy s ILE 82 CO 0.22 0.52 -0.14 -0.31 -0.10 0.00 0.00 174.94 175.13 1gpy s TYR 83 N 0.26 2.83 -0.34 3.97 2.02 -0.14 -0.88 117.35 125.07 1gpy s TYR 83 Ca -0.08 -1.31 -0.14 0.00 -0.37 0.00 0.00 57.07 55.18 1gpy s TYR 83 Cb -0.15 -1.97 -0.02 0.00 -0.40 0.00 0.00 41.96 39.42 1gpy s TYR 83 CO 0.05 -0.66 0.28 -0.47 -1.57 0.00 0.00 175.55 173.17 1gpy s TYR 84 N 1.25 3.22 -0.21 2.71 5.04 0.06 -0.50 117.35 128.92 1gpy s TYR 84 Ca 0.03 -0.17 -0.04 0.00 -2.44 0.00 0.00 57.07 54.45 1gpy s TYR 84 Cb -0.14 -2.53 -0.01 0.00 0.35 0.00 0.00 41.96 39.62 1gpy s TYR 84 CO -0.07 -0.39 -0.04 -0.51 -1.34 0.00 0.00 175.55 173.21 1gpy s LEU 85 N 1.80 2.96 -0.02 6.97 1.43 -0.99 -1.02 118.68 129.82 1gpy s LEU 85 Ca 0.08 -0.35 -0.02 0.00 -1.03 0.00 0.00 54.13 52.81 1gpy s LEU 85 Cb -0.17 -1.75 0.01 0.00 0.03 0.00 0.00 46.19 44.30 1gpy s LEU 85 CO 0.11 0.00 0.05 -0.55 0.23 0.00 0.00 176.35 176.19 1gpy s SER 86 N 1.34 -0.05 0.00 2.29 0.15 -0.92 -2.92 113.70 113.60 1gpy s SER 86 Ca 0.04 0.11 0.15 0.00 0.70 0.00 0.00 55.95 56.95 1gpy s SER 86 Cb -0.14 0.10 0.90 0.00 -1.71 0.00 0.00 66.02 65.17 1gpy s SER 86 CO -0.02 -0.02 1.53 0.18 1.20 0.00 0.00 173.24 176.11 1gpy n LEU 87 N 3.11 0.00 -3.76 3.45 4.32 -1.26 -4.04 117.00 118.82 1gpy n LEU 87 Ca -0.13 0.00 -0.14 0.00 -0.02 0.00 0.00 56.01 55.72 1gpy n LEU 87 Cb 0.59 0.00 -0.15 0.00 -1.62 0.00 0.00 43.42 42.24 1gpy n LEU 87 CO 0.24 0.00 -0.29 -1.61 -1.22 0.00 0.00 177.39 174.51 1gpy s GLU 88 N -2.00 0.02 -0.27 3.23 2.02 -1.26 -4.76 118.70 115.68 1gpy s GLU 88 Ca 0.23 0.28 -0.03 0.00 0.02 0.00 0.00 54.97 55.46 1gpy s GLU 88 Cb 0.10 -0.22 0.10 0.00 0.10 0.00 0.00 34.13 34.22 1gpy s GLU 88 CO 0.18 -0.17 0.17 -0.06 0.02 0.00 0.00 175.26 175.40 1gpy s PHE 89 N 1.12 0.08 -1.07 1.61 0.08 0.05 -4.75 117.98 115.10 1gpy s PHE 89 Ca -0.09 -0.58 -0.07 0.00 0.12 0.00 0.00 56.93 56.32 1gpy s PHE 89 Cb -0.12 -0.74 0.28 0.00 -0.57 0.00 0.00 43.02 41.87 1gpy s PHE 89 CO -0.04 -0.80 1.13 0.98 -0.10 0.00 0.00 175.22 176.39 1gpy n TYR 90 N 5.27 4.57 0.10 0.36 4.19 -0.99 -3.44 117.16 127.22 1gpy n TYR 90 Ca -0.05 -3.71 -0.05 0.00 3.31 0.00 0.00 57.90 57.40 1gpy n TYR 90 Cb 0.44 -1.53 0.09 0.00 0.49 0.00 0.00 39.34 38.83 1gpy n TYR 90 CO 0.00 0.00 0.00 0.52 0.91 0.00 0.00 176.86 178.29 1gpy h MET 91 N 6.28 0.16 0.00 2.98 2.86 -1.82 -3.40 114.93 122.00 1gpy h MET 91 Ca 0.18 -0.13 0.00 0.00 -2.06 0.00 0.00 59.70 57.69 1gpy h MET 91 Cb 0.81 0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.50 1gpy h MET 91 CO 1.05 0.79 0.00 0.41 1.06 0.00 0.00 176.91 180.22 1gpy n GLY 92 N 0.47 -0.79 3.81 8.32 0.00 -0.99 -4.77 105.19 111.25 1gpy n GLY 92 Ca -0.02 -1.16 -0.33 0.00 0.00 0.00 0.00 46.02 44.51 1gpy n GLY 92 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1gpy s ARG 93 N 0.00 3.70 -0.01 1.61 0.52 -1.26 -2.23 118.95 121.28 1gpy s ARG 93 Ca 0.00 1.18 0.22 0.00 -0.52 0.00 0.00 55.73 56.60 1gpy s ARG 93 Cb 0.00 -2.09 -0.27 0.00 0.52 0.00 0.00 34.95 33.11 1gpy s ARG 93 CO 0.00 -0.49 0.54 2.41 0.02 0.00 0.00 175.30 177.78 1gpy n THR 94 N -1.48 0.27 0.14 0.02 -1.04 -1.26 -4.75 114.28 106.17 1gpy n THR 94 Ca 0.08 -0.55 -0.13 0.00 -2.04 0.00 0.00 64.05 61.41 1gpy n THR 94 Cb 0.53 -0.12 -0.08 0.00 -1.82 0.00 0.00 70.33 68.84 1gpy n THR 94 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1gpy h LEU 95 N 0.00 -0.30 -0.64 -4.42 5.85 -1.96 -2.54 115.31 111.30 1gpy h LEU 95 Ca -0.06 -0.19 -0.07 0.00 0.84 0.00 0.00 57.88 58.41 1gpy h LEU 95 Cb 1.14 0.08 -0.03 0.00 0.37 0.00 0.00 40.66 42.22 1gpy h LEU 95 CO 0.00 0.04 0.12 -0.61 -0.34 0.00 0.00 178.44 177.66 1gpy h GLN 96 N -0.67 1.04 -0.83 1.25 4.15 -1.97 -2.30 115.11 115.77 1gpy h GLN 96 Ca -0.04 -0.27 0.07 0.00 0.77 0.00 0.00 58.65 59.18 1gpy h GLN 96 Cb 0.47 -0.13 -0.06 0.00 0.21 0.00 0.00 27.48 27.97 1gpy h GLN 96 CO 0.06 0.96 0.51 -0.97 -1.93 0.00 0.00 178.83 177.45 1gpy h ASN 97 N 0.96 0.78 0.26 -0.69 -0.00 -1.85 -0.13 115.58 114.91 1gpy h ASN 97 Ca 0.20 0.02 -0.10 0.00 -0.00 0.00 0.00 56.30 56.42 1gpy h ASN 97 Cb 0.41 -0.14 -0.01 0.00 -0.00 0.00 0.00 38.32 38.58 1gpy h ASN 97 CO 0.01 0.49 -0.40 0.74 -0.00 0.00 0.00 177.43 178.27 1gpy h THR 98 N 0.91 1.31 0.05 -3.57 2.02 -0.97 -2.38 112.91 110.28 1gpy h THR 98 Ca 0.37 -1.49 -0.23 0.00 0.77 0.00 0.00 66.41 65.83 1gpy h THR 98 Cb 0.20 1.69 -0.01 0.00 -1.74 0.00 0.00 68.15 68.29 1gpy h THR 98 CO -0.18 0.44 -1.05 0.24 0.37 0.00 0.00 175.52 175.33 1gpy h MET 99 N 0.16 0.19 0.31 6.66 2.86 -0.76 -2.48 114.93 121.88 1gpy h MET 99 Ca 0.02 -0.27 0.00 0.00 -2.06 0.00 0.00 59.70 57.39 1gpy h MET 99 Cb 0.79 0.09 -0.03 0.00 0.06 0.00 0.00 31.60 32.51 1gpy h MET 99 CO 0.06 1.07 -0.39 0.28 1.06 0.00 0.00 176.91 179.00 1gpy h VAL 100 N 0.07 0.21 0.00 -2.22 2.07 -1.00 0.30 116.25 115.68 1gpy h VAL 100 Ca -0.07 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.43 1gpy h VAL 100 Cb 1.76 0.21 -0.00 0.00 -1.52 0.00 0.00 31.29 31.73 1gpy h VAL 100 CO 0.16 0.00 -0.08 0.78 0.02 0.00 0.00 177.57 178.45 1gpy h ASN 101 N -0.75 0.00 -0.29 0.57 4.21 -1.37 -1.45 115.58 116.50 1gpy h ASN 101 Ca -0.02 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.49 1gpy h ASN 101 Cb 0.70 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.90 1gpy h ASN 101 CO -0.11 0.08 0.00 0.18 -1.29 0.00 0.00 177.43 176.29 1gpy n LEU 102 N -3.35 3.08 -1.33 1.61 4.32 -0.94 -1.49 117.00 118.91 1gpy n LEU 102 Ca -0.01 -1.45 -0.13 0.00 -0.02 0.00 0.00 56.01 54.39 1gpy n LEU 102 Cb 0.26 -0.19 -0.03 0.00 -1.62 0.00 0.00 43.42 41.85 1gpy n LEU 102 CO 0.28 0.66 -0.15 0.00 -1.22 0.00 0.00 177.39 176.96 1gpy n ALA 103 N 1.18 -0.32 0.99 -1.18 0.00 -0.14 -4.92 120.51 116.12 1gpy n ALA 103 Ca 0.15 0.15 0.11 0.00 0.00 0.00 0.00 53.44 53.86 1gpy n ALA 103 Cb 0.52 -1.56 -0.04 0.00 0.00 0.00 0.00 19.45 18.37 1gpy n ALA 103 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1gpy n LEU 104 N -1.77 1.68 -0.05 0.00 4.32 0.87 -4.15 117.00 117.91 1gpy n LEU 104 Ca -0.15 -0.67 0.03 0.00 -0.02 0.00 0.00 56.01 55.20 1gpy n LEU 104 Cb 0.55 0.00 0.38 0.00 -1.62 0.00 0.00 43.42 42.72 1gpy n LEU 104 CO 0.19 0.33 1.17 -0.08 -1.22 0.00 0.00 177.39 177.78 1gpy h GLU 105 N 1.62 0.64 -0.13 3.23 4.81 -1.61 -0.26 114.58 122.87 1gpy h GLU 105 Ca 0.00 -0.04 -0.17 0.00 -0.13 0.00 0.00 59.36 59.01 1gpy h GLU 105 Cb 0.67 -0.14 0.01 0.00 0.63 0.00 0.00 28.75 29.91 1gpy h GLU 105 CO 0.00 0.43 -0.60 -0.91 -0.73 0.00 0.00 179.01 177.20 1gpy h ASN 106 N 0.65 0.75 -0.12 1.04 -0.26 -1.71 -2.32 115.58 113.61 1gpy h ASN 106 Ca 0.17 -0.63 -0.09 0.00 -0.56 0.00 0.00 56.30 55.19 1gpy h ASN 106 Cb -0.05 -0.22 0.00 0.00 -1.06 0.00 0.00 38.32 36.99 1gpy h ASN 106 CO -0.04 1.26 -0.29 0.00 -1.06 0.00 0.00 177.43 177.30 1gpy h ALA 107 N 0.51 0.20 -0.40 -0.83 0.00 -1.69 -1.51 119.26 115.54 1gpy h ALA 107 Ca -0.04 -0.41 0.10 0.00 0.00 0.00 0.00 54.91 54.56 1gpy h ALA 107 Cb 1.24 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 1gpy h ALA 107 CO 0.12 0.22 0.29 0.00 0.00 0.00 0.00 179.25 179.88 1gpy h ASP 109 N 0.07 0.86 -0.13 0.00 1.82 -1.33 -1.34 116.42 116.38 1gpy h ASP 109 Ca 0.19 -0.53 -0.06 0.00 -0.39 0.00 0.00 57.03 56.25 1gpy h ASP 109 Cb 0.67 -0.25 -0.00 0.00 0.68 0.00 0.00 39.33 40.42 1gpy h ASP 109 CO -0.01 1.31 -0.14 -0.08 -1.61 0.00 0.00 179.24 178.71 1gpy h GLU 110 N 0.53 0.33 -0.72 0.28 4.22 -0.81 -2.60 114.58 115.81 1gpy h GLU 110 Ca -0.02 -0.18 0.02 0.00 0.08 0.00 0.00 59.36 59.26 1gpy h GLU 110 Cb 1.29 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 30.51 1gpy h GLU 110 CO 0.14 0.73 0.46 0.00 -2.18 0.00 0.00 179.01 178.16 1gpy h ALA 111 N 0.59 0.93 -0.04 2.92 0.00 -1.11 -0.62 119.26 121.93 1gpy h ALA 111 Ca 0.02 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.74 1gpy h ALA 111 Cb 0.67 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 1gpy h ALA 111 CO 0.03 0.27 -0.68 1.79 0.00 0.00 0.00 179.25 180.67 1gpy h THR 112 N 0.91 1.43 0.20 0.00 1.35 -1.31 -2.59 112.91 112.91 1gpy h THR 112 Ca 0.28 -2.17 -0.01 0.00 -0.55 0.00 0.00 66.41 63.96 1gpy h THR 112 Cb -0.03 2.14 -0.01 0.00 -1.73 0.00 0.00 68.15 68.52 1gpy h THR 112 CO -0.09 0.64 -0.22 0.22 -0.25 0.00 0.00 175.52 175.82 1gpy h TYR 113 N 0.13 -0.61 -0.88 4.73 5.03 -1.14 0.78 116.97 125.01 1gpy h TYR 113 Ca -0.01 0.01 0.22 0.00 2.58 0.00 0.00 58.73 61.52 1gpy h TYR 113 Cb 1.21 0.24 -0.16 0.00 1.55 0.00 0.00 36.73 39.57 1gpy h TYR 113 CO 0.02 -0.29 0.01 1.96 -1.32 0.00 0.00 178.16 178.54 1gpy h GLN 114 N -0.42 0.07 0.00 1.82 4.20 -1.10 0.80 115.11 120.47 1gpy h GLN 114 Ca -0.03 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.68 1gpy h GLN 114 Cb 0.37 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.14 1gpy h GLN 114 CO -0.04 0.04 0.00 1.28 -0.67 0.00 0.00 178.83 179.45 1gpy n LEU 115 N -5.42 0.00 -0.07 1.46 4.77 -0.77 -4.86 117.00 112.12 1gpy n LEU 115 Ca 0.18 0.31 0.00 0.00 -0.03 0.00 0.00 56.01 56.47 1gpy n LEU 115 Cb 0.60 -0.31 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 1gpy n LEU 115 CO -0.01 -0.15 0.00 0.61 -1.33 0.00 0.00 177.39 176.52 1gpy n GLY 116 N 0.08 1.15 0.17 -0.72 0.00 0.28 -5.04 105.19 101.11 1gpy n GLY 116 Ca 0.07 -0.40 -0.05 0.00 0.00 0.00 0.00 46.02 45.64 1gpy n GLY 116 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1gpy n LEU 117 N -0.07 2.54 -2.01 0.99 4.77 0.02 -5.01 117.00 118.23 1gpy n LEU 117 Ca 0.00 -0.01 -0.02 0.00 -0.03 0.00 0.00 56.01 55.95 1gpy n LEU 117 Cb 0.24 -0.21 -0.02 0.00 -2.33 0.00 0.00 43.42 41.10 1gpy n LEU 117 CO 0.00 0.52 -0.29 -0.67 -1.33 0.00 0.00 177.39 175.62 1gpy n ASP 118 N -2.79 -1.95 0.01 -1.43 2.03 -1.26 -4.86 116.55 106.31 1gpy n ASP 118 Ca -0.11 0.63 -0.01 0.00 0.52 0.00 0.00 54.79 55.82 1gpy n ASP 118 Cb 0.61 -2.97 0.28 0.00 -0.72 0.00 0.00 41.12 38.32 1gpy n ASP 118 CO 0.00 0.00 0.00 -0.03 -1.92 0.00 0.00 177.20 175.25 1gpy h MET 119 N 1.77 0.50 0.00 -0.67 1.85 -1.91 -2.62 114.93 113.85 1gpy h MET 119 Ca -0.21 -0.13 -0.05 0.00 -0.61 0.00 0.00 59.70 58.70 1gpy h MET 119 Cb 0.47 -0.06 -0.01 0.00 0.43 0.00 0.00 31.60 32.43 1gpy h MET 119 CO 0.01 0.58 -0.25 0.93 -0.40 0.00 0.00 176.91 177.79 1gpy h GLU 120 N 0.47 0.00 -0.12 0.39 5.08 -1.99 -0.43 114.58 117.98 1gpy h GLU 120 Ca 0.09 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.33 1gpy h GLU 120 Cb 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.67 1gpy h GLU 120 CO 0.02 0.25 -0.42 0.93 -1.00 0.00 0.00 179.01 178.79 1gpy h GLU 121 N 0.00 0.49 -0.61 2.33 5.08 -1.80 -3.06 114.58 117.01 1gpy h GLU 121 Ca -0.00 -0.37 -0.01 0.00 -1.00 0.00 0.00 59.36 57.98 1gpy h GLU 121 Cb 0.46 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.75 1gpy h GLU 121 CO 0.03 1.00 0.35 -0.07 -1.00 0.00 0.00 179.01 179.31 1gpy h LEU 122 N 0.09 0.74 -0.54 1.33 4.07 -1.23 -2.79 115.31 116.97 1gpy h LEU 122 Ca -0.02 -0.05 0.00 0.00 0.08 0.00 0.00 57.88 57.90 1gpy h LEU 122 Cb 1.05 -0.19 -0.03 0.00 1.08 0.00 0.00 40.66 42.58 1gpy h LEU 122 CO 0.09 0.59 0.35 -0.33 -1.08 0.00 0.00 178.44 178.06 1gpy h GLU 123 N 0.84 0.72 0.00 1.13 5.08 -1.13 -1.72 114.58 119.50 1gpy h GLU 123 Ca 0.22 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1gpy h GLU 123 Cb 0.00 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.09 1gpy h GLU 123 CO -0.04 0.48 0.00 -1.91 -1.00 0.00 0.00 179.01 176.55 1gpy n GLU 124 N -4.70 0.10 0.17 2.33 4.07 -1.06 -1.56 120.64 119.99 1gpy n GLU 124 Ca 0.03 0.51 0.11 0.00 -0.06 0.00 0.00 57.16 57.76 1gpy n GLU 124 Cb 0.03 -1.77 0.10 0.00 -0.06 0.00 0.00 31.44 29.74 1gpy n GLU 124 CO 0.00 0.00 0.00 0.82 -0.06 0.00 0.00 177.13 177.89 1gpy h ILE 125 N 0.00 0.04 -3.61 6.31 5.03 -1.23 -3.45 117.51 120.59 1gpy h ILE 125 Ca 0.00 -1.06 -0.53 0.00 -0.12 0.00 0.00 64.86 63.16 1gpy h ILE 125 Cb 0.10 1.83 0.07 0.00 -3.03 0.00 0.00 36.82 35.79 1gpy h ILE 125 CO 0.00 0.02 0.73 -0.70 -0.68 0.00 0.00 178.15 177.52 1gpy s GLU 126 N -3.25 4.26 0.14 2.37 2.12 -0.60 -5.01 118.70 118.72 1gpy s GLU 126 Ca 0.04 2.33 -0.10 0.00 0.36 0.00 0.00 54.97 57.60 1gpy s GLU 126 Cb 0.07 -3.07 -0.06 0.00 0.26 0.00 0.00 34.13 31.32 1gpy s GLU 126 CO 0.72 -0.38 0.47 -2.00 -0.54 0.00 0.00 175.26 173.53 1gpy s GLU 127 N -1.05 3.81 0.32 4.30 2.12 -1.26 -4.99 118.70 121.94 1gpy s GLU 127 Ca 0.55 0.24 -0.28 0.00 0.36 0.00 0.00 54.97 55.84 1gpy s GLU 127 Cb -0.42 -2.89 -0.10 0.00 0.26 0.00 0.00 34.13 30.99 1gpy s GLU 127 CO 0.49 0.47 1.20 -0.51 -0.54 0.00 0.00 175.26 176.38 1gpy s ASP 128 N -1.97 6.94 -1.13 -1.70 1.11 -1.26 -4.60 116.67 114.06 1gpy s ASP 128 Ca 0.38 2.47 -0.18 0.00 0.18 0.00 0.00 52.55 55.40 1gpy s ASP 128 Cb -0.13 -2.64 0.11 0.00 1.07 0.00 0.00 42.92 41.33 1gpy s ASP 128 CO 0.20 -0.39 1.45 0.00 1.18 0.00 0.00 175.17 177.60 1gpy s ALA 129 N -1.19 3.39 -0.98 5.23 0.00 -0.95 -4.91 121.76 122.35 1gpy s ALA 129 Ca 0.48 -2.87 -0.04 0.00 0.00 0.00 0.00 51.96 49.54 1gpy s ALA 129 Cb -0.35 -4.33 0.17 0.00 0.00 0.00 0.00 23.12 18.60 1gpy s ALA 129 CO 0.46 -3.14 2.34 0.41 0.00 0.00 0.00 175.76 175.83 1gpy n GLY 130 N 5.38 5.21 1.73 0.00 0.00 -1.26 -2.34 105.19 113.90 1gpy n GLY 130 Ca 0.36 -2.16 -0.14 0.00 0.00 0.00 0.00 46.02 44.08 1gpy n GLY 130 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1gpy n LEU 131 N 0.90 5.50 -3.65 0.99 4.32 -1.22 -1.33 117.00 122.50 1gpy n LEU 131 Ca 0.55 -2.86 -0.10 0.00 -0.02 0.00 0.00 56.01 53.58 1gpy n LEU 131 Cb 0.33 -0.81 -0.04 0.00 -1.62 0.00 0.00 43.42 41.28 1gpy n LEU 131 CO 0.54 0.95 0.22 -0.83 -1.22 0.00 0.00 177.39 177.05 1gpy s GLY 132 N -0.09 -0.23 -0.16 -0.72 0.00 -1.26 -0.77 107.32 104.10 1gpy s GLY 132 Ca 0.30 -0.07 0.08 0.00 0.00 0.00 0.00 44.72 45.04 1gpy s GLY 132 CO 0.03 -0.25 0.20 0.70 0.00 0.00 0.00 173.10 173.79 1gpy n ASN 133 N -0.28 1.08 0.00 1.64 3.02 -1.26 -4.58 115.26 114.87 1gpy n ASN 133 Ca -0.14 0.11 0.00 0.00 -0.03 0.00 0.00 54.58 54.52 1gpy n ASN 133 Cb 0.63 0.05 0.00 0.00 -0.61 0.00 0.00 39.78 39.86 1gpy n ASN 133 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1gpy n GLY 134 N 1.87 -0.39 0.40 7.41 0.00 -1.26 -4.94 105.19 108.28 1gpy n GLY 134 Ca -0.32 0.59 -0.17 0.00 0.00 0.00 0.00 46.02 46.13 1gpy n GLY 134 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1gpy h GLY 135 N 0.00 -0.94 2.00 -0.02 0.00 -2.00 -1.44 103.07 100.67 1gpy h GLY 135 Ca 0.00 0.42 -0.05 0.00 0.00 0.00 0.00 47.33 47.70 1gpy h GLY 135 CO 0.00 -0.33 -0.26 0.17 0.00 0.00 0.00 176.54 176.12 1gpy h LEU 136 N -0.85 0.00 0.70 3.11 8.10 -1.99 -2.57 115.31 121.82 1gpy h LEU 136 Ca -0.05 0.00 -0.03 0.00 0.11 0.00 0.00 57.88 57.90 1gpy h LEU 136 Cb 0.72 0.00 0.01 0.00 -0.44 0.00 0.00 40.66 40.95 1gpy h LEU 136 CO 0.01 0.26 -0.34 1.23 -4.11 0.00 0.00 178.44 175.49 1gpy h GLY 137 N 2.48 -0.99 0.58 0.17 0.00 -1.76 -2.75 103.07 100.80 1gpy h GLY 137 Ca -0.00 0.37 0.09 0.00 0.00 0.00 0.00 47.33 47.79 1gpy h GLY 137 CO 0.03 -0.36 0.58 -0.09 0.00 0.00 0.00 176.54 176.70 1gpy h ARG 138 N -1.17 0.95 -0.37 4.80 1.12 -1.26 -2.56 114.38 115.90 1gpy h ARG 138 Ca -0.10 -0.06 -0.03 0.00 -1.11 0.00 0.00 59.98 58.68 1gpy h ARG 138 Cb 0.75 -0.21 -0.02 0.00 -0.01 0.00 0.00 29.97 30.48 1gpy h ARG 138 CO 0.16 0.63 0.09 1.25 -3.11 0.00 0.00 179.97 178.99 1gpy h LEU 139 N 0.98 0.49 -0.40 3.80 5.85 -1.39 -0.65 115.31 123.99 1gpy h LEU 139 Ca 0.44 -0.07 -0.13 0.00 0.84 0.00 0.00 57.88 58.96 1gpy h LEU 139 Cb 0.34 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 1gpy h LEU 139 CO -0.23 0.50 -0.27 0.00 -0.34 0.00 0.00 178.44 178.10 1gpy h ALA 140 N 1.57 0.57 -0.32 1.25 0.00 -1.21 -1.25 119.26 119.87 1gpy h ALA 140 Ca 0.13 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 1gpy h ALA 140 Cb 0.20 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1gpy h ALA 140 CO -0.00 0.59 0.16 0.00 0.00 0.00 0.00 179.25 179.99 1gpy h ALA 141 N 0.80 0.42 -0.72 0.00 0.00 -1.08 -2.22 119.26 116.45 1gpy h ALA 141 Ca 0.08 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 1gpy h ALA 141 Cb 0.85 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 1gpy h ALA 141 CO 0.07 -0.02 0.33 0.00 0.00 0.00 0.00 179.25 179.63 1gpy h PHE 143 N 1.03 0.86 -0.40 0.00 -1.00 -1.04 -2.21 116.94 114.19 1gpy h PHE 143 Ca 0.25 -0.05 0.00 0.00 2.81 0.00 0.00 57.97 60.98 1gpy h PHE 143 Cb 0.13 -0.27 -0.02 0.00 3.61 0.00 0.00 35.95 39.40 1gpy h PHE 143 CO 0.01 0.67 0.25 -0.07 -1.61 0.00 0.00 178.31 177.56 1gpy h LEU 144 N 0.81 0.46 -0.11 1.54 4.07 -1.27 0.45 115.31 121.26 1gpy h LEU 144 Ca 0.20 -0.03 0.04 0.00 0.08 0.00 0.00 57.88 58.18 1gpy h LEU 144 Cb 0.13 -0.12 -0.05 0.00 1.08 0.00 0.00 40.66 41.71 1gpy h LEU 144 CO -0.02 0.35 -0.19 -0.78 -1.08 0.00 0.00 178.44 176.71 1gpy h ASP 145 N 0.53 -0.58 0.60 -0.43 1.82 -1.42 -2.31 116.42 114.62 1gpy h ASP 145 Ca 0.14 0.10 -0.06 0.00 -0.39 0.00 0.00 57.03 56.82 1gpy h ASP 145 Cb -0.04 0.26 -0.01 0.00 0.68 0.00 0.00 39.33 40.22 1gpy h ASP 145 CO -0.03 -0.24 -0.28 0.28 -1.61 0.00 0.00 179.24 177.35 1gpy h SER 146 N -0.25 0.00 0.26 2.28 0.02 -0.73 -1.77 113.55 113.37 1gpy h SER 146 Ca 0.09 0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 60.86 1gpy h SER 146 Cb 0.38 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.92 1gpy h SER 146 CO -0.25 0.28 -0.73 0.24 -1.14 0.00 0.00 176.83 175.23 1gpy h MET 147 N 0.00 0.40 -0.09 3.45 2.86 0.05 -1.87 114.93 119.74 1gpy h MET 147 Ca -0.00 -0.33 -0.13 0.00 -2.06 0.00 0.00 59.70 57.17 1gpy h MET 147 Cb 0.66 0.07 0.01 0.00 0.06 0.00 0.00 31.60 32.40 1gpy h MET 147 CO 0.04 0.97 -0.46 0.00 1.06 0.00 0.00 176.91 178.52 1gpy h ALA 148 N 0.93 0.17 -0.71 6.32 0.00 -0.84 -1.77 119.26 123.37 1gpy h ALA 148 Ca -0.03 -0.49 0.11 0.00 0.00 0.00 0.00 54.91 54.49 1gpy h ALA 148 Cb 1.31 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 19.02 1gpy h ALA 148 CO 0.13 0.33 0.33 1.15 0.00 0.00 0.00 179.25 181.18 1gpy h THR 149 N 0.03 0.79 -0.21 0.00 2.02 -1.37 -1.84 112.91 112.32 1gpy h THR 149 Ca -0.03 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 66.96 1gpy h THR 149 Cb 1.11 0.20 0.00 0.00 -1.74 0.00 0.00 68.15 67.73 1gpy h THR 149 CO 0.10 0.10 0.00 0.18 0.37 0.00 0.00 175.52 176.26 1gpy n LEU 150 N -4.91 1.69 -3.71 2.58 4.77 -0.70 -4.64 117.00 112.08 1gpy n LEU 150 Ca 0.12 -0.85 -0.24 0.00 -0.03 0.00 0.00 56.01 55.00 1gpy n LEU 150 Cb 0.31 -0.30 0.05 0.00 -2.33 0.00 0.00 43.42 41.15 1gpy n LEU 150 CO 0.23 0.33 0.09 0.61 -1.33 0.00 0.00 177.39 177.32 1gpy n GLY 151 N 0.63 -0.43 3.88 -0.72 0.00 -0.69 -0.98 105.19 106.88 1gpy n GLY 151 Ca 0.08 0.18 -0.33 0.00 0.00 0.00 0.00 46.02 45.94 1gpy n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1gpy s LEU 152 N -6.98 4.32 -1.31 0.99 1.02 -0.70 -4.62 118.68 111.41 1gpy s LEU 152 Ca 0.36 0.63 -0.09 0.00 0.02 0.00 0.00 54.13 55.06 1gpy s LEU 152 Cb -0.17 -3.02 0.14 0.00 0.02 0.00 0.00 46.19 43.16 1gpy s LEU 152 CO 0.79 0.15 2.06 0.00 0.02 0.00 0.00 176.35 179.36 1gpy n ALA 153 N 0.64 5.81 -2.79 4.21 0.00 -1.26 -4.69 120.51 122.43 1gpy n ALA 153 Ca -0.07 -4.21 -0.28 0.00 0.00 0.00 0.00 53.44 48.88 1gpy n ALA 153 Cb 0.52 -2.97 -0.06 0.00 0.00 0.00 0.00 19.45 16.94 1gpy n ALA 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1gpy s ALA 154 N 0.20 3.57 -0.03 0.00 0.00 -1.26 -1.94 121.76 122.29 1gpy s ALA 154 Ca 0.44 -1.11 0.01 0.00 0.00 0.00 0.00 51.96 51.30 1gpy s ALA 154 Cb 0.12 -1.40 0.01 0.00 0.00 0.00 0.00 23.12 21.86 1gpy s ALA 154 CO -0.03 0.62 -0.05 0.71 0.00 0.00 0.00 175.76 177.02 1gpy s TYR 155 N -1.57 0.71 -0.17 0.00 1.51 -0.06 -4.13 117.35 113.63 1gpy s TYR 155 Ca 0.30 -0.18 -0.09 0.00 -1.01 0.00 0.00 57.07 56.09 1gpy s TYR 155 Cb -0.11 -0.59 -0.05 0.00 -0.11 0.00 0.00 41.96 41.10 1gpy s TYR 155 CO 0.23 -0.14 0.14 0.20 -1.11 0.00 0.00 175.55 174.87 1gpy s GLY 156 N 0.62 2.09 -0.02 0.71 0.00 -0.99 -0.76 107.32 108.95 1gpy s GLY 156 Ca -0.08 -0.66 0.03 0.00 0.00 0.00 0.00 44.72 44.01 1gpy s GLY 156 CO 0.00 0.01 -0.11 -0.19 0.00 0.00 0.00 173.10 172.82 1gpy s TYR 157 N -0.03 1.06 0.00 1.90 1.51 -0.19 -1.67 117.35 119.94 1gpy s TYR 157 Ca 0.10 -0.26 0.00 0.00 -1.01 0.00 0.00 57.07 55.91 1gpy s TYR 157 Cb -0.11 -0.73 0.00 0.00 -0.11 0.00 0.00 41.96 41.00 1gpy s TYR 157 CO 0.00 -0.09 0.00 0.41 -1.11 0.00 0.00 175.55 174.76 1gpy n GLY 158 N 3.15 3.28 3.46 0.71 0.00 -1.09 -2.16 105.19 112.53 1gpy n GLY 158 Ca -0.17 -0.63 -0.33 0.00 0.00 0.00 0.00 46.02 44.89 1gpy n GLY 158 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gpy s ILE 159 N -1.90 3.37 -0.74 -0.61 1.01 -1.26 -2.38 121.20 118.69 1gpy s ILE 159 Ca 0.00 -0.57 -0.23 0.00 0.00 0.00 0.00 60.65 59.85 1gpy s ILE 159 Cb 0.00 -2.40 0.07 0.00 0.01 0.00 0.00 42.46 40.14 1gpy s ILE 159 CO 0.00 0.55 1.08 -0.60 0.00 0.00 0.00 174.94 175.97 1gpy s ARG 160 N -0.10 3.24 0.27 2.79 3.52 -0.14 -4.76 118.95 123.77 1gpy s ARG 160 Ca -0.00 -0.91 -0.20 0.00 -0.13 0.00 0.00 55.73 54.49 1gpy s ARG 160 Cb -0.14 -4.42 -0.09 0.00 -1.56 0.00 0.00 34.95 28.75 1gpy s ARG 160 CO 0.03 -1.90 0.78 0.71 -0.81 0.00 0.00 175.30 174.11 1gpy s TYR 161 N 4.20 3.59 0.17 5.12 2.02 -1.26 -4.75 117.35 126.44 1gpy s TYR 161 Ca 0.28 1.44 0.02 0.00 -0.37 0.00 0.00 57.07 58.44 1gpy s TYR 161 Cb -0.12 -2.67 0.01 0.00 -0.40 0.00 0.00 41.96 38.77 1gpy s TYR 161 CO 0.06 0.25 1.39 0.93 -1.57 0.00 0.00 175.55 176.61 1gpy h GLU 162 N 3.10 0.23 -4.88 -0.62 5.08 -1.10 -3.42 114.58 112.96 1gpy h GLU 162 Ca -0.48 -0.24 -0.66 0.00 -1.00 0.00 0.00 59.36 56.98 1gpy h GLU 162 Cb 1.19 0.07 -0.36 0.00 0.50 0.00 0.00 28.75 30.14 1gpy h GLU 162 CO 0.65 0.95 -0.82 -0.06 -1.00 0.00 0.00 179.01 178.74 1gpy s PHE 163 N -3.27 3.01 0.00 4.33 0.08 -0.28 -3.55 117.98 118.30 1gpy s PHE 163 Ca -0.03 -2.03 0.00 0.00 0.12 0.00 0.00 56.93 54.98 1gpy s PHE 163 Cb 0.10 -1.89 0.00 0.00 -0.57 0.00 0.00 43.02 40.67 1gpy s PHE 163 CO 0.83 -0.84 0.00 0.41 -0.10 0.00 0.00 175.22 175.52 1gpy n GLY 164 N 4.52 0.13 3.77 4.36 0.00 -1.21 -1.53 105.19 115.23 1gpy n GLY 164 Ca -0.16 -1.57 -0.40 0.00 0.00 0.00 0.00 46.02 43.89 1gpy n GLY 164 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1gpy s ILE 165 N 0.06 2.71 1.16 -0.61 -1.16 -0.44 -4.46 121.20 118.45 1gpy s ILE 165 Ca 0.00 0.66 -0.17 0.00 -0.51 0.00 0.00 60.65 60.64 1gpy s ILE 165 Cb 0.00 -3.40 0.19 0.00 0.61 0.00 0.00 42.46 39.85 1gpy s ILE 165 CO 0.00 0.12 0.39 2.22 -2.81 0.00 0.00 174.94 174.86 1gpy n PHE 166 N 0.40 -1.43 -4.29 3.50 1.16 -1.26 -4.41 117.46 111.13 1gpy n PHE 166 Ca 0.02 0.00 -0.35 0.00 -1.87 0.00 0.00 57.45 55.25 1gpy n PHE 166 Cb 0.43 -1.60 -0.10 0.00 -1.61 0.00 0.00 39.48 36.60 1gpy n PHE 166 CO 0.00 0.00 0.00 -0.80 -1.87 0.00 0.00 176.76 174.09 1gpy s ASN 167 N -2.05 5.32 -0.15 5.98 0.01 -0.32 -4.86 114.94 118.88 1gpy s ASN 167 Ca 0.61 0.13 -0.03 0.00 -0.71 0.00 0.00 52.86 52.86 1gpy s ASN 167 Cb -0.17 -1.63 -0.02 0.00 0.41 0.00 0.00 41.25 39.84 1gpy s ASN 167 CO 0.66 0.33 -0.07 -1.58 -1.51 0.00 0.00 177.10 174.93 1gpy s GLN 168 N -0.56 3.57 -0.06 -0.60 0.74 -1.26 -0.93 119.66 120.55 1gpy s GLN 168 Ca 0.10 -0.58 0.04 0.00 0.05 0.00 0.00 55.36 54.97 1gpy s GLN 168 Cb -0.12 -2.83 -0.02 0.00 1.10 0.00 0.00 33.01 31.14 1gpy s GLN 168 CO 0.02 0.21 -0.17 0.21 -0.55 0.00 0.00 175.29 175.01 1gpy s LYS 169 N 0.42 2.63 -0.14 1.67 2.47 0.85 -3.71 119.74 123.93 1gpy s LYS 169 Ca -0.06 -0.75 -0.04 0.00 -1.56 0.00 0.00 55.97 53.56 1gpy s LYS 169 Cb -0.15 -2.36 -0.03 0.00 -1.46 0.00 0.00 37.83 33.83 1gpy s LYS 169 CO 0.04 0.51 0.01 0.42 0.16 0.00 0.00 175.35 176.49 1gpy s ILE 170 N -0.44 4.39 -0.15 5.43 1.09 -1.26 0.86 121.20 131.13 1gpy s ILE 170 Ca 0.05 -0.19 -0.03 0.00 -1.10 0.00 0.00 60.65 59.38 1gpy s ILE 170 Cb -0.12 -2.91 0.05 0.00 -1.06 0.00 0.00 42.46 38.42 1gpy s ILE 170 CO 0.02 0.53 0.04 0.00 -0.10 0.00 0.00 174.94 175.43 1gpy n GLY 172 N 5.15 1.07 1.25 0.00 0.00 -1.26 -1.98 105.19 109.41 1gpy n GLY 172 Ca -0.08 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.52 1gpy n GLY 172 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gpy n GLY 173 N -1.49 1.18 3.91 -0.02 0.00 -1.26 -5.06 105.19 102.45 1gpy n GLY 173 Ca -0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.61 1gpy n GLY 173 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1gpy s TRP 174 N -2.46 3.50 0.34 1.61 0.52 -0.84 -4.07 118.94 117.54 1gpy s TRP 174 Ca 0.00 0.41 -0.29 0.00 0.02 0.00 0.00 56.10 56.24 1gpy s TRP 174 Cb 0.00 -1.89 -0.10 0.00 -1.15 0.00 0.00 33.47 30.33 1gpy s TRP 174 CO 0.00 0.52 1.35 -1.14 0.02 0.00 0.00 176.95 177.70 1gpy s GLN 175 N -2.53 4.29 -0.14 4.98 0.74 -1.26 -0.27 119.66 125.48 1gpy s GLN 175 Ca 0.37 2.31 0.02 0.00 0.05 0.00 0.00 55.36 58.11 1gpy s GLN 175 Cb -0.13 -3.04 0.02 0.00 1.10 0.00 0.00 33.01 30.96 1gpy s GLN 175 CO 0.26 -0.28 -0.18 -1.64 -0.55 0.00 0.00 175.29 172.90 1gpy s MET 176 N -1.87 2.61 -0.08 1.67 -1.94 0.25 -4.89 119.30 115.06 1gpy s MET 176 Ca 0.50 -0.70 -0.09 0.00 -1.71 0.00 0.00 55.69 53.69 1gpy s MET 176 Cb -0.41 -2.21 -0.05 0.00 2.01 0.00 0.00 34.83 34.17 1gpy s MET 176 CO 0.56 -0.10 0.23 -1.83 -0.01 0.00 0.00 175.02 173.87 1gpy s GLU 177 N 1.06 3.60 -0.02 2.03 1.03 -1.26 -0.11 118.70 125.02 1gpy s GLU 177 Ca -0.03 0.04 0.03 0.00 0.03 0.00 0.00 54.97 55.04 1gpy s GLU 177 Cb -0.14 -3.20 -0.00 0.00 -0.80 0.00 0.00 34.13 29.99 1gpy s GLU 177 CO -0.05 0.75 -0.10 -1.21 -1.33 0.00 0.00 175.26 173.32 1gpy s GLU 178 N -1.07 1.02 -0.45 -4.83 2.02 -0.11 -4.93 118.70 110.36 1gpy s GLU 178 Ca 0.18 -0.36 -0.42 0.00 0.02 0.00 0.00 54.97 54.39 1gpy s GLU 178 Cb -0.14 -0.95 -0.18 0.00 0.10 0.00 0.00 34.13 32.96 1gpy s GLU 178 CO 0.07 0.16 1.46 0.00 0.02 0.00 0.00 175.26 176.97 1gpy n ALA 179 N 3.15 -1.14 -2.64 5.21 0.00 -1.26 -1.17 120.51 122.66 1gpy n ALA 179 Ca -0.17 0.43 -0.42 0.00 0.00 0.00 0.00 53.44 53.29 1gpy n ALA 179 Cb 0.55 -1.73 -0.03 0.00 0.00 0.00 0.00 19.45 18.24 1gpy n ALA 179 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1gpy s ASP 180 N 2.84 6.39 -1.40 0.00 2.15 -1.26 -4.72 116.67 120.66 1gpy s ASP 180 Ca 0.95 -1.20 -0.11 0.00 0.43 0.00 0.00 52.55 52.62 1gpy s ASP 180 Cb -1.34 -2.53 0.08 0.00 -0.30 0.00 0.00 42.92 38.83 1gpy s ASP 180 CO 0.73 -1.53 2.23 -0.67 -0.17 0.00 0.00 175.17 175.75 1gpy n ASP 181 N 8.57 5.56 0.14 -0.34 -0.08 -1.26 -3.32 116.55 125.81 1gpy n ASP 181 Ca 0.19 -2.94 0.08 0.00 -1.51 0.00 0.00 54.79 50.62 1gpy n ASP 181 Cb 0.50 -1.54 0.05 0.00 2.34 0.00 0.00 41.12 42.47 1gpy n ASP 181 CO 0.00 0.00 0.00 4.11 0.12 0.00 0.00 177.20 181.43 1gpy h TRP 182 N 5.58 0.00 -0.40 -0.67 5.08 -1.90 -3.08 115.95 120.56 1gpy h TRP 182 Ca 0.57 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.54 1gpy h TRP 182 Cb 0.54 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.70 1gpy h TRP 182 CO 1.47 0.17 0.00 1.28 -1.28 0.00 0.00 178.44 180.08 1gpy n LEU 183 N -2.95 2.82 -0.34 0.11 4.77 -1.26 -4.61 117.00 115.54 1gpy n LEU 183 Ca 0.00 -1.42 0.21 0.00 -0.03 0.00 0.00 56.01 54.77 1gpy n LEU 183 Cb 0.62 -0.40 0.44 0.00 -2.33 0.00 0.00 43.42 41.74 1gpy n LEU 183 CO 0.38 0.54 1.14 -0.09 -1.33 0.00 0.00 177.39 178.03 1gpy h ARG 184 N 2.47 0.42 -0.14 3.23 2.43 -1.90 -2.56 114.38 118.34 1gpy h ARG 184 Ca 0.00 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1gpy h ARG 184 Cb 0.85 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.31 1gpy h ARG 184 CO 0.10 0.28 0.00 0.66 -1.51 0.00 0.00 179.97 179.50 1gpy n TYR 185 N -4.98 0.17 0.00 2.20 4.01 -1.26 -5.10 117.16 112.21 1gpy n TYR 185 Ca 0.30 -0.24 0.00 0.00 -0.16 0.00 0.00 57.90 57.80 1gpy n TYR 185 Cb 0.88 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.89 1gpy n TYR 185 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1gpy n GLY 186 N 0.40 2.39 2.85 2.72 0.00 -0.96 -5.03 105.19 107.55 1gpy n GLY 186 Ca 0.07 -2.00 -0.29 0.00 0.00 0.00 0.00 46.02 43.79 1gpy n GLY 186 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1gpy s ASN 187 N 0.00 3.62 0.05 1.61 3.04 -1.26 -4.77 114.94 117.23 1gpy s ASN 187 Ca 0.00 -1.17 0.18 0.00 0.04 0.00 0.00 52.86 51.91 1gpy s ASN 187 Cb 0.00 -0.97 0.76 0.00 -1.54 0.00 0.00 41.25 39.51 1gpy s ASN 187 CO 0.00 -0.29 1.57 -0.81 -3.04 0.00 0.00 177.10 174.53 1gpy n PRO 188 N 4.80 0.04 0.07 0.43 -0.04 -1.26 -3.44 135.00 135.60 1gpy n PRO 188 Ca -0.09 0.25 0.10 0.00 -0.04 0.00 0.00 63.50 63.72 1gpy n PRO 188 Cb 0.45 -1.57 -0.05 0.00 -0.04 0.00 0.00 33.50 32.29 1gpy n PRO 188 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 1gpy n TRP 189 N -1.65 0.75 -2.65 0.54 7.02 -1.26 -4.89 117.44 115.30 1gpy n TRP 189 Ca 0.04 0.22 -0.25 0.00 -1.02 0.00 0.00 57.50 56.49 1gpy n TRP 189 Cb 0.21 -0.87 0.03 0.00 -2.42 0.00 0.00 31.31 28.25 1gpy n TRP 189 CO 0.00 0.00 0.00 -1.83 -2.02 0.00 0.00 177.69 173.84 1gpy s GLU 190 N -3.35 2.92 -0.28 -0.99 -1.05 -1.22 -4.34 118.70 110.38 1gpy s GLU 190 Ca -0.03 -0.28 -0.02 0.00 -0.15 0.00 0.00 54.97 54.50 1gpy s GLU 190 Cb 0.10 -2.40 0.09 0.00 -0.44 0.00 0.00 34.13 31.48 1gpy s GLU 190 CO 0.82 -0.55 0.08 0.21 0.95 0.00 0.00 175.26 176.77 1gpy s LYS 191 N -4.80 0.69 0.44 -4.83 2.36 0.16 -4.96 119.74 108.80 1gpy s LYS 191 Ca 0.52 -0.85 -0.25 0.00 -2.55 0.00 0.00 55.97 52.84 1gpy s LYS 191 Cb -0.10 -1.97 -0.08 0.00 -1.05 0.00 0.00 37.83 34.63 1gpy s LYS 191 CO 0.42 -0.88 1.33 0.00 1.55 0.00 0.00 175.35 177.76 1gpy s ALA 192 N 1.71 3.17 -0.56 3.13 0.00 -1.26 -1.61 121.76 126.34 1gpy s ALA 192 Ca 0.06 1.27 0.04 0.00 0.00 0.00 0.00 51.96 53.33 1gpy s ALA 192 Cb -0.17 -3.51 0.16 0.00 0.00 0.00 0.00 23.12 19.60 1gpy s ALA 192 CO -0.21 -0.97 0.39 1.03 0.00 0.00 0.00 175.76 176.00 1gpy s ARG 193 N -2.43 1.74 0.44 0.00 1.81 -0.39 -4.91 118.95 115.21 1gpy s ARG 193 Ca 0.61 -2.68 0.23 0.00 -1.72 0.00 0.00 55.73 52.16 1gpy s ARG 193 Cb -0.39 -2.59 0.99 0.00 -0.45 0.00 0.00 34.95 32.52 1gpy s ARG 193 CO 0.49 -1.29 1.87 -1.35 -0.68 0.00 0.00 175.30 174.34 1gpy h PRO 194 N 5.76 0.00 0.00 3.54 0.11 -1.95 -2.39 132.00 137.07 1gpy h PRO 194 Ca 0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 1gpy h PRO 194 Cb 0.84 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.95 1gpy h PRO 194 CO 0.56 0.25 0.00 -0.85 -0.21 0.00 0.00 178.00 177.75 1gpy n GLU 195 N -3.55 0.09 -0.26 1.05 0.00 -1.26 -1.50 120.64 115.20 1gpy n GLU 195 Ca -0.01 0.49 0.08 0.00 0.00 0.00 0.00 57.16 57.72 1gpy n GLU 195 Cb 0.39 -1.74 0.22 0.00 0.00 0.00 0.00 31.44 30.32 1gpy n GLU 195 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 1gpy n PHE 196 N -1.92 0.68 -1.69 -1.84 3.72 -0.90 -4.99 117.46 110.51 1gpy n PHE 196 Ca 0.01 -0.51 -0.44 0.00 -0.05 0.00 0.00 57.45 56.46 1gpy n PHE 196 Cb 0.09 -0.03 -0.03 0.00 -0.94 0.00 0.00 39.48 38.58 1gpy n PHE 196 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 1gpy n THR 197 N 0.93 0.55 -4.20 4.37 -1.04 -0.56 -4.78 114.28 109.54 1gpy n THR 197 Ca 0.17 -0.14 -0.15 0.00 -2.04 0.00 0.00 64.05 61.89 1gpy n THR 197 Cb 0.51 -1.68 -0.11 0.00 -1.82 0.00 0.00 70.33 67.23 1gpy n THR 197 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1gpy s LEU 198 N 0.36 2.42 -0.01 -4.42 1.02 -1.02 -4.94 118.68 112.10 1gpy s LEU 198 Ca 0.71 -0.84 -0.11 0.00 0.02 0.00 0.00 54.13 53.91 1gpy s LEU 198 Cb -0.60 -0.36 -0.05 0.00 0.02 0.00 0.00 46.19 45.20 1gpy s LEU 198 CO 0.43 -0.25 0.33 -2.16 0.02 0.00 0.00 176.35 174.73 1gpy s PRO 199 N -2.90 3.74 -0.10 1.29 0.04 -1.26 -0.59 135.00 135.22 1gpy s PRO 199 Ca 0.08 0.19 0.03 0.00 0.04 0.00 0.00 61.00 61.34 1gpy s PRO 199 Cb -0.02 -3.15 0.01 0.00 0.04 0.00 0.00 34.50 31.37 1gpy s PRO 199 CO 0.01 0.68 -0.20 0.08 0.04 0.00 0.00 177.00 177.61 1gpy s VAL 200 N -1.16 1.81 -0.06 -0.36 1.01 0.56 -4.86 120.40 117.35 1gpy s VAL 200 Ca 0.24 -0.86 -0.09 0.00 0.00 0.00 0.00 61.98 61.27 1gpy s VAL 200 Cb -0.15 -1.59 -0.05 0.00 0.00 0.00 0.00 36.38 34.60 1gpy s VAL 200 CO 0.13 0.50 0.24 -1.00 0.00 0.00 0.00 175.10 174.97 1gpy s HIS 201 N 0.57 3.63 0.03 5.22 3.76 -1.26 -0.44 115.29 126.80 1gpy s HIS 201 Ca -0.14 0.67 0.02 0.00 -0.15 0.00 0.00 55.06 55.46 1gpy s HIS 201 Cb -0.17 -2.05 -0.02 0.00 1.11 0.00 0.00 32.58 31.45 1gpy s HIS 201 CO 0.05 0.69 -0.07 -0.06 -0.85 0.00 0.00 174.74 174.49 1gpy s PHE 202 N -1.10 0.61 0.00 1.40 0.08 0.20 -4.92 117.98 114.24 1gpy s PHE 202 Ca 0.20 -0.43 0.00 0.00 0.12 0.00 0.00 56.93 56.82 1gpy s PHE 202 Cb -0.14 -0.37 0.00 0.00 -0.57 0.00 0.00 43.02 41.94 1gpy s PHE 202 CO 0.09 -0.08 0.00 0.66 -0.10 0.00 0.00 175.22 175.80 1gpy n TYR 203 N 1.71 0.00 -4.41 0.36 4.01 0.52 0.01 117.16 119.36 1gpy n TYR 203 Ca -0.21 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.53 1gpy n TYR 203 Cb 0.55 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.58 1gpy n TYR 203 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1gpy n GLY 204 N 0.00 -0.55 3.64 2.72 0.00 -1.20 -4.48 105.19 105.33 1gpy n GLY 204 Ca 0.00 -1.12 -0.09 0.00 0.00 0.00 0.00 46.02 44.81 1gpy n GLY 204 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1gpy s ARG 205 N 0.00 1.54 -0.15 1.61 1.70 0.55 -4.82 118.95 119.37 1gpy s ARG 205 Ca 0.00 -0.88 -0.03 0.00 -0.47 0.00 0.00 55.73 54.36 1gpy s ARG 205 Cb 0.00 0.56 -0.02 0.00 -0.57 0.00 0.00 34.95 34.92 1gpy s ARG 205 CO 0.00 -0.68 -0.07 0.08 -1.08 0.00 0.00 175.30 173.56 1gpy s VAL 206 N -3.88 3.60 -0.05 4.99 1.01 -1.26 -0.05 120.40 124.76 1gpy s VAL 206 Ca 0.10 -0.46 0.06 0.00 0.00 0.00 0.00 61.98 61.67 1gpy s VAL 206 Cb -0.03 -2.56 -0.01 0.00 0.00 0.00 0.00 36.38 33.78 1gpy s VAL 206 CO 0.00 0.50 -0.24 -1.83 0.00 0.00 0.00 175.10 173.53 1gpy s GLU 207 N 0.40 2.36 -0.71 2.72 -1.05 -0.72 -4.94 118.70 116.76 1gpy s GLU 207 Ca -0.06 -0.87 -0.17 0.00 -0.15 0.00 0.00 54.97 53.73 1gpy s GLU 207 Cb -0.15 -2.05 0.15 0.00 -0.44 0.00 0.00 34.13 31.65 1gpy s GLU 207 CO 0.04 0.39 0.75 -1.01 0.95 0.00 0.00 175.26 176.38 1gpy s HIS 208 N -0.21 3.33 -0.91 4.83 3.76 -1.26 -0.17 115.29 124.66 1gpy s HIS 208 Ca -0.01 -1.45 -0.01 0.00 -0.15 0.00 0.00 55.06 53.44 1gpy s HIS 208 Cb -0.13 -3.95 0.27 0.00 1.11 0.00 0.00 32.58 29.89 1gpy s HIS 208 CO 0.03 -1.17 1.10 0.25 -0.85 0.00 0.00 174.74 174.10 1gpy n THR 209 N 4.94 3.94 0.00 1.30 -2.24 0.80 -4.98 114.28 118.04 1gpy n THR 209 Ca 0.03 -5.53 0.00 0.00 -2.27 0.00 0.00 64.05 56.28 1gpy n THR 209 Cb 0.44 -2.17 0.00 0.00 -2.10 0.00 0.00 70.33 66.50 1gpy n THR 209 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1gpy n SER 210 N 1.44 0.00 -0.73 3.42 7.64 -1.26 -0.82 113.62 123.31 1gpy n SER 210 Ca 0.26 0.00 0.03 0.00 1.01 0.00 0.00 58.87 60.18 1gpy n SER 210 Cb 0.37 0.00 0.20 0.00 -1.01 0.00 0.00 64.21 63.76 1gpy n SER 210 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 1gpy n GLN 211 N 0.00 1.76 0.00 1.43 7.27 -1.26 -5.03 117.38 121.55 1gpy n GLN 211 Ca 0.00 -3.09 0.00 0.00 0.07 0.00 0.00 57.00 53.98 1gpy n GLN 211 Cb 0.00 -1.69 0.00 0.00 2.41 0.00 0.00 30.24 30.96 1gpy n GLN 211 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1gpy n GLY 212 N -1.12 2.52 3.79 1.69 0.00 -0.00 -5.04 105.19 107.03 1gpy n GLY 212 Ca 0.24 -0.55 -0.38 0.00 0.00 0.00 0.00 46.02 45.32 1gpy n GLY 212 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gpy s ALA 213 N -2.00 3.42 -0.02 4.61 0.00 -1.26 -0.14 121.76 126.36 1gpy s ALA 213 Ca 0.00 0.32 0.07 0.00 0.00 0.00 0.00 51.96 52.34 1gpy s ALA 213 Cb 0.00 -2.94 -0.02 0.00 0.00 0.00 0.00 23.12 20.17 1gpy s ALA 213 CO 0.00 0.29 -0.22 0.21 0.00 0.00 0.00 175.76 176.05 1gpy s LYS 214 N -1.48 1.77 -0.23 0.00 2.47 0.76 -4.90 119.74 118.13 1gpy s LYS 214 Ca 0.39 -0.77 -0.07 0.00 -1.56 0.00 0.00 55.97 53.96 1gpy s LYS 214 Cb -0.21 -1.70 -0.03 0.00 -1.46 0.00 0.00 37.83 34.44 1gpy s LYS 214 CO 0.24 0.46 0.05 -0.46 0.16 0.00 0.00 175.35 175.80 1gpy s TRP 215 N -0.48 3.09 0.12 4.03 -0.00 -1.26 -1.75 118.94 122.68 1gpy s TRP 215 Ca 0.08 -0.38 0.03 0.00 -0.00 0.00 0.00 56.10 55.82 1gpy s TRP 215 Cb -0.08 -2.18 -0.04 0.00 -0.00 0.00 0.00 33.47 31.16 1gpy s TRP 215 CO -0.01 -0.28 -0.08 0.54 -0.00 0.00 0.00 176.95 177.13 1gpy s VAL 216 N 1.33 0.89 -1.26 5.86 0.11 0.93 -4.85 120.40 123.41 1gpy s VAL 216 Ca 0.05 -1.98 -0.30 0.00 -2.93 0.00 0.00 61.98 56.82 1gpy s VAL 216 Cb -0.15 -1.74 0.04 0.00 -1.53 0.00 0.00 36.38 33.00 1gpy s VAL 216 CO 0.03 -0.82 0.60 0.47 -3.33 0.00 0.00 175.10 172.06 1gpy n ASP 217 N -0.09 -3.53 -4.95 3.54 8.00 -1.26 -0.33 116.55 117.92 1gpy n ASP 217 Ca -0.11 -1.29 -0.24 0.00 0.71 0.00 0.00 54.79 53.86 1gpy n ASP 217 Cb 0.61 -1.75 -0.02 0.00 -0.02 0.00 0.00 41.12 39.93 1gpy n ASP 217 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1gpy s THR 218 N -3.63 5.26 -0.01 -3.53 -4.23 -1.26 -3.25 115.64 104.99 1gpy s THR 218 Ca 0.43 -0.77 -0.17 0.00 -1.18 0.00 0.00 61.69 60.00 1gpy s THR 218 Cb -0.23 -3.81 -0.06 0.00 1.34 0.00 0.00 72.50 69.74 1gpy s THR 218 CO 0.97 -0.27 0.48 -1.58 -0.54 0.00 0.00 174.62 173.69 1gpy s GLN 219 N -3.72 4.13 -0.07 3.99 -0.44 0.10 -4.84 119.66 118.81 1gpy s GLN 219 Ca 0.35 0.53 0.01 0.00 -2.50 0.00 0.00 55.36 53.76 1gpy s GLN 219 Cb -0.10 -3.29 -0.03 0.00 -1.64 0.00 0.00 33.01 27.96 1gpy s GLN 219 CO 0.30 0.53 -0.07 0.08 0.50 0.00 0.00 175.29 176.62 1gpy s VAL 220 N -0.62 3.66 -0.02 1.34 1.01 -1.26 0.58 120.40 125.09 1gpy s VAL 220 Ca 0.26 -0.49 0.01 0.00 0.00 0.00 0.00 61.98 61.76 1gpy s VAL 220 Cb -0.17 -2.49 0.01 0.00 0.00 0.00 0.00 36.38 33.73 1gpy s VAL 220 CO 0.14 0.60 -0.04 -0.69 0.00 0.00 0.00 175.10 175.11 1gpy s VAL 221 N -0.80 0.39 0.07 2.92 1.01 0.41 -4.56 120.40 119.85 1gpy s VAL 221 Ca 0.12 -0.12 -0.08 0.00 0.00 0.00 0.00 61.98 61.90 1gpy s VAL 221 Cb -0.11 -0.39 -0.05 0.00 0.00 0.00 0.00 36.38 35.82 1gpy s VAL 221 CO 0.01 0.15 0.36 -0.76 0.00 0.00 0.00 175.10 174.86 1gpy s LEU 222 N 0.44 4.34 -0.27 3.92 1.43 -0.08 -0.33 118.68 128.13 1gpy s LEU 222 Ca -0.05 0.68 -0.03 0.00 -1.03 0.00 0.00 54.13 53.71 1gpy s LEU 222 Cb -0.08 -2.96 0.03 0.00 0.03 0.00 0.00 46.19 43.20 1gpy s LEU 222 CO -0.00 0.17 -0.02 0.00 0.23 0.00 0.00 176.35 176.72 1gpy s ALA 223 N -1.42 2.79 -0.35 4.21 0.00 0.24 -0.91 121.76 126.33 1gpy s ALA 223 Ca 0.33 -1.50 -0.10 0.00 0.00 0.00 0.00 51.96 50.68 1gpy s ALA 223 Cb -0.13 -1.82 0.01 0.00 0.00 0.00 0.00 23.12 21.18 1gpy s ALA 223 CO 0.19 -0.90 0.19 1.41 0.00 0.00 0.00 175.76 176.64 1gpy s MET 224 N 1.35 3.05 0.47 0.00 1.75 -0.27 -2.44 119.30 123.22 1gpy s MET 224 Ca -0.00 -0.92 -0.23 0.00 -1.25 0.00 0.00 55.69 53.29 1gpy s MET 224 Cb -0.17 -3.67 -0.07 0.00 2.84 0.00 0.00 34.83 33.76 1gpy s MET 224 CO -0.03 -0.58 1.18 -1.25 -0.65 0.00 0.00 175.02 173.70 1gpy s PRO 225 N 1.58 3.68 -0.11 4.11 0.04 -1.26 -0.49 135.00 142.56 1gpy s PRO 225 Ca 0.03 1.81 -0.03 0.00 0.04 0.00 0.00 61.00 62.85 1gpy s PRO 225 Cb -0.18 -2.37 0.05 0.00 0.04 0.00 0.00 34.50 32.04 1gpy s PRO 225 CO 0.07 -0.63 0.13 0.71 0.04 0.00 0.00 177.00 177.32 1gpy s TYR 226 N -1.53 -0.05 -0.07 0.56 1.51 0.41 -1.27 117.35 116.91 1gpy s TYR 226 Ca 0.65 0.26 -0.20 0.00 -1.01 0.00 0.00 57.07 56.77 1gpy s TYR 226 Cb -0.29 -0.43 -0.04 0.00 -0.11 0.00 0.00 41.96 41.09 1gpy s TYR 226 CO 0.35 -0.36 0.55 -0.51 -1.11 0.00 0.00 175.55 174.48 1gpy s ASP 227 N 2.23 6.83 -0.04 2.29 1.01 -0.64 -1.33 116.67 127.03 1gpy s ASP 227 Ca 0.04 0.99 0.05 0.00 0.71 0.00 0.00 52.55 54.34 1gpy s ASP 227 Cb -0.13 -2.33 -0.02 0.00 1.01 0.00 0.00 42.92 41.44 1gpy s ASP 227 CO -0.07 0.03 -0.19 -0.89 0.21 0.00 0.00 175.17 174.26 1gpy s THR 228 N 0.33 2.65 0.27 -1.27 2.01 -0.22 0.41 115.64 119.82 1gpy s THR 228 Ca 0.29 -0.88 -0.29 0.00 0.31 0.00 0.00 61.69 61.12 1gpy s THR 228 Cb -0.17 -2.00 -0.09 0.00 0.01 0.00 0.00 72.50 70.25 1gpy s THR 228 CO 0.14 0.58 1.20 -2.16 -0.69 0.00 0.00 174.62 173.69 1gpy s PRO 229 N -0.61 4.50 -0.46 4.92 0.04 -1.26 -1.31 135.00 140.83 1gpy s PRO 229 Ca 0.09 1.97 0.03 0.00 0.04 0.00 0.00 61.00 63.14 1gpy s PRO 229 Cb -0.11 -3.16 0.12 0.00 0.04 0.00 0.00 34.50 31.40 1gpy s PRO 229 CO 0.00 -0.01 0.21 0.08 0.04 0.00 0.00 177.00 177.32 1gpy s VAL 230 N -0.84 2.18 0.14 -0.36 1.01 0.12 -4.85 120.40 117.80 1gpy s VAL 230 Ca 0.48 -2.88 -0.28 0.00 0.00 0.00 0.00 61.98 59.30 1gpy s VAL 230 Cb -0.35 -2.54 -0.07 0.00 0.00 0.00 0.00 36.38 33.42 1gpy s VAL 230 CO 0.44 -0.78 0.90 -2.16 0.00 0.00 0.00 175.10 173.50 1gpy s PRO 231 N 0.16 4.69 0.69 2.72 0.04 -1.26 -1.36 135.00 140.68 1gpy s PRO 231 Ca 0.16 1.35 -0.11 0.00 0.04 0.00 0.00 61.00 62.44 1gpy s PRO 231 Cb -0.24 -3.33 0.01 0.00 0.04 0.00 0.00 34.50 30.98 1gpy s PRO 231 CO -0.03 0.35 1.08 0.20 0.04 0.00 0.00 177.00 178.64 1gpy s GLY 232 N -0.46 1.63 -0.18 0.56 0.00 -0.47 -4.76 107.32 103.64 1gpy s GLY 232 Ca 0.42 -0.36 -0.29 0.00 0.00 0.00 0.00 44.72 44.49 1gpy s GLY 232 CO 0.29 -0.00 1.12 -0.47 0.00 0.00 0.00 173.10 174.04 1gpy s TYR 233 N -3.31 3.18 -1.39 1.90 5.04 -1.26 -4.01 117.35 117.49 1gpy s TYR 233 Ca 0.58 1.31 -0.17 0.00 -2.44 0.00 0.00 57.07 56.35 1gpy s TYR 233 Cb -0.11 -3.35 0.17 0.00 0.35 0.00 0.00 41.96 39.01 1gpy s TYR 233 CO 0.51 -0.93 0.42 0.54 -1.34 0.00 0.00 175.55 174.75 1gpy n ARG 234 N 6.20 -0.80 0.00 4.97 3.00 -0.55 -4.80 116.66 124.68 1gpy n ARG 234 Ca 0.12 0.10 0.00 0.00 -0.01 0.00 0.00 57.85 58.06 1gpy n ARG 234 Cb 0.46 -3.46 0.00 0.00 0.00 0.00 0.00 32.46 29.46 1gpy n ARG 234 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 1gpy n ASN 235 N -1.67 1.09 -0.98 0.55 2.04 -1.26 -4.92 115.26 110.12 1gpy n ASN 235 Ca 0.07 -1.44 -0.13 0.00 -0.44 0.00 0.00 54.58 52.64 1gpy n ASN 235 Cb 0.35 0.00 -0.05 0.00 -2.53 0.00 0.00 39.78 37.54 1gpy n ASN 235 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 1gpy n ASN 236 N -0.22 -4.61 -4.60 0.53 3.02 -1.26 -1.01 115.26 107.11 1gpy n ASN 236 Ca 0.00 0.32 -0.35 0.00 -0.03 0.00 0.00 54.58 54.52 1gpy n ASN 236 Cb 0.26 -3.24 -0.10 0.00 -0.61 0.00 0.00 39.78 36.09 1gpy n ASN 236 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1gpy s VAL 237 N -2.46 4.69 -0.17 2.41 1.01 -1.26 -4.36 120.40 120.26 1gpy s VAL 237 Ca 0.00 -0.07 -0.05 0.00 0.00 0.00 0.00 61.98 61.87 1gpy s VAL 237 Cb 0.00 -3.12 0.06 0.00 0.00 0.00 0.00 36.38 33.31 1gpy s VAL 237 CO 0.00 0.44 0.09 -0.69 0.00 0.00 0.00 175.10 174.93 1gpy s VAL 238 N 0.60 -0.07 0.58 2.92 1.01 -1.26 -1.36 120.40 122.82 1gpy s VAL 238 Ca 0.03 -0.16 0.04 0.00 0.00 0.00 0.00 61.98 61.89 1gpy s VAL 238 Cb -0.13 -0.58 0.07 0.00 0.00 0.00 0.00 36.38 35.74 1gpy s VAL 238 CO 0.01 -0.26 0.81 0.20 0.00 0.00 0.00 175.10 175.86 1gpy s ASN 239 N 2.13 5.03 0.00 3.32 0.01 -0.46 -4.59 114.94 120.39 1gpy s ASN 239 Ca 0.02 -0.35 0.05 0.00 -0.71 0.00 0.00 52.86 51.87 1gpy s ASN 239 Cb -0.16 -0.35 -0.03 0.00 0.41 0.00 0.00 41.25 41.12 1gpy s ASN 239 CO -0.09 -1.33 -0.14 0.42 -1.51 0.00 0.00 177.10 174.46 1gpy s THR 240 N -2.78 3.12 -0.30 1.60 -4.23 -1.26 0.11 115.64 111.90 1gpy s THR 240 Ca 0.60 -0.93 -0.08 0.00 -1.18 0.00 0.00 61.69 60.11 1gpy s THR 240 Cb -0.08 -2.30 -0.00 0.00 1.34 0.00 0.00 72.50 71.46 1gpy s THR 240 CO 0.39 0.43 0.11 -0.32 -0.54 0.00 0.00 174.62 174.70 1gpy s MET 241 N -1.22 3.25 -0.35 3.99 1.75 -0.42 -2.36 119.30 123.94 1gpy s MET 241 Ca 0.14 -0.76 -0.13 0.00 -1.25 0.00 0.00 55.69 53.69 1gpy s MET 241 Cb -0.11 -3.46 -0.01 0.00 2.84 0.00 0.00 34.83 34.10 1gpy s MET 241 CO 0.05 -0.41 0.24 0.50 -0.65 0.00 0.00 175.02 174.75 1gpy s ARG 242 N 1.56 3.36 -0.14 4.11 6.06 -0.67 -1.06 118.95 132.17 1gpy s ARG 242 Ca 0.04 -0.74 0.00 0.00 -2.50 0.00 0.00 55.73 52.53 1gpy s ARG 242 Cb -0.17 -3.81 -0.01 0.00 0.06 0.00 0.00 34.95 31.02 1gpy s ARG 242 CO 0.04 -0.51 -0.14 -0.51 -2.50 0.00 0.00 175.30 171.68 1gpy s LEU 243 N 1.70 2.59 0.02 -0.88 1.02 -0.44 -2.69 118.68 120.01 1gpy s LEU 243 Ca 0.06 -0.40 -0.17 0.00 0.02 0.00 0.00 54.13 53.64 1gpy s LEU 243 Cb -0.18 -1.59 -0.06 0.00 0.02 0.00 0.00 46.19 44.39 1gpy s LEU 243 CO 0.10 0.13 0.49 0.26 0.02 0.00 0.00 176.35 177.34 1gpy s TRP 244 N 0.56 3.74 0.10 0.29 0.52 -1.00 -0.44 118.94 122.71 1gpy s TRP 244 Ca -0.09 1.11 0.06 0.00 0.02 0.00 0.00 56.10 57.20 1gpy s TRP 244 Cb -0.16 -2.41 -0.04 0.00 -1.15 0.00 0.00 33.47 29.71 1gpy s TRP 244 CO 0.04 0.57 -0.06 -1.12 0.02 0.00 0.00 176.95 176.40 1gpy s SER 245 N -0.92 4.66 0.03 2.95 0.01 0.36 -0.97 113.70 119.83 1gpy s SER 245 Ca 0.26 -0.30 -0.21 0.00 1.31 0.00 0.00 55.95 57.02 1gpy s SER 245 Cb -0.18 -0.99 -0.06 0.00 0.21 0.00 0.00 66.02 65.00 1gpy s SER 245 CO 0.16 0.18 0.62 0.00 0.41 0.00 0.00 173.24 174.60 1gpy s ALA 246 N -1.26 3.50 -0.02 1.44 0.00 -1.26 -1.11 121.76 123.04 1gpy s ALA 246 Ca 0.23 0.08 -0.00 0.00 0.00 0.00 0.00 51.96 52.27 1gpy s ALA 246 Cb -0.11 -2.76 0.03 0.00 0.00 0.00 0.00 23.12 20.28 1gpy s ALA 246 CO 0.16 0.22 0.03 0.21 0.00 0.00 0.00 175.76 176.38 1gpy s LYS 247 N -0.48 0.04 0.29 0.00 2.20 -0.08 -4.76 119.74 116.95 1gpy s LYS 247 Ca 0.32 0.18 -0.29 0.00 -0.36 0.00 0.00 55.97 55.82 1gpy s LYS 247 Cb -0.19 -0.33 -0.10 0.00 -1.51 0.00 0.00 37.83 35.70 1gpy s LYS 247 CO 0.19 -0.18 1.22 0.00 -0.36 0.00 0.00 175.35 176.22 1gpy s ALA 248 N 1.17 3.46 0.36 3.13 0.00 -1.26 -0.91 121.76 127.72 1gpy s ALA 248 Ca -0.08 1.09 -0.28 0.00 0.00 0.00 0.00 51.96 52.69 1gpy s ALA 248 Cb -0.13 -3.42 -0.11 0.00 0.00 0.00 0.00 23.12 19.46 1gpy s ALA 248 CO -0.03 -0.43 1.47 -0.35 0.00 0.00 0.00 175.76 176.42 1gpy n PRO 249 N 1.17 2.58 -0.16 0.00 -0.04 -1.26 -4.87 135.00 132.42 1gpy n PRO 249 Ca 0.00 0.91 -0.08 0.00 -0.04 0.00 0.00 63.50 64.29 1gpy n PRO 249 Cb 0.43 -2.62 0.01 0.00 -0.04 0.00 0.00 33.50 31.28 1gpy n PRO 249 CO 0.00 0.00 0.00 -2.95 -0.04 0.00 0.00 175.50 172.51 1gpy h ASN 250 N 3.15 0.59 0.21 3.54 -1.07 -1.99 -3.32 115.58 116.69 1gpy h ASN 250 Ca -0.49 -0.09 -0.31 0.00 0.07 0.00 0.00 56.30 55.48 1gpy h ASN 250 Cb 1.25 -0.15 0.03 0.00 -2.07 0.00 0.00 38.32 37.37 1gpy h ASN 250 CO 0.66 0.51 -1.41 -2.24 0.07 0.00 0.00 177.43 175.02 1gpy h ASP 251 N 0.63 0.70 0.75 6.14 2.03 -1.96 -3.38 116.42 121.32 1gpy h ASP 251 Ca 0.17 -0.93 0.00 0.00 -0.73 0.00 0.00 57.03 55.54 1gpy h ASP 251 Cb 0.05 -0.23 0.00 0.00 -0.83 0.00 0.00 39.33 38.32 1gpy h ASP 251 CO -0.03 1.67 -0.34 0.33 -1.03 0.00 0.00 179.24 179.84 1gpy n PHE 252 N -3.79 0.12 0.17 4.15 -0.00 -1.25 0.19 117.46 117.05 1gpy n PHE 252 Ca -0.19 0.03 0.02 0.00 -0.00 0.00 0.00 57.45 57.31 1gpy n PHE 252 Cb 1.03 -0.41 0.29 0.00 -0.00 0.00 0.00 39.48 40.39 1gpy n PHE 252 CO 0.00 0.00 0.00 -0.91 -0.00 0.00 0.00 176.76 175.85 1gpy h ASN 253 N 0.00 0.00 0.13 -2.13 4.21 -1.73 0.64 115.58 116.70 1gpy h ASN 253 Ca 0.00 0.00 -0.31 0.00 1.21 0.00 0.00 56.30 57.20 1gpy h ASN 253 Cb 0.54 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.74 1gpy h ASN 253 CO 0.00 0.47 -1.61 -0.07 -1.29 0.00 0.00 177.43 174.93 1gpy h LEU 254 N 0.00 0.42 -7.66 1.61 4.07 -1.62 -3.46 115.31 108.68 1gpy h LEU 254 Ca -0.00 -0.87 -0.57 0.00 0.08 0.00 0.00 57.88 56.51 1gpy h LEU 254 Cb 0.88 -0.14 -0.38 0.00 1.08 0.00 0.00 40.66 42.11 1gpy h LEU 254 CO 0.06 1.70 -0.80 -0.75 -1.08 0.00 0.00 178.44 177.58 1gpy s LYS 255 N -2.51 1.58 0.00 1.13 2.20 0.50 -4.46 119.74 118.17 1gpy s LYS 255 Ca -0.20 -0.58 0.00 0.00 -0.36 0.00 0.00 55.97 54.83 1gpy s LYS 255 Cb 0.05 -2.09 0.00 0.00 -1.51 0.00 0.00 37.83 34.28 1gpy s LYS 255 CO 0.78 -0.43 0.00 -3.47 -0.36 0.00 0.00 175.35 171.87 1gpy n ASP 256 N 4.83 0.53 -3.60 1.43 2.03 -1.26 -4.65 116.55 115.87 1gpy n ASP 256 Ca -0.13 0.00 -0.41 0.00 0.52 0.00 0.00 54.79 54.78 1gpy n ASP 256 Cb 0.48 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.88 1gpy n ASP 256 CO 0.00 0.00 0.00 2.22 -1.92 0.00 0.00 177.20 177.50 1gpy n PHE 257 N 0.00 2.66 -2.05 -0.67 1.16 -1.26 -4.89 117.46 112.41 1gpy n PHE 257 Ca 0.00 -2.72 -0.42 0.00 -1.87 0.00 0.00 57.45 52.44 1gpy n PHE 257 Cb 0.00 -1.61 -0.00 0.00 -1.61 0.00 0.00 39.48 36.26 1gpy n PHE 257 CO 0.00 0.00 0.00 0.09 -1.87 0.00 0.00 176.76 174.98 1gpy n ASN 258 N 1.31 5.44 -4.80 5.98 5.03 -1.26 -4.97 115.26 121.99 1gpy n ASN 258 Ca 0.53 -3.00 -0.36 0.00 0.87 0.00 0.00 54.58 52.62 1gpy n ASN 258 Cb 0.27 -1.52 -0.06 0.00 -1.02 0.00 0.00 39.78 37.45 1gpy n ASN 258 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 1gpy s VAL 259 N 1.06 4.42 0.00 2.41 0.11 -1.26 -4.52 120.40 122.63 1gpy s VAL 259 Ca 0.46 1.50 0.00 0.00 -2.93 0.00 0.00 61.98 61.01 1gpy s VAL 259 Cb 0.13 -3.91 0.00 0.00 -1.53 0.00 0.00 36.38 31.06 1gpy s VAL 259 CO -0.04 0.17 0.00 0.61 -3.33 0.00 0.00 175.10 172.51 1gpy n GLY 260 N 0.63 0.07 0.00 6.54 0.00 -1.26 -5.16 105.19 106.01 1gpy n GLY 260 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1gpy n GLY 260 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gpy n GLY 261 N -0.65 4.25 0.28 -0.02 0.00 -1.26 -4.93 105.19 102.86 1gpy n GLY 261 Ca 0.00 -1.31 -0.14 0.00 0.00 0.00 0.00 46.02 44.57 1gpy n GLY 261 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1gpy h TYR 262 N 0.00 -0.60 -0.43 1.61 3.20 -1.99 -1.83 116.97 116.93 1gpy h TYR 262 Ca 0.00 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 61.91 1gpy h TYR 262 Cb 0.00 0.20 -0.05 0.00 1.54 0.00 0.00 36.73 38.42 1gpy h TYR 262 CO 0.00 -0.28 0.16 0.82 -1.64 0.00 0.00 178.16 177.23 1gpy h ILE 263 N -0.93 0.88 -0.65 1.81 1.08 -1.99 -1.94 117.51 115.78 1gpy h ILE 263 Ca -0.07 -0.12 -0.08 0.00 -0.39 0.00 0.00 64.86 64.21 1gpy h ILE 263 Cb 0.59 0.52 -0.03 0.00 -3.07 0.00 0.00 36.82 34.83 1gpy h ILE 263 CO 0.11 0.06 0.10 -0.61 -0.69 0.00 0.00 178.15 177.12 1gpy h GLN 264 N 0.34 1.07 0.00 2.37 5.75 -1.92 -0.67 115.11 122.05 1gpy h GLN 264 Ca 0.20 -0.28 -0.03 0.00 -0.15 0.00 0.00 58.65 58.38 1gpy h GLN 264 Cb 0.17 -0.13 -0.00 0.00 1.07 0.00 0.00 27.48 28.59 1gpy h GLN 264 CO -0.19 0.98 -0.15 0.00 -2.65 0.00 0.00 178.83 176.82 1gpy h ALA 265 N 1.10 1.20 0.14 3.38 0.00 -1.03 0.31 119.26 124.36 1gpy h ALA 265 Ca 0.20 -0.14 -0.28 0.00 0.00 0.00 0.00 54.91 54.69 1gpy h ALA 265 Cb 0.43 -0.02 0.03 0.00 0.00 0.00 0.00 17.79 18.23 1gpy h ALA 265 CO 0.01 0.19 -1.17 0.28 0.00 0.00 0.00 179.25 178.56 1gpy h VAL 266 N 0.00 1.33 0.00 0.00 2.07 -1.02 -3.31 116.25 115.31 1gpy h VAL 266 Ca -0.00 -2.47 -0.16 0.00 0.82 0.00 0.00 66.70 64.89 1gpy h VAL 266 Cb 0.46 2.82 -0.02 0.00 -1.52 0.00 0.00 31.29 33.03 1gpy h VAL 266 CO 0.02 0.74 -0.75 -0.07 0.02 0.00 0.00 177.57 177.53 1gpy h LEU 267 N 0.13 0.00 0.00 2.57 3.38 -0.19 -3.01 115.31 118.20 1gpy h LEU 267 Ca -0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.78 1gpy h LEU 267 Cb 1.87 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.62 1gpy h LEU 267 CO 0.22 0.75 0.00 0.47 0.09 0.00 0.00 178.44 179.97 1gpy n ASP 268 N -3.63 0.00 0.28 -0.43 9.92 0.10 -2.53 116.55 120.26 1gpy n ASP 268 Ca -0.01 -0.34 0.19 0.00 -0.53 0.00 0.00 54.79 54.10 1gpy n ASP 268 Cb 0.73 -0.14 0.85 0.00 -0.64 0.00 0.00 41.12 41.92 1gpy n ASP 268 CO 0.00 0.00 0.00 0.03 0.13 0.00 0.00 177.20 177.36 1gpy h ARG 269 N 0.00 0.00 0.00 -1.24 3.08 -1.61 -2.54 114.38 112.07 1gpy h ARG 269 Ca 0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 1gpy h ARG 269 Cb 0.10 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.14 1gpy h ARG 269 CO 0.00 0.00 -0.11 -0.91 -1.07 0.00 0.00 179.97 177.88 1gpy h ASN 270 N 0.00 0.00 0.39 7.04 -0.26 -1.74 -1.48 115.58 119.54 1gpy h ASN 270 Ca 0.00 0.00 -0.02 0.00 -0.56 0.00 0.00 56.30 55.72 1gpy h ASN 270 Cb 0.30 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.56 1gpy h ASN 270 CO 0.00 0.11 -0.19 -0.07 -1.06 0.00 0.00 177.43 176.22 1gpy h LEU 271 N 0.00 -0.45 -1.57 1.61 4.07 -1.69 -1.88 115.31 115.40 1gpy h LEU 271 Ca -0.00 -0.07 -0.05 0.00 0.08 0.00 0.00 57.88 57.85 1gpy h LEU 271 Cb 0.28 0.12 -0.01 0.00 1.08 0.00 0.00 40.66 42.13 1gpy h LEU 271 CO 0.01 -0.21 -0.23 0.00 -1.08 0.00 0.00 178.44 176.94 1gpy h ALA 272 N -0.13 1.39 -0.01 1.53 0.00 -1.43 -1.56 119.26 119.05 1gpy h ALA 272 Ca -0.05 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1gpy h ALA 272 Cb 0.49 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1gpy h ALA 272 CO 0.09 0.29 -0.11 0.39 0.00 0.00 0.00 179.25 179.91 1gpy n GLU 273 N -3.94 0.89 0.00 0.00 1.02 -0.89 -3.52 120.64 114.20 1gpy n GLU 273 Ca -0.02 -0.37 0.09 0.00 -0.02 0.00 0.00 57.16 56.84 1gpy n GLU 273 Cb 0.31 -1.49 0.43 0.00 -0.02 0.00 0.00 31.44 30.66 1gpy n GLU 273 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1gpy n ASN 274 N -0.74 0.00 -0.23 1.62 3.02 -0.59 -3.53 115.26 114.82 1gpy n ASN 274 Ca 0.16 0.24 -0.02 0.00 -0.03 0.00 0.00 54.58 54.92 1gpy n ASN 274 Cb 0.29 -0.38 0.09 0.00 -0.61 0.00 0.00 39.78 39.16 1gpy n ASN 274 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 1gpy h ILE 275 N 0.00 1.01 -0.61 2.41 1.08 -1.76 -2.67 117.51 116.98 1gpy h ILE 275 Ca 0.00 -0.25 -0.07 0.00 -0.39 0.00 0.00 64.86 64.16 1gpy h ILE 275 Cb 0.23 0.23 -0.04 0.00 -3.07 0.00 0.00 36.82 34.17 1gpy h ILE 275 CO 0.00 0.13 0.08 -1.54 -0.69 0.00 0.00 178.15 176.14 1gpy n SER 276 N -4.76 5.31 -0.01 1.72 3.41 -1.23 -4.69 113.62 113.38 1gpy n SER 276 Ca 0.08 -2.98 -0.17 0.00 -0.26 0.00 0.00 58.87 55.54 1gpy n SER 276 Cb 0.14 -0.70 -0.14 0.00 -0.26 0.00 0.00 64.21 63.25 1gpy n SER 276 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1gpy h ARG 277 N 3.45 0.15 -3.70 4.33 2.43 -1.65 -2.68 114.38 116.72 1gpy h ARG 277 Ca 0.08 -0.26 -0.30 0.00 -0.81 0.00 0.00 59.98 58.69 1gpy h ARG 277 Cb 2.04 0.10 -0.32 0.00 -0.42 0.00 0.00 29.97 31.37 1gpy h ARG 277 CO 0.55 1.13 -0.73 0.54 -1.51 0.00 0.00 179.97 179.94 1gpy s VAL 278 N -2.33 0.07 0.26 0.20 0.11 -1.26 -1.13 120.40 116.32 1gpy s VAL 278 Ca -0.16 0.09 -0.30 0.00 -2.93 0.00 0.00 61.98 58.68 1gpy s VAL 278 Cb -0.01 -0.15 -0.10 0.00 -1.53 0.00 0.00 36.38 34.59 1gpy s VAL 278 CO 0.76 0.09 1.49 -0.22 -3.33 0.00 0.00 175.10 173.89 1gpy s LEU 279 N 0.70 4.37 -0.05 2.54 2.96 -0.58 -4.99 118.68 123.64 1gpy s LEU 279 Ca -0.06 2.75 -0.30 0.00 -0.22 0.00 0.00 54.13 56.30 1gpy s LEU 279 Cb -0.09 -3.63 -0.05 0.00 0.50 0.00 0.00 46.19 42.92 1gpy s LEU 279 CO -0.02 -0.76 1.44 -0.31 -1.32 0.00 0.00 176.35 175.38 1gpy s TYR 280 N -0.01 2.61 -0.32 5.38 1.51 -1.26 -4.87 117.35 120.38 1gpy s TYR 280 Ca 0.60 0.68 0.02 0.00 -1.01 0.00 0.00 57.07 57.37 1gpy s TYR 280 Cb -0.44 -3.70 0.25 0.00 -0.11 0.00 0.00 41.96 37.96 1gpy s TYR 280 CO 0.45 -2.70 1.21 -0.35 -1.11 0.00 0.00 175.55 173.05 1gpy n PRO 281 N 6.10 1.69 -3.46 -1.71 -0.04 -1.26 -4.83 135.00 131.49 1gpy n PRO 281 Ca 0.14 -1.05 -0.43 0.00 -0.04 0.00 0.00 63.50 62.12 1gpy n PRO 281 Cb 0.44 -1.51 -0.10 0.00 -0.04 0.00 0.00 33.50 32.29 1gpy n PRO 281 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1gpy s ASN 282 N 0.07 6.09 -0.32 3.54 0.01 -1.26 -4.49 114.94 118.58 1gpy s ASN 282 Ca 0.19 -0.98 -0.15 0.00 -0.71 0.00 0.00 52.86 51.21 1gpy s ASN 282 Cb 0.16 -2.15 -0.02 0.00 0.41 0.00 0.00 41.25 39.65 1gpy s ASN 282 CO 0.04 -0.48 0.37 -0.62 -1.51 0.00 0.00 177.10 174.90 1gpy s ASP 283 N 1.83 6.20 -1.04 -1.22 2.15 -1.26 -4.26 116.67 119.07 1gpy s ASP 283 Ca 0.05 -0.09 -0.09 0.00 0.43 0.00 0.00 52.55 52.85 1gpy s ASP 283 Cb -0.20 -2.20 -0.05 0.00 -0.30 0.00 0.00 42.92 40.17 1gpy s ASP 283 CO 0.09 -0.30 0.86 0.59 -0.17 0.00 0.00 175.17 176.24 1gpy n ASN 284 N 5.39 -6.43 -3.53 -0.34 3.02 -1.26 -5.02 115.26 107.09 1gpy n ASN 284 Ca -0.09 -0.73 -0.17 0.00 -0.03 0.00 0.00 54.58 53.57 1gpy n ASN 284 Cb 0.50 -4.71 -0.06 0.00 -0.61 0.00 0.00 39.78 34.89 1gpy n ASN 284 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1gpy s PHE 285 N -3.36 -0.62 -0.12 3.10 2.19 -1.26 -4.58 117.98 113.33 1gpy s PHE 285 Ca 0.41 1.09 0.02 0.00 0.33 0.00 0.00 56.93 58.78 1gpy s PHE 285 Cb -0.08 0.41 0.01 0.00 -1.31 0.00 0.00 43.02 42.05 1gpy s PHE 285 CO 0.77 -0.56 -0.19 0.12 1.83 0.00 0.00 175.22 177.19 1gpy s PHE 286 N -1.11 2.37 -0.22 10.12 5.36 -0.83 -4.87 117.98 128.81 1gpy s PHE 286 Ca -0.09 -1.15 -0.01 0.00 -0.96 0.00 0.00 56.93 54.72 1gpy s PHE 286 Cb -0.00 -1.64 0.02 0.00 -0.34 0.00 0.00 43.02 41.05 1gpy s PHE 286 CO 0.08 -0.54 -0.10 -2.00 -1.46 0.00 0.00 175.22 171.20 1gpy s GLU 287 N 0.85 3.01 -1.46 10.12 2.12 -1.26 -4.97 118.70 127.10 1gpy s GLU 287 Ca -0.08 -0.85 -0.13 0.00 0.36 0.00 0.00 54.97 54.27 1gpy s GLU 287 Cb -0.15 -2.85 0.04 0.00 0.26 0.00 0.00 34.13 31.43 1gpy s GLU 287 CO -0.01 -0.29 2.27 0.41 -0.54 0.00 0.00 175.26 177.10 1gpy n GLY 288 N 4.68 4.43 3.86 -1.50 0.00 -1.26 -4.89 105.19 110.51 1gpy n GLY 288 Ca -0.18 -1.61 -0.36 0.00 0.00 0.00 0.00 46.02 43.87 1gpy n GLY 288 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gpy s LYS 289 N 2.97 3.72 0.18 1.61 -0.14 -1.26 -4.97 119.74 121.84 1gpy s LYS 289 Ca 0.48 0.15 -0.13 0.00 -1.36 0.00 0.00 55.97 55.11 1gpy s LYS 289 Cb 0.14 -3.11 0.08 0.00 -1.68 0.00 0.00 37.83 33.26 1gpy s LYS 289 CO -0.08 0.65 1.82 1.49 -0.76 0.00 0.00 175.35 178.47 1gpy h GLU 290 N 4.25 0.77 0.00 1.68 4.81 -1.99 -1.09 114.58 123.00 1gpy h GLU 290 Ca -0.51 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 58.65 1gpy h GLU 290 Cb 1.21 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 30.42 1gpy h GLU 290 CO 0.64 0.54 -0.05 1.25 -0.73 0.00 0.00 179.01 180.66 1gpy h LEU 291 N 0.77 0.00 -0.29 1.64 5.85 -1.99 -0.51 115.31 120.78 1gpy h LEU 291 Ca 0.20 0.00 -0.14 0.00 0.84 0.00 0.00 57.88 58.79 1gpy h LEU 291 Cb -0.03 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 40.99 1gpy h LEU 291 CO -0.04 0.05 -0.36 -0.09 -0.34 0.00 0.00 178.44 177.66 1gpy h ARG 292 N 0.00 0.77 -0.24 1.25 1.12 -1.55 -2.70 114.38 113.02 1gpy h ARG 292 Ca -0.00 -0.43 -0.06 0.00 -1.11 0.00 0.00 59.98 58.38 1gpy h ARG 292 Cb 0.10 0.03 -0.01 0.00 -0.01 0.00 0.00 29.97 30.08 1gpy h ARG 292 CO 0.01 1.06 -0.10 1.25 -3.11 0.00 0.00 179.97 179.07 1gpy h LEU 293 N 0.52 0.37 -0.55 3.80 5.85 -1.00 -2.32 115.31 121.98 1gpy h LEU 293 Ca 0.04 -0.08 0.04 0.00 0.84 0.00 0.00 57.88 58.71 1gpy h LEU 293 Cb 0.95 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.84 1gpy h LEU 293 CO 0.09 0.51 0.31 0.11 -0.34 0.00 0.00 178.44 179.12 1gpy h LYS 294 N 0.37 0.58 -0.38 1.25 1.57 -1.04 -0.60 116.57 118.32 1gpy h LYS 294 Ca 0.07 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.81 1gpy h LYS 294 Cb 0.41 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.57 1gpy h LYS 294 CO 0.02 0.38 0.19 1.96 -0.57 0.00 0.00 179.45 181.44 1gpy h GLN 295 N 0.60 0.55 -0.18 3.15 4.20 -1.12 -0.46 115.11 121.84 1gpy h GLN 295 Ca 0.24 -0.08 -0.00 0.00 0.06 0.00 0.00 58.65 58.87 1gpy h GLN 295 Cb 0.09 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.77 1gpy h GLN 295 CO -0.14 0.48 0.10 0.93 -0.67 0.00 0.00 178.83 179.53 1gpy h GLU 296 N 0.48 0.25 -0.47 1.46 5.08 -1.23 -1.76 114.58 118.39 1gpy h GLU 296 Ca 0.13 -0.03 -0.13 0.00 -1.00 0.00 0.00 59.36 58.33 1gpy h GLU 296 Cb 0.11 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.29 1gpy h GLU 296 CO -0.02 0.24 -0.22 -0.92 -1.00 0.00 0.00 179.01 177.10 1gpy h TYR 297 N 0.18 1.09 -0.37 4.33 3.20 -1.02 -3.09 116.97 121.28 1gpy h TYR 297 Ca 0.06 -0.26 -0.03 0.00 3.14 0.00 0.00 58.73 61.65 1gpy h TYR 297 Cb 0.07 -0.26 -0.02 0.00 1.54 0.00 0.00 36.73 38.07 1gpy h TYR 297 CO -0.04 1.07 0.13 0.35 -1.64 0.00 0.00 178.16 178.03 1gpy h PHE 298 N 0.82 0.59 -0.74 -3.82 3.57 -0.94 -0.52 116.94 115.90 1gpy h PHE 298 Ca 0.11 -0.05 -0.06 0.00 3.53 0.00 0.00 57.97 61.50 1gpy h PHE 298 Cb 0.78 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 39.32 1gpy h PHE 298 CO 0.05 0.55 0.25 -0.24 -2.23 0.00 0.00 178.31 176.69 1gpy h VAL 299 N 0.45 1.26 0.38 1.41 3.04 -1.38 -2.81 116.25 118.61 1gpy h VAL 299 Ca 0.12 -0.88 -0.02 0.00 -1.01 0.00 0.00 66.70 64.91 1gpy h VAL 299 Cb 0.23 0.42 0.00 0.00 -2.01 0.00 0.00 31.29 29.94 1gpy h VAL 299 CO -0.01 0.35 -0.18 0.58 -1.01 0.00 0.00 177.57 177.30 1gpy h VAL 300 N 1.10 0.57 -0.28 1.51 2.07 -1.45 -1.48 116.25 118.29 1gpy h VAL 300 Ca 0.24 -0.49 0.06 0.00 0.82 0.00 0.00 66.70 67.33 1gpy h VAL 300 Cb 0.28 0.79 -0.06 0.00 -1.52 0.00 0.00 31.29 30.79 1gpy h VAL 300 CO -0.01 0.08 -0.11 0.00 0.02 0.00 0.00 177.57 177.55 1gpy h ALA 301 N -0.35 0.13 -0.13 1.67 0.00 -1.14 -1.06 119.26 118.37 1gpy h ALA 301 Ca -0.05 0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1gpy h ALA 301 Cb 0.53 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1gpy h ALA 301 CO 0.09 -0.51 0.05 0.00 0.00 0.00 0.00 179.25 178.87 1gpy h ALA 302 N 1.19 0.17 -0.78 0.00 0.00 -1.57 -2.86 119.26 115.41 1gpy h ALA 302 Ca 0.14 -0.11 0.07 0.00 0.00 0.00 0.00 54.91 55.01 1gpy h ALA 302 Cb 0.28 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 17.97 1gpy h ALA 302 CO -0.32 -0.22 0.51 1.15 0.00 0.00 0.00 179.25 180.36 1gpy h THR 303 N 0.04 1.03 -0.00 0.00 2.02 -1.12 -2.04 112.91 112.83 1gpy h THR 303 Ca 0.04 -0.28 -0.12 0.00 0.77 0.00 0.00 66.41 66.82 1gpy h THR 303 Cb 0.20 0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 66.73 1gpy h THR 303 CO -0.00 0.15 -0.56 -0.07 0.37 0.00 0.00 175.52 175.41 1gpy h LEU 304 N 0.82 0.00 -0.24 2.58 3.38 -1.15 -2.14 115.31 118.57 1gpy h LEU 304 Ca 0.34 -0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.29 1gpy h LEU 304 Cb 0.26 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1gpy h LEU 304 CO -0.12 0.57 0.08 1.56 0.09 0.00 0.00 178.44 180.62 1gpy h GLN 305 N 0.00 0.37 -0.04 1.13 4.20 -1.15 -2.67 115.11 116.96 1gpy h GLN 305 Ca -0.01 -0.08 -0.12 0.00 0.06 0.00 0.00 58.65 58.50 1gpy h GLN 305 Cb 1.00 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.71 1gpy h GLN 305 CO 0.07 0.45 -0.53 0.22 -0.67 0.00 0.00 178.83 178.38 1gpy h ASP 306 N 0.22 0.13 0.52 1.46 3.58 -1.43 -1.89 116.42 119.01 1gpy h ASP 306 Ca 0.08 -0.07 -0.02 0.00 0.42 0.00 0.00 57.03 57.44 1gpy h ASP 306 Cb 0.23 -0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.24 1gpy h ASP 306 CO -0.00 0.63 -0.33 0.40 -2.88 0.00 0.00 179.24 177.06 1gpy h ILE 307 N 0.09 0.33 -0.57 2.25 2.04 -1.32 -1.70 117.51 118.63 1gpy h ILE 307 Ca -0.00 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.86 1gpy h ILE 307 Cb 0.96 0.33 -0.03 0.00 -0.74 0.00 0.00 36.82 37.35 1gpy h ILE 307 CO 0.07 0.00 0.34 0.40 0.00 0.00 0.00 178.15 178.96 1gpy h ILE 308 N -0.80 1.16 -0.61 -0.67 2.04 -1.48 0.20 117.51 117.35 1gpy h ILE 308 Ca -0.06 -0.37 0.04 0.00 1.00 0.00 0.00 64.86 65.47 1gpy h ILE 308 Cb 0.66 0.37 -0.03 0.00 -0.74 0.00 0.00 36.82 37.07 1gpy h ILE 308 CO 0.06 0.17 0.41 -0.09 0.00 0.00 0.00 178.15 178.69 1gpy h ARG 309 N 0.78 0.68 0.24 2.37 2.43 -1.19 0.46 114.38 120.16 1gpy h ARG 309 Ca 0.20 -0.04 -0.34 0.00 -0.81 0.00 0.00 59.98 59.00 1gpy h ARG 309 Cb -0.02 -0.15 0.03 0.00 -0.42 0.00 0.00 29.97 29.41 1gpy h ARG 309 CO -0.04 0.45 -1.51 0.00 -1.51 0.00 0.00 179.97 177.36 1gpy h ARG 310 N 0.70 0.52 0.00 0.20 3.08 -0.50 -2.84 114.38 115.54 1gpy h ARG 310 Ca 0.25 -0.88 0.00 0.00 0.07 0.00 0.00 59.98 59.42 1gpy h ARG 310 Cb 0.11 0.33 0.00 0.00 0.08 0.00 0.00 29.97 30.49 1gpy h ARG 310 CO -0.07 1.42 0.00 0.34 -1.07 0.00 0.00 179.97 180.59 1gpy n PHE 311 N -3.71 0.00 -0.55 3.04 7.35 -0.02 -2.13 117.46 121.43 1gpy n PHE 311 Ca -0.18 0.00 0.42 0.00 -0.76 0.00 0.00 57.45 56.92 1gpy n PHE 311 Cb 1.09 -0.12 0.64 0.00 0.35 0.00 0.00 39.48 41.45 1gpy n PHE 311 CO 0.00 0.00 0.00 1.63 -0.76 0.00 0.00 176.76 177.63 1gpy n LYS 312 N -0.85 -0.00 -0.03 -4.13 5.02 0.16 -1.72 118.16 116.61 1gpy n LYS 312 Ca 0.00 0.85 -0.00 0.00 -2.02 0.00 0.00 58.31 57.14 1gpy n LYS 312 Cb 0.00 -1.96 -0.00 0.00 -0.02 0.00 0.00 35.03 33.05 1gpy n LYS 312 CO 0.00 0.00 0.00 0.77 -0.52 0.00 0.00 177.40 177.65 1gpy h SER 313 N 0.00 -0.00 -1.48 4.39 0.02 -1.55 -2.09 113.55 112.84 1gpy h SER 313 Ca 0.74 0.00 -0.63 0.00 -0.84 0.00 0.00 61.79 61.06 1gpy h SER 313 Cb 2.95 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 65.48 1gpy h SER 313 CO -0.02 0.34 1.47 -0.24 -1.14 0.00 0.00 176.83 177.23 1gpy n SER 314 N -3.90 2.60 -3.33 3.07 2.88 -0.70 -0.21 113.62 114.03 1gpy n SER 314 Ca -0.00 0.28 -0.21 0.00 -1.33 0.00 0.00 58.87 57.61 1gpy n SER 314 Cb 0.00 -1.40 -0.04 0.00 -0.75 0.00 0.00 64.21 62.02 1gpy n SER 314 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 1gpy n LYS 315 N 8.48 -1.67 0.00 -1.46 4.76 -1.26 -4.27 118.16 122.74 1gpy n LYS 315 Ca 0.37 0.07 0.00 0.00 -2.87 0.00 0.00 58.31 55.87 1gpy n LYS 315 Cb 0.33 -4.11 0.00 0.00 -1.84 0.00 0.00 35.03 29.41 1gpy n LYS 315 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 1gpy n PHE 316 N -3.01 0.00 0.15 2.13 3.01 -1.01 -4.72 117.46 114.01 1gpy n PHE 316 Ca 0.06 0.00 0.06 0.00 1.01 0.00 0.00 57.45 58.58 1gpy n PHE 316 Cb 0.42 0.00 0.24 0.00 -0.01 0.00 0.00 39.48 40.13 1gpy n PHE 316 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1gpy n GLY 317 N 0.22 1.81 3.13 1.37 0.00 0.70 -3.46 105.19 108.96 1gpy n GLY 317 Ca 0.00 -0.56 0.02 0.00 0.00 0.00 0.00 46.02 45.48 1gpy n GLY 317 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gpy n ARG 319 N 4.46 0.00 0.00 0.00 0.00 -1.26 -4.65 116.66 115.20 1gpy n ARG 319 Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.94 1gpy n ARG 319 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 32.46 33.04 1gpy n ARG 319 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1gpy n ASP 320 N -0.48 0.00 -0.36 6.15 9.92 -1.22 -3.81 116.55 126.75 1gpy n ASP 320 Ca 0.00 0.00 -0.03 0.00 -0.53 0.00 0.00 54.79 54.23 1gpy n ASP 320 Cb 0.00 0.20 0.00 0.00 -0.64 0.00 0.00 41.12 40.68 1gpy n ASP 320 CO 0.00 0.00 0.00 -2.65 0.13 0.00 0.00 177.20 174.68 1gpy n PRO 321 N -2.15 0.00 0.00 -0.24 -0.02 -1.26 -3.03 135.00 128.30 1gpy n PRO 321 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1gpy n PRO 321 Cb 0.00 -0.09 0.00 0.00 -0.02 0.00 0.00 33.50 33.39 1gpy n PRO 321 CO 0.00 0.00 0.00 1.55 1.98 0.00 0.00 175.50 179.03 1gpy n VAL 322 N -0.17 0.00 -3.10 -1.45 3.14 -1.26 -4.04 118.33 111.45 1gpy n VAL 322 Ca 0.00 0.00 -0.20 0.00 -2.96 0.00 0.00 64.34 61.18 1gpy n VAL 322 Cb 0.04 0.00 -0.03 0.00 -1.06 0.00 0.00 33.84 32.79 1gpy n VAL 322 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 1gpy n ARG 323 N 0.00 1.54 -2.28 1.45 3.00 -1.26 -5.05 116.66 114.06 1gpy n ARG 323 Ca 0.00 -3.74 -0.00 0.00 -0.01 0.00 0.00 57.85 54.09 1gpy n ARG 323 Cb 0.00 -1.82 -0.00 0.00 0.00 0.00 0.00 32.46 30.63 1gpy n ARG 323 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.63 180.04 1gpy n THR 324 N 0.13 -5.59 -4.91 0.55 -1.04 -1.17 -4.89 114.28 97.37 1gpy n THR 324 Ca 0.26 1.28 -0.28 0.00 -2.04 0.00 0.00 64.05 63.27 1gpy n THR 324 Cb 0.60 -3.53 -0.17 0.00 -1.82 0.00 0.00 70.33 65.42 1gpy n THR 324 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 1gpy s ASN 325 N -0.25 2.39 0.00 8.00 0.02 -1.26 -4.96 114.94 118.88 1gpy s ASN 325 Ca -0.02 -0.41 0.09 0.00 -1.02 0.00 0.00 52.86 51.50 1gpy s ASN 325 Cb 0.00 -0.95 0.45 0.00 0.02 0.00 0.00 41.25 40.77 1gpy s ASN 325 CO 0.06 0.12 1.23 0.49 0.02 0.00 0.00 177.10 179.02 1gpy n PHE 326 N 3.48 0.00 -0.27 2.20 3.72 -1.26 -2.31 117.46 123.01 1gpy n PHE 326 Ca -0.20 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.24 1gpy n PHE 326 Cb 0.52 -0.36 0.26 0.00 -0.94 0.00 0.00 39.48 38.96 1gpy n PHE 326 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 1gpy h ASP 327 N 0.00 0.86 0.90 4.37 5.19 -1.96 -1.92 116.42 123.86 1gpy h ASP 327 Ca 0.00 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.41 1gpy h ASP 327 Cb 0.11 -0.19 0.00 0.00 0.18 0.00 0.00 39.33 39.44 1gpy h ASP 327 CO 0.00 0.57 0.00 0.00 -3.12 0.00 0.00 179.24 176.69 1gpy h ALA 328 N 1.53 1.00 -0.35 3.45 0.00 -1.90 -3.38 119.26 119.60 1gpy h ALA 328 Ca 0.36 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.27 1gpy h ALA 328 Cb 0.16 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1gpy h ALA 328 CO -0.13 0.00 0.21 0.35 0.00 0.00 0.00 179.25 179.69 1gpy h PHE 329 N 0.00 0.47 0.00 0.00 3.57 -1.54 0.43 116.94 119.87 1gpy h PHE 329 Ca 0.00 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1gpy h PHE 329 Cb 0.45 -0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.04 1gpy h PHE 329 CO 0.00 0.34 0.00 -0.35 -2.23 0.00 0.00 178.31 176.07 1gpy n PRO 330 N -4.80 0.29 -0.01 6.41 -0.04 -1.26 -0.86 135.00 134.74 1gpy n PRO 330 Ca -0.01 0.10 0.10 0.00 -0.04 0.00 0.00 63.50 63.65 1gpy n PRO 330 Cb 0.06 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 31.87 1gpy n PRO 330 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1gpy n ASP 331 N -1.18 0.63 -0.01 3.54 8.00 0.05 -4.31 116.55 123.28 1gpy n ASP 331 Ca 0.08 -0.23 0.09 0.00 0.71 0.00 0.00 54.79 55.45 1gpy n ASP 331 Cb 0.09 1.68 -0.14 0.00 -0.02 0.00 0.00 41.12 42.73 1gpy n ASP 331 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1gpy n LYS 332 N -2.00 0.63 -4.63 -1.24 5.02 -0.67 -4.42 118.16 110.85 1gpy n LYS 332 Ca -0.02 -0.14 -0.26 0.00 -2.02 0.00 0.00 58.31 55.87 1gpy n LYS 332 Cb 0.46 -1.42 -0.14 0.00 -0.02 0.00 0.00 35.03 33.91 1gpy n LYS 332 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1gpy s VAL 333 N -3.18 1.71 -0.03 -0.18 1.01 -0.04 -0.37 120.40 119.32 1gpy s VAL 333 Ca -0.05 -1.24 -0.01 0.00 0.00 0.00 0.00 61.98 60.68 1gpy s VAL 333 Cb 0.12 -1.49 0.03 0.00 0.00 0.00 0.00 36.38 35.04 1gpy s VAL 333 CO 0.75 0.20 0.04 0.00 0.00 0.00 0.00 175.10 176.10 1gpy s ALA 334 N -0.83 0.09 0.06 5.51 0.00 -0.29 -4.52 121.76 121.78 1gpy s ALA 334 Ca 0.08 0.31 0.09 0.00 0.00 0.00 0.00 51.96 52.43 1gpy s ALA 334 Cb -0.09 -0.35 -0.03 0.00 0.00 0.00 0.00 23.12 22.65 1gpy s ALA 334 CO 0.02 -0.20 -0.24 0.96 0.00 0.00 0.00 175.76 176.30 1gpy s ILE 335 N 1.33 2.36 -0.14 0.00 -5.25 -1.10 -0.97 121.20 117.44 1gpy s ILE 335 Ca -0.06 -1.40 0.01 0.00 -0.99 0.00 0.00 60.65 58.21 1gpy s ILE 335 Cb -0.13 -1.97 -0.00 0.00 2.95 0.00 0.00 42.46 43.31 1gpy s ILE 335 CO -0.03 0.30 -0.16 -1.58 -1.79 0.00 0.00 174.94 171.68 1gpy s GLN 336 N -1.47 3.23 -0.38 0.37 2.00 0.34 -3.20 119.66 120.56 1gpy s GLN 336 Ca 0.13 -0.75 -0.19 0.00 -2.00 0.00 0.00 55.36 52.55 1gpy s GLN 336 Cb -0.10 -2.58 0.01 0.00 0.80 0.00 0.00 33.01 31.13 1gpy s GLN 336 CO 0.04 0.08 0.56 -0.51 -0.50 0.00 0.00 175.29 174.96 1gpy s LEU 337 N 0.64 4.43 -0.89 3.68 2.01 -0.06 -2.34 118.68 126.15 1gpy s LEU 337 Ca -0.08 -0.15 -0.22 0.00 0.01 0.00 0.00 54.13 53.68 1gpy s LEU 337 Cb -0.16 -2.63 0.07 0.00 0.01 0.00 0.00 46.19 43.49 1gpy s LEU 337 CO 0.02 -0.58 1.26 0.21 1.01 0.00 0.00 176.35 178.27 1gpy s ASN 338 N 1.83 6.43 0.37 2.29 2.47 -1.15 -1.02 114.94 126.16 1gpy s ASN 338 Ca 0.20 -1.37 0.00 0.00 0.42 0.00 0.00 52.86 52.11 1gpy s ASN 338 Cb -0.15 -2.50 0.00 0.00 -1.45 0.00 0.00 41.25 37.15 1gpy s ASN 338 CO 0.15 -1.43 0.00 -0.67 -3.72 0.00 0.00 177.10 171.43 1gpy n ASP 339 N 8.15 -5.70 0.00 -4.21 -0.08 -0.94 -4.10 116.55 109.67 1gpy n ASP 339 Ca 0.20 0.82 0.06 0.00 -1.51 0.00 0.00 54.79 54.36 1gpy n ASP 339 Cb 0.49 -2.31 0.27 0.00 2.34 0.00 0.00 41.12 41.91 1gpy n ASP 339 CO 0.00 0.00 0.00 0.41 0.12 0.00 0.00 177.20 177.73 1gpy n THR 340 N -2.83 1.06 -0.07 5.18 -1.04 -1.26 -4.24 114.28 111.08 1gpy n THR 340 Ca 0.01 0.26 -0.02 0.00 -2.04 0.00 0.00 64.05 62.26 1gpy n THR 340 Cb 0.35 -1.06 0.24 0.00 -1.82 0.00 0.00 70.33 68.04 1gpy n THR 340 CO 0.00 0.00 0.00 0.45 -0.64 0.00 0.00 175.07 174.88 1gpy h HIS 341 N 0.00 0.71 -0.85 -1.42 3.86 -1.98 0.11 115.15 115.59 1gpy h HIS 341 Ca 0.00 -0.07 -0.51 0.00 -1.16 0.00 0.00 60.37 58.63 1gpy h HIS 341 Cb 0.19 -0.21 -0.25 0.00 1.06 0.00 0.00 27.41 28.19 1gpy h HIS 341 CO 0.00 0.63 0.66 -0.35 0.86 0.00 0.00 177.93 179.73 1gpy n PRO 342 N -4.28 2.26 0.29 2.45 -0.04 -1.26 -4.71 135.00 129.71 1gpy n PRO 342 Ca 0.03 -2.68 0.14 0.00 -0.04 0.00 0.00 63.50 60.95 1gpy n PRO 342 Cb 0.23 -2.05 0.86 0.00 -0.04 0.00 0.00 33.50 32.50 1gpy n PRO 342 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1gpy h SER 343 N 1.38 0.00 -0.47 3.54 4.64 -1.03 -1.91 113.55 119.71 1gpy h SER 343 Ca 0.53 0.00 0.13 0.00 -0.47 0.00 0.00 61.79 61.98 1gpy h SER 343 Cb 1.66 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.73 1gpy h SER 343 CO 1.16 0.02 0.41 -0.07 -0.87 0.00 0.00 176.83 177.49 1gpy h LEU 344 N 0.00 0.00 -0.93 5.97 4.07 -1.84 -1.64 115.31 120.94 1gpy h LEU 344 Ca -0.00 0.00 0.26 0.00 0.08 0.00 0.00 57.88 58.22 1gpy h LEU 344 Cb 0.06 0.00 -0.16 0.00 1.08 0.00 0.00 40.66 41.63 1gpy h LEU 344 CO 0.00 0.00 0.13 0.00 -1.08 0.00 0.00 178.44 177.49 1gpy h ALA 345 N 1.61 1.24 0.68 1.53 0.00 -1.70 0.13 119.26 122.75 1gpy h ALA 345 Ca 0.22 0.29 -0.03 0.00 0.00 0.00 0.00 54.91 55.39 1gpy h ALA 345 Cb 1.05 0.47 0.00 0.00 0.00 0.00 0.00 17.79 19.30 1gpy h ALA 345 CO -0.00 -0.55 -0.37 0.82 0.00 0.00 0.00 179.25 179.14 1gpy h ILE 346 N 0.08 0.00 0.00 0.00 2.04 -1.52 0.23 117.51 118.34 1gpy h ILE 346 Ca 0.58 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.44 1gpy h ILE 346 Cb 1.21 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.29 1gpy h ILE 346 CO -0.80 0.00 0.00 1.55 0.00 0.00 0.00 178.15 178.90 1gpy h PRO 347 N -0.98 0.00 -0.09 2.37 0.13 -1.69 -2.28 132.00 129.47 1gpy h PRO 347 Ca -0.09 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.87 1gpy h PRO 347 Cb 0.77 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.90 1gpy h PRO 347 CO 0.12 0.00 -0.60 1.49 -0.23 0.00 0.00 178.00 178.78 1gpy h GLU 348 N 0.00 0.56 -0.70 0.86 4.57 -0.60 0.13 114.58 119.40 1gpy h GLU 348 Ca 0.00 -0.49 -0.07 0.00 -1.18 0.00 0.00 59.36 57.62 1gpy h GLU 348 Cb 0.46 0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 29.14 1gpy h GLU 348 CO 0.00 1.11 0.17 1.25 -1.18 0.00 0.00 179.01 180.36 1gpy h LEU 349 N 0.17 1.07 -0.60 1.64 5.85 -0.52 -1.54 115.31 121.38 1gpy h LEU 349 Ca -0.05 -0.23 0.05 0.00 0.84 0.00 0.00 57.88 58.49 1gpy h LEU 349 Cb 1.26 -0.28 -0.05 0.00 0.37 0.00 0.00 40.66 41.96 1gpy h LEU 349 CO 0.12 1.03 0.33 0.24 -0.34 0.00 0.00 178.44 179.82 1gpy h MET 350 N 1.06 0.60 0.08 1.25 2.86 -1.31 -2.34 114.93 117.13 1gpy h MET 350 Ca 0.22 -0.04 0.01 0.00 -2.06 0.00 0.00 59.70 57.84 1gpy h MET 350 Cb 0.38 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.88 1gpy h MET 350 CO 0.00 0.40 -0.15 -0.09 1.06 0.00 0.00 176.91 178.13 1gpy h ARG 351 N 0.62 -0.28 -0.47 1.72 2.43 -0.27 -1.59 114.38 116.53 1gpy h ARG 351 Ca 0.27 0.02 -0.01 0.00 -0.81 0.00 0.00 59.98 59.45 1gpy h ARG 351 Cb 0.16 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.75 1gpy h ARG 351 CO -0.17 -0.19 0.26 0.28 -1.51 0.00 0.00 179.97 178.64 1gpy h VAL 352 N -0.29 1.17 -0.08 0.20 2.07 -1.24 0.16 116.25 118.23 1gpy h VAL 352 Ca 0.02 -0.42 -0.11 0.00 0.82 0.00 0.00 66.70 67.02 1gpy h VAL 352 Cb 0.31 0.58 0.00 0.00 -1.52 0.00 0.00 31.29 30.67 1gpy h VAL 352 CO -0.09 0.17 -0.37 -0.07 0.02 0.00 0.00 177.57 177.24 1gpy h LEU 353 N 0.63 0.47 0.01 2.57 3.38 -1.41 0.41 115.31 121.36 1gpy h LEU 353 Ca 0.17 -0.64 -0.05 0.00 0.09 0.00 0.00 57.88 57.44 1gpy h LEU 353 Cb 0.05 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.66 1gpy h LEU 353 CO -0.03 1.04 -0.21 0.58 0.09 0.00 0.00 178.44 179.91 1gpy h VAL 354 N -0.07 1.61 0.14 1.22 2.07 -1.22 -0.23 116.25 119.77 1gpy h VAL 354 Ca -0.02 -2.07 -0.31 0.00 0.82 0.00 0.00 66.70 65.11 1gpy h VAL 354 Cb 1.02 2.97 0.00 0.00 -1.52 0.00 0.00 31.29 33.76 1gpy h VAL 354 CO 0.08 0.56 -1.53 0.44 0.02 0.00 0.00 177.57 177.14 1gpy h ASP 355 N -0.64 0.46 0.00 0.57 3.32 -0.79 -2.54 116.42 116.81 1gpy h ASP 355 Ca -0.03 -0.62 -0.43 0.00 0.02 0.00 0.00 57.03 55.97 1gpy h ASP 355 Cb 1.03 -0.15 -0.07 0.00 0.22 0.00 0.00 39.33 40.36 1gpy h ASP 355 CO 0.04 1.51 -2.46 0.18 -1.72 0.00 0.00 179.24 176.79 1gpy n LEU 356 N -3.50 2.29 -0.18 1.55 4.32 -0.78 -4.53 117.00 116.17 1gpy n LEU 356 Ca -0.17 0.19 0.13 0.00 -0.02 0.00 0.00 56.01 56.15 1gpy n LEU 356 Cb 1.05 -0.86 0.48 0.00 -1.62 0.00 0.00 43.42 42.46 1gpy n LEU 356 CO 0.52 0.68 0.74 -0.62 -1.22 0.00 0.00 177.39 177.50 1gpy n GLU 357 N -3.93 0.74 -1.15 3.23 -0.58 0.14 -4.92 120.64 114.17 1gpy n GLU 357 Ca -0.51 -0.37 -0.05 0.00 -0.42 0.00 0.00 57.16 55.82 1gpy n GLU 357 Cb 0.92 -1.49 -0.02 0.00 -0.57 0.00 0.00 31.44 30.27 1gpy n GLU 357 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1gpy n ARG 358 N -0.81 -0.76 -1.34 3.49 5.12 -0.22 -4.92 116.66 117.22 1gpy n ARG 358 Ca 0.13 0.56 -0.33 0.00 -1.93 0.00 0.00 57.85 56.28 1gpy n ARG 358 Cb 0.32 -4.35 0.10 0.00 -1.16 0.00 0.00 32.46 27.36 1gpy n ARG 358 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1gpy s LEU 359 N -1.18 3.21 0.53 0.55 1.43 -0.49 -4.97 118.68 117.76 1gpy s LEU 359 Ca 0.00 2.19 -0.20 0.00 -1.03 0.00 0.00 54.13 55.09 1gpy s LEU 359 Cb 0.00 -4.57 -0.06 0.00 0.03 0.00 0.00 46.19 41.59 1gpy s LEU 359 CO 0.00 -2.27 1.11 -1.81 0.23 0.00 0.00 176.35 173.61 1gpy s ASP 360 N -2.42 5.86 0.08 2.29 1.11 -1.26 -4.44 116.67 117.90 1gpy s ASP 360 Ca 0.70 2.13 -0.29 0.00 0.18 0.00 0.00 52.55 55.27 1gpy s ASP 360 Cb -0.25 -2.58 -0.16 0.00 1.07 0.00 0.00 42.92 41.01 1gpy s ASP 360 CO 0.48 -1.12 1.66 -0.25 1.18 0.00 0.00 175.17 177.12 1gpy h TRP 361 N 1.31 -0.61 -0.02 4.23 7.01 -1.97 -2.50 115.95 123.40 1gpy h TRP 361 Ca -0.50 -0.01 -0.07 0.00 2.11 0.00 0.00 58.89 60.42 1gpy h TRP 361 Cb 1.25 0.22 -0.01 0.00 -2.10 0.00 0.00 29.16 28.52 1gpy h TRP 361 CO 0.52 -0.36 -0.34 -0.44 -2.79 0.00 0.00 178.44 175.03 1gpy h ASP 362 N -0.59 0.03 -0.58 2.65 3.32 -1.99 0.16 116.42 119.42 1gpy h ASP 362 Ca -0.04 -0.01 -0.10 0.00 0.02 0.00 0.00 57.03 56.90 1gpy h ASP 362 Cb 0.48 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 40.00 1gpy h ASP 362 CO 0.05 0.37 -0.02 0.50 -1.72 0.00 0.00 179.24 178.43 1gpy h LYS 363 N 0.03 1.04 -0.02 3.56 3.11 -1.87 -2.96 116.57 119.46 1gpy h LYS 363 Ca 0.00 -0.34 -0.15 0.00 -2.81 0.00 0.00 60.65 57.35 1gpy h LYS 363 Cb 0.62 -0.09 -0.02 0.00 -1.00 0.00 0.00 32.23 31.75 1gpy h LYS 363 CO 0.05 1.03 -0.70 0.00 -2.81 0.00 0.00 179.45 177.02 1gpy h ALA 364 N 0.97 0.81 -0.18 5.00 0.00 -0.90 -2.53 119.26 122.42 1gpy h ALA 364 Ca 0.16 -0.62 -0.14 0.00 0.00 0.00 0.00 54.91 54.31 1gpy h ALA 364 Cb 0.57 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1gpy h ALA 364 CO 0.03 0.84 -0.47 2.35 0.00 0.00 0.00 179.25 181.99 1gpy h TRP 365 N 0.06 0.58 -0.00 0.00 2.91 -0.65 -1.40 115.95 117.44 1gpy h TRP 365 Ca -0.01 -0.18 0.01 0.00 1.13 0.00 0.00 58.89 59.84 1gpy h TRP 365 Cb 1.23 -0.12 -0.02 0.00 -0.51 0.00 0.00 29.16 29.75 1gpy h TRP 365 CO 0.01 0.86 -0.06 1.49 -1.03 0.00 0.00 178.44 179.70 1gpy h GLU 366 N 0.38 -0.11 0.38 2.65 4.81 -1.44 -2.61 114.58 118.64 1gpy h GLU 366 Ca 0.02 0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.24 1gpy h GLU 366 Cb 0.97 0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.38 1gpy h GLU 366 CO 0.09 -0.07 -0.18 0.28 -0.73 0.00 0.00 179.01 178.39 1gpy h VAL 367 N -0.11 0.57 -0.56 0.32 2.07 -1.37 -2.72 116.25 114.44 1gpy h VAL 367 Ca 0.03 -0.53 0.11 0.00 0.82 0.00 0.00 66.70 67.13 1gpy h VAL 367 Cb 0.15 0.80 -0.10 0.00 -1.52 0.00 0.00 31.29 30.62 1gpy h VAL 367 CO -0.07 0.09 -0.05 0.74 0.02 0.00 0.00 177.57 178.30 1gpy h THR 368 N -0.84 0.50 -0.59 2.57 2.02 -1.18 -2.25 112.91 113.15 1gpy h THR 368 Ca -0.05 -0.02 -0.09 0.00 0.77 0.00 0.00 66.41 67.01 1gpy h THR 368 Cb 0.54 0.43 -0.02 0.00 -1.74 0.00 0.00 68.15 67.35 1gpy h THR 368 CO 0.09 0.01 0.00 0.58 0.37 0.00 0.00 175.52 176.57 1gpy h VAL 369 N 0.07 1.27 0.00 3.16 2.07 -1.34 0.31 116.25 121.79 1gpy h VAL 369 Ca 0.28 -1.14 0.00 0.00 0.82 0.00 0.00 66.70 66.67 1gpy h VAL 369 Cb 0.44 0.83 0.00 0.00 -1.52 0.00 0.00 31.29 31.05 1gpy h VAL 369 CO -0.52 0.41 0.00 0.29 0.02 0.00 0.00 177.57 177.77 1gpy n LYS 370 N -4.22 0.05 -0.10 1.57 5.02 -1.01 -1.63 118.16 117.86 1gpy n LYS 370 Ca 0.02 0.20 -0.20 0.00 -2.02 0.00 0.00 58.31 56.31 1gpy n LYS 370 Cb 0.34 -1.58 -0.12 0.00 -0.02 0.00 0.00 35.03 33.65 1gpy n LYS 370 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1gpy n THR 371 N -1.68 1.57 -3.52 -0.18 -1.04 -0.56 -4.84 114.28 104.04 1gpy n THR 371 Ca 0.04 -0.55 -0.34 0.00 -2.04 0.00 0.00 64.05 61.17 1gpy n THR 371 Cb 0.25 -1.58 -0.05 0.00 -1.82 0.00 0.00 70.33 67.13 1gpy n THR 371 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1gpy s ALA 373 N -1.53 -0.14 -0.01 0.00 0.00 -1.19 -1.01 121.76 117.88 1gpy s ALA 373 Ca 0.38 0.25 0.08 0.00 0.00 0.00 0.00 51.96 52.67 1gpy s ALA 373 Cb -0.13 -0.16 -0.02 0.00 0.00 0.00 0.00 23.12 22.80 1gpy s ALA 373 CO 0.20 -0.06 -0.26 -0.47 0.00 0.00 0.00 175.76 175.18 1gpy s TYR 374 N 0.31 2.34 -0.21 0.00 5.04 -0.45 -0.88 117.35 123.50 1gpy s TYR 374 Ca -0.02 -0.43 -0.03 0.00 -2.44 0.00 0.00 57.07 54.15 1gpy s TYR 374 Cb -0.03 -1.48 0.00 0.00 0.35 0.00 0.00 41.96 40.79 1gpy s TYR 374 CO -0.01 -0.00 -0.08 0.99 -1.34 0.00 0.00 175.55 175.11 1gpy s THR 375 N -0.65 3.03 -0.03 4.34 2.01 -0.19 -1.88 115.64 122.27 1gpy s THR 375 Ca 0.10 -0.64 -0.22 0.00 0.31 0.00 0.00 61.69 61.24 1gpy s THR 375 Cb -0.10 -2.37 -0.05 0.00 0.01 0.00 0.00 72.50 69.99 1gpy s THR 375 CO -0.00 0.43 0.65 0.21 -0.69 0.00 0.00 174.62 175.21 1gpy s ASN 376 N 1.42 6.99 -0.00 3.53 3.84 -0.27 -2.22 114.94 128.24 1gpy s ASN 376 Ca 0.05 1.18 0.12 0.00 0.21 0.00 0.00 52.86 54.43 1gpy s ASN 376 Cb -0.14 -2.39 -0.14 0.00 -0.55 0.00 0.00 41.25 38.02 1gpy s ASN 376 CO -0.06 -0.00 0.49 1.41 -2.79 0.00 0.00 177.10 176.15 1gpy n HIS 377 N 3.23 0.00 -3.84 0.43 8.25 -1.26 -3.84 115.22 118.18 1gpy n HIS 377 Ca -0.04 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.35 1gpy n HIS 377 Cb 0.51 -0.05 -0.02 0.00 1.12 0.00 0.00 29.99 31.56 1gpy n HIS 377 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 1gpy s THR 378 N -2.28 0.00 0.00 1.59 -1.32 -1.26 -4.56 115.64 107.81 1gpy s THR 378 Ca 0.03 -0.95 0.00 0.00 -1.21 0.00 0.00 61.69 59.56 1gpy s THR 378 Cb 0.09 -2.01 0.00 0.00 -1.51 0.00 0.00 72.50 69.07 1gpy s THR 378 CO 0.51 0.00 0.00 0.55 -2.21 0.00 0.00 174.62 173.47 1gpy n VAL 379 N -0.46 0.00 -1.65 5.08 3.14 -1.26 -5.00 118.33 118.18 1gpy n VAL 379 Ca -0.04 -0.36 -0.45 0.00 -2.96 0.00 0.00 64.34 60.53 1gpy n VAL 379 Cb 0.59 0.95 -0.04 0.00 -1.06 0.00 0.00 33.84 34.28 1gpy n VAL 379 CO 0.00 0.00 0.00 -0.11 -6.46 0.00 0.00 176.83 170.26 1gpy n LEU 380 N -0.81 3.69 -0.00 6.55 7.94 -1.26 -4.93 117.00 128.17 1gpy n LEU 380 Ca 0.00 0.77 -0.11 0.00 -1.11 0.00 0.00 56.01 55.56 1gpy n LEU 380 Cb 0.00 -1.47 -0.06 0.00 0.53 0.00 0.00 43.42 42.42 1gpy n LEU 380 CO 0.00 -0.08 0.87 1.55 -1.11 0.00 0.00 177.39 178.62 1gpy h PRO 381 N 11.08 0.12 0.00 1.96 0.13 -1.98 -2.79 132.00 140.52 1gpy h PRO 381 Ca -0.47 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1gpy h PRO 381 Cb 1.25 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1gpy h PRO 381 CO 0.95 0.14 0.04 -0.85 -0.23 0.00 0.00 178.00 178.05 1gpy n GLU 382 N -4.99 0.13 0.02 0.86 0.00 -1.26 -2.06 120.64 113.33 1gpy n GLU 382 Ca -0.06 0.63 0.13 0.00 0.00 0.00 0.00 57.16 57.86 1gpy n GLU 382 Cb 0.06 -1.97 0.44 0.00 0.00 0.00 0.00 31.44 29.97 1gpy n GLU 382 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1gpy n ALA 383 N -1.74 2.77 -2.31 -1.84 0.00 -1.05 -1.96 120.51 114.38 1gpy n ALA 383 Ca -0.01 -0.19 -0.39 0.00 0.00 0.00 0.00 53.44 52.85 1gpy n ALA 383 Cb 0.07 -1.33 -0.06 0.00 0.00 0.00 0.00 19.45 18.13 1gpy n ALA 383 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1gpy s LEU 384 N -3.27 4.49 -0.21 0.00 2.96 -0.87 -4.43 118.68 117.34 1gpy s LEU 384 Ca 0.12 1.40 -0.21 0.00 -0.22 0.00 0.00 54.13 55.21 1gpy s LEU 384 Cb 0.17 -3.12 -0.02 0.00 0.50 0.00 0.00 46.19 43.72 1gpy s LEU 384 CO 0.61 0.12 0.67 -1.61 -1.32 0.00 0.00 176.35 174.82 1gpy s GLU 385 N -0.49 4.19 -0.32 1.98 2.02 -1.26 -4.85 118.70 119.98 1gpy s GLU 385 Ca 0.35 0.67 -0.02 0.00 0.02 0.00 0.00 54.97 55.98 1gpy s GLU 385 Cb -0.20 -3.60 0.11 0.00 0.10 0.00 0.00 34.13 30.53 1gpy s GLU 385 CO 0.22 -0.32 0.15 1.03 0.02 0.00 0.00 175.26 176.36 1gpy s ARG 386 N 2.19 0.39 0.06 1.61 0.52 -1.26 -1.97 118.95 120.50 1gpy s ARG 386 Ca 0.30 -0.87 -0.26 0.00 -0.52 0.00 0.00 55.73 54.37 1gpy s ARG 386 Cb -0.16 -1.34 -0.06 0.00 0.52 0.00 0.00 34.95 33.92 1gpy s ARG 386 CO 0.10 -1.07 0.81 -1.58 0.02 0.00 0.00 175.30 173.57 1gpy s TRP 387 N 1.69 3.76 0.01 -0.53 0.52 -0.92 -4.72 118.94 118.76 1gpy s TRP 387 Ca 0.12 1.55 -0.36 0.00 0.02 0.00 0.00 56.10 57.43 1gpy s TRP 387 Cb -0.18 -2.87 -0.15 0.00 -1.15 0.00 0.00 33.47 29.12 1gpy s TRP 387 CO -0.24 0.27 1.58 -2.30 0.02 0.00 0.00 176.95 176.28 1gpy n PRO 388 N 2.76 1.63 -0.31 4.98 -0.02 -1.26 -1.07 135.00 141.70 1gpy n PRO 388 Ca -0.02 0.59 0.24 0.00 -2.02 0.00 0.00 63.50 62.29 1gpy n PRO 388 Cb 0.50 -2.31 0.54 0.00 -0.02 0.00 0.00 33.50 32.21 1gpy n PRO 388 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 1gpy h VAL 389 N 4.14 0.54 -0.87 -1.45 -1.51 -1.81 0.75 116.25 116.03 1gpy h VAL 389 Ca -0.47 -0.12 0.10 0.00 -1.23 0.00 0.00 66.70 64.98 1gpy h VAL 389 Cb 1.30 0.17 -0.07 0.00 -2.13 0.00 0.00 31.29 30.55 1gpy h VAL 389 CO 0.87 0.06 0.51 -0.74 -1.23 0.00 0.00 177.57 177.05 1gpy h HIS 390 N 0.34 0.93 -0.18 5.19 -0.00 -1.91 0.09 115.15 119.61 1gpy h HIS 390 Ca 0.57 0.03 -0.01 0.00 -0.00 0.00 0.00 60.37 60.96 1gpy h HIS 390 Cb 1.55 -0.29 -0.01 0.00 -0.00 0.00 0.00 27.41 28.66 1gpy h HIS 390 CO -0.00 0.39 0.09 -0.07 -0.00 0.00 0.00 177.93 178.34 1gpy h LEU 391 N 0.86 0.23 -0.04 0.26 4.07 -1.22 -3.06 115.31 116.42 1gpy h LEU 391 Ca 0.42 -0.11 0.01 0.00 0.08 0.00 0.00 57.88 58.27 1gpy h LEU 391 Cb 0.37 -0.06 -0.01 0.00 1.08 0.00 0.00 40.66 42.04 1gpy h LEU 391 CO -0.24 0.28 -0.02 -0.07 -1.08 0.00 0.00 178.44 177.31 1gpy h LEU 392 N 0.17 -0.05 -0.17 1.67 3.38 -1.33 -1.46 115.31 117.51 1gpy h LEU 392 Ca 0.06 0.01 0.02 0.00 0.09 0.00 0.00 57.88 58.06 1gpy h LEU 392 Cb 0.11 0.03 -0.02 0.00 0.09 0.00 0.00 40.66 40.87 1gpy h LEU 392 CO -0.01 -0.02 -0.10 1.21 0.09 0.00 0.00 178.44 179.61 1gpy n GLU 393 N -5.12 -0.08 0.17 1.13 4.07 -0.02 -0.57 120.64 120.23 1gpy n GLU 393 Ca -0.06 0.44 -0.13 0.00 -0.06 0.00 0.00 57.16 57.35 1gpy n GLU 393 Cb 0.06 -0.66 -0.08 0.00 -0.06 0.00 0.00 31.44 30.70 1gpy n GLU 393 CO 0.00 0.00 0.00 1.15 -0.06 0.00 0.00 177.13 178.22 1gpy h THR 394 N 0.00 0.63 0.19 6.31 2.02 -1.39 -3.20 112.91 117.46 1gpy h THR 394 Ca 0.03 -0.61 -0.30 0.00 0.77 0.00 0.00 66.41 66.30 1gpy h THR 394 Cb 0.07 0.91 0.02 0.00 -1.74 0.00 0.00 68.15 67.41 1gpy h THR 394 CO -0.16 0.11 -1.41 0.25 0.37 0.00 0.00 175.52 174.68 1gpy h LEU 395 N -0.82 0.62 -6.08 2.58 5.85 -1.11 -3.37 115.31 112.98 1gpy h LEU 395 Ca -0.05 -0.92 -0.58 0.00 0.84 0.00 0.00 57.88 57.18 1gpy h LEU 395 Cb 0.52 -0.20 -0.41 0.00 0.37 0.00 0.00 40.66 40.94 1gpy h LEU 395 CO 0.07 1.65 -0.84 0.18 -0.34 0.00 0.00 178.44 179.17 1gpy n LEU 396 N -3.81 2.12 -0.29 2.25 4.77 0.27 -0.35 117.00 121.96 1gpy n LEU 396 Ca -0.20 -5.11 0.11 0.00 -0.03 0.00 0.00 56.01 50.78 1gpy n LEU 396 Cb 1.00 -0.05 0.26 0.00 -2.33 0.00 0.00 43.42 42.29 1gpy n LEU 396 CO 0.52 2.08 0.92 -0.65 -1.33 0.00 0.00 177.39 178.92 1gpy h PRO 397 N 4.04 0.19 -0.02 3.23 0.11 -1.53 -2.64 132.00 135.38 1gpy h PRO 397 Ca 0.14 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 66.22 1gpy h PRO 397 Cb 0.76 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.83 1gpy h PRO 397 CO 0.66 0.13 -0.05 0.00 -0.21 0.00 0.00 178.00 178.52 1gpy h ARG 398 N 0.20 0.08 -0.82 1.05 2.47 -1.91 -3.22 114.38 112.23 1gpy h ARG 398 Ca 0.52 -0.05 0.06 0.00 -1.26 0.00 0.00 59.98 59.25 1gpy h ARG 398 Cb 1.01 0.01 -0.05 0.00 -1.65 0.00 0.00 29.97 29.28 1gpy h ARG 398 CO -0.65 0.65 0.54 0.45 0.56 0.00 0.00 179.97 181.52 1gpy h HIS 399 N -0.49 0.92 0.00 3.04 3.86 -1.88 0.30 115.15 120.90 1gpy h HIS 399 Ca -0.00 0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 59.21 1gpy h HIS 399 Cb 0.65 -0.30 -0.00 0.00 1.06 0.00 0.00 27.41 28.82 1gpy h HIS 399 CO 0.13 0.49 -0.10 1.25 0.86 0.00 0.00 177.93 180.56 1gpy h LEU 400 N 0.91 0.00 0.20 2.43 6.46 -1.48 -1.22 115.31 122.62 1gpy h LEU 400 Ca 0.35 0.00 -0.29 0.00 -0.12 0.00 0.00 57.88 57.82 1gpy h LEU 400 Cb 0.22 0.00 0.03 0.00 -0.73 0.00 0.00 40.66 40.18 1gpy h LEU 400 CO -0.13 0.10 -1.26 1.56 -0.62 0.00 0.00 178.44 178.09 1gpy h GLN 401 N 0.00 0.50 -0.69 1.25 4.20 -0.46 -3.03 115.11 116.88 1gpy h GLN 401 Ca -0.00 -0.80 -0.02 0.00 0.06 0.00 0.00 58.65 57.88 1gpy h GLN 401 Cb 0.45 0.29 -0.03 0.00 0.30 0.00 0.00 27.48 28.50 1gpy h GLN 401 CO 0.01 1.38 0.34 0.82 -0.67 0.00 0.00 178.83 180.71 1gpy h ILE 402 N 0.03 1.23 -0.42 2.54 2.04 -1.26 -1.08 117.51 120.59 1gpy h ILE 402 Ca -0.21 -0.62 -0.04 0.00 1.00 0.00 0.00 64.86 64.99 1gpy h ILE 402 Cb 1.98 0.37 -0.02 0.00 -0.74 0.00 0.00 36.82 38.41 1gpy h ILE 402 CO 0.24 0.26 0.10 0.40 0.00 0.00 0.00 178.15 179.15 1gpy h ILE 403 N 0.95 1.19 -0.13 -0.67 2.04 -1.25 -1.32 117.51 118.32 1gpy h ILE 403 Ca 0.24 -0.66 -0.18 0.00 1.00 0.00 0.00 64.86 65.26 1gpy h ILE 403 Cb 0.10 0.76 -0.00 0.00 -0.74 0.00 0.00 36.82 36.93 1gpy h ILE 403 CO -0.03 0.24 -0.66 1.88 0.00 0.00 0.00 178.15 179.58 1gpy h TYR 404 N 0.61 0.64 -0.10 1.37 0.05 -1.33 -1.62 116.97 116.59 1gpy h TYR 404 Ca 0.14 -0.26 -0.02 0.00 0.05 0.00 0.00 58.73 58.65 1gpy h TYR 404 Cb 0.23 -0.11 -0.00 0.00 1.01 0.00 0.00 36.73 37.86 1gpy h TYR 404 CO 0.01 1.01 -0.00 1.49 -1.05 0.00 0.00 178.16 179.62 1gpy h GLU 405 N 0.35 0.17 -0.11 4.88 4.22 -0.92 -2.31 114.58 120.88 1gpy h GLU 405 Ca -0.02 -0.05 0.04 0.00 0.08 0.00 0.00 59.36 59.41 1gpy h GLU 405 Cb 1.22 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 30.40 1gpy h GLU 405 CO 0.12 0.43 -0.21 0.82 -2.18 0.00 0.00 179.01 177.98 1gpy h ILE 406 N -0.10 0.48 -0.38 2.32 2.04 -1.33 -1.41 117.51 119.13 1gpy h ILE 406 Ca 0.03 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.97 1gpy h ILE 406 Cb 0.35 0.48 -0.08 0.00 -0.74 0.00 0.00 36.82 36.82 1gpy h ILE 406 CO 0.01 0.00 -0.20 -1.13 0.00 0.00 0.00 178.15 176.82 1gpy h ASN 407 N -0.28 -0.69 -0.05 1.72 -1.24 -1.32 -0.38 115.58 113.33 1gpy h ASN 407 Ca 0.09 0.15 0.02 0.00 0.71 0.00 0.00 56.30 57.27 1gpy h ASN 407 Cb 0.42 0.36 -0.05 0.00 0.73 0.00 0.00 38.32 39.79 1gpy h ASN 407 CO -0.27 -0.24 -0.42 -0.61 -1.29 0.00 0.00 177.43 174.61 1gpy h GLN 408 N -0.14 -0.47 -0.35 6.67 4.15 -1.24 0.22 115.11 123.95 1gpy h GLN 408 Ca 0.19 0.03 -0.10 0.00 0.77 0.00 0.00 58.65 59.54 1gpy h GLN 408 Cb 0.43 0.11 -0.02 0.00 0.21 0.00 0.00 27.48 28.21 1gpy h GLN 408 CO -0.47 -0.31 -0.19 0.00 -1.93 0.00 0.00 178.83 175.93 1gpy h ARG 409 N -0.49 0.65 -0.00 1.69 3.08 -0.97 -2.97 114.38 115.37 1gpy h ARG 409 Ca 0.02 -0.24 -0.00 0.00 0.07 0.00 0.00 59.98 59.83 1gpy h ARG 409 Cb 0.54 -0.04 -0.00 0.00 0.08 0.00 0.00 29.97 30.55 1gpy h ARG 409 CO -0.30 0.80 0.00 0.35 -1.07 0.00 0.00 179.97 179.75 1gpy h PHE 410 N 0.58 0.00 0.00 3.04 3.57 -0.40 -1.40 116.94 122.34 1gpy h PHE 410 Ca 0.09 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.59 1gpy h PHE 410 Cb 0.64 -0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.38 1gpy h PHE 410 CO 0.03 0.11 0.00 1.28 -2.23 0.00 0.00 178.31 177.50 1gpy n LEU 411 N -5.04 0.00 0.02 0.59 4.77 0.70 -1.03 117.00 117.01 1gpy n LEU 411 Ca -0.07 0.04 0.01 0.00 -0.03 0.00 0.00 56.01 55.96 1gpy n LEU 411 Cb 0.08 -0.04 -0.09 0.00 -2.33 0.00 0.00 43.42 41.03 1gpy n LEU 411 CO 0.33 -0.01 -0.42 0.59 -1.33 0.00 0.00 177.39 176.55 1gpy n ASN 412 N -1.04 0.67 -0.04 -1.43 3.02 -0.61 -2.74 115.26 113.09 1gpy n ASN 412 Ca 0.14 0.29 -0.16 0.00 -0.03 0.00 0.00 54.58 54.83 1gpy n ASN 412 Cb 0.08 0.47 -0.07 0.00 -0.61 0.00 0.00 39.78 39.65 1gpy n ASN 412 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 1gpy h ARG 413 N 0.00 0.64 0.39 3.52 3.08 -0.26 -2.97 114.38 118.78 1gpy h ARG 413 Ca -0.18 -0.48 -0.02 0.00 0.07 0.00 0.00 59.98 59.38 1gpy h ARG 413 Cb 1.55 0.08 -0.01 0.00 0.08 0.00 0.00 29.97 31.68 1gpy h ARG 413 CO 0.04 1.10 -0.28 0.28 -1.07 0.00 0.00 179.97 180.03 1gpy h VAL 414 N 0.31 0.00 -0.97 2.04 2.07 -1.43 -1.78 116.25 116.50 1gpy h VAL 414 Ca -0.02 0.00 0.27 0.00 0.82 0.00 0.00 66.70 67.77 1gpy h VAL 414 Cb 1.16 0.00 -0.18 0.00 -1.52 0.00 0.00 31.29 30.75 1gpy h VAL 414 CO 0.11 0.00 0.04 0.00 0.02 0.00 0.00 177.57 177.74 1gpy n ALA 415 N -2.50 0.51 -0.24 1.67 0.00 -1.11 0.31 120.51 119.14 1gpy n ALA 415 Ca -0.08 1.03 -0.07 0.00 0.00 0.00 0.00 53.44 54.33 1gpy n ALA 415 Cb 0.28 -0.76 0.07 0.00 0.00 0.00 0.00 19.45 19.03 1gpy n ALA 415 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1gpy h ALA 416 N 1.93 0.99 0.06 0.00 0.00 -1.33 -1.37 119.26 119.54 1gpy h ALA 416 Ca 0.59 -0.24 -0.26 0.00 0.00 0.00 0.00 54.91 55.00 1gpy h ALA 416 Cb 1.24 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 1gpy h ALA 416 CO -0.90 0.66 -1.28 0.00 0.00 0.00 0.00 179.25 177.72 1gpy h ALA 417 N 1.13 0.32 -2.35 0.00 0.00 0.23 -3.37 119.26 115.22 1gpy h ALA 417 Ca 0.22 -1.03 -0.60 0.00 0.00 0.00 0.00 54.91 53.51 1gpy h ALA 417 Cb 0.36 0.07 -0.42 0.00 0.00 0.00 0.00 17.79 17.80 1gpy h ALA 417 CO 0.00 1.20 -0.65 1.19 0.00 0.00 0.00 179.25 180.99 1gpy n PHE 418 N -3.38 3.02 -1.71 0.00 3.72 0.15 -5.08 117.46 114.17 1gpy n PHE 418 Ca -0.08 -4.10 -0.57 0.00 -0.05 0.00 0.00 57.45 52.65 1gpy n PHE 418 Cb 1.00 -0.53 -0.07 0.00 -0.94 0.00 0.00 39.48 38.94 1gpy n PHE 418 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 1gpy n PRO 419 N 1.18 1.21 -0.38 -1.08 -0.02 -0.53 -2.63 135.00 132.74 1gpy n PRO 419 Ca 0.27 0.44 0.00 0.00 -2.02 0.00 0.00 63.50 62.19 1gpy n PRO 419 Cb 0.41 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 31.76 1gpy n PRO 419 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1gpy n GLY 420 N 4.24 1.88 2.98 -1.23 0.00 -1.26 -4.92 105.19 106.87 1gpy n GLY 420 Ca 0.26 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.86 1gpy n GLY 420 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1gpy n ASP 421 N 0.00 4.60 -0.15 1.61 -0.08 -1.08 -4.77 116.55 116.69 1gpy n ASP 421 Ca 0.00 -2.96 -0.03 0.00 -1.51 0.00 0.00 54.79 50.29 1gpy n ASP 421 Cb 0.00 -1.60 0.06 0.00 2.34 0.00 0.00 41.12 41.92 1gpy n ASP 421 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 1gpy h VAL 422 N 4.19 0.68 -0.93 5.18 2.07 -1.91 -2.71 116.25 122.81 1gpy h VAL 422 Ca 0.46 -0.06 0.09 0.00 0.82 0.00 0.00 66.70 68.01 1gpy h VAL 422 Cb 0.69 0.50 -0.07 0.00 -1.52 0.00 0.00 31.29 30.89 1gpy h VAL 422 CO 1.67 0.03 0.58 -0.78 0.02 0.00 0.00 177.57 179.09 1gpy h ASP 423 N 0.17 0.88 -0.54 0.57 1.82 -1.99 -2.26 116.42 115.07 1gpy h ASP 423 Ca 0.24 0.03 0.04 0.00 -0.39 0.00 0.00 57.03 56.95 1gpy h ASP 423 Cb 0.34 -0.15 -0.04 0.00 0.68 0.00 0.00 39.33 40.15 1gpy h ASP 423 CO -0.35 0.52 0.29 -0.09 -1.61 0.00 0.00 179.24 178.00 1gpy h ARG 424 N 0.99 0.55 -0.30 0.28 2.43 -1.89 0.28 114.38 116.72 1gpy h ARG 424 Ca 0.43 -0.03 0.03 0.00 -0.81 0.00 0.00 59.98 59.60 1gpy h ARG 424 Cb 0.31 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.71 1gpy h ARG 424 CO -0.22 0.36 0.12 -0.07 -1.51 0.00 0.00 179.97 178.65 1gpy h LEU 425 N 0.56 0.15 -0.68 3.80 4.07 -1.35 0.49 115.31 122.35 1gpy h LEU 425 Ca 0.23 0.03 0.00 0.00 0.08 0.00 0.00 57.88 58.22 1gpy h LEU 425 Cb 0.12 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.86 1gpy h LEU 425 CO -0.15 0.12 0.00 0.08 -1.08 0.00 0.00 178.44 177.41 1gpy h ARG 426 N 0.26 0.00 0.01 1.13 0.11 -1.22 -0.60 114.38 114.07 1gpy h ARG 426 Ca 0.13 0.00 -0.22 0.00 0.10 0.00 0.00 59.98 59.99 1gpy h ARG 426 Cb 0.09 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.13 1gpy h ARG 426 CO -0.12 0.00 -1.07 0.00 0.10 0.00 0.00 179.97 178.87 1gpy h ARG 427 N 0.00 0.01 0.00 0.08 3.08 0.13 -3.35 114.38 114.33 1gpy h ARG 427 Ca 0.00 -0.02 -0.06 0.00 0.07 0.00 0.00 59.98 59.97 1gpy h ARG 427 Cb 0.63 0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.68 1gpy h ARG 427 CO 0.00 0.97 -0.86 0.52 -1.07 0.00 0.00 179.97 179.53 1gpy h MET 428 N 0.00 0.00 -5.75 0.04 2.86 0.30 -3.48 114.93 108.90 1gpy h MET 428 Ca -0.04 0.00 -0.75 0.00 -2.06 0.00 0.00 59.70 56.85 1gpy h MET 428 Cb 1.80 0.00 0.05 0.00 0.06 0.00 0.00 31.60 33.51 1gpy h MET 428 CO 0.13 0.14 0.02 0.45 1.06 0.00 0.00 176.91 178.70 1gpy n SER 429 N -2.88 -0.09 0.19 1.22 2.88 -0.27 -4.85 113.62 109.82 1gpy n SER 429 Ca -0.01 1.11 0.13 0.00 -1.33 0.00 0.00 58.87 58.77 1gpy n SER 429 Cb 0.64 -0.88 0.36 0.00 -0.75 0.00 0.00 64.21 63.57 1gpy n SER 429 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 1gpy h LEU 430 N 2.74 0.00 -8.38 2.46 3.38 -1.91 -3.42 115.31 110.18 1gpy h LEU 430 Ca -0.47 0.00 -0.69 0.00 0.09 0.00 0.00 57.88 56.81 1gpy h LEU 430 Cb 1.37 0.00 -0.25 0.00 0.09 0.00 0.00 40.66 41.87 1gpy h LEU 430 CO 0.62 0.00 -0.58 -0.69 0.09 0.00 0.00 178.44 177.88 1gpy s VAL 431 N -3.28 4.22 -0.13 1.22 1.01 -1.26 -0.38 120.40 121.80 1gpy s VAL 431 Ca 0.07 -0.77 -0.20 0.00 0.00 0.00 0.00 61.98 61.08 1gpy s VAL 431 Cb 0.08 -3.26 -0.04 0.00 0.00 0.00 0.00 36.38 33.16 1gpy s VAL 431 CO 0.60 -0.06 0.54 -1.61 0.00 0.00 0.00 175.10 174.58 1gpy s GLU 432 N 1.52 4.32 0.94 2.72 2.02 0.13 -4.92 118.70 125.42 1gpy s GLU 432 Ca 0.02 0.54 -0.15 0.00 0.02 0.00 0.00 54.97 55.40 1gpy s GLU 432 Cb -0.18 -3.48 0.18 0.00 0.10 0.00 0.00 34.13 30.75 1gpy s GLU 432 CO 0.04 0.04 1.28 -1.21 0.02 0.00 0.00 175.26 175.43 1gpy s GLU 433 N 0.99 0.85 -0.06 1.61 0.41 -1.26 -0.99 118.70 120.24 1gpy s GLU 433 Ca 0.28 -0.26 -0.02 0.00 -0.41 0.00 0.00 54.97 54.56 1gpy s GLU 433 Cb -0.16 -1.86 0.01 0.00 -1.78 0.00 0.00 34.13 30.34 1gpy s GLU 433 CO 0.12 -2.30 0.04 0.41 -0.49 0.00 0.00 175.26 173.03 1gpy n GLY 434 N -3.49 -3.39 2.21 -1.39 0.00 -1.26 -4.74 105.19 93.13 1gpy n GLY 434 Ca 0.13 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.22 1gpy n GLY 434 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gpy n ALA 435 N 0.32 0.00 -3.15 4.61 0.00 -1.26 -4.54 120.51 116.49 1gpy n ALA 435 Ca -0.06 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.40 1gpy n ALA 435 Cb 0.09 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.54 1gpy n ALA 435 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1gpy s VAL 436 N -1.21 -0.90 0.22 0.00 1.01 -1.26 -5.15 120.40 113.11 1gpy s VAL 436 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 61.98 61.66 1gpy s VAL 436 Cb 0.00 -0.39 -0.14 0.00 0.00 0.00 0.00 36.38 35.85 1gpy s VAL 436 CO 0.00 0.00 1.38 1.17 0.00 0.00 0.00 175.10 177.65 1gpy n LYS 437 N 4.79 1.89 -4.04 2.72 4.81 -1.26 -4.86 118.16 122.20 1gpy n LYS 437 Ca 0.08 0.67 -0.09 0.00 -0.87 0.00 0.00 58.31 58.11 1gpy n LYS 437 Cb 0.56 -2.31 -0.11 0.00 0.02 0.00 0.00 35.03 33.20 1gpy n LYS 437 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1gpy s ARG 438 N -0.29 0.48 -0.25 1.64 0.52 -0.16 -2.41 118.95 118.48 1gpy s ARG 438 Ca 0.70 -0.89 -0.12 0.00 -0.52 0.00 0.00 55.73 54.90 1gpy s ARG 438 Cb -0.69 0.08 -0.05 0.00 0.52 0.00 0.00 34.95 34.81 1gpy s ARG 438 CO 0.49 -0.06 0.24 0.42 0.02 0.00 0.00 175.30 176.42 1gpy s ILE 439 N -2.46 5.29 -0.63 1.52 1.01 -0.24 0.20 121.20 125.89 1gpy s ILE 439 Ca -0.05 0.33 -0.28 0.00 0.00 0.00 0.00 60.65 60.65 1gpy s ILE 439 Cb -0.03 -3.58 0.03 0.00 0.01 0.00 0.00 42.46 38.89 1gpy s ILE 439 CO -0.04 0.28 1.22 0.21 0.00 0.00 0.00 174.94 176.61 1gpy s ASN 440 N 1.31 6.35 0.50 3.58 3.84 0.49 -2.15 114.94 128.85 1gpy s ASN 440 Ca 0.11 -0.07 0.27 0.00 0.21 0.00 0.00 52.86 53.37 1gpy s ASN 440 Cb -0.15 -2.56 1.27 0.00 -0.55 0.00 0.00 41.25 39.27 1gpy s ASN 440 CO 0.07 -1.60 1.99 0.24 -2.79 0.00 0.00 177.10 175.01 1gpy h MET 441 N 9.72 0.00 -0.19 0.43 2.86 -1.69 -2.30 114.93 123.76 1gpy h MET 441 Ca -0.26 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.24 1gpy h MET 441 Cb 1.05 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.71 1gpy h MET 441 CO 1.22 0.16 -0.48 0.00 1.06 0.00 0.00 176.91 178.86 1gpy h ALA 442 N 1.84 0.81 -0.13 6.32 0.00 -1.91 -1.94 119.26 124.25 1gpy h ALA 442 Ca -0.00 -0.48 -0.08 0.00 0.00 0.00 0.00 54.91 54.35 1gpy h ALA 442 Cb 0.48 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1gpy h ALA 442 CO 0.02 0.67 -0.29 0.45 0.00 0.00 0.00 179.25 180.09 1gpy h HIS 443 N 0.40 0.28 0.15 0.00 3.86 -1.80 -1.61 115.15 116.44 1gpy h HIS 443 Ca 0.02 -0.06 -0.01 0.00 -1.16 0.00 0.00 60.37 59.17 1gpy h HIS 443 Cb 0.99 -0.07 0.00 0.00 1.06 0.00 0.00 27.41 29.39 1gpy h HIS 443 CO 0.04 0.53 -0.07 1.25 0.86 0.00 0.00 177.93 180.53 1gpy h LEU 444 N 0.23 -0.17 -0.29 2.43 6.46 -1.35 -2.09 115.31 120.53 1gpy h LEU 444 Ca 0.03 -0.19 0.01 0.00 -0.12 0.00 0.00 57.88 57.61 1gpy h LEU 444 Cb 0.64 0.04 -0.02 0.00 -0.73 0.00 0.00 40.66 40.60 1gpy h LEU 444 CO 0.05 0.09 0.18 0.00 -0.62 0.00 0.00 178.44 178.14 1gpy h ILE 446 N 0.38 1.15 -0.23 0.00 2.04 -1.30 -3.01 117.51 116.55 1gpy h ILE 446 Ca 0.11 -0.32 -0.02 0.00 1.00 0.00 0.00 64.86 65.63 1gpy h ILE 446 Cb -0.03 0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 36.19 1gpy h ILE 446 CO -0.03 0.17 0.05 0.00 0.00 0.00 0.00 178.15 178.33 1gpy h ALA 447 N 1.27 0.30 -0.46 1.87 0.00 -1.03 -3.26 119.26 117.95 1gpy h ALA 447 Ca 0.27 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1gpy h ALA 447 Cb -0.07 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.64 1gpy h ALA 447 CO -0.07 -0.04 0.00 0.41 0.00 0.00 0.00 179.25 179.55 1gpy n GLY 448 N -0.50 1.41 3.38 0.00 0.00 -0.28 -4.92 105.19 104.28 1gpy n GLY 448 Ca -0.04 -0.53 -0.30 0.00 0.00 0.00 0.00 46.02 45.16 1gpy n GLY 448 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1gpy s SER 449 N -0.93 3.35 0.00 1.61 0.15 -1.14 -2.93 113.70 113.82 1gpy s SER 449 Ca 0.32 -0.56 0.25 0.00 0.70 0.00 0.00 55.95 56.66 1gpy s SER 449 Cb 0.18 -0.37 0.46 0.00 -1.71 0.00 0.00 66.02 64.59 1gpy s SER 449 CO 0.20 0.25 1.38 0.00 1.20 0.00 0.00 173.24 176.27 1gpy n HIS 450 N 1.62 0.00 -3.70 3.44 -0.00 -0.18 -4.89 115.22 111.51 1gpy n HIS 450 Ca -0.17 0.00 -0.13 0.00 -0.00 0.00 0.00 57.72 57.42 1gpy n HIS 450 Cb 0.52 -0.18 -0.13 0.00 -0.00 0.00 0.00 29.99 30.20 1gpy n HIS 450 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1gpy s ALA 451 N -2.85 -0.53 -0.12 1.59 0.00 -1.26 -4.53 121.76 114.06 1gpy s ALA 451 Ca 0.14 0.94 0.02 0.00 0.00 0.00 0.00 51.96 53.07 1gpy s ALA 451 Cb 0.18 -0.78 -0.01 0.00 0.00 0.00 0.00 23.12 22.51 1gpy s ALA 451 CO 0.67 -0.38 -0.18 0.08 0.00 0.00 0.00 175.76 175.95 1gpy s VAL 452 N 1.74 2.54 0.17 0.00 1.01 0.18 -1.34 120.40 124.71 1gpy s VAL 452 Ca -0.05 -0.84 0.06 0.00 0.00 0.00 0.00 61.98 61.16 1gpy s VAL 452 Cb -0.11 -2.03 -0.04 0.00 0.00 0.00 0.00 36.38 34.19 1gpy s VAL 452 CO -0.08 0.54 -0.13 0.54 0.00 0.00 0.00 175.10 175.97 1gpy s ASN 453 N 0.44 2.21 0.30 3.32 4.22 -0.79 -0.52 114.94 124.12 1gpy s ASN 453 Ca -0.13 -0.98 0.09 0.00 -2.14 0.00 0.00 52.86 49.70 1gpy s ASN 453 Cb -0.17 -0.08 -0.04 0.00 1.28 0.00 0.00 41.25 42.24 1gpy s ASN 453 CO 0.06 -0.22 0.07 -0.83 -2.04 0.00 0.00 177.10 174.14 1gpy s GLY 454 N -3.10 1.78 -0.02 0.45 0.00 -0.84 -1.11 107.32 104.48 1gpy s GLY 454 Ca 0.18 -1.73 0.21 0.00 0.00 0.00 0.00 44.72 43.39 1gpy s GLY 454 CO 0.04 -1.73 1.54 3.33 0.00 0.00 0.00 173.10 176.28 1gpy n VAL 455 N -1.02 1.12 -3.63 1.40 0.24 -1.25 -2.42 118.33 112.77 1gpy n VAL 455 Ca -0.05 -1.03 -0.12 0.00 -2.04 0.00 0.00 64.34 61.09 1gpy n VAL 455 Cb 0.60 0.45 -0.07 0.00 -1.47 0.00 0.00 33.84 33.35 1gpy n VAL 455 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1gpy s ALA 456 N -1.12 -1.85 0.43 2.33 0.00 -1.26 -2.37 121.76 117.92 1gpy s ALA 456 Ca 0.48 1.93 0.21 0.00 0.00 0.00 0.00 51.96 54.58 1gpy s ALA 456 Cb 0.26 -1.20 1.17 0.00 0.00 0.00 0.00 23.12 23.35 1gpy s ALA 456 CO 0.31 -0.31 1.81 -0.09 0.00 0.00 0.00 175.76 177.48 1gpy h ARG 457 N 4.57 0.32 -0.23 0.00 1.12 -1.89 0.01 114.38 118.27 1gpy h ARG 457 Ca -0.28 -0.02 -0.12 0.00 -1.11 0.00 0.00 59.98 58.45 1gpy h ARG 457 Cb 1.16 -0.07 -0.00 0.00 -0.01 0.00 0.00 29.97 31.05 1gpy h ARG 457 CO 0.09 0.21 -0.32 0.97 -3.11 0.00 0.00 179.97 177.81 1gpy h ILE 458 N 0.33 1.32 -0.35 1.20 2.10 -1.90 -2.15 117.51 118.06 1gpy h ILE 458 Ca 0.54 -1.52 0.02 0.00 1.08 0.00 0.00 64.86 64.99 1gpy h ILE 458 Cb 1.51 1.74 -0.03 0.00 -1.09 0.00 0.00 36.82 38.95 1gpy h ILE 458 CO -0.21 0.47 0.17 -0.74 -1.08 0.00 0.00 178.15 176.77 1gpy h HIS 459 N 0.33 0.32 0.00 2.19 2.76 -1.50 0.60 115.15 119.85 1gpy h HIS 459 Ca 0.03 0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.21 1gpy h HIS 459 Cb 0.90 -0.10 0.00 0.00 1.55 0.00 0.00 27.41 29.77 1gpy h HIS 459 CO 0.08 0.18 0.00 0.77 -1.30 0.00 0.00 177.93 177.66 1gpy h SER 460 N 0.36 0.00 0.01 3.26 0.02 -1.05 -2.09 113.55 114.07 1gpy h SER 460 Ca 0.14 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 61.06 1gpy h SER 460 Cb 0.05 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.59 1gpy h SER 460 CO -0.10 0.00 -0.19 -0.33 -1.14 0.00 0.00 176.83 175.08 1gpy h GLU 461 N 0.00 0.02 -1.20 3.45 4.39 -0.39 -3.30 114.58 117.55 1gpy h GLU 461 Ca 0.00 -0.03 0.42 0.00 0.34 0.00 0.00 59.36 60.10 1gpy h GLU 461 Cb 0.28 0.01 -0.15 0.00 -0.10 0.00 0.00 28.75 28.79 1gpy h GLU 461 CO 0.00 1.01 0.73 0.82 -1.16 0.00 0.00 179.01 180.41 1gpy h ILE 462 N -0.97 0.09 0.33 3.13 1.08 -0.82 -1.25 117.51 119.10 1gpy h ILE 462 Ca -0.05 -0.03 -0.02 0.00 -0.39 0.00 0.00 64.86 64.38 1gpy h ILE 462 Cb 1.07 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 34.83 1gpy h ILE 462 CO -0.02 0.01 -0.16 -0.07 -0.69 0.00 0.00 178.15 177.23 1gpy h LEU 463 N 0.08 -0.37 -0.29 1.44 3.38 -1.50 0.53 115.31 118.58 1gpy h LEU 463 Ca 0.83 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 58.63 1gpy h LEU 463 Cb 2.41 0.10 0.00 0.00 0.09 0.00 0.00 40.66 43.26 1gpy h LEU 463 CO -0.55 0.06 0.00 2.29 0.09 0.00 0.00 178.44 180.33 1gpy n LYS 464 N -5.10 0.24 0.02 1.13 2.85 -0.73 -0.74 118.16 115.83 1gpy n LYS 464 Ca -0.09 0.30 -0.22 0.00 -1.05 0.00 0.00 58.31 57.25 1gpy n LYS 464 Cb 0.27 -1.84 -0.14 0.00 -0.65 0.00 0.00 35.03 32.67 1gpy n LYS 464 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 177.40 178.22 1gpy h LYS 465 N 0.00 0.28 0.00 -1.58 1.79 -1.31 -3.35 116.57 112.41 1gpy h LYS 465 Ca 0.00 -0.49 0.00 0.00 -2.18 0.00 0.00 60.65 57.98 1gpy h LYS 465 Cb 0.59 0.18 0.00 0.00 -1.58 0.00 0.00 32.23 31.43 1gpy h LYS 465 CO 0.00 1.23 0.00 2.41 -1.08 0.00 0.00 179.45 182.01 1gpy n THR 466 N -3.60 0.00 0.06 -0.16 -1.04 0.17 -4.66 114.28 105.05 1gpy n THR 466 Ca -0.30 0.09 -0.14 0.00 -2.04 0.00 0.00 64.05 61.66 1gpy n THR 466 Cb 1.02 -0.95 -0.05 0.00 -1.82 0.00 0.00 70.33 68.53 1gpy n THR 466 CO 0.00 0.00 0.00 0.16 -0.64 0.00 0.00 175.07 174.59 1gpy h ILE 467 N 0.00 1.37 -0.48 12.58 3.07 -1.46 -3.24 117.51 129.36 1gpy h ILE 467 Ca 0.00 -2.35 -0.31 0.00 1.55 0.00 0.00 64.86 63.75 1gpy h ILE 467 Cb 0.00 2.35 -0.20 0.00 -0.27 0.00 0.00 36.82 38.70 1gpy h ILE 467 CO 0.00 0.71 -0.25 0.49 -1.05 0.00 0.00 178.15 178.05 1gpy n PHE 468 N -3.78 1.62 -0.12 0.16 3.72 0.08 -4.76 117.46 114.39 1gpy n PHE 468 Ca -0.07 -1.92 -0.09 0.00 -0.05 0.00 0.00 57.45 55.32 1gpy n PHE 468 Cb 0.82 -0.52 -0.01 0.00 -0.94 0.00 0.00 39.48 38.83 1gpy n PHE 468 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 1gpy h LYS 469 N 1.44 0.52 -0.90 -1.08 -0.00 -1.58 -0.42 116.57 114.55 1gpy h LYS 469 Ca 0.27 -0.07 0.24 0.00 -0.00 0.00 0.00 60.65 61.09 1gpy h LYS 469 Cb 1.44 -0.10 -0.13 0.00 -0.00 0.00 0.00 32.23 33.44 1gpy h LYS 469 CO 0.56 0.45 0.35 -0.44 -0.00 0.00 0.00 179.45 180.38 1gpy h ASP 470 N 0.46 0.22 -0.14 7.07 3.32 -1.88 -0.06 116.42 125.41 1gpy h ASP 470 Ca 0.13 0.17 -0.14 0.00 0.02 0.00 0.00 57.03 57.21 1gpy h ASP 470 Cb 0.09 0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.83 1gpy h ASP 470 CO -0.02 -0.08 -0.47 -0.26 -1.72 0.00 0.00 179.24 176.70 1gpy h PHE 471 N 0.32 0.73 -0.69 4.55 0.04 -1.83 -2.62 116.94 117.44 1gpy h PHE 471 Ca 0.57 -0.30 -0.06 0.00 2.80 0.00 0.00 57.97 60.99 1gpy h PHE 471 Cb 1.15 -0.12 -0.03 0.00 2.20 0.00 0.00 35.95 39.15 1gpy h PHE 471 CO -0.17 1.07 0.21 -0.92 -0.60 0.00 0.00 178.31 177.90 1gpy h TYR 472 N 0.18 1.10 -0.11 -0.55 3.20 -0.51 0.14 116.97 120.42 1gpy h TYR 472 Ca -0.02 -0.10 -0.08 0.00 3.14 0.00 0.00 58.73 61.67 1gpy h TYR 472 Cb 1.10 -0.32 -0.01 0.00 1.54 0.00 0.00 36.73 39.03 1gpy h TYR 472 CO 0.10 0.87 -0.27 0.93 -1.64 0.00 0.00 178.16 178.16 1gpy h GLU 473 N 1.03 0.21 0.00 1.82 5.08 -0.99 0.36 114.58 122.08 1gpy h GLU 473 Ca 0.23 -0.07 -0.01 0.00 -1.00 0.00 0.00 59.36 58.50 1gpy h GLU 473 Cb 0.29 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.53 1gpy h GLU 473 CO -0.01 0.47 -0.06 1.25 -1.00 0.00 0.00 179.01 179.67 1gpy h LEU 474 N 0.19 0.04 -5.82 1.33 7.12 -1.34 -3.43 115.31 113.39 1gpy h LEU 474 Ca 0.03 -0.84 -0.54 0.00 0.13 0.00 0.00 57.88 56.66 1gpy h LEU 474 Cb 0.59 -0.01 -0.41 0.00 -0.53 0.00 0.00 40.66 40.30 1gpy h LEU 474 CO 0.04 0.88 -0.97 -0.62 -0.13 0.00 0.00 178.44 177.65 1gpy n GLU 475 N -4.64 1.72 -0.15 1.25 1.02 0.46 -4.92 120.64 115.37 1gpy n GLU 475 Ca -0.10 -3.90 0.28 0.00 -0.02 0.00 0.00 57.16 53.43 1gpy n GLU 475 Cb 0.44 -1.83 0.72 0.00 -0.02 0.00 0.00 31.44 30.75 1gpy n GLU 475 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1gpy h PRO 476 N 3.29 0.00 0.00 3.49 0.13 -1.12 -0.61 132.00 137.18 1gpy h PRO 476 Ca 0.11 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1gpy h PRO 476 Cb 0.79 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.92 1gpy h PRO 476 CO 0.62 0.00 -0.02 1.12 -0.23 0.00 0.00 178.00 179.49 1gpy h HIS 477 N 0.00 0.00 0.00 1.56 2.07 -1.91 -1.87 115.15 114.99 1gpy h HIS 477 Ca 0.41 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.93 1gpy h HIS 477 Cb 1.78 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.76 1gpy h HIS 477 CO 0.00 0.02 -0.11 1.63 -3.07 0.00 0.00 177.93 176.39 1gpy n LYS 478 N -3.22 0.25 -3.64 5.12 5.02 -0.23 -4.91 118.16 116.54 1gpy n LYS 478 Ca -0.02 0.18 -0.38 0.00 -2.02 0.00 0.00 58.31 56.07 1gpy n LYS 478 Cb 0.15 -1.76 -0.12 0.00 -0.02 0.00 0.00 35.03 33.28 1gpy n LYS 478 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 1gpy s PHE 479 N -3.10 3.18 0.36 2.13 0.40 -0.71 -0.65 117.98 119.59 1gpy s PHE 479 Ca 0.10 -0.30 0.08 0.00 -0.60 0.00 0.00 56.93 56.21 1gpy s PHE 479 Cb 0.13 -2.35 -0.07 0.00 0.51 0.00 0.00 43.02 41.24 1gpy s PHE 479 CO 0.62 -0.34 -0.05 -0.65 0.70 0.00 0.00 175.22 175.49 1gpy s GLN 480 N 1.67 1.84 -0.01 0.44 -0.21 0.32 -4.99 119.66 118.71 1gpy s GLN 480 Ca 0.06 -1.99 0.04 0.00 0.02 0.00 0.00 55.36 53.49 1gpy s GLN 480 Cb -0.16 -1.60 -0.01 0.00 1.00 0.00 0.00 33.01 32.24 1gpy s GLN 480 CO 0.08 0.05 -0.12 1.21 -2.12 0.00 0.00 175.29 174.39 1gpy s ASN 481 N -3.63 1.44 -0.28 5.90 3.84 -1.26 -1.98 114.94 118.98 1gpy s ASN 481 Ca 0.33 -0.22 -0.02 0.00 0.21 0.00 0.00 52.86 53.16 1gpy s ASN 481 Cb 0.06 -0.19 0.12 0.00 -0.55 0.00 0.00 41.25 40.68 1gpy s ASN 481 CO 0.17 0.14 0.23 -0.54 -2.79 0.00 0.00 177.10 174.31 1gpy s LYS 482 N -0.23 0.26 0.32 0.43 -0.14 -1.02 -4.93 119.74 114.44 1gpy s LYS 482 Ca 0.04 -0.22 -0.29 0.00 -1.36 0.00 0.00 55.97 54.14 1gpy s LYS 482 Cb -0.05 -0.89 -0.11 0.00 -1.68 0.00 0.00 37.83 35.10 1gpy s LYS 482 CO -0.00 -0.98 1.44 0.99 -0.76 0.00 0.00 175.35 176.04 1gpy s THR 483 N 2.27 2.39 1.07 2.17 2.01 -1.26 -4.29 115.64 120.00 1gpy s THR 483 Ca 0.09 0.36 -0.13 0.00 0.31 0.00 0.00 61.69 62.32 1gpy s THR 483 Cb -0.15 -3.23 0.23 0.00 0.01 0.00 0.00 72.50 69.36 1gpy s THR 483 CO -0.31 0.07 1.07 0.20 -0.69 0.00 0.00 174.62 174.96 1gpy s ASN 484 N -0.01 1.93 0.28 3.53 0.02 -1.00 -4.52 114.94 115.17 1gpy s ASN 484 Ca 0.55 1.21 -0.20 0.00 -1.02 0.00 0.00 52.86 53.40 1gpy s ASN 484 Cb -0.44 -1.88 0.02 0.00 0.02 0.00 0.00 41.25 38.97 1gpy s ASN 484 CO 0.53 -3.57 0.69 -0.83 0.02 0.00 0.00 177.10 173.95 1gpy s GLY 485 N -3.23 -0.00 0.35 0.66 0.00 -1.26 -4.75 107.32 99.09 1gpy s GLY 485 Ca 0.67 -0.39 0.06 0.00 0.00 0.00 0.00 44.72 45.06 1gpy s GLY 485 CO 0.59 -0.16 -0.00 -1.50 0.00 0.00 0.00 173.10 172.03 1gpy s ILE 486 N -3.89 1.71 -0.17 0.90 1.10 -0.49 -4.54 121.20 115.82 1gpy s ILE 486 Ca 0.13 -2.05 -0.03 0.00 -0.51 0.00 0.00 60.65 58.19 1gpy s ILE 486 Cb -0.05 -2.79 -0.02 0.00 0.15 0.00 0.00 42.46 39.75 1gpy s ILE 486 CO 0.07 -0.08 -0.07 0.28 -2.11 0.00 0.00 174.94 173.03 1gpy s THR 487 N -2.94 3.39 0.42 4.00 -1.32 -1.26 0.89 115.64 118.82 1gpy s THR 487 Ca 0.34 -0.52 0.10 0.00 -1.21 0.00 0.00 61.69 60.40 1gpy s THR 487 Cb 0.08 -2.49 0.21 0.00 -1.51 0.00 0.00 72.50 68.79 1gpy s THR 487 CO 0.16 0.48 2.01 1.55 -2.21 0.00 0.00 174.62 176.60 1gpy h PRO 488 N 7.26 0.31 0.00 7.08 0.13 -1.92 -1.78 132.00 143.08 1gpy h PRO 488 Ca -0.33 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 1gpy h PRO 488 Cb 1.19 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.26 1gpy h PRO 488 CO 0.59 0.31 0.00 0.54 -0.23 0.00 0.00 178.00 179.21 1gpy n ARG 489 N -4.39 0.00 -0.26 0.86 3.00 -1.26 -1.02 116.66 113.58 1gpy n ARG 489 Ca 0.00 0.19 0.04 0.00 -0.01 0.00 0.00 57.85 58.07 1gpy n ARG 489 Cb 0.16 -1.16 0.17 0.00 0.00 0.00 0.00 32.46 31.63 1gpy n ARG 489 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.63 177.54 1gpy h ARG 490 N 0.00 0.56 -0.39 5.56 2.43 -1.96 0.23 114.38 120.82 1gpy h ARG 490 Ca 0.00 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 1gpy h ARG 490 Cb 0.00 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 29.42 1gpy h ARG 490 CO 0.00 0.37 0.00 0.91 -1.51 0.00 0.00 179.97 179.74 1gpy n TRP 491 N -4.89 0.51 0.16 2.20 7.02 -0.67 -1.89 117.44 119.88 1gpy n TRP 491 Ca 0.13 -0.26 0.00 0.00 -1.02 0.00 0.00 57.50 56.36 1gpy n TRP 491 Cb 0.35 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.24 1gpy n TRP 491 CO 0.00 0.00 0.00 -0.11 -2.02 0.00 0.00 177.69 175.56 1gpy n LEU 492 N 0.65 -1.30 0.06 -0.99 7.94 -0.19 -4.78 117.00 118.38 1gpy n LEU 492 Ca 0.13 0.57 -0.12 0.00 -1.11 0.00 0.00 56.01 55.48 1gpy n LEU 492 Cb 0.33 1.38 -0.07 0.00 0.53 0.00 0.00 43.42 45.59 1gpy n LEU 492 CO 0.09 -0.46 0.84 0.58 -1.11 0.00 0.00 177.39 177.34 1gpy h VAL 493 N 0.00 0.98 0.43 1.96 2.07 -1.11 0.53 116.25 121.12 1gpy h VAL 493 Ca 0.00 -0.07 -0.02 0.00 0.82 0.00 0.00 66.70 67.43 1gpy h VAL 493 Cb 0.00 1.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.80 1gpy h VAL 493 CO 0.00 0.02 -0.21 0.25 0.02 0.00 0.00 177.57 177.65 1gpy h LEU 494 N -0.08 -0.49 -0.01 2.57 6.46 -0.67 -3.30 115.31 119.80 1gpy h LEU 494 Ca -0.01 -0.02 0.00 0.00 -0.12 0.00 0.00 57.88 57.74 1gpy h LEU 494 Cb 0.07 0.13 0.00 0.00 -0.73 0.00 0.00 40.66 40.12 1gpy h LEU 494 CO 0.01 -0.06 0.00 0.00 -0.62 0.00 0.00 178.44 177.77 1gpy n ASN 496 N -1.57 -0.91 0.19 0.00 2.85 0.18 -4.81 115.26 111.19 1gpy n ASN 496 Ca 0.07 -2.99 0.14 0.00 -0.11 0.00 0.00 54.58 51.69 1gpy n ASN 496 Cb 0.33 0.32 0.55 0.00 1.24 0.00 0.00 39.78 42.22 1gpy n ASN 496 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1gpy h PRO 497 N 3.83 0.00 0.74 1.20 0.13 -1.63 -2.56 132.00 133.72 1gpy h PRO 497 Ca -0.01 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.09 1gpy h PRO 497 Cb 0.95 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.09 1gpy h PRO 497 CO 0.40 0.00 -0.36 0.78 -0.23 0.00 0.00 178.00 178.59 1gpy h GLY 498 N 2.40 -1.04 0.73 1.56 0.00 -1.91 -1.34 103.07 103.46 1gpy h GLY 498 Ca 0.00 0.39 0.06 0.00 0.00 0.00 0.00 47.33 47.78 1gpy h GLY 498 CO 0.00 -0.38 0.56 -2.00 0.00 0.00 0.00 176.54 174.72 1gpy h LEU 499 N -1.24 0.88 -0.76 3.11 5.85 -1.91 -0.60 115.31 120.65 1gpy h LEU 499 Ca -0.10 0.02 -0.13 0.00 0.84 0.00 0.00 57.88 58.50 1gpy h LEU 499 Cb 0.78 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 1gpy h LEU 499 CO 0.17 0.56 -0.54 0.00 -0.34 0.00 0.00 178.44 178.29 1gpy h ALA 500 N 1.42 0.94 0.34 1.25 0.00 -1.40 -1.86 119.26 119.95 1gpy h ALA 500 Ca 0.39 -0.50 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1gpy h ALA 500 Cb 0.17 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1gpy h ALA 500 CO -0.17 0.69 -0.16 1.49 0.00 0.00 0.00 179.25 181.09 1gpy h GLU 501 N 0.17 -0.44 -0.19 0.00 4.81 0.03 -1.42 114.58 117.54 1gpy h GLU 501 Ca 0.00 0.03 0.05 0.00 -0.13 0.00 0.00 59.36 59.32 1gpy h GLU 501 Cb 1.01 0.10 -0.01 0.00 0.63 0.00 0.00 28.75 30.49 1gpy h GLU 501 CO 0.08 -0.11 0.16 -0.84 -0.73 0.00 0.00 179.01 177.57 1gpy h ILE 502 N -0.89 0.69 0.31 2.32 3.07 -1.18 -0.75 117.51 121.08 1gpy h ILE 502 Ca -0.05 0.00 -0.02 0.00 1.55 0.00 0.00 64.86 66.35 1gpy h ILE 502 Cb 0.53 0.88 0.00 0.00 -0.27 0.00 0.00 36.82 37.96 1gpy h ILE 502 CO 0.08 0.00 -0.15 0.40 -1.05 0.00 0.00 178.15 177.43 1gpy h ILE 503 N 0.00 0.47 -0.13 0.16 2.04 -1.20 -3.30 117.51 115.55 1gpy h ILE 503 Ca 0.09 -0.79 0.04 0.00 1.00 0.00 0.00 64.86 65.19 1gpy h ILE 503 Cb 0.41 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 37.25 1gpy h ILE 503 CO -0.00 0.11 0.12 0.00 0.00 0.00 0.00 178.15 178.38 1gpy h ALA 504 N -0.64 1.89 -0.51 1.87 0.00 -0.79 -1.15 119.26 119.93 1gpy h ALA 504 Ca -0.04 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.88 1gpy h ALA 504 Cb 0.50 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 1gpy h ALA 504 CO 0.07 -0.18 0.34 0.93 0.00 0.00 0.00 179.25 180.40 1gpy h GLU 505 N 0.00 0.60 0.00 0.00 5.08 -1.23 0.25 114.58 119.29 1gpy h GLU 505 Ca 0.06 -0.04 -0.10 0.00 -1.00 0.00 0.00 59.36 58.29 1gpy h GLU 505 Cb 0.30 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 1gpy h GLU 505 CO -0.00 0.40 -0.71 0.00 -1.00 0.00 0.00 179.01 177.70 1gpy h ARG 506 N 0.62 0.00 -0.19 2.33 -0.00 -1.47 -3.44 114.38 112.23 1gpy h ARG 506 Ca 0.20 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.68 1gpy h ARG 506 Cb 0.03 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.00 1gpy h ARG 506 CO -0.05 0.57 0.00 0.44 0.00 0.00 0.00 179.97 180.93 1gpy n ILE 507 N -4.55 1.55 0.00 2.04 -5.35 -0.50 -5.11 119.36 107.44 1gpy n ILE 507 Ca -0.18 -1.49 0.00 0.00 -0.27 0.00 0.00 62.75 60.81 1gpy n ILE 507 Cb 0.44 0.14 0.00 0.00 -1.74 0.00 0.00 39.64 38.48 1gpy n ILE 507 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1gpy n GLY 508 N -0.34 -1.74 0.72 3.28 0.00 0.88 -4.69 105.19 103.30 1gpy n GLY 508 Ca 0.13 -1.54 0.11 0.00 0.00 0.00 0.00 46.02 44.72 1gpy n GLY 508 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1gpy n GLU 509 N -1.90 1.94 0.21 1.61 1.02 -1.26 -4.09 120.64 118.17 1gpy n GLU 509 Ca 0.00 -1.42 0.15 0.00 -0.02 0.00 0.00 57.16 55.87 1gpy n GLU 509 Cb 0.00 -1.42 0.68 0.00 -0.02 0.00 0.00 31.44 30.68 1gpy n GLU 509 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1gpy h GLU 510 N 2.82 0.00 0.00 3.49 4.39 -1.94 -3.24 114.58 120.11 1gpy h GLU 510 Ca 0.00 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 1gpy h GLU 510 Cb 0.62 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 29.27 1gpy h GLU 510 CO 0.00 0.00 -0.14 0.10 -1.16 0.00 0.00 179.01 177.81 1gpy h TYR 511 N 0.00 0.00 0.00 4.33 -0.00 -1.78 -2.66 116.97 116.86 1gpy h TYR 511 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 1gpy h TYR 511 Cb 0.27 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.00 1gpy h TYR 511 CO 0.00 0.14 0.00 -0.89 -0.00 0.00 0.00 178.16 177.41 1gpy n ILE 512 N -3.29 0.85 -1.39 -0.90 5.41 -1.22 -1.44 119.36 117.38 1gpy n ILE 512 Ca 0.00 0.22 0.06 0.00 1.00 0.00 0.00 62.75 64.03 1gpy n ILE 512 Cb 0.38 -1.10 0.09 0.00 -0.71 0.00 0.00 39.64 38.30 1gpy n ILE 512 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 1gpy n SER 513 N -2.06 1.46 -2.72 4.38 3.41 -1.03 -4.69 113.62 112.38 1gpy n SER 513 Ca 0.03 -2.65 -0.05 0.00 -0.26 0.00 0.00 58.87 55.94 1gpy n SER 513 Cb 0.22 -0.33 0.03 0.00 -0.26 0.00 0.00 64.21 63.87 1gpy n SER 513 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1gpy n ASP 514 N -0.89 -2.54 0.21 4.04 2.03 -0.52 -5.07 116.55 113.82 1gpy n ASP 514 Ca 0.10 -2.30 0.09 0.00 0.52 0.00 0.00 54.79 53.19 1gpy n ASP 514 Cb 0.65 1.36 0.37 0.00 -0.72 0.00 0.00 41.12 42.79 1gpy n ASP 514 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 1gpy h LEU 515 N 4.36 0.00 -2.37 -2.67 6.46 -1.66 -3.07 115.31 116.36 1gpy h LEU 515 Ca -0.03 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.73 1gpy h LEU 515 Cb 1.12 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 41.05 1gpy h LEU 515 CO 0.01 0.26 0.00 0.44 -0.62 0.00 0.00 178.44 178.53 1gpy h ASP 516 N 0.00 0.00 -1.01 1.25 3.32 -1.87 -1.98 116.42 116.12 1gpy h ASP 516 Ca -0.00 0.00 0.29 0.00 0.02 0.00 0.00 57.03 57.34 1gpy h ASP 516 Cb 0.86 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.37 1gpy h ASP 516 CO 0.03 0.00 0.92 1.56 -1.72 0.00 0.00 179.24 180.04 1gpy h GLN 517 N 0.00 0.00 -0.03 3.56 4.20 -1.88 -0.70 115.11 120.26 1gpy h GLN 517 Ca 0.00 0.00 0.01 0.00 0.06 0.00 0.00 58.65 58.72 1gpy h GLN 517 Cb 0.18 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.96 1gpy h GLN 517 CO 0.00 0.00 0.04 1.25 -0.67 0.00 0.00 178.83 179.45 1gpy h LEU 518 N 0.00 0.00 -2.02 1.46 5.85 -1.59 -1.35 115.31 117.66 1gpy h LEU 518 Ca 0.48 0.00 0.12 0.00 0.84 0.00 0.00 57.88 59.32 1gpy h LEU 518 Cb 2.32 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 43.34 1gpy h LEU 518 CO -0.01 0.00 0.41 0.03 -0.34 0.00 0.00 178.44 178.53 1gpy h ARG 519 N 0.00 0.00 0.00 1.25 3.08 -0.30 -0.56 114.38 117.85 1gpy h ARG 519 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1gpy h ARG 519 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.14 1gpy h ARG 519 CO -0.00 0.00 0.00 0.87 -1.07 0.00 0.00 179.97 179.77 1gpy h LYS 520 N 0.00 0.00 0.00 0.04 1.57 -1.49 -0.99 116.57 115.70 1gpy h LYS 520 Ca 0.20 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 1gpy h LYS 520 Cb 1.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.32 1gpy h LYS 520 CO -0.00 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.16 1gpy n LEU 521 N -3.07 0.00 0.17 2.94 4.77 -0.22 -2.29 117.00 119.30 1gpy n LEU 521 Ca -0.02 0.23 0.02 0.00 -0.03 0.00 0.00 56.01 56.21 1gpy n LEU 521 Cb 0.12 -0.23 0.31 0.00 -2.33 0.00 0.00 43.42 41.29 1gpy n LEU 521 CO 0.21 -0.12 0.67 -0.07 -1.33 0.00 0.00 177.39 176.75 1gpy h LEU 522 N 0.00 0.00 -0.05 2.23 4.07 -1.39 -2.68 115.31 117.49 1gpy h LEU 522 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1gpy h LEU 522 Cb 0.12 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.86 1gpy h LEU 522 CO 0.00 0.43 0.00 -1.54 -1.08 0.00 0.00 178.44 176.25 1gpy n SER 523 N -4.01 0.06 -0.46 -0.43 3.41 -0.97 -2.90 113.62 108.32 1gpy n SER 523 Ca -0.02 0.51 0.04 0.00 -0.26 0.00 0.00 58.87 59.15 1gpy n SER 523 Cb 0.46 -0.53 0.10 0.00 -0.26 0.00 0.00 64.21 63.98 1gpy n SER 523 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 1gpy n TYR 524 N -1.56 0.27 -0.04 7.33 4.02 -1.01 -4.61 117.16 121.55 1gpy n TYR 524 Ca 0.04 -0.37 0.20 0.00 -0.01 0.00 0.00 57.90 57.76 1gpy n TYR 524 Cb 0.19 -0.02 0.66 0.00 -0.02 0.00 0.00 39.34 40.15 1gpy n TYR 524 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 176.86 176.13 1gpy h VAL 525 N 1.60 0.73 -0.42 -0.72 2.07 -1.53 0.45 116.25 118.44 1gpy h VAL 525 Ca 0.00 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.49 1gpy h VAL 525 Cb 0.60 0.65 0.00 0.00 -1.52 0.00 0.00 31.29 31.02 1gpy h VAL 525 CO 0.00 0.01 0.00 0.47 0.02 0.00 0.00 177.57 178.07 1gpy n ASP 526 N -4.39 3.19 -4.69 0.57 8.00 -1.26 -4.77 116.55 113.21 1gpy n ASP 526 Ca 0.11 -1.94 -0.42 0.00 0.71 0.00 0.00 54.79 53.26 1gpy n ASP 526 Cb 0.62 -0.28 -0.03 0.00 -0.02 0.00 0.00 41.12 41.41 1gpy n ASP 526 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1gpy s ASP 527 N -1.09 7.15 0.22 -2.24 -1.08 0.16 -4.93 116.67 114.86 1gpy s ASP 527 Ca 0.32 1.41 0.08 0.00 -0.52 0.00 0.00 52.55 53.84 1gpy s ASP 527 Cb 0.17 -2.52 0.15 0.00 -1.46 0.00 0.00 42.92 39.27 1gpy s ASP 527 CO 0.23 -0.40 1.49 -0.08 0.52 0.00 0.00 175.17 176.93 1gpy h GLU 528 N 7.12 0.04 0.10 4.34 4.57 -1.93 0.12 114.58 128.94 1gpy h GLU 528 Ca -0.32 -0.04 -0.26 0.00 -1.18 0.00 0.00 59.36 57.56 1gpy h GLU 528 Cb 1.15 0.01 -0.00 0.00 -0.16 0.00 0.00 28.75 29.75 1gpy h GLU 528 CO 0.84 0.77 -1.20 0.00 -1.18 0.00 0.00 179.01 178.24 1gpy h ALA 529 N 1.21 0.15 -0.31 2.92 0.00 -1.95 -3.06 119.26 118.22 1gpy h ALA 529 Ca -0.01 -0.89 -0.14 0.00 0.00 0.00 0.00 54.91 53.86 1gpy h ALA 529 Cb 1.33 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 1gpy h ALA 529 CO 0.10 1.03 -0.39 0.35 0.00 0.00 0.00 179.25 180.35 1gpy h PHE 530 N 0.06 0.87 -0.05 0.00 3.57 -1.66 -0.15 116.94 119.57 1gpy h PHE 530 Ca -0.11 -0.25 -0.04 0.00 3.53 0.00 0.00 57.97 61.10 1gpy h PHE 530 Cb 1.93 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 40.48 1gpy h PHE 530 CO 0.05 1.00 -0.14 0.82 -2.23 0.00 0.00 178.31 177.81 1gpy h ILE 531 N 0.60 1.13 0.00 1.41 2.04 -0.89 -0.94 117.51 120.87 1gpy h ILE 531 Ca 0.05 -0.61 -0.16 0.00 1.00 0.00 0.00 64.86 65.14 1gpy h ILE 531 Cb 0.93 1.26 -0.03 0.00 -0.74 0.00 0.00 36.82 38.24 1gpy h ILE 531 CO 0.08 0.18 -1.06 0.03 0.00 0.00 0.00 178.15 177.38 1gpy h ARG 532 N 0.07 0.00 0.07 2.37 3.08 -1.06 -2.85 114.38 116.07 1gpy h ARG 532 Ca 0.02 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 1gpy h ARG 532 Cb 0.30 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.35 1gpy h ARG 532 CO 0.02 0.49 -0.04 -0.44 -1.07 0.00 0.00 179.97 178.94 1gpy h ASP 533 N 0.00 -0.08 -0.92 7.04 3.32 -0.70 -2.91 116.42 122.17 1gpy h ASP 533 Ca -0.10 -0.46 0.24 0.00 0.02 0.00 0.00 57.03 56.73 1gpy h ASP 533 Cb 1.59 0.02 -0.13 0.00 0.22 0.00 0.00 39.33 41.03 1gpy h ASP 533 CO 0.07 0.59 0.42 0.58 -1.72 0.00 0.00 179.24 179.18 1gpy h VAL 534 N -0.94 0.44 0.00 -1.35 2.07 -1.28 -0.08 116.25 115.11 1gpy h VAL 534 Ca -0.01 -0.13 -0.07 0.00 0.82 0.00 0.00 66.70 67.31 1gpy h VAL 534 Cb 0.54 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 1gpy h VAL 534 CO 0.02 0.07 -0.32 0.00 0.02 0.00 0.00 177.57 177.36 1gpy h ALA 535 N 1.74 0.90 -0.02 1.67 0.00 -1.57 -3.18 119.26 118.80 1gpy h ALA 535 Ca 0.59 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 1gpy h ALA 535 Cb 1.16 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1gpy h ALA 535 CO -0.55 0.40 -0.07 0.87 0.00 0.00 0.00 179.25 179.90 1gpy h LYS 536 N 0.00 0.09 -0.60 0.00 1.57 -0.81 -1.70 116.57 115.13 1gpy h LYS 536 Ca -0.00 -0.07 0.12 0.00 -1.87 0.00 0.00 60.65 58.83 1gpy h LYS 536 Cb 0.99 0.01 -0.09 0.00 0.08 0.00 0.00 32.23 33.22 1gpy h LYS 536 CO 0.04 0.69 0.08 0.28 -0.57 0.00 0.00 179.45 179.97 1gpy h VAL 537 N -0.49 0.59 -0.60 0.50 2.07 -1.57 0.35 116.25 117.09 1gpy h VAL 537 Ca -0.00 -0.07 -0.05 0.00 0.82 0.00 0.00 66.70 67.40 1gpy h VAL 537 Cb 0.70 0.37 -0.03 0.00 -1.52 0.00 0.00 31.29 30.81 1gpy h VAL 537 CO 0.02 0.04 0.20 0.50 0.02 0.00 0.00 177.57 178.34 1gpy h LYS 538 N 0.20 0.93 -0.29 1.57 1.63 -1.53 0.43 116.57 119.52 1gpy h LYS 538 Ca 0.32 -0.19 -0.01 0.00 -0.85 0.00 0.00 60.65 59.91 1gpy h LYS 538 Cb 0.49 -0.14 -0.01 0.00 -0.60 0.00 0.00 32.23 31.97 1gpy h LYS 538 CO -0.44 0.82 0.13 0.37 -3.45 0.00 0.00 179.45 176.87 1gpy h GLN 539 N 0.85 0.42 0.28 1.90 -0.00 0.22 0.28 115.11 119.07 1gpy h GLN 539 Ca 0.20 -0.07 -0.01 0.00 -0.00 0.00 0.00 58.65 58.77 1gpy h GLN 539 Cb 0.27 -0.07 -0.00 0.00 0.00 0.00 0.00 27.48 27.67 1gpy h GLN 539 CO -0.01 0.43 -0.17 0.93 0.00 0.00 0.00 178.83 180.01 1gpy h GLU 540 N 0.32 -0.42 -0.26 1.69 5.08 -0.37 0.32 114.58 120.94 1gpy h GLU 540 Ca 0.10 0.03 0.04 0.00 -1.00 0.00 0.00 59.36 58.52 1gpy h GLU 540 Cb 0.15 0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 1gpy h GLU 540 CO -0.01 -0.28 0.18 -0.91 -1.00 0.00 0.00 179.01 176.99 1gpy h ASN 541 N -0.43 0.16 0.08 1.42 4.21 -0.79 0.13 115.58 120.36 1gpy h ASN 541 Ca -0.03 -0.00 -0.23 0.00 1.21 0.00 0.00 56.30 57.25 1gpy h ASN 541 Cb 0.36 -0.04 0.01 0.00 -1.12 0.00 0.00 38.32 37.53 1gpy h ASN 541 CO 0.03 0.11 -0.86 0.11 -1.29 0.00 0.00 177.43 175.53 1gpy h LYS 542 N 0.19 0.61 -0.42 0.81 1.57 0.41 -2.93 116.57 116.81 1gpy h LYS 542 Ca 0.11 -0.56 -0.12 0.00 -1.87 0.00 0.00 60.65 58.21 1gpy h LYS 542 Cb 0.21 0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.65 1gpy h LYS 542 CO -0.02 1.18 -0.19 1.25 -0.57 0.00 0.00 179.45 181.10 1gpy h LEU 543 N 0.39 0.89 0.95 2.94 5.85 0.04 -0.58 115.31 125.80 1gpy h LEU 543 Ca -0.07 -0.40 -0.05 0.00 0.84 0.00 0.00 57.88 58.20 1gpy h LEU 543 Cb 1.49 -0.25 0.01 0.00 0.37 0.00 0.00 40.66 42.28 1gpy h LEU 543 CO 0.16 1.09 -0.46 0.50 -0.34 0.00 0.00 178.44 179.40 1gpy h LYS 544 N 0.69 -1.23 -0.65 1.25 1.63 -0.84 -2.71 116.57 114.70 1gpy h LYS 544 Ca 0.09 0.08 0.01 0.00 -0.85 0.00 0.00 60.65 59.99 1gpy h LYS 544 Cb 0.75 0.28 -0.03 0.00 -0.60 0.00 0.00 32.23 32.63 1gpy h LYS 544 CO 0.06 -0.82 0.43 0.35 -3.45 0.00 0.00 179.45 176.02 1gpy h PHE 545 N -1.34 0.81 -0.62 1.91 3.57 -1.35 -0.88 116.94 119.03 1gpy h PHE 545 Ca -0.13 0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.41 1gpy h PHE 545 Cb 0.98 -0.27 -0.04 0.00 2.79 0.00 0.00 35.95 39.41 1gpy h PHE 545 CO -0.00 0.50 0.39 0.00 -2.23 0.00 0.00 178.31 176.97 1gpy h ALA 546 N 1.60 0.81 0.10 2.41 0.00 -1.07 -0.92 119.26 122.18 1gpy h ALA 546 Ca 0.24 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 1gpy h ALA 546 Cb -0.07 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 17.51 1gpy h ALA 546 CO -0.06 0.15 -0.09 0.00 0.00 0.00 0.00 179.25 179.26 1gpy h ALA 547 N 1.26 -0.84 -1.29 0.00 0.00 -0.84 -2.82 119.26 114.73 1gpy h ALA 547 Ca 0.25 -0.04 0.44 0.00 0.00 0.00 0.00 54.91 55.56 1gpy h ALA 547 Cb -0.01 0.32 -0.14 0.00 0.00 0.00 0.00 17.79 17.96 1gpy h ALA 547 CO -0.09 -0.84 0.82 -0.92 0.00 0.00 0.00 179.25 178.21 1gpy h TYR 548 N -0.18 0.57 0.15 0.00 5.03 -1.43 1.44 116.97 122.55 1gpy h TYR 548 Ca -0.01 0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.32 1gpy h TYR 548 Cb 0.16 -0.14 0.00 0.00 1.55 0.00 0.00 36.73 38.30 1gpy h TYR 548 CO -0.07 -0.25 -0.07 1.25 -1.32 0.00 0.00 178.16 177.69 1gpy h LEU 549 N 0.07 -0.17 -0.11 2.82 5.85 -0.94 0.22 115.31 123.05 1gpy h LEU 549 Ca 0.84 -0.11 -0.19 0.00 0.84 0.00 0.00 57.88 59.26 1gpy h LEU 549 Cb 2.58 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 43.63 1gpy h LEU 549 CO -0.48 -0.00 -0.90 -0.33 -0.34 0.00 0.00 178.44 176.40 1gpy h GLU 550 N -0.34 0.00 0.29 1.25 3.07 0.21 0.35 114.58 119.41 1gpy h GLU 550 Ca -0.02 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.82 1gpy h GLU 550 Cb 0.27 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.18 1gpy h GLU 550 CO 0.03 0.90 -0.14 0.07 -1.40 0.00 0.00 179.01 178.47 1gpy h ARG 551 N 0.00 -0.38 0.00 2.33 -0.00 -1.05 -3.35 114.38 111.94 1gpy h ARG 551 Ca -0.01 0.03 -0.07 0.00 -0.00 0.00 0.00 59.98 59.93 1gpy h ARG 551 Cb 1.64 0.09 -0.01 0.00 -0.00 0.00 0.00 29.97 31.68 1gpy h ARG 551 CO 0.12 -0.25 -0.32 0.93 -0.00 0.00 0.00 179.97 180.45 1gpy h GLU 552 N -0.41 0.00 0.00 0.08 4.39 -0.53 -3.46 114.58 114.65 1gpy h GLU 552 Ca -0.04 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.66 1gpy h GLU 552 Cb 0.30 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.95 1gpy h GLU 552 CO 0.07 0.32 0.00 0.66 -1.16 0.00 0.00 179.01 178.89 1gpy n TYR 553 N -4.07 0.00 -3.64 4.33 4.01 0.12 -5.06 117.16 112.85 1gpy n TYR 553 Ca -0.02 0.00 -0.03 0.00 -0.16 0.00 0.00 57.90 57.69 1gpy n TYR 553 Cb 0.37 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.36 1gpy n TYR 553 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 1gpy s LYS 554 N 4.33 0.11 0.00 -0.72 1.02 -1.25 -4.51 119.74 118.71 1gpy s LYS 554 Ca 0.00 0.03 0.00 0.00 0.02 0.00 0.00 55.97 56.02 1gpy s LYS 554 Cb 0.00 0.05 0.00 0.00 -0.52 0.00 0.00 37.83 37.36 1gpy s LYS 554 CO 0.00 -0.03 0.00 1.55 -0.92 0.00 0.00 175.35 175.95 1gpy n VAL 555 N 0.56 0.00 -1.85 3.17 3.14 -1.26 -5.04 118.33 117.05 1gpy n VAL 555 Ca -0.01 0.00 -0.01 0.00 -2.96 0.00 0.00 64.34 61.35 1gpy n VAL 555 Cb 0.59 0.00 -0.01 0.00 -1.06 0.00 0.00 33.84 33.36 1gpy n VAL 555 CO 0.00 0.00 0.00 1.57 -6.46 0.00 0.00 176.83 171.94 1gpy n HIS 556 N 0.00 -2.26 -2.64 1.45 -0.00 -1.26 -5.12 115.22 105.39 1gpy n HIS 556 Ca 0.00 1.33 -0.22 0.00 -0.00 0.00 0.00 57.72 58.84 1gpy n HIS 556 Cb 0.00 -2.78 0.05 0.00 -0.00 0.00 0.00 29.99 27.26 1gpy n HIS 556 CO 0.00 0.00 0.00 0.96 -0.00 0.00 0.00 176.34 177.30 1gpy s ILE 557 N -0.31 2.53 -0.33 3.57 -4.36 -1.26 -5.10 121.20 115.95 1gpy s ILE 557 Ca -0.07 -0.66 0.00 0.00 -0.26 0.00 0.00 60.65 59.66 1gpy s ILE 557 Cb 0.00 -2.87 0.08 0.00 1.25 0.00 0.00 42.46 40.92 1gpy s ILE 557 CO 0.20 0.00 0.04 0.21 0.24 0.00 0.00 174.94 175.63 1gpy s ASN 558 N -4.50 4.87 0.18 4.36 2.47 -1.26 -5.00 114.94 116.06 1gpy s ASN 558 Ca 0.59 -1.66 0.06 0.00 0.42 0.00 0.00 52.86 52.27 1gpy s ASN 558 Cb -0.09 -1.69 0.32 0.00 -1.45 0.00 0.00 41.25 38.33 1gpy s ASN 558 CO 0.40 -0.34 0.99 -0.81 -3.72 0.00 0.00 177.10 173.62 1gpy n PRO 559 N 4.50 0.04 -0.19 0.43 -0.04 -1.26 -1.25 135.00 137.24 1gpy n PRO 559 Ca -0.07 0.41 0.05 0.00 -0.04 0.00 0.00 63.50 63.85 1gpy n PRO 559 Cb 0.42 -1.97 0.15 0.00 -0.04 0.00 0.00 33.50 32.07 1gpy n PRO 559 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1gpy n ASN 560 N -1.66 1.88 -4.92 3.54 4.13 -1.26 -4.92 115.26 112.06 1gpy n ASN 560 Ca -0.00 -2.03 -0.22 0.00 1.68 0.00 0.00 54.58 54.01 1gpy n ASN 560 Cb 0.34 -0.25 0.05 0.00 -1.54 0.00 0.00 39.78 38.39 1gpy n ASN 560 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 1gpy s SER 561 N -0.96 5.06 0.04 6.41 1.04 -0.38 -4.87 113.70 120.05 1gpy s SER 561 Ca 0.23 -0.02 -0.29 0.00 0.48 0.00 0.00 55.95 56.34 1gpy s SER 561 Cb 0.12 -0.75 -0.04 0.00 0.10 0.00 0.00 66.02 65.45 1gpy s SER 561 CO 0.15 -1.32 0.93 -0.22 0.98 0.00 0.00 173.24 173.76 1gpy s LEU 562 N -4.88 4.42 -0.38 2.42 0.20 -0.80 -4.85 118.68 114.81 1gpy s LEU 562 Ca 0.59 1.65 -0.12 0.00 0.69 0.00 0.00 54.13 56.94 1gpy s LEU 562 Cb -0.10 -3.51 0.02 0.00 -0.43 0.00 0.00 46.19 42.18 1gpy s LEU 562 CO 0.40 -0.15 0.24 -0.36 -0.29 0.00 0.00 176.35 176.18 1gpy s PHE 563 N 0.54 3.23 -0.36 5.38 0.40 -1.26 -0.47 117.98 125.44 1gpy s PHE 563 Ca 0.48 -0.72 -0.10 0.00 -0.60 0.00 0.00 56.93 55.99 1gpy s PHE 563 Cb -0.21 -2.49 0.03 0.00 0.51 0.00 0.00 43.02 40.85 1gpy s PHE 563 CO 0.27 -0.58 0.18 0.34 0.70 0.00 0.00 175.22 176.13 1gpy s ASP 564 N 1.62 5.60 -0.03 1.36 -1.08 0.11 -1.07 116.67 123.19 1gpy s ASP 564 Ca 0.04 -0.99 0.02 0.00 -0.52 0.00 0.00 52.55 51.10 1gpy s ASP 564 Cb -0.19 -1.98 0.01 0.00 -1.46 0.00 0.00 42.92 39.30 1gpy s ASP 564 CO 0.08 -0.35 -0.06 0.54 0.52 0.00 0.00 175.17 175.89 1gpy s VAL 565 N 1.52 0.61 -0.25 1.11 0.11 -0.70 0.11 120.40 122.91 1gpy s VAL 565 Ca 0.01 -0.23 0.03 0.00 -2.93 0.00 0.00 61.98 58.86 1gpy s VAL 565 Cb -0.19 -0.58 0.06 0.00 -1.53 0.00 0.00 36.38 34.13 1gpy s VAL 565 CO 0.06 0.22 -0.11 -1.58 -3.33 0.00 0.00 175.10 170.35 1gpy s GLN 566 N 0.47 2.25 -0.09 1.54 0.74 -0.42 -1.73 119.66 122.43 1gpy s GLN 566 Ca -0.07 -1.30 -0.01 0.00 0.05 0.00 0.00 55.36 54.04 1gpy s GLN 566 Cb -0.10 -2.85 0.03 0.00 1.10 0.00 0.00 33.01 31.18 1gpy s GLN 566 CO 0.00 -0.55 -0.02 0.14 -0.55 0.00 0.00 175.29 174.31 1gpy s VAL 567 N 1.13 0.60 0.00 1.34 -7.23 -1.26 -1.61 120.40 113.37 1gpy s VAL 567 Ca -0.08 -0.02 0.00 0.00 -1.81 0.00 0.00 61.98 60.07 1gpy s VAL 567 Cb -0.19 -0.71 0.00 0.00 0.56 0.00 0.00 36.38 36.03 1gpy s VAL 567 CO -0.06 0.30 0.00 2.29 -0.31 0.00 0.00 175.10 177.32 1gpy n LYS 568 N 5.08 0.00 -1.57 4.82 2.85 -1.06 -4.99 118.16 123.28 1gpy n LYS 568 Ca -0.09 0.00 -0.43 0.00 -1.05 0.00 0.00 58.31 56.74 1gpy n LYS 568 Cb 0.50 0.00 -0.00 0.00 -0.65 0.00 0.00 35.03 34.88 1gpy n LYS 568 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1gpy n ARG 569 N -0.07 1.23 -2.74 -1.58 5.12 -1.26 -3.95 116.66 113.40 1gpy n ARG 569 Ca 0.00 0.43 -0.43 0.00 -1.93 0.00 0.00 57.85 55.93 1gpy n ARG 569 Cb 0.00 -1.85 -0.03 0.00 -1.16 0.00 0.00 32.46 29.42 1gpy n ARG 569 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1gpy s ILE 570 N -1.19 4.63 0.03 0.55 -1.09 -0.91 -4.90 121.20 118.32 1gpy s ILE 570 Ca 0.61 1.60 0.00 0.00 -2.23 0.00 0.00 60.65 60.63 1gpy s ILE 570 Cb -0.64 -4.31 -0.02 0.00 -1.58 0.00 0.00 42.46 35.90 1gpy s ILE 570 CO 0.59 -0.36 -0.04 -1.00 -1.23 0.00 0.00 174.94 172.90 1gpy s HIS 571 N 3.36 0.37 0.07 3.97 3.76 -1.26 -4.69 115.29 120.88 1gpy s HIS 571 Ca 0.41 -0.64 -0.23 0.00 -0.15 0.00 0.00 55.06 54.45 1gpy s HIS 571 Cb -0.13 -0.26 -0.15 0.00 1.11 0.00 0.00 32.58 33.15 1gpy s HIS 571 CO 0.13 -0.21 1.66 0.93 -0.85 0.00 0.00 174.74 176.40 1gpy h GLU 572 N 4.30 0.04 0.00 1.40 5.08 -1.97 -3.28 114.58 120.14 1gpy h GLU 572 Ca -0.33 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.03 1gpy h GLU 572 Cb 1.19 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1gpy h GLU 572 CO 0.46 0.12 0.00 2.48 -1.00 0.00 0.00 179.01 181.07 1gpy n TYR 573 N -5.02 0.76 0.87 4.33 0.18 -1.26 -1.33 117.16 115.69 1gpy n TYR 573 Ca -0.07 0.36 0.13 0.00 1.88 0.00 0.00 57.90 60.20 1gpy n TYR 573 Cb 0.07 -1.07 0.45 0.00 -0.38 0.00 0.00 39.34 38.41 1gpy n TYR 573 CO 0.00 0.00 0.00 1.63 -2.08 0.00 0.00 176.86 176.41 1gpy n LYS 574 N -2.25 0.09 -3.60 -3.48 5.02 -1.24 -2.92 118.16 109.78 1gpy n LYS 574 Ca -0.00 0.06 -0.24 0.00 -2.02 0.00 0.00 58.31 56.11 1gpy n LYS 574 Cb 0.11 -1.59 0.04 0.00 -0.02 0.00 0.00 35.03 33.58 1gpy n LYS 574 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1gpy n ARG 575 N -1.73 -3.02 0.19 1.97 1.74 -0.44 -3.92 116.66 111.44 1gpy n ARG 575 Ca 0.06 0.61 0.03 0.00 -0.77 0.00 0.00 57.85 57.78 1gpy n ARG 575 Cb 0.37 -4.93 0.36 0.00 -1.02 0.00 0.00 32.46 27.24 1gpy n ARG 575 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1gpy h GLN 576 N -1.71 0.00 0.00 5.56 7.50 -1.80 -1.85 115.11 122.81 1gpy h GLN 576 Ca -0.63 0.00 -0.06 0.00 0.50 0.00 0.00 58.65 58.46 1gpy h GLN 576 Cb 1.35 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 28.87 1gpy h GLN 576 CO 0.51 0.38 -0.29 -0.07 -1.50 0.00 0.00 178.83 177.86 1gpy h LEU 577 N 0.00 0.00 -0.29 1.46 3.38 -1.90 -1.71 115.31 116.25 1gpy h LEU 577 Ca -0.00 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.85 1gpy h LEU 577 Cb 0.69 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 1gpy h LEU 577 CO 0.05 0.29 -0.26 0.25 0.09 0.00 0.00 178.44 178.86 1gpy h LEU 578 N 0.00 0.74 -1.06 1.67 5.85 -1.72 -1.44 115.31 119.35 1gpy h LEU 578 Ca -0.00 -0.46 -0.04 0.00 0.84 0.00 0.00 57.88 58.21 1gpy h LEU 578 Cb 0.55 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.35 1gpy h LEU 578 CO 0.04 1.04 0.17 -1.13 -0.34 0.00 0.00 178.44 178.22 1gpy h ASN 579 N 0.44 0.77 -0.77 1.25 -0.00 -1.29 0.11 115.58 116.09 1gpy h ASN 579 Ca 0.05 -0.12 0.09 0.00 -0.00 0.00 0.00 56.30 56.31 1gpy h ASN 579 Cb 0.82 -0.20 -0.05 0.00 -0.00 0.00 0.00 38.32 38.89 1gpy h ASN 579 CO 0.07 0.74 0.50 0.00 -0.00 0.00 0.00 177.43 178.73 1gpy h LEU 581 N 0.73 0.93 -0.27 0.00 3.38 0.29 -1.81 115.31 118.55 1gpy h LEU 581 Ca 0.35 -0.65 0.06 0.00 0.09 0.00 0.00 57.88 57.73 1gpy h LEU 581 Cb 0.39 -0.28 -0.06 0.00 0.09 0.00 0.00 40.66 40.80 1gpy h LEU 581 CO -0.13 1.45 -0.13 -0.74 0.09 0.00 0.00 178.44 178.98 1gpy h HIS 582 N 0.50 -0.31 -0.63 1.13 2.76 -1.13 -1.04 115.15 116.44 1gpy h HIS 582 Ca -0.07 0.03 -0.04 0.00 -2.20 0.00 0.00 60.37 58.09 1gpy h HIS 582 Cb 1.49 0.18 -0.03 0.00 1.55 0.00 0.00 27.41 30.60 1gpy h HIS 582 CO 0.09 -0.20 0.25 0.28 -1.30 0.00 0.00 177.93 177.05 1gpy h VAL 583 N -0.09 1.22 -0.11 5.26 2.07 -1.17 -1.09 116.25 122.34 1gpy h VAL 583 Ca 0.14 -0.70 -0.15 0.00 0.82 0.00 0.00 66.70 66.82 1gpy h VAL 583 Cb 0.31 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 30.54 1gpy h VAL 583 CO -0.33 0.28 -0.58 0.40 0.02 0.00 0.00 177.57 177.35 1gpy h ILE 584 N 0.90 1.36 -0.11 4.57 2.04 -1.08 -2.49 117.51 122.71 1gpy h ILE 584 Ca 0.21 -1.90 0.02 0.00 1.00 0.00 0.00 64.86 64.18 1gpy h ILE 584 Cb 0.18 1.92 -0.02 0.00 -0.74 0.00 0.00 36.82 38.16 1gpy h ILE 584 CO -0.02 0.57 0.01 0.74 0.00 0.00 0.00 178.15 179.45 1gpy h THR 585 N 0.26 0.94 -0.16 -0.27 2.02 -0.82 -1.46 112.91 113.42 1gpy h THR 585 Ca -0.00 -0.02 -0.04 0.00 0.77 0.00 0.00 66.41 67.12 1gpy h THR 585 Cb 1.09 0.88 -0.01 0.00 -1.74 0.00 0.00 68.15 68.38 1gpy h THR 585 CO 0.10 0.01 -0.09 -0.07 0.37 0.00 0.00 175.52 175.84 1gpy h LEU 586 N 0.05 0.22 0.03 2.58 4.07 -1.13 -1.55 115.31 119.57 1gpy h LEU 586 Ca 0.05 -0.04 -0.00 0.00 0.08 0.00 0.00 57.88 57.97 1gpy h LEU 586 Cb 0.05 -0.06 0.00 0.00 1.08 0.00 0.00 40.66 41.73 1gpy h LEU 586 CO -0.08 0.34 -0.01 0.22 -1.08 0.00 0.00 178.44 177.83 1gpy h TYR 587 N 0.23 -0.03 -0.11 1.13 3.20 -1.21 -2.86 116.97 117.31 1gpy h TYR 587 Ca 0.05 -0.00 0.03 0.00 3.14 0.00 0.00 58.73 61.95 1gpy h TYR 587 Cb 0.31 0.01 -0.00 0.00 1.54 0.00 0.00 36.73 38.59 1gpy h TYR 587 CO 0.00 0.57 0.10 -0.91 -1.64 0.00 0.00 178.16 176.28 1gpy h ASN 588 N -0.67 0.00 0.33 -2.11 2.35 -0.99 0.31 115.58 114.80 1gpy h ASN 588 Ca -0.00 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.73 1gpy h ASN 588 Cb 0.62 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.99 1gpy h ASN 588 CO 0.01 0.00 -0.16 0.03 -1.65 0.00 0.00 177.43 175.66 1gpy h ARG 589 N 0.00 -0.43 -0.14 0.81 3.08 -1.32 -2.90 114.38 113.47 1gpy h ARG 589 Ca 0.05 0.03 0.05 0.00 0.07 0.00 0.00 59.98 60.18 1gpy h ARG 589 Cb 0.25 0.10 -0.06 0.00 0.08 0.00 0.00 29.97 30.34 1gpy h ARG 589 CO -0.00 -0.13 -0.28 0.82 -1.07 0.00 0.00 179.97 179.31 1gpy h ILE 590 N -0.98 0.35 -0.02 2.04 2.04 -1.23 -1.43 117.51 118.28 1gpy h ILE 590 Ca -0.05 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.82 1gpy h ILE 590 Cb 0.50 0.35 -0.00 0.00 -0.74 0.00 0.00 36.82 36.93 1gpy h ILE 590 CO 0.08 0.00 0.17 0.11 0.00 0.00 0.00 178.15 178.50 1gpy h LYS 591 N -0.35 0.00 0.10 2.37 1.79 -1.03 0.60 116.57 120.05 1gpy h LYS 591 Ca 0.10 0.00 -0.34 0.00 -2.18 0.00 0.00 60.65 58.23 1gpy h LYS 591 Cb 0.50 0.00 -0.02 0.00 -1.58 0.00 0.00 32.23 31.13 1gpy h LYS 591 CO -0.33 0.00 -1.89 -0.22 -1.08 0.00 0.00 179.45 175.93 1gpy h LYS 592 N 0.00 0.21 -2.13 3.15 1.63 -1.08 -3.39 116.57 114.97 1gpy h LYS 592 Ca 0.01 -0.36 -0.56 0.00 -0.85 0.00 0.00 60.65 58.88 1gpy h LYS 592 Cb 0.35 0.13 -0.41 0.00 -0.60 0.00 0.00 32.23 31.70 1gpy h LYS 592 CO -0.00 1.05 -0.85 -1.91 -3.45 0.00 0.00 179.45 174.28 1gpy n GLU 593 N -3.39 1.96 0.00 1.90 4.07 -0.71 -4.94 120.64 119.52 1gpy n GLU 593 Ca -0.27 -4.11 0.06 0.00 -0.06 0.00 0.00 57.16 52.78 1gpy n GLU 593 Cb 1.05 -1.89 0.31 0.00 -0.06 0.00 0.00 31.44 30.85 1gpy n GLU 593 CO 0.00 0.00 0.00 -0.35 -0.06 0.00 0.00 177.13 176.72 1gpy n PRO 594 N 0.58 0.16 -0.16 5.31 -0.04 0.17 -2.02 135.00 139.01 1gpy n PRO 594 Ca 0.27 0.18 0.07 0.00 -0.04 0.00 0.00 63.50 63.98 1gpy n PRO 594 Cb 0.49 -1.50 0.15 0.00 -0.04 0.00 0.00 33.50 32.60 1gpy n PRO 594 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1gpy n ASN 595 N -1.31 2.88 -4.88 3.54 3.02 -1.26 -4.93 115.26 112.32 1gpy n ASN 595 Ca 0.06 -1.87 -0.33 0.00 -0.03 0.00 0.00 54.58 52.40 1gpy n ASN 595 Cb 0.11 -0.20 -0.05 0.00 -0.61 0.00 0.00 39.78 39.02 1gpy n ASN 595 CO 0.00 0.00 0.00 -1.59 -2.62 0.00 0.00 177.26 173.05 1gpy s LYS 596 N -1.06 3.77 0.34 3.52 -2.85 -0.86 -5.05 119.74 117.56 1gpy s LYS 596 Ca 0.26 0.19 -0.27 0.00 -1.00 0.00 0.00 55.97 55.14 1gpy s LYS 596 Cb 0.14 -2.80 -0.09 0.00 -2.06 0.00 0.00 37.83 33.02 1gpy s LYS 596 CO 0.19 0.42 1.16 0.12 0.10 0.00 0.00 175.35 177.34 1gpy s PHE 597 N -1.66 3.27 -0.03 1.78 5.36 -1.26 -5.01 117.98 120.43 1gpy s PHE 597 Ca 0.42 1.59 -0.01 0.00 -0.96 0.00 0.00 56.93 57.97 1gpy s PHE 597 Cb -0.12 -3.38 0.03 0.00 -0.34 0.00 0.00 43.02 39.20 1gpy s PHE 597 CO 0.21 -1.08 0.06 0.54 -1.46 0.00 0.00 175.22 173.49 1gpy s VAL 598 N -1.29 -0.05 -0.04 3.12 0.11 -1.26 -5.13 120.40 115.86 1gpy s VAL 598 Ca 0.51 0.19 -0.30 0.00 -2.93 0.00 0.00 61.98 59.45 1gpy s VAL 598 Cb -0.32 -0.11 -0.05 0.00 -1.53 0.00 0.00 36.38 34.37 1gpy s VAL 598 CO 0.41 0.08 1.48 -0.69 -3.33 0.00 0.00 175.10 173.05 1gpy s VAL 599 N 0.99 3.70 0.39 2.04 1.01 -1.26 -4.98 120.40 122.29 1gpy s VAL 599 Ca -0.08 0.98 -0.23 0.00 0.00 0.00 0.00 61.98 62.65 1gpy s VAL 599 Cb -0.11 -3.63 -0.11 0.00 0.00 0.00 0.00 36.38 32.53 1gpy s VAL 599 CO -0.03 -0.04 0.95 -2.16 0.00 0.00 0.00 175.10 173.81 1gpy s PRO 600 N 3.12 4.36 -0.11 2.72 0.04 -1.26 -4.98 135.00 138.90 1gpy s PRO 600 Ca 0.66 1.20 -0.15 0.00 0.04 0.00 0.00 61.00 62.75 1gpy s PRO 600 Cb -0.31 -2.41 0.04 0.00 0.04 0.00 0.00 34.50 31.86 1gpy s PRO 600 CO 0.26 0.08 0.39 -0.98 0.04 0.00 0.00 177.00 176.80 1gpy s ARG 601 N -2.77 0.55 -0.33 4.56 1.70 -0.23 -1.90 118.95 120.53 1gpy s ARG 601 Ca 0.58 0.34 -0.07 0.00 -0.47 0.00 0.00 55.73 56.11 1gpy s ARG 601 Cb -0.13 0.26 0.03 0.00 -0.57 0.00 0.00 34.95 34.55 1gpy s ARG 601 CO 0.17 -0.10 0.11 0.99 -1.08 0.00 0.00 175.30 175.38 1gpy s THR 602 N -0.27 3.87 -0.23 4.99 2.01 0.38 -2.94 115.64 123.45 1gpy s THR 602 Ca -0.04 -1.04 -0.19 0.00 0.31 0.00 0.00 61.69 60.73 1gpy s THR 602 Cb -0.03 -3.16 -0.03 0.00 0.01 0.00 0.00 72.50 69.29 1gpy s THR 602 CO 0.02 -0.14 0.55 -0.69 -0.69 0.00 0.00 174.62 173.67 1gpy s VAL 603 N 1.43 5.06 -0.11 3.82 1.01 -1.08 0.10 120.40 130.64 1gpy s VAL 603 Ca -0.01 0.99 0.03 0.00 0.00 0.00 0.00 61.98 62.99 1gpy s VAL 603 Cb -0.19 -3.87 0.01 0.00 0.00 0.00 0.00 36.38 32.33 1gpy s VAL 603 CO 0.03 0.11 -0.19 -0.04 0.00 0.00 0.00 175.10 175.01 1gpy s MET 604 N 2.05 2.56 -0.04 2.72 -1.94 0.29 -0.62 119.30 124.32 1gpy s MET 604 Ca 0.24 -0.70 0.04 0.00 -1.71 0.00 0.00 55.69 53.56 1gpy s MET 604 Cb -0.16 -2.06 0.00 0.00 2.01 0.00 0.00 34.83 34.63 1gpy s MET 604 CO 0.09 0.03 -0.15 0.42 -0.01 0.00 0.00 175.02 175.40 1gpy s ILE 605 N 0.72 1.28 -0.00 2.53 1.01 -0.68 -1.30 121.20 124.76 1gpy s ILE 605 Ca -0.11 -0.63 -0.14 0.00 0.00 0.00 0.00 60.65 59.77 1gpy s ILE 605 Cb -0.16 -1.12 0.02 0.00 0.01 0.00 0.00 42.46 41.21 1gpy s ILE 605 CO 0.02 0.38 0.30 -0.83 0.00 0.00 0.00 174.94 174.81 1gpy s GLY 606 N 0.16 -0.14 0.00 6.18 0.00 -0.63 -0.29 107.32 112.59 1gpy s GLY 606 Ca -0.05 0.23 0.00 0.00 0.00 0.00 0.00 44.72 44.90 1gpy s GLY 606 CO 0.02 0.03 0.00 0.61 0.00 0.00 0.00 173.10 173.76 1gpy n GLY 607 N 1.12 3.40 3.70 0.20 0.00 -1.25 -2.57 105.19 109.79 1gpy n GLY 607 Ca -0.21 -0.99 -0.33 0.00 0.00 0.00 0.00 46.02 44.50 1gpy n GLY 607 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gpy s LYS 608 N -2.19 2.85 0.18 1.61 1.02 -1.26 -4.67 119.74 117.29 1gpy s LYS 608 Ca 0.00 -0.57 0.02 0.00 0.02 0.00 0.00 55.97 55.43 1gpy s LYS 608 Cb 0.00 -2.71 -0.04 0.00 -0.52 0.00 0.00 37.83 34.56 1gpy s LYS 608 CO 0.00 0.63 0.34 0.00 -0.92 0.00 0.00 175.35 175.40 1gpy s ALA 609 N -1.10 3.91 0.37 5.17 0.00 -1.26 -2.13 121.76 126.71 1gpy s ALA 609 Ca 0.20 -0.98 -0.25 0.00 0.00 0.00 0.00 51.96 50.93 1gpy s ALA 609 Cb -0.12 -1.86 -0.09 0.00 0.00 0.00 0.00 23.12 21.05 1gpy s ALA 609 CO 0.10 0.45 1.00 0.00 0.00 0.00 0.00 175.76 177.32 1gpy s ALA 610 N -1.83 3.14 -0.63 0.00 0.00 -1.26 -4.95 121.76 116.23 1gpy s ALA 610 Ca 0.36 0.62 -0.25 0.00 0.00 0.00 0.00 51.96 52.69 1gpy s ALA 610 Cb -0.11 -3.23 -0.15 0.00 0.00 0.00 0.00 23.12 19.63 1gpy s ALA 610 CO 0.29 -0.04 1.86 -2.30 0.00 0.00 0.00 175.76 175.57 1gpy n PRO 611 N 0.17 0.00 -0.70 0.00 -0.02 -1.26 -1.78 135.00 131.41 1gpy n PRO 611 Ca 0.04 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.52 1gpy n PRO 611 Cb 0.50 -1.09 0.00 0.00 -0.02 0.00 0.00 33.50 32.89 1gpy n PRO 611 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1gpy n GLY 612 N 4.93 0.64 3.44 -1.23 0.00 -1.26 -4.96 105.19 106.75 1gpy n GLY 612 Ca 0.46 -0.11 -0.44 0.00 0.00 0.00 0.00 46.02 45.94 1gpy n GLY 612 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1gpy s TYR 613 N -2.00 2.86 0.21 1.61 6.14 -0.74 -4.88 117.35 120.56 1gpy s TYR 613 Ca 0.00 -0.87 -0.07 0.00 0.64 0.00 0.00 57.07 56.78 1gpy s TYR 613 Cb 0.00 -4.24 0.17 0.00 0.42 0.00 0.00 41.96 38.31 1gpy s TYR 613 CO 0.00 -1.54 1.71 1.25 0.64 0.00 0.00 175.55 177.61 1gpy h HIS 614 N 9.29 1.10 -0.10 4.97 -0.00 -1.93 -1.61 115.15 126.88 1gpy h HIS 614 Ca -0.16 -0.15 -0.03 0.00 -0.00 0.00 0.00 60.37 60.02 1gpy h HIS 614 Cb 1.06 -0.30 -0.00 0.00 -0.00 0.00 0.00 27.41 28.17 1gpy h HIS 614 CO 1.00 0.93 -0.08 1.98 -0.00 0.00 0.00 177.93 181.77 1gpy h MET 615 N 0.97 0.22 -0.60 5.26 1.85 -1.98 -0.25 114.93 120.40 1gpy h MET 615 Ca 0.19 -0.11 0.11 0.00 -0.61 0.00 0.00 59.70 59.28 1gpy h MET 615 Cb 0.44 0.00 -0.08 0.00 0.43 0.00 0.00 31.60 32.38 1gpy h MET 615 CO 0.01 0.62 0.15 0.00 -0.40 0.00 0.00 176.91 177.30 1gpy h ALA 616 N 0.60 0.73 -0.13 0.39 0.00 -1.88 0.30 119.26 119.28 1gpy h ALA 616 Ca 0.02 0.12 -0.09 0.00 0.00 0.00 0.00 54.91 54.96 1gpy h ALA 616 Cb 0.57 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1gpy h ALA 616 CO 0.02 -0.28 -0.32 0.87 0.00 0.00 0.00 179.25 179.54 1gpy h LYS 617 N 0.30 0.25 -0.15 0.00 1.57 -1.22 -2.12 116.57 115.19 1gpy h LYS 617 Ca 0.31 -0.10 -0.13 0.00 -1.87 0.00 0.00 60.65 58.87 1gpy h LYS 617 Cb 0.45 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 32.74 1gpy h LYS 617 CO -0.38 0.55 -0.47 0.52 -0.57 0.00 0.00 179.45 179.11 1gpy h MET 618 N 0.22 0.39 -0.31 3.15 2.86 -0.24 -2.89 114.93 118.10 1gpy h MET 618 Ca 0.03 -0.21 -0.15 0.00 -2.06 0.00 0.00 59.70 57.30 1gpy h MET 618 Cb 0.69 0.01 -0.01 0.00 0.06 0.00 0.00 31.60 32.35 1gpy h MET 618 CO 0.05 0.78 -0.42 0.82 1.06 0.00 0.00 176.91 179.20 1gpy h ILE 619 N 0.31 1.29 -0.99 -1.22 2.04 0.10 -1.32 117.51 117.71 1gpy h ILE 619 Ca 0.02 -1.60 0.03 0.00 1.00 0.00 0.00 64.86 64.31 1gpy h ILE 619 Cb 0.94 1.49 -0.06 0.00 -0.74 0.00 0.00 36.82 38.46 1gpy h ILE 619 CO 0.08 0.52 0.65 0.40 0.00 0.00 0.00 178.15 179.80 1gpy h ILE 620 N 0.63 1.19 -0.72 -0.67 2.04 -1.38 -2.44 117.51 116.15 1gpy h ILE 620 Ca 0.05 -0.44 -0.02 0.00 1.00 0.00 0.00 64.86 65.45 1gpy h ILE 620 Cb 0.98 -0.19 -0.03 0.00 -0.74 0.00 0.00 36.82 36.83 1gpy h ILE 620 CO 0.09 0.23 0.38 0.50 0.00 0.00 0.00 178.15 179.35 1gpy h LYS 621 N 1.27 1.01 -0.09 2.37 1.63 -1.20 -2.65 116.57 118.91 1gpy h LYS 621 Ca 0.39 -0.12 0.00 0.00 -0.85 0.00 0.00 60.65 60.07 1gpy h LYS 621 Cb -0.03 -0.20 -0.00 0.00 -0.60 0.00 0.00 32.23 31.40 1gpy h LYS 621 CO -0.12 0.76 0.06 -0.07 -3.45 0.00 0.00 179.45 176.63 1gpy h LEU 622 N 1.01 0.11 -0.39 5.20 3.38 -0.81 -0.35 115.31 123.46 1gpy h LEU 622 Ca 0.25 -0.02 0.05 0.00 0.09 0.00 0.00 57.88 58.26 1gpy h LEU 622 Cb 0.06 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 40.73 1gpy h LEU 622 CO -0.04 0.10 0.10 0.40 0.09 0.00 0.00 178.44 179.09 1gpy h ILE 623 N 0.11 0.84 0.00 1.22 2.04 -1.25 0.14 117.51 120.61 1gpy h ILE 623 Ca 0.03 -0.08 -0.18 0.00 1.00 0.00 0.00 64.86 65.63 1gpy h ILE 623 Cb 0.01 0.57 -0.03 0.00 -0.74 0.00 0.00 36.82 36.63 1gpy h ILE 623 CO -0.01 0.04 -0.86 0.71 0.00 0.00 0.00 178.15 178.04 1gpy h THR 624 N 0.24 1.59 -0.42 -0.27 1.35 -1.49 -2.04 112.91 111.87 1gpy h THR 624 Ca 0.18 -2.98 -0.10 0.00 -0.55 0.00 0.00 66.41 62.96 1gpy h THR 624 Cb 0.19 2.62 -0.02 0.00 -1.73 0.00 0.00 68.15 69.22 1gpy h THR 624 CO -0.21 0.84 -0.14 0.00 -0.25 0.00 0.00 175.52 175.76 1gpy h ALA 625 N 1.14 0.96 -0.23 6.62 0.00 -0.43 -0.05 119.26 127.26 1gpy h ALA 625 Ca -0.01 -0.33 -0.04 0.00 0.00 0.00 0.00 54.91 54.53 1gpy h ALA 625 Cb 1.55 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 19.16 1gpy h ALA 625 CO 0.11 0.61 -0.01 0.82 0.00 0.00 0.00 179.25 180.79 1gpy h ILE 626 N 0.70 1.26 -0.89 0.00 2.04 -0.66 -3.13 117.51 116.83 1gpy h ILE 626 Ca 0.11 -0.91 0.03 0.00 1.00 0.00 0.00 64.86 65.09 1gpy h ILE 626 Cb 0.63 1.40 -0.05 0.00 -0.74 0.00 0.00 36.82 38.06 1gpy h ILE 626 CO 0.04 0.28 0.58 1.23 0.00 0.00 0.00 178.15 180.29 1gpy h GLY 627 N 0.18 1.27 1.65 5.37 0.00 -1.15 0.15 103.07 110.53 1gpy h GLY 627 Ca 0.06 -0.44 -0.00 0.00 0.00 0.00 0.00 47.33 46.95 1gpy h GLY 627 CO 0.01 0.39 0.21 -0.55 0.00 0.00 0.00 176.54 176.60 1gpy h ASP 628 N 1.12 0.41 0.00 0.19 3.32 -1.00 -0.56 116.42 119.90 1gpy h ASP 628 Ca 0.35 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.38 1gpy h ASP 628 Cb 0.00 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.45 1gpy h ASP 628 CO -0.10 0.32 -0.07 0.58 -1.72 0.00 0.00 179.24 178.25 1gpy h VAL 629 N 0.48 0.00 -0.29 -1.35 2.07 -1.31 -3.32 116.25 112.54 1gpy h VAL 629 Ca 0.13 -0.72 0.07 0.00 0.82 0.00 0.00 66.70 67.00 1gpy h VAL 629 Cb -0.01 0.00 -0.08 0.00 -1.52 0.00 0.00 31.29 29.68 1gpy h VAL 629 CO -0.02 0.00 -0.26 0.58 0.02 0.00 0.00 177.57 177.89 1gpy h VAL 630 N -0.72 0.35 0.00 2.57 2.07 -0.81 -1.60 116.25 118.11 1gpy h VAL 630 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1gpy h VAL 630 Cb 0.07 0.35 0.00 0.00 -1.52 0.00 0.00 31.29 30.19 1gpy h VAL 630 CO 0.00 0.00 0.00 0.59 0.02 0.00 0.00 177.57 178.18 1gpy n ASN 631 N -5.39 0.00 -0.80 0.57 3.02 -0.22 -1.66 115.26 110.78 1gpy n ASN 631 Ca -0.00 -0.00 0.05 0.00 -0.03 0.00 0.00 54.58 54.60 1gpy n ASN 631 Cb 0.30 -0.18 0.13 0.00 -0.61 0.00 0.00 39.78 39.42 1gpy n ASN 631 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1gpy n HIS 632 N -1.18 0.00 -3.13 3.10 8.25 -0.61 -4.99 115.22 116.65 1gpy n HIS 632 Ca 0.05 -1.06 -0.40 0.00 -0.26 0.00 0.00 57.72 56.05 1gpy n HIS 632 Cb 0.06 -0.20 -0.07 0.00 1.12 0.00 0.00 29.99 30.90 1gpy n HIS 632 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1gpy s ASP 633 N -2.70 6.55 0.48 0.41 -1.08 -0.66 -4.91 116.67 114.76 1gpy s ASP 633 Ca 0.34 0.67 0.28 0.00 -0.52 0.00 0.00 52.55 53.32 1gpy s ASP 633 Cb 0.34 -2.33 1.01 0.00 -1.46 0.00 0.00 42.92 40.49 1gpy s ASP 633 CO -0.08 -0.35 1.85 1.55 0.52 0.00 0.00 175.17 178.66 1gpy h PRO 634 N 7.92 0.00 -0.02 4.34 0.13 -1.94 -1.82 132.00 140.61 1gpy h PRO 634 Ca -0.27 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.69 1gpy h PRO 634 Cb 1.13 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.24 1gpy h PRO 634 CO 0.76 0.11 -0.73 0.28 -0.23 0.00 0.00 178.00 178.19 1gpy h VAL 635 N 0.00 1.47 0.06 1.56 2.07 -1.98 -3.22 116.25 116.21 1gpy h VAL 635 Ca -0.00 -2.35 -0.28 0.00 0.82 0.00 0.00 66.70 64.88 1gpy h VAL 635 Cb 0.70 2.27 0.02 0.00 -1.52 0.00 0.00 31.29 32.76 1gpy h VAL 635 CO 0.01 0.68 -1.14 0.58 0.02 0.00 0.00 177.57 177.73 1gpy h VAL 636 N 0.09 1.28 0.00 2.57 2.07 -1.74 -3.48 116.25 117.04 1gpy h VAL 636 Ca -0.02 -2.35 0.00 0.00 0.82 0.00 0.00 66.70 65.15 1gpy h VAL 636 Cb 1.29 2.52 0.00 0.00 -1.52 0.00 0.00 31.29 33.59 1gpy h VAL 636 CO 0.11 0.72 0.00 0.61 0.02 0.00 0.00 177.57 179.03 1gpy n GLY 637 N 1.22 2.89 1.10 2.17 0.00 -0.75 -2.43 105.19 109.38 1gpy n GLY 637 Ca -0.12 -0.32 0.03 0.00 0.00 0.00 0.00 46.02 45.61 1gpy n GLY 637 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1gpy n ASP 638 N 1.13 3.05 0.08 1.61 9.92 -1.26 -4.09 116.55 126.98 1gpy n ASP 638 Ca 0.00 -2.39 -0.23 0.00 -0.53 0.00 0.00 54.79 51.64 1gpy n ASP 638 Cb 0.00 -0.56 -0.15 0.00 -0.64 0.00 0.00 41.12 39.77 1gpy n ASP 638 CO 0.00 0.00 0.00 0.03 0.13 0.00 0.00 177.20 177.36 1gpy h ARG 639 N 1.83 0.38 -4.08 -1.24 3.08 -1.85 -3.43 114.38 109.08 1gpy h ARG 639 Ca 0.00 -0.66 -0.41 0.00 0.07 0.00 0.00 59.98 58.98 1gpy h ARG 639 Cb 1.12 0.24 -0.34 0.00 0.08 0.00 0.00 29.97 31.08 1gpy h ARG 639 CO 0.21 1.31 -0.77 -0.51 -1.07 0.00 0.00 179.97 179.14 1gpy s LEU 640 N -7.58 1.39 -0.05 3.04 1.43 -1.26 -1.07 118.68 114.58 1gpy s LEU 640 Ca -0.14 -0.14 0.03 0.00 -1.03 0.00 0.00 54.13 52.85 1gpy s LEU 640 Cb 0.04 -0.46 0.01 0.00 0.03 0.00 0.00 46.19 45.80 1gpy s LEU 640 CO 0.86 -0.04 -0.11 -0.60 0.23 0.00 0.00 176.35 176.68 1gpy s ARG 641 N 0.82 1.44 -0.16 1.70 6.06 -1.15 -4.58 118.95 123.09 1gpy s ARG 641 Ca -0.11 -0.39 0.01 0.00 -2.50 0.00 0.00 55.73 52.74 1gpy s ARG 641 Cb -0.14 -1.25 0.02 0.00 0.06 0.00 0.00 34.95 33.64 1gpy s ARG 641 CO 0.01 0.07 -0.19 0.08 -2.50 0.00 0.00 175.30 172.77 1gpy s VAL 642 N 0.47 1.94 -0.14 7.11 1.01 -1.26 -2.62 120.40 126.91 1gpy s VAL 642 Ca -0.10 -0.87 0.02 0.00 0.00 0.00 0.00 61.98 61.03 1gpy s VAL 642 Cb -0.13 -1.75 0.01 0.00 0.00 0.00 0.00 36.38 34.51 1gpy s VAL 642 CO 0.02 0.52 -0.20 -0.63 0.00 0.00 0.00 175.10 174.81 1gpy s ILE 643 N 1.23 1.94 -0.26 2.22 -1.09 0.20 -4.47 121.20 120.97 1gpy s ILE 643 Ca 0.02 -0.90 -0.20 0.00 -2.23 0.00 0.00 60.65 57.34 1gpy s ILE 643 Cb -0.14 -1.73 -0.02 0.00 -1.58 0.00 0.00 42.46 39.00 1gpy s ILE 643 CO -0.10 0.53 0.61 0.12 -1.23 0.00 0.00 174.94 174.86 1gpy s PHE 644 N 0.92 3.27 -0.75 3.97 2.19 -1.26 -1.69 117.98 124.63 1gpy s PHE 644 Ca -0.05 0.74 -0.26 0.00 0.33 0.00 0.00 56.93 57.69 1gpy s PHE 644 Cb -0.15 -2.84 0.01 0.00 -1.31 0.00 0.00 43.02 38.72 1gpy s PHE 644 CO -0.03 -0.34 1.57 -0.51 1.83 0.00 0.00 175.22 177.73 1gpy s LEU 645 N 2.49 3.25 0.19 6.12 1.02 0.60 -4.95 118.68 127.40 1gpy s LEU 645 Ca 0.25 -0.35 -0.32 0.00 0.02 0.00 0.00 54.13 53.73 1gpy s LEU 645 Cb -0.15 -2.55 -0.12 0.00 0.02 0.00 0.00 46.19 43.39 1gpy s LEU 645 CO 0.09 -2.07 1.72 -1.61 0.02 0.00 0.00 176.35 174.50 1gpy s GLU 646 N 6.21 4.13 -1.10 1.70 2.02 -1.26 -3.92 118.70 126.48 1gpy s GLU 646 Ca 0.51 2.58 -0.15 0.00 0.02 0.00 0.00 54.97 57.93 1gpy s GLU 646 Cb -0.08 -3.14 -0.03 0.00 0.10 0.00 0.00 34.13 30.98 1gpy s GLU 646 CO 0.12 -0.75 0.84 -1.71 0.02 0.00 0.00 175.26 173.78 1gpy n ASN 647 N 4.17 -5.87 -4.68 -0.19 5.15 -1.24 -4.95 115.26 107.64 1gpy n ASN 647 Ca 0.16 -0.89 -0.42 0.00 -0.60 0.00 0.00 54.58 52.82 1gpy n ASN 647 Cb 0.36 -4.08 -0.03 0.00 -0.53 0.00 0.00 39.78 35.51 1gpy n ASN 647 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 1gpy s TYR 648 N -3.43 2.90 0.33 1.20 5.04 -1.26 -4.88 117.35 117.26 1gpy s TYR 648 Ca 0.47 0.93 -0.05 0.00 -2.44 0.00 0.00 57.07 55.98 1gpy s TYR 648 Cb -0.13 -3.58 0.02 0.00 0.35 0.00 0.00 41.96 38.62 1gpy s TYR 648 CO 0.82 -2.08 0.51 2.89 -1.34 0.00 0.00 175.55 176.35 1gpy n ARG 649 N 5.61 0.74 0.34 4.97 1.85 -1.26 -4.83 116.66 124.07 1gpy n ARG 649 Ca 0.13 -2.41 -0.18 0.00 -1.00 0.00 0.00 57.85 54.39 1gpy n ARG 649 Cb 0.45 2.47 -0.09 0.00 -1.05 0.00 0.00 32.46 34.23 1gpy n ARG 649 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 1gpy h VAL 650 N 1.91 0.25 0.00 8.89 2.07 -1.95 0.10 116.25 127.53 1gpy h VAL 650 Ca -0.26 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.26 1gpy h VAL 650 Cb 1.09 0.25 -0.00 0.00 -1.52 0.00 0.00 31.29 31.11 1gpy h VAL 650 CO 0.35 0.00 -0.00 0.77 0.02 0.00 0.00 177.57 178.70 1gpy h SER 651 N -0.92 0.00 0.57 0.57 4.64 -1.96 -0.84 113.55 115.60 1gpy h SER 651 Ca -0.07 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.02 1gpy h SER 651 Cb 0.74 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.83 1gpy h SER 651 CO 0.08 0.00 -1.01 0.25 -0.87 0.00 0.00 176.83 175.29 1gpy h LEU 652 N 0.00 0.36 -1.25 5.97 5.85 -1.79 -3.25 115.31 121.20 1gpy h LEU 652 Ca -0.00 -0.32 -0.04 0.00 0.84 0.00 0.00 57.88 58.36 1gpy h LEU 652 Cb 0.01 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 1gpy h LEU 652 CO 0.00 1.16 0.05 0.00 -0.34 0.00 0.00 178.44 179.32 1gpy h ALA 653 N 0.80 1.39 0.00 1.25 0.00 0.63 -1.47 119.26 121.87 1gpy h ALA 653 Ca -0.08 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1gpy h ALA 653 Cb 1.68 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.31 1gpy h ALA 653 CO 0.16 0.43 0.00 0.39 0.00 0.00 0.00 179.25 180.23 1gpy n GLU 654 N -4.30 0.17 -0.13 0.00 1.02 -0.95 -1.64 120.64 114.80 1gpy n GLU 654 Ca 0.02 0.55 -0.24 0.00 -0.02 0.00 0.00 57.16 57.46 1gpy n GLU 654 Cb 0.22 -1.92 -0.08 0.00 -0.02 0.00 0.00 31.44 29.63 1gpy n GLU 654 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1gpy n LYS 655 N -2.26 0.57 0.17 3.49 4.01 -0.60 -4.64 118.16 118.90 1gpy n LYS 655 Ca 0.00 0.24 0.05 0.00 -0.51 0.00 0.00 58.31 58.10 1gpy n LYS 655 Cb 0.12 -1.46 0.22 0.00 -0.51 0.00 0.00 35.03 33.39 1gpy n LYS 655 CO 0.00 0.00 0.00 -0.24 -1.11 0.00 0.00 177.40 176.05 1gpy h VAL 656 N -0.99 0.81 -0.20 -0.18 3.04 -1.43 -3.28 116.25 114.02 1gpy h VAL 656 Ca -0.52 -1.77 -0.10 0.00 -1.01 0.00 0.00 66.70 63.31 1gpy h VAL 656 Cb 1.45 2.13 -0.00 0.00 -2.01 0.00 0.00 31.29 32.86 1gpy h VAL 656 CO -0.31 0.40 -0.27 0.40 -1.01 0.00 0.00 177.57 176.78 1gpy h ILE 657 N 0.00 1.33 -0.35 3.17 2.04 -1.56 -2.42 117.51 119.72 1gpy h ILE 657 Ca -0.00 -1.47 0.10 0.00 1.00 0.00 0.00 64.86 64.49 1gpy h ILE 657 Cb 1.10 1.82 -0.01 0.00 -0.74 0.00 0.00 36.82 38.98 1gpy h ILE 657 CO 0.05 0.45 0.30 -0.65 0.00 0.00 0.00 178.15 178.31 1gpy h PRO 658 N 0.19 0.00 -0.12 2.37 0.11 -1.80 -2.49 132.00 130.27 1gpy h PRO 658 Ca 0.02 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.13 1gpy h PRO 658 Cb 0.84 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.95 1gpy h PRO 658 CO 0.06 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 177.85 1gpy n ALA 659 N -2.47 2.50 -1.98 -0.75 0.00 -1.11 -4.73 120.51 111.97 1gpy n ALA 659 Ca 0.06 -0.63 -0.37 0.00 0.00 0.00 0.00 53.44 52.50 1gpy n ALA 659 Cb 0.47 -1.00 -0.06 0.00 0.00 0.00 0.00 19.45 18.86 1gpy n ALA 659 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1gpy s ALA 660 N -1.87 3.38 -0.26 0.00 0.00 -0.93 -4.70 121.76 117.37 1gpy s ALA 660 Ca 0.34 0.32 -0.07 0.00 0.00 0.00 0.00 51.96 52.55 1gpy s ALA 660 Cb 0.20 -2.95 -0.15 0.00 0.00 0.00 0.00 23.12 20.22 1gpy s ALA 660 CO 0.31 0.28 -0.26 -0.25 0.00 0.00 0.00 175.76 175.83 1gpy n ASP 661 N 0.99 1.97 -4.23 0.00 8.00 -0.73 -4.19 116.55 118.36 1gpy n ASP 661 Ca -0.02 0.13 -0.32 0.00 0.71 0.00 0.00 54.79 55.28 1gpy n ASP 661 Cb 0.50 -0.65 -0.17 0.00 -0.02 0.00 0.00 41.12 40.78 1gpy n ASP 661 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1gpy s LEU 662 N -7.07 2.10 -0.38 0.64 0.20 -0.23 -0.95 118.68 112.99 1gpy s LEU 662 Ca -0.36 -0.55 -0.06 0.00 0.69 0.00 0.00 54.13 53.85 1gpy s LEU 662 Cb 0.12 -1.41 0.07 0.00 -0.43 0.00 0.00 46.19 44.54 1gpy s LEU 662 CO 0.55 0.17 0.16 -0.55 -0.29 0.00 0.00 176.35 176.39 1gpy s SER 663 N 0.28 5.34 -0.06 3.68 0.15 0.05 -1.72 113.70 121.43 1gpy s SER 663 Ca -0.17 -1.49 -0.30 0.00 0.70 0.00 0.00 55.95 54.69 1gpy s SER 663 Cb -0.17 -1.87 -0.03 0.00 -1.71 0.00 0.00 66.02 62.23 1gpy s SER 663 CO 0.08 -0.44 1.14 -1.61 1.20 0.00 0.00 173.24 173.61 1gpy s GLU 664 N 1.32 4.39 -0.39 5.44 0.41 -0.70 -1.47 118.70 127.70 1gpy s GLU 664 Ca 0.02 1.59 0.09 0.00 -0.41 0.00 0.00 54.97 56.25 1gpy s GLU 664 Cb -0.22 -3.54 0.26 0.00 -1.78 0.00 0.00 34.13 28.86 1gpy s GLU 664 CO 0.00 -0.38 0.55 1.04 -0.49 0.00 0.00 175.26 175.98 1gpy n GLN 665 N 5.02 0.75 -0.83 1.61 3.00 -0.82 -4.73 117.38 121.37 1gpy n GLN 665 Ca 0.10 -3.23 -0.06 0.00 -0.01 0.00 0.00 57.00 53.80 1gpy n GLN 665 Cb 0.47 -1.28 0.21 0.00 0.00 0.00 0.00 30.24 29.64 1gpy n GLN 665 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.06 176.17 1gpy n ILE 666 N 1.26 2.63 -1.52 5.09 2.08 -1.26 -3.05 119.36 124.58 1gpy n ILE 666 Ca 0.21 -2.51 -0.39 0.00 0.56 0.00 0.00 62.75 60.63 1gpy n ILE 666 Cb 0.55 -0.33 0.04 0.00 -0.75 0.00 0.00 39.64 39.14 1gpy n ILE 666 CO 0.00 0.00 0.00 -1.20 0.56 0.00 0.00 176.55 175.91 1gpy n SER 667 N -1.03 -0.25 -4.74 4.38 7.64 -1.25 -4.54 113.62 113.82 1gpy n SER 667 Ca 0.36 0.81 -0.41 0.00 1.01 0.00 0.00 58.87 60.63 1gpy n SER 667 Cb 1.12 -1.25 -0.02 0.00 -1.01 0.00 0.00 64.21 63.05 1gpy n SER 667 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1gpy s THR 668 N -1.58 2.61 0.15 0.44 2.01 -1.15 -4.72 115.64 113.41 1gpy s THR 668 Ca 0.69 0.50 -0.34 0.00 0.31 0.00 0.00 61.69 62.86 1gpy s THR 668 Cb -0.47 -3.32 -0.16 0.00 0.01 0.00 0.00 72.50 68.56 1gpy s THR 668 CO 0.53 0.07 1.17 0.00 -0.69 0.00 0.00 174.62 175.71 1gpy n ALA 669 N 2.61 -0.99 -0.09 7.40 0.00 -1.26 -2.75 120.51 125.43 1gpy n ALA 669 Ca 0.08 0.48 0.00 0.00 0.00 0.00 0.00 53.44 54.00 1gpy n ALA 669 Cb 0.40 -2.01 0.00 0.00 0.00 0.00 0.00 19.45 17.83 1gpy n ALA 669 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1gpy n GLY 670 N 2.08 0.79 0.09 0.00 0.00 -1.26 -4.76 105.19 102.13 1gpy n GLY 670 Ca 0.16 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.03 1gpy n GLY 670 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1gpy n THR 671 N -2.00 1.49 -1.90 2.61 -2.24 -1.11 -4.81 114.28 106.32 1gpy n THR 671 Ca 0.00 0.06 -0.40 0.00 -2.27 0.00 0.00 64.05 61.45 1gpy n THR 671 Cb 0.00 -2.18 -0.03 0.00 -2.10 0.00 0.00 70.33 66.02 1gpy n THR 671 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1gpy s GLU 672 N -2.32 2.76 0.18 -0.78 2.56 -1.26 -4.53 118.70 115.30 1gpy s GLU 672 Ca -0.24 1.12 -0.13 0.00 0.00 0.00 0.00 54.97 55.72 1gpy s GLU 672 Cb 0.05 -4.37 0.16 0.00 2.00 0.00 0.00 34.13 31.96 1gpy s GLU 672 CO 0.44 -2.54 1.74 0.00 -0.56 0.00 0.00 175.26 174.34 1gpy h ALA 673 N 15.31 0.57 0.00 6.30 0.00 -1.87 -3.07 119.26 136.50 1gpy h ALA 673 Ca -0.29 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1gpy h ALA 673 Cb 1.19 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1gpy h ALA 673 CO 1.13 -0.24 -0.10 0.45 0.00 0.00 0.00 179.25 180.49 1gpy n SER 674 N -5.03 0.07 0.00 0.00 2.88 -1.26 -4.10 113.62 106.18 1gpy n SER 674 Ca 0.05 0.25 0.00 0.00 -1.33 0.00 0.00 58.87 57.83 1gpy n SER 674 Cb 0.20 0.14 0.00 0.00 -0.75 0.00 0.00 64.21 63.80 1gpy n SER 674 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1gpy n GLY 675 N 1.92 -2.47 0.00 0.46 0.00 -1.26 0.04 105.19 103.88 1gpy n GLY 675 Ca 0.00 -1.39 0.00 0.00 0.00 0.00 0.00 46.02 44.63 1gpy n GLY 675 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1gpy n THR 676 N -1.54 0.00 -0.28 2.61 -2.24 -1.26 -4.79 114.28 106.79 1gpy n THR 676 Ca 0.00 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.86 1gpy n THR 676 Cb 0.00 0.00 0.22 0.00 -2.10 0.00 0.00 70.33 68.45 1gpy n THR 676 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1gpy h GLY 677 N 0.00 1.27 0.44 3.38 0.00 -1.95 -1.90 103.07 104.32 1gpy h GLY 677 Ca 0.00 -0.16 0.05 0.00 0.00 0.00 0.00 47.33 47.23 1gpy h GLY 677 CO 0.00 -0.15 -0.08 3.45 0.00 0.00 0.00 176.54 179.76 1gpy h ASN 678 N 0.44 -0.28 -0.66 0.19 7.08 -1.94 -2.14 115.58 118.26 1gpy h ASN 678 Ca 0.46 0.08 0.00 0.00 -3.08 0.00 0.00 56.30 53.77 1gpy h ASN 678 Cb 0.76 0.18 -0.03 0.00 -2.08 0.00 0.00 38.32 37.15 1gpy h ASN 678 CO -0.45 -0.10 0.43 0.24 -2.08 0.00 0.00 177.43 175.47 1gpy h MET 679 N -0.02 0.88 -0.40 4.14 2.86 -1.70 -2.47 114.93 118.23 1gpy h MET 679 Ca 0.13 -0.06 -0.10 0.00 -2.06 0.00 0.00 59.70 57.61 1gpy h MET 679 Cb 0.22 -0.20 -0.02 0.00 0.06 0.00 0.00 31.60 31.66 1gpy h MET 679 CO -0.28 0.59 -0.16 0.87 1.06 0.00 0.00 176.91 178.98 1gpy h LYS 680 N 0.90 0.75 -0.19 1.72 1.57 -0.80 -2.27 116.57 118.26 1gpy h LYS 680 Ca 0.24 -0.27 -0.11 0.00 -1.87 0.00 0.00 60.65 58.64 1gpy h LYS 680 Cb -0.09 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.17 1gpy h LYS 680 CO -0.05 0.87 -0.31 0.74 -0.57 0.00 0.00 179.45 180.13 1gpy h PHE 681 N 0.67 0.67 0.00 -1.35 0.04 -1.44 -2.68 116.94 112.84 1gpy h PHE 681 Ca 0.10 -0.23 -0.02 0.00 2.80 0.00 0.00 57.97 60.62 1gpy h PHE 681 Cb 0.65 -0.13 -0.00 0.00 2.20 0.00 0.00 35.95 38.67 1gpy h PHE 681 CO 0.03 0.95 -0.12 1.98 -0.60 0.00 0.00 178.31 180.55 1gpy h MET 682 N 0.20 0.00 -0.04 1.51 4.05 -1.26 -2.13 114.93 117.25 1gpy h MET 682 Ca 0.01 0.00 -0.18 0.00 -0.28 0.00 0.00 59.70 59.25 1gpy h MET 682 Cb 0.89 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.68 1gpy h MET 682 CO 0.07 0.12 -0.77 -0.07 0.23 0.00 0.00 176.91 176.49 1gpy h LEU 683 N 0.00 0.35 -1.69 3.39 3.38 -1.30 -3.30 115.31 116.13 1gpy h LEU 683 Ca -0.00 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.72 1gpy h LEU 683 Cb 0.27 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.92 1gpy h LEU 683 CO 0.02 0.99 0.00 0.59 0.09 0.00 0.00 178.44 180.13 1gpy n ASN 684 N -3.77 2.50 -0.01 -0.43 3.02 -0.86 -4.87 115.26 110.84 1gpy n ASN 684 Ca -0.04 -1.91 0.00 0.00 -0.03 0.00 0.00 54.58 52.61 1gpy n ASN 684 Cb 0.73 -0.24 0.00 0.00 -0.61 0.00 0.00 39.78 39.66 1gpy n ASN 684 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1gpy n GLY 685 N 1.28 1.42 3.74 7.41 0.00 -0.94 -4.84 105.19 113.26 1gpy n GLY 685 Ca 0.17 -0.30 -0.27 0.00 0.00 0.00 0.00 46.02 45.62 1gpy n GLY 685 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gpy s ALA 686 N -2.02 3.40 0.38 4.61 0.00 -0.87 -4.72 121.76 122.54 1gpy s ALA 686 Ca 0.00 -1.26 -0.04 0.00 0.00 0.00 0.00 51.96 50.66 1gpy s ALA 686 Cb 0.00 -1.20 -0.04 0.00 0.00 0.00 0.00 23.12 21.87 1gpy s ALA 686 CO 0.00 0.52 0.64 -0.51 0.00 0.00 0.00 175.76 176.41 1gpy s LEU 687 N -2.96 3.89 -0.14 0.00 1.02 -0.12 -4.47 118.68 115.90 1gpy s LEU 687 Ca 0.29 0.74 -0.02 0.00 0.02 0.00 0.00 54.13 55.16 1gpy s LEU 687 Cb -0.10 -3.62 -0.02 0.00 0.02 0.00 0.00 46.19 42.47 1gpy s LEU 687 CO 0.21 -0.36 -0.08 -0.89 0.02 0.00 0.00 176.35 175.25 1gpy s THR 688 N -2.38 3.53 -0.06 5.49 2.01 -1.26 -0.77 115.64 122.20 1gpy s THR 688 Ca 0.44 -0.50 -0.03 0.00 0.31 0.00 0.00 61.69 61.92 1gpy s THR 688 Cb -0.10 -2.51 -0.04 0.00 0.01 0.00 0.00 72.50 69.86 1gpy s THR 688 CO 0.36 0.52 0.09 -0.51 -0.69 0.00 0.00 174.62 174.39 1gpy s ILE 689 N 0.25 4.97 0.10 1.82 2.07 -0.54 -2.66 121.20 127.21 1gpy s ILE 689 Ca -0.06 -0.15 -0.21 0.00 -1.41 0.00 0.00 60.65 58.83 1gpy s ILE 689 Cb -0.15 -3.20 0.07 0.00 0.13 0.00 0.00 42.46 39.31 1gpy s ILE 689 CO 0.04 0.49 0.98 0.61 -1.91 0.00 0.00 174.94 175.15 1gpy n GLY 690 N 1.62 0.55 3.97 1.50 0.00 -0.37 -1.94 105.19 110.52 1gpy n GLY 690 Ca -0.16 -1.09 -0.19 0.00 0.00 0.00 0.00 46.02 44.58 1gpy n GLY 690 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1gpy s THR 691 N -2.09 3.27 -1.18 2.61 -4.23 -1.17 -1.81 115.64 111.03 1gpy s THR 691 Ca 0.22 -1.10 -0.17 0.00 -1.18 0.00 0.00 61.69 59.46 1gpy s THR 691 Cb -0.02 -3.12 0.11 0.00 1.34 0.00 0.00 72.50 70.81 1gpy s THR 691 CO 0.03 -0.06 1.50 -0.04 -0.54 0.00 0.00 174.62 175.52 1gpy s MET 692 N -4.23 3.93 0.10 3.99 -1.94 -1.26 -4.78 119.30 115.10 1gpy s MET 692 Ca 0.50 -2.08 -0.01 0.00 -1.71 0.00 0.00 55.69 52.39 1gpy s MET 692 Cb -0.08 -5.25 -0.04 0.00 2.01 0.00 0.00 34.83 31.47 1gpy s MET 692 CO 0.31 -2.00 0.03 0.34 -0.01 0.00 0.00 175.02 173.69 1gpy s ASP 693 N 3.71 0.37 0.00 3.03 2.15 -1.26 -4.55 116.67 120.12 1gpy s ASP 693 Ca 0.46 -1.12 0.00 0.00 0.43 0.00 0.00 52.55 52.31 1gpy s ASP 693 Cb -0.00 0.26 0.00 0.00 -0.30 0.00 0.00 42.92 42.88 1gpy s ASP 693 CO 0.00 -0.68 0.00 0.61 -0.17 0.00 0.00 175.17 174.93 1gpy n GLY 694 N -0.02 1.50 0.24 2.66 0.00 -1.16 -1.47 105.19 106.94 1gpy n GLY 694 Ca -0.09 0.03 0.12 0.00 0.00 0.00 0.00 46.02 46.09 1gpy n GLY 694 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gpy n ALA 695 N 4.40 2.60 0.18 4.61 0.00 0.11 -2.93 120.51 129.48 1gpy n ALA 695 Ca 0.00 -0.31 0.05 0.00 0.00 0.00 0.00 53.44 53.18 1gpy n ALA 695 Cb 0.00 -1.27 0.31 0.00 0.00 0.00 0.00 19.45 18.49 1gpy n ALA 695 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1gpy h ASN 696 N 1.05 0.00 -0.18 0.00 2.35 -1.44 -1.56 115.58 115.79 1gpy h ASN 696 Ca 0.00 0.00 -0.11 0.00 -0.55 0.00 0.00 56.30 55.64 1gpy h ASN 696 Cb 0.23 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.58 1gpy h ASN 696 CO 0.00 0.40 -0.27 0.58 -1.65 0.00 0.00 177.43 176.49 1gpy h VAL 697 N 0.00 1.28 0.16 2.81 2.07 -1.40 -2.79 116.25 118.38 1gpy h VAL 697 Ca -0.00 -1.37 -0.30 0.00 0.82 0.00 0.00 66.70 65.84 1gpy h VAL 697 Cb 0.93 1.32 0.01 0.00 -1.52 0.00 0.00 31.29 32.03 1gpy h VAL 697 CO 0.05 0.45 -1.42 -0.33 0.02 0.00 0.00 177.57 176.34 1gpy h GLU 698 N 0.57 0.33 -0.09 1.57 5.08 -1.71 -2.94 114.58 117.38 1gpy h GLU 698 Ca 0.07 -0.57 0.04 0.00 -1.00 0.00 0.00 59.36 57.90 1gpy h GLU 698 Cb 0.75 0.21 -0.04 0.00 0.50 0.00 0.00 28.75 30.18 1gpy h GLU 698 CO 0.06 1.24 -0.15 0.52 -1.00 0.00 0.00 179.01 179.68 1gpy h MET 699 N 0.09 -0.19 -0.37 2.33 2.86 -1.38 0.11 114.93 118.38 1gpy h MET 699 Ca -0.21 0.01 -0.08 0.00 -2.06 0.00 0.00 59.70 57.36 1gpy h MET 699 Cb 2.04 0.04 -0.02 0.00 0.06 0.00 0.00 31.60 33.73 1gpy h MET 699 CO 0.21 -0.13 -0.12 0.00 1.06 0.00 0.00 176.91 177.93 1gpy h ALA 700 N 0.82 1.10 -0.45 6.32 0.00 -1.56 0.16 119.26 125.64 1gpy h ALA 700 Ca 0.08 -0.30 -0.09 0.00 0.00 0.00 0.00 54.91 54.60 1gpy h ALA 700 Cb 0.32 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1gpy h ALA 700 CO -0.21 0.56 -0.08 1.49 0.00 0.00 0.00 179.25 181.01 1gpy h GLU 701 N 0.60 0.86 0.08 0.00 4.81 -1.54 0.17 114.58 119.56 1gpy h GLU 701 Ca 0.11 -0.31 -0.00 0.00 -0.13 0.00 0.00 59.36 59.02 1gpy h GLU 701 Cb 0.55 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.88 1gpy h GLU 701 CO 0.03 0.95 -0.04 1.49 -0.73 0.00 0.00 179.01 180.72 1gpy h GLU 702 N 0.70 -0.10 0.00 1.92 4.57 -0.10 -3.28 114.58 118.30 1gpy h GLU 702 Ca 0.12 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.31 1gpy h GLU 702 Cb 0.61 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.23 1gpy h GLU 702 CO 0.04 0.36 0.00 0.00 -1.18 0.00 0.00 179.01 178.22 1gpy h ALA 703 N 0.26 1.00 -0.99 2.92 0.00 -0.74 -3.48 119.26 118.23 1gpy h ALA 703 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1gpy h ALA 703 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1gpy h ALA 703 CO 0.02 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.68 1gpy n GLY 704 N -0.39 -2.49 0.07 0.00 0.00 0.42 -4.43 105.19 98.37 1gpy n GLY 704 Ca -0.00 -0.82 0.02 0.00 0.00 0.00 0.00 46.02 45.22 1gpy n GLY 704 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1gpy n GLU 705 N 0.62 -0.02 0.08 1.61 2.13 -0.11 0.33 120.64 125.29 1gpy n GLU 705 Ca 0.00 0.31 0.04 0.00 0.66 0.00 0.00 57.16 58.17 1gpy n GLU 705 Cb 0.00 -0.48 0.44 0.00 0.27 0.00 0.00 31.44 31.68 1gpy n GLU 705 CO 0.00 0.00 0.00 0.93 -0.41 0.00 0.00 177.13 177.65 1gpy h GLU 706 N 0.00 0.35 -1.22 5.31 3.07 -1.89 -2.88 114.58 117.31 1gpy h GLU 706 Ca 0.11 -0.04 -0.14 0.00 -0.50 0.00 0.00 59.36 58.78 1gpy h GLU 706 Cb 0.18 -0.07 -0.08 0.00 -0.84 0.00 0.00 28.75 27.95 1gpy h GLU 706 CO -0.20 0.31 0.18 0.09 -1.40 0.00 0.00 179.01 178.00 1gpy n ASN 707 N -4.41 4.01 -3.80 1.42 3.02 0.15 -4.86 115.26 110.80 1gpy n ASN 707 Ca 0.01 -2.51 -0.10 0.00 -0.03 0.00 0.00 54.58 51.95 1gpy n ASN 707 Cb 0.14 -0.74 -0.05 0.00 -0.61 0.00 0.00 39.78 38.53 1gpy n ASN 707 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1gpy s PHE 708 N -0.87 0.04 -0.63 3.10 5.36 -1.09 -4.86 117.98 119.02 1gpy s PHE 708 Ca 0.15 -0.39 0.06 0.00 -0.96 0.00 0.00 56.93 55.79 1gpy s PHE 708 Cb 0.12 0.22 0.23 0.00 -0.34 0.00 0.00 43.02 43.25 1gpy s PHE 708 CO 0.02 -0.81 0.65 1.19 -1.46 0.00 0.00 175.22 174.81 1gpy n PHE 709 N -0.27 3.06 -3.21 10.12 3.01 -1.09 -5.00 117.46 124.08 1gpy n PHE 709 Ca -0.10 -4.12 -0.37 0.00 1.01 0.00 0.00 57.45 53.86 1gpy n PHE 709 Cb 0.63 -0.53 -0.06 0.00 -0.01 0.00 0.00 39.48 39.51 1gpy n PHE 709 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 1gpy s ILE 710 N -2.01 4.67 0.26 4.37 1.09 -1.26 -1.24 121.20 127.07 1gpy s ILE 710 Ca 0.35 1.21 -0.11 0.00 -1.10 0.00 0.00 60.65 61.00 1gpy s ILE 710 Cb 0.10 -3.88 -0.00 0.00 -1.06 0.00 0.00 42.46 37.61 1gpy s ILE 710 CO -0.07 0.39 0.47 0.72 -0.10 0.00 0.00 174.94 176.34 1gpy s PHE 711 N -1.31 0.46 0.00 3.97 -0.71 -0.75 -4.94 117.98 114.70 1gpy s PHE 711 Ca 0.36 -0.81 0.00 0.00 -1.04 0.00 0.00 56.93 55.44 1gpy s PHE 711 Cb -0.18 0.14 0.00 0.00 -1.21 0.00 0.00 43.02 41.77 1gpy s PHE 711 CO 0.21 -1.00 0.00 0.41 -1.34 0.00 0.00 175.22 173.50 1gpy n GLY 712 N -0.39 -2.14 3.74 1.99 0.00 -1.26 -4.36 105.19 102.76 1gpy n GLY 712 Ca -0.01 -1.46 -0.42 0.00 0.00 0.00 0.00 46.02 44.13 1gpy n GLY 712 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1gpy s MET 713 N -0.19 4.20 0.58 1.61 -1.94 -1.26 -4.88 119.30 117.42 1gpy s MET 713 Ca 0.00 2.42 -0.04 0.00 -1.71 0.00 0.00 55.69 56.36 1gpy s MET 713 Cb 0.00 -3.10 0.02 0.00 2.01 0.00 0.00 34.83 33.76 1gpy s MET 713 CO 0.00 -0.56 0.87 1.03 -0.01 0.00 0.00 175.02 176.35 1gpy s ARG 714 N 0.14 2.81 0.48 2.03 3.00 -1.26 -4.44 118.95 121.71 1gpy s ARG 714 Ca 0.65 -0.20 0.13 0.00 0.00 0.00 0.00 55.73 56.31 1gpy s ARG 714 Cb -0.45 -2.33 1.12 0.00 0.00 0.00 0.00 34.95 33.30 1gpy s ARG 714 CO 0.40 -0.70 2.12 0.28 0.00 0.00 0.00 175.30 177.39 1gpy h VAL 715 N -0.11 1.04 -0.94 3.52 2.07 -1.86 0.71 116.25 120.67 1gpy h VAL 715 Ca -0.45 -0.07 0.23 0.00 0.82 0.00 0.00 66.70 67.23 1gpy h VAL 715 Cb 1.27 0.82 -0.12 0.00 -1.52 0.00 0.00 31.29 31.73 1gpy h VAL 715 CO 0.59 0.04 0.48 -0.33 0.02 0.00 0.00 177.57 178.37 1gpy h GLU 716 N 0.20 0.47 0.00 1.57 5.08 -1.96 -2.80 114.58 117.15 1gpy h GLU 716 Ca 0.06 -0.03 -0.18 0.00 -1.00 0.00 0.00 59.36 58.20 1gpy h GLU 716 Cb -0.01 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.10 1gpy h GLU 716 CO -0.01 0.31 -1.08 -0.44 -1.00 0.00 0.00 179.01 176.79 1gpy h ASP 717 N 0.49 0.00 -0.21 1.42 3.32 -1.21 -2.88 116.42 117.34 1gpy h ASP 717 Ca 0.59 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.64 1gpy h ASP 717 Cb 1.11 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.65 1gpy h ASP 717 CO -0.50 0.76 0.11 0.58 -1.72 0.00 0.00 179.24 178.47 1gpy h VAL 718 N 0.00 1.11 0.11 -1.35 2.07 -1.36 -1.81 116.25 115.02 1gpy h VAL 718 Ca -0.09 -0.30 0.01 0.00 0.82 0.00 0.00 66.70 67.13 1gpy h VAL 718 Cb 1.66 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 32.35 1gpy h VAL 718 CO 0.08 0.11 -0.12 0.44 0.02 0.00 0.00 177.57 178.10 1gpy h ASP 719 N 0.23 -0.32 -0.95 0.57 3.32 -1.54 -0.55 116.42 117.18 1gpy h ASP 719 Ca 0.07 0.03 0.11 0.00 0.02 0.00 0.00 57.03 57.27 1gpy h ASP 719 Cb 0.07 0.12 -0.08 0.00 0.22 0.00 0.00 39.33 39.66 1gpy h ASP 719 CO -0.01 -0.19 0.61 -0.09 -1.72 0.00 0.00 179.24 177.84 1gpy h ARG 720 N -0.26 0.89 -0.32 3.56 2.43 -1.36 -0.45 114.38 118.87 1gpy h ARG 720 Ca 0.01 -0.05 -0.14 0.00 -0.81 0.00 0.00 59.98 58.99 1gpy h ARG 720 Cb 0.26 -0.20 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 1gpy h ARG 720 CO -0.04 0.59 -0.37 1.25 -1.51 0.00 0.00 179.97 179.89 1gpy h LEU 721 N 0.92 0.77 -0.68 3.80 5.85 -0.75 -2.69 115.31 122.53 1gpy h LEU 721 Ca 0.46 -0.34 -0.14 0.00 0.84 0.00 0.00 57.88 58.70 1gpy h LEU 721 Cb 0.49 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 1gpy h LEU 721 CO -0.22 1.06 -0.54 0.44 -0.34 0.00 0.00 178.44 178.84 1gpy h ASP 722 N 0.61 0.37 -0.04 1.25 3.32 0.47 0.62 116.42 123.02 1gpy h ASP 722 Ca 0.06 -0.19 -0.01 0.00 0.02 0.00 0.00 57.03 56.90 1gpy h ASP 722 Cb 0.90 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 40.35 1gpy h ASP 722 CO 0.08 0.84 -0.01 1.56 -1.72 0.00 0.00 179.24 179.99 1gpy h GLN 723 N 0.26 0.09 0.00 3.56 4.20 -1.25 -2.56 115.11 119.41 1gpy h GLN 723 Ca 0.01 -0.03 -0.06 0.00 0.06 0.00 0.00 58.65 58.62 1gpy h GLN 723 Cb 1.03 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.80 1gpy h GLN 723 CO 0.09 0.43 -0.28 0.07 -0.67 0.00 0.00 178.83 178.47 1gpy h ARG 724 N -0.27 0.00 0.00 1.46 0.11 -1.29 -3.49 114.38 110.90 1gpy h ARG 724 Ca 0.01 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.09 1gpy h ARG 724 Cb 0.40 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.48 1gpy h ARG 724 CO 0.00 0.28 0.00 0.41 0.10 0.00 0.00 179.97 180.76 1gpy n GLY 725 N -0.50 1.14 3.68 0.08 0.00 0.22 -5.01 105.19 104.80 1gpy n GLY 725 Ca -0.02 -1.05 -0.42 0.00 0.00 0.00 0.00 46.02 44.53 1gpy n GLY 725 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1gpy s TYR 726 N 0.00 2.84 -0.32 1.61 5.04 -1.21 -4.89 117.35 120.42 1gpy s TYR 726 Ca 0.00 0.90 0.03 0.00 -2.44 0.00 0.00 57.07 55.56 1gpy s TYR 726 Cb 0.00 -3.59 0.09 0.00 0.35 0.00 0.00 41.96 38.81 1gpy s TYR 726 CO 0.00 -2.13 0.03 1.21 -1.34 0.00 0.00 175.55 173.31 1gpy s ASN 727 N 1.96 4.59 0.50 4.32 3.84 -1.26 -4.99 114.94 123.89 1gpy s ASN 727 Ca 0.61 -1.93 0.15 0.00 0.21 0.00 0.00 52.86 51.90 1gpy s ASN 727 Cb -0.28 -1.51 1.20 0.00 -0.55 0.00 0.00 41.25 40.12 1gpy s ASN 727 CO 0.23 -0.35 2.12 0.00 -2.79 0.00 0.00 177.10 176.31 1gpy h ALA 728 N 7.71 1.93 -0.54 1.71 0.00 -1.89 -2.98 119.26 125.20 1gpy h ALA 728 Ca -0.08 -0.03 0.08 0.00 0.00 0.00 0.00 54.91 54.88 1gpy h ALA 728 Cb 1.03 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.74 1gpy h ALA 728 CO 0.50 0.05 0.19 0.37 0.00 0.00 0.00 179.25 180.36 1gpy h GLN 729 N 0.04 0.35 -0.97 0.00 -0.00 -1.94 -0.55 115.11 112.05 1gpy h GLN 729 Ca 0.01 -0.02 0.27 0.00 -0.00 0.00 0.00 58.65 58.91 1gpy h GLN 729 Cb 0.05 -0.08 -0.14 0.00 0.00 0.00 0.00 27.48 27.31 1gpy h GLN 729 CO 0.00 0.23 0.50 1.49 0.00 0.00 0.00 178.83 181.05 1gpy h GLU 730 N 0.36 0.39 0.10 1.69 4.81 -1.95 -0.72 114.58 119.26 1gpy h GLU 730 Ca 0.26 -0.02 -0.27 0.00 -0.13 0.00 0.00 59.36 59.21 1gpy h GLU 730 Cb 0.30 -0.09 0.01 0.00 0.63 0.00 0.00 28.75 29.61 1gpy h GLU 730 CO -0.27 0.25 -1.16 1.88 -0.73 0.00 0.00 179.01 178.98 1gpy h TYR 731 N 0.40 0.61 0.04 0.92 0.05 -1.29 -0.37 116.97 117.33 1gpy h TYR 731 Ca 0.65 -0.40 -0.00 0.00 0.05 0.00 0.00 58.73 59.03 1gpy h TYR 731 Cb 1.36 -0.04 0.00 0.00 1.01 0.00 0.00 36.73 39.06 1gpy h TYR 731 CO -0.07 1.28 -0.02 -0.92 -1.05 0.00 0.00 178.16 177.38 1gpy h TYR 732 N 0.15 -0.05 -0.01 4.88 3.20 -0.55 0.26 116.97 124.85 1gpy h TYR 732 Ca -0.13 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.74 1gpy h TYR 732 Cb 1.86 0.02 0.00 0.00 1.54 0.00 0.00 36.73 40.14 1gpy h TYR 732 CO 0.07 0.19 -0.29 -0.40 -1.64 0.00 0.00 178.16 176.09 1gpy n ASP 733 N -5.00 0.97 0.02 -2.11 5.68 -0.38 -3.75 116.55 111.98 1gpy n ASP 733 Ca -0.08 -0.82 -0.18 0.00 -0.50 0.00 0.00 54.79 53.21 1gpy n ASP 733 Cb 0.15 0.16 -0.13 0.00 -1.14 0.00 0.00 41.12 40.15 1gpy n ASP 733 CO 0.00 0.00 0.00 -0.09 -1.33 0.00 0.00 177.20 175.78 1gpy h ARG 734 N 1.06 0.29 -4.91 0.11 9.65 -0.92 -3.45 114.38 116.20 1gpy h ARG 734 Ca 0.00 -0.42 -0.66 0.00 -1.10 0.00 0.00 59.98 57.80 1gpy h ARG 734 Cb 0.51 0.14 -0.27 0.00 -1.39 0.00 0.00 29.97 28.96 1gpy h ARG 734 CO 0.00 1.16 -0.68 0.42 2.80 0.00 0.00 179.97 183.67 1gpy s ILE 735 N -2.66 3.65 0.14 1.20 -1.09 0.07 -4.99 121.20 117.51 1gpy s ILE 735 Ca -0.14 -0.58 -0.12 0.00 -2.23 0.00 0.00 60.65 57.58 1gpy s ILE 735 Cb 0.01 -2.77 -0.00 0.00 -1.58 0.00 0.00 42.46 38.12 1gpy s ILE 735 CO 0.81 0.27 1.56 -0.65 -1.23 0.00 0.00 174.94 175.70 1gpy h PRO 736 N 8.16 0.87 -0.69 2.79 0.11 -1.88 -1.71 132.00 139.65 1gpy h PRO 736 Ca -0.37 -0.32 0.12 0.00 0.11 0.00 0.00 66.00 65.54 1gpy h PRO 736 Cb 1.14 -0.06 -0.09 0.00 0.11 0.00 0.00 31.00 32.11 1gpy h PRO 736 CO 0.60 0.96 0.25 0.93 -0.21 0.00 0.00 178.00 180.53 1gpy h GLU 737 N 0.71 0.40 -0.63 1.05 5.08 -1.95 0.66 114.58 119.90 1gpy h GLU 737 Ca 0.12 -0.02 -0.03 0.00 -1.00 0.00 0.00 59.36 58.43 1gpy h GLU 737 Cb 0.63 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.76 1gpy h GLU 737 CO 0.04 0.27 0.28 1.25 -1.00 0.00 0.00 179.01 179.85 1gpy h LEU 738 N 0.41 0.84 -0.73 1.33 6.46 -1.87 -3.02 115.31 118.74 1gpy h LEU 738 Ca 0.36 -0.15 -0.10 0.00 -0.12 0.00 0.00 57.88 57.87 1gpy h LEU 738 Cb 0.51 -0.22 -0.02 0.00 -0.73 0.00 0.00 40.66 40.21 1gpy h LEU 738 CO -0.37 0.76 -0.12 -0.09 -0.62 0.00 0.00 178.44 178.00 1gpy h ARG 739 N 0.87 0.85 -0.79 1.25 2.43 -0.08 -2.36 114.38 116.56 1gpy h ARG 739 Ca 0.21 -0.30 0.04 0.00 -0.81 0.00 0.00 59.98 59.13 1gpy h ARG 739 Cb 0.16 -0.06 -0.05 0.00 -0.42 0.00 0.00 29.97 29.59 1gpy h ARG 739 CO -0.02 0.93 0.49 0.37 -1.51 0.00 0.00 179.97 180.23 1gpy h GLN 740 N 0.77 0.91 -0.28 0.20 4.15 -0.91 -2.63 115.11 117.32 1gpy h GLN 740 Ca 0.12 -0.05 -0.12 0.00 0.77 0.00 0.00 58.65 59.37 1gpy h GLN 740 Cb 0.63 -0.20 -0.01 0.00 0.21 0.00 0.00 27.48 28.10 1gpy h GLN 740 CO 0.04 0.60 -0.34 0.82 -1.93 0.00 0.00 178.83 178.02 1gpy h ILE 741 N 0.93 1.29 0.00 2.39 2.04 -1.31 -1.90 117.51 120.95 1gpy h ILE 741 Ca 0.33 -1.48 -0.11 0.00 1.00 0.00 0.00 64.86 64.60 1gpy h ILE 741 Cb 0.08 1.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.59 1gpy h ILE 741 CO -0.14 0.47 -0.52 0.40 0.00 0.00 0.00 178.15 178.36 1gpy h ILE 742 N 0.51 1.06 0.00 -0.67 1.08 -1.13 -1.80 117.51 116.57 1gpy h ILE 742 Ca 0.06 -2.02 -0.11 0.00 -0.39 0.00 0.00 64.86 62.39 1gpy h ILE 742 Cb 0.84 2.20 -0.02 0.00 -3.07 0.00 0.00 36.82 36.77 1gpy h ILE 742 CO 0.07 0.51 -0.84 -0.33 -0.69 0.00 0.00 178.15 176.87 1gpy h GLU 743 N 0.00 0.00 -0.72 2.37 3.07 -1.39 -1.39 114.58 116.52 1gpy h GLU 743 Ca -0.01 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 58.81 1gpy h GLU 743 Cb 1.16 0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 29.04 1gpy h GLU 743 CO 0.07 0.34 0.29 1.96 -1.40 0.00 0.00 179.01 180.27 1gpy h GLN 744 N 0.00 1.08 -0.11 2.33 4.20 -0.93 0.35 115.11 122.03 1gpy h GLN 744 Ca -0.06 -0.19 -0.01 0.00 0.06 0.00 0.00 58.65 58.45 1gpy h GLN 744 Cb 1.39 -0.18 -0.00 0.00 0.30 0.00 0.00 27.48 28.99 1gpy h GLN 744 CO 0.05 0.89 0.03 -0.07 -0.67 0.00 0.00 178.83 179.05 1gpy h LEU 745 N 1.04 0.16 -1.44 1.46 3.38 -1.38 -1.72 115.31 116.82 1gpy h LEU 745 Ca 0.24 -0.23 -0.02 0.00 0.09 0.00 0.00 57.88 57.96 1gpy h LEU 745 Cb 0.21 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.91 1gpy h LEU 745 CO -0.02 0.35 -0.08 0.28 0.09 0.00 0.00 178.44 179.06 1gpy h SER 746 N -0.03 0.00 0.21 -0.43 0.02 -0.92 -3.03 113.55 109.37 1gpy h SER 746 Ca 0.03 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.98 1gpy h SER 746 Cb 0.25 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.79 1gpy h SER 746 CO 0.00 0.08 -0.24 -1.54 -1.14 0.00 0.00 176.83 174.00 1gpy n SER 747 N -3.24 1.10 -0.01 3.07 3.41 0.12 -4.89 113.62 113.18 1gpy n SER 747 Ca 0.00 -0.96 0.00 0.00 -0.26 0.00 0.00 58.87 57.65 1gpy n SER 747 Cb 0.33 0.13 0.00 0.00 -0.26 0.00 0.00 64.21 64.41 1gpy n SER 747 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1gpy n GLY 748 N 1.33 0.51 0.29 5.00 0.00 -1.14 -4.88 105.19 106.29 1gpy n GLY 748 Ca 0.13 -0.81 -0.07 0.00 0.00 0.00 0.00 46.02 45.27 1gpy n GLY 748 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1gpy h PHE 749 N 0.00 0.99 -0.02 1.61 3.57 -1.56 -3.15 116.94 118.39 1gpy h PHE 749 Ca 0.00 -0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.43 1gpy h PHE 749 Cb 0.92 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 39.36 1gpy h PHE 749 CO 0.00 0.76 -0.37 1.19 -2.23 0.00 0.00 178.31 177.67 1gpy n PHE 750 N -4.43 0.00 -3.41 0.41 3.72 -1.26 -4.47 117.46 108.03 1gpy n PHE 750 Ca 0.05 0.00 -0.26 0.00 -0.05 0.00 0.00 57.45 57.19 1gpy n PHE 750 Cb 0.16 -0.01 -0.09 0.00 -0.94 0.00 0.00 39.48 38.59 1gpy n PHE 750 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 1gpy n SER 751 N 0.12 0.65 -2.39 4.37 3.41 -1.19 -4.82 113.62 113.76 1gpy n SER 751 Ca 0.11 -2.70 -0.26 0.00 -0.26 0.00 0.00 58.87 55.76 1gpy n SER 751 Cb 0.47 -0.62 -0.03 0.00 -0.26 0.00 0.00 64.21 63.77 1gpy n SER 751 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1gpy n PRO 752 N 2.08 2.32 0.00 4.33 -0.04 -1.19 -1.59 135.00 140.90 1gpy n PRO 752 Ca 0.26 -2.30 0.00 0.00 -0.04 0.00 0.00 63.50 61.42 1gpy n PRO 752 Cb 0.47 -2.06 0.00 0.00 -0.04 0.00 0.00 33.50 31.87 1gpy n PRO 752 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1gpy n LYS 753 N 0.63 0.00 -2.90 0.54 4.01 -1.26 -4.98 118.16 114.19 1gpy n LYS 753 Ca 0.46 0.00 -0.12 0.00 -0.51 0.00 0.00 58.31 58.14 1gpy n LYS 753 Cb 0.54 -0.02 0.04 0.00 -0.51 0.00 0.00 35.03 35.09 1gpy n LYS 753 CO 0.00 0.00 0.00 0.94 -1.11 0.00 0.00 177.40 177.23 1gpy n GLN 754 N 0.00 1.02 0.09 1.97 0.00 -0.62 -5.01 117.38 114.83 1gpy n GLN 754 Ca 0.00 -2.58 0.05 0.00 -0.00 0.00 0.00 57.00 54.47 1gpy n GLN 754 Cb 0.09 -1.23 0.48 0.00 0.00 0.00 0.00 30.24 29.59 1gpy n GLN 754 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.06 176.06 1gpy h PRO 755 N 2.92 0.34 0.00 3.69 0.13 -1.84 -1.98 132.00 135.26 1gpy h PRO 755 Ca -0.04 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 1gpy h PRO 755 Cb 1.07 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.13 1gpy h PRO 755 CO 0.28 0.25 0.00 -0.25 -0.23 0.00 0.00 178.00 178.06 1gpy n ASP 756 N -4.47 0.00 -0.15 1.44 9.92 -1.26 -4.08 116.55 117.96 1gpy n ASP 756 Ca 0.01 -0.81 -0.04 0.00 -0.53 0.00 0.00 54.79 53.42 1gpy n ASP 756 Cb 0.09 0.00 0.05 0.00 -0.64 0.00 0.00 41.12 40.63 1gpy n ASP 756 CO 0.00 0.00 0.00 0.25 0.13 0.00 0.00 177.20 177.58 1gpy h LEU 757 N 0.00 0.10 -3.21 0.64 5.85 -1.69 -2.33 115.31 114.67 1gpy h LEU 757 Ca 0.00 0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.79 1gpy h LEU 757 Cb 0.00 0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.10 1gpy h LEU 757 CO 0.00 0.09 0.00 0.49 -0.34 0.00 0.00 178.44 178.68 1gpy n PHE 758 N -5.05 1.47 0.21 1.25 3.72 -1.26 -4.49 117.46 113.32 1gpy n PHE 758 Ca 0.04 -0.65 0.02 0.00 -0.05 0.00 0.00 57.45 56.81 1gpy n PHE 758 Cb 0.20 -0.29 0.10 0.00 -0.94 0.00 0.00 39.48 38.56 1gpy n PHE 758 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1gpy n LYS 759 N 0.83 0.08 -0.08 -1.08 5.02 -0.88 -1.87 118.16 120.18 1gpy n LYS 759 Ca 0.25 0.16 -0.11 0.00 -2.02 0.00 0.00 58.31 56.59 1gpy n LYS 759 Cb 0.92 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 34.37 1gpy n LYS 759 CO 0.00 0.00 0.00 0.22 -0.52 0.00 0.00 177.40 177.10 1gpy h ASP 760 N 0.00 0.00 -0.48 4.39 3.58 -1.82 -2.74 116.42 119.34 1gpy h ASP 760 Ca 0.00 -0.32 -0.00 0.00 0.42 0.00 0.00 57.03 57.12 1gpy h ASP 760 Cb 0.02 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.05 1gpy h ASP 760 CO 0.00 0.98 0.30 0.40 -2.88 0.00 0.00 179.24 178.04 1gpy h ILE 761 N -1.00 1.15 -0.26 2.25 2.04 -1.70 -2.78 117.51 117.21 1gpy h ILE 761 Ca -0.11 -0.32 0.06 0.00 1.00 0.00 0.00 64.86 65.49 1gpy h ILE 761 Cb 0.75 0.49 -0.06 0.00 -0.74 0.00 0.00 36.82 37.26 1gpy h ILE 761 CO -0.07 0.15 -0.11 0.58 0.00 0.00 0.00 178.15 178.70 1gpy h VAL 762 N 0.65 0.64 -0.45 1.67 2.07 -1.58 -2.06 116.25 117.19 1gpy h VAL 762 Ca 0.17 0.00 -0.12 0.00 0.82 0.00 0.00 66.70 67.57 1gpy h VAL 762 Cb -0.02 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1gpy h VAL 762 CO -0.03 0.00 -0.20 -1.13 0.02 0.00 0.00 177.57 176.22 1gpy h ASN 763 N -0.06 0.92 0.16 0.57 -1.24 -1.35 0.28 115.58 114.84 1gpy h ASN 763 Ca 0.14 -0.33 -0.14 0.00 0.71 0.00 0.00 56.30 56.67 1gpy h ASN 763 Cb 0.27 -0.25 -0.01 0.00 0.73 0.00 0.00 38.32 39.06 1gpy h ASN 763 CO -0.31 1.09 -0.52 0.00 -1.29 0.00 0.00 177.43 176.40 1gpy h MET 764 N 0.78 0.40 -0.64 6.67 -0.00 -1.47 0.50 114.93 121.16 1gpy h MET 764 Ca 0.11 -0.24 -0.06 0.00 -0.00 0.00 0.00 59.70 59.51 1gpy h MET 764 Cb 0.75 0.02 -0.03 0.00 -0.00 0.00 0.00 31.60 32.34 1gpy h MET 764 CO 0.06 0.82 0.16 -0.07 -0.00 0.00 0.00 176.91 177.89 1gpy h LEU 765 N 0.31 0.97 0.00 -0.10 -0.00 -0.64 0.77 115.31 116.62 1gpy h LEU 765 Ca 0.01 -0.23 -0.10 0.00 -0.00 0.00 0.00 57.88 57.56 1gpy h LEU 765 Cb 1.02 -0.26 -0.02 0.00 -0.00 0.00 0.00 40.66 41.40 1gpy h LEU 765 CO 0.09 0.95 -0.97 0.24 -0.00 0.00 0.00 178.44 178.75 1gpy h MET 766 N 0.95 0.00 0.00 1.13 2.86 -0.32 -3.41 114.93 116.13 1gpy h MET 766 Ca 0.20 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.84 1gpy h MET 766 Cb 0.35 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.01 1gpy h MET 766 CO 0.00 0.27 -0.13 0.72 1.06 0.00 0.00 176.91 178.83 1gpy n HIS 767 N -2.96 0.00 -2.09 -0.22 8.25 0.17 -4.57 115.22 113.80 1gpy n HIS 767 Ca -0.03 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.45 1gpy n HIS 767 Cb 0.73 0.00 0.02 0.00 1.12 0.00 0.00 29.99 31.86 1gpy n HIS 767 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1gpy n HIS 768 N -0.41 0.00 -2.27 4.41 8.25 0.24 -4.96 115.22 120.48 1gpy n HIS 768 Ca 0.00 -0.29 -0.43 0.00 -0.26 0.00 0.00 57.72 56.74 1gpy n HIS 768 Cb 0.00 -0.10 -0.02 0.00 1.12 0.00 0.00 29.99 30.99 1gpy n HIS 768 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1gpy s ASP 769 N -1.55 6.16 0.12 0.41 2.15 0.59 -4.87 116.67 119.68 1gpy s ASP 769 Ca 0.15 0.80 0.27 0.00 0.43 0.00 0.00 52.55 54.20 1gpy s ASP 769 Cb 0.16 -2.54 0.90 0.00 -0.30 0.00 0.00 42.92 41.14 1gpy s ASP 769 CO -0.06 -1.58 1.77 0.54 -0.17 0.00 0.00 175.17 175.66 1gpy n ARG 770 N 8.31 0.16 -0.08 4.34 1.74 -1.26 -3.88 116.66 125.98 1gpy n ARG 770 Ca 0.17 0.12 0.04 0.00 -0.77 0.00 0.00 57.85 57.41 1gpy n ARG 770 Cb 0.48 -1.67 0.09 0.00 -1.02 0.00 0.00 32.46 30.34 1gpy n ARG 770 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1gpy n PHE 771 N -1.94 0.22 -3.57 -1.55 3.72 -1.26 -5.02 117.46 108.05 1gpy n PHE 771 Ca 0.06 -0.31 -0.20 0.00 -0.05 0.00 0.00 57.45 56.95 1gpy n PHE 771 Cb 0.39 -0.02 0.06 0.00 -0.94 0.00 0.00 39.48 38.98 1gpy n PHE 771 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1gpy n LYS 772 N 0.36 -6.07 -0.13 -1.08 5.02 -1.25 -4.67 118.16 110.33 1gpy n LYS 772 Ca 0.07 0.75 -0.04 0.00 -2.02 0.00 0.00 58.31 57.08 1gpy n LYS 772 Cb 0.32 -5.60 0.04 0.00 -0.02 0.00 0.00 35.03 29.78 1gpy n LYS 772 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 1gpy h VAL 773 N -1.98 0.75 0.00 -0.18 2.07 -1.94 -3.06 116.25 111.92 1gpy h VAL 773 Ca -0.60 -0.07 -0.07 0.00 0.82 0.00 0.00 66.70 66.79 1gpy h VAL 773 Cb 1.35 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 31.64 1gpy h VAL 773 CO 0.54 0.04 -0.32 -0.26 0.02 0.00 0.00 177.57 177.59 1gpy h PHE 774 N 0.20 0.00 0.00 1.57 -1.00 -1.91 -3.03 116.94 112.78 1gpy h PHE 774 Ca 0.21 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.99 1gpy h PHE 774 Cb 0.28 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.84 1gpy h PHE 774 CO -0.22 0.32 0.00 0.00 -1.61 0.00 0.00 178.31 176.80 1gpy h ALA 775 N 1.68 1.00 -0.15 2.45 0.00 -1.92 -2.77 119.26 119.55 1gpy h ALA 775 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1gpy h ALA 775 Cb 0.61 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1gpy h ALA 775 CO 0.04 0.00 0.00 -0.25 0.00 0.00 0.00 179.25 179.04 1gpy n ASP 776 N -2.71 2.25 -0.03 0.00 8.00 -1.14 -4.76 116.55 118.15 1gpy n ASP 776 Ca 0.02 -1.72 -0.12 0.00 0.71 0.00 0.00 54.79 53.68 1gpy n ASP 776 Cb 0.30 -0.10 -0.08 0.00 -0.02 0.00 0.00 41.12 41.23 1gpy n ASP 776 CO 0.00 0.00 0.00 0.22 -0.39 0.00 0.00 177.20 177.03 1gpy h TYR 777 N 1.52 0.21 0.07 1.24 5.03 -1.53 -1.99 116.97 121.52 1gpy h TYR 777 Ca 0.00 -0.05 -0.00 0.00 2.58 0.00 0.00 58.73 61.26 1gpy h TYR 777 Cb 0.53 -0.05 0.00 0.00 1.55 0.00 0.00 36.73 38.76 1gpy h TYR 777 CO 0.10 0.52 -0.03 0.93 -1.32 0.00 0.00 178.16 178.35 1gpy h GLU 778 N -0.16 -0.09 -0.71 1.82 5.08 -1.86 -1.14 114.58 117.52 1gpy h GLU 778 Ca 0.02 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 1gpy h GLU 778 Cb 0.46 0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.69 1gpy h GLU 778 CO 0.01 -0.05 0.40 0.93 -1.00 0.00 0.00 179.01 179.30 1gpy h GLU 779 N -0.11 0.99 -0.66 2.33 5.08 -1.90 -1.98 114.58 118.33 1gpy h GLU 779 Ca -0.01 -0.11 -0.06 0.00 -1.00 0.00 0.00 59.36 58.17 1gpy h GLU 779 Cb 0.08 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 29.11 1gpy h GLU 779 CO 0.02 0.74 0.17 -0.92 -1.00 0.00 0.00 179.01 178.01 1gpy h TYR 780 N 0.98 1.11 -0.24 4.33 3.20 -1.15 0.47 116.97 125.67 1gpy h TYR 780 Ca 0.25 -0.13 -0.13 0.00 3.14 0.00 0.00 58.73 61.86 1gpy h TYR 780 Cb 0.03 -0.31 -0.01 0.00 1.54 0.00 0.00 36.73 37.97 1gpy h TYR 780 CO -0.00 0.91 -0.39 0.28 -1.64 0.00 0.00 178.16 177.32 1gpy h VAL 781 N 0.99 1.30 -0.12 1.81 2.07 -0.96 -1.25 116.25 120.09 1gpy h VAL 781 Ca 0.21 -1.54 -0.03 0.00 0.82 0.00 0.00 66.70 66.15 1gpy h VAL 781 Cb 0.36 1.54 -0.00 0.00 -1.52 0.00 0.00 31.29 31.66 1gpy h VAL 781 CO 0.00 0.49 -0.06 0.11 0.02 0.00 0.00 177.57 178.13 1gpy h LYS 782 N 0.46 0.25 -0.82 1.57 1.57 -1.35 -1.91 116.57 116.33 1gpy h LYS 782 Ca 0.04 -0.11 0.06 0.00 -1.87 0.00 0.00 60.65 58.78 1gpy h LYS 782 Cb 0.88 -0.01 -0.05 0.00 0.08 0.00 0.00 32.23 33.13 1gpy h LYS 782 CO 0.08 0.59 0.54 0.00 -0.57 0.00 0.00 179.45 180.08 1gpy h GLN 784 N 0.91 0.56 -0.97 0.00 1.08 -1.21 -1.71 115.11 113.77 1gpy h GLN 784 Ca 0.35 -0.32 0.03 0.00 -1.45 0.00 0.00 58.65 57.26 1gpy h GLN 784 Cb 0.21 0.02 -0.05 0.00 -0.05 0.00 0.00 27.48 27.61 1gpy h GLN 784 CO -0.12 0.92 0.64 0.93 -0.95 0.00 0.00 178.83 180.25 1gpy h GLU 785 N 0.45 1.21 -0.16 1.46 5.08 -0.76 -2.30 114.58 119.56 1gpy h GLU 785 Ca 0.02 -0.07 -0.05 0.00 -1.00 0.00 0.00 59.36 58.26 1gpy h GLU 785 Cb 1.01 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 29.97 1gpy h GLU 785 CO 0.09 0.80 -0.14 0.00 -1.00 0.00 0.00 179.01 178.77 1gpy h ARG 786 N 1.25 0.25 -0.06 2.33 3.08 -0.91 -2.65 114.38 117.67 1gpy h ARG 786 Ca 0.38 -0.06 0.02 0.00 0.07 0.00 0.00 59.98 60.39 1gpy h ARG 786 Cb -0.03 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 29.96 1gpy h ARG 786 CO -0.11 0.40 -0.06 0.28 -1.07 0.00 0.00 179.97 179.41 1gpy h VAL 787 N 0.24 0.82 0.00 2.04 2.07 -0.83 -2.69 116.25 117.90 1gpy h VAL 787 Ca 0.05 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.50 1gpy h VAL 787 Cb 0.40 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 30.98 1gpy h VAL 787 CO 0.02 0.00 -0.30 0.28 0.02 0.00 0.00 177.57 177.59 1gpy h SER 788 N -0.08 0.00 -0.03 0.57 0.02 -1.38 -1.07 113.55 111.58 1gpy h SER 788 Ca 0.05 0.00 -0.19 0.00 -0.84 0.00 0.00 61.79 60.80 1gpy h SER 788 Cb 0.15 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.69 1gpy h SER 788 CO -0.11 0.30 -0.68 0.00 -1.14 0.00 0.00 176.83 175.20 1gpy h ALA 789 N 1.70 0.49 -0.35 3.77 0.00 -1.26 -2.13 119.26 121.47 1gpy h ALA 789 Ca -0.00 -0.57 -0.15 0.00 0.00 0.00 0.00 54.91 54.18 1gpy h ALA 789 Cb 0.55 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1gpy h ALA 789 CO 0.04 0.70 -0.39 1.25 0.00 0.00 0.00 179.25 180.85 1gpy h LEU 790 N 0.47 0.92 -1.91 0.00 7.12 -1.00 -2.85 115.31 118.06 1gpy h LEU 790 Ca -0.02 -0.42 -0.00 0.00 0.13 0.00 0.00 57.88 57.57 1gpy h LEU 790 Cb 1.27 -0.26 -0.00 0.00 -0.53 0.00 0.00 40.66 41.14 1gpy h LEU 790 CO 0.13 1.19 0.05 0.22 -0.13 0.00 0.00 178.44 179.91 1gpy h TYR 791 N 0.70 0.10 0.00 1.25 3.20 -0.96 0.79 116.97 122.06 1gpy h TYR 791 Ca 0.06 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.93 1gpy h TYR 791 Cb 0.97 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 39.20 1gpy h TYR 791 CO 0.06 0.07 0.00 0.87 -1.64 0.00 0.00 178.16 177.52 1gpy h LYS 792 N 0.11 0.00 -3.61 1.82 1.57 -1.14 -3.35 116.57 111.97 1gpy h LYS 792 Ca 0.03 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.21 1gpy h LYS 792 Cb -0.00 0.00 -0.40 0.00 0.08 0.00 0.00 32.23 31.91 1gpy h LYS 792 CO -0.01 0.00 -0.75 1.21 -0.57 0.00 0.00 179.45 179.34 1gpy s ASN 793 N -4.83 4.07 0.54 0.86 2.47 0.27 -5.02 114.94 113.30 1gpy s ASN 793 Ca -0.04 -1.93 0.21 0.00 0.42 0.00 0.00 52.86 51.52 1gpy s ASN 793 Cb 0.11 -1.02 1.45 0.00 -1.45 0.00 0.00 41.25 40.34 1gpy s ASN 793 CO 0.35 -0.38 2.17 -0.65 -3.72 0.00 0.00 177.10 174.87 1gpy h PRO 794 N 7.72 0.00 0.05 0.43 0.11 -1.77 -0.64 132.00 137.91 1gpy h PRO 794 Ca -0.09 0.00 -0.27 0.00 0.11 0.00 0.00 66.00 65.74 1gpy h PRO 794 Cb 1.00 0.00 0.02 0.00 0.11 0.00 0.00 31.00 32.13 1gpy h PRO 794 CO 0.48 0.03 -1.10 -0.09 -0.21 0.00 0.00 178.00 177.11 1gpy h ARG 795 N 0.00 0.65 0.13 1.05 2.43 -1.94 -2.63 114.38 114.08 1gpy h ARG 795 Ca -0.00 -0.77 -0.30 0.00 -0.81 0.00 0.00 59.98 58.10 1gpy h ARG 795 Cb 0.05 0.24 0.03 0.00 -0.42 0.00 0.00 29.97 29.87 1gpy h ARG 795 CO 0.00 1.34 -1.26 0.93 -1.51 0.00 0.00 179.97 179.47 1gpy h GLU 796 N 0.31 0.58 -0.08 0.20 4.39 -1.49 -0.93 114.58 117.55 1gpy h GLU 796 Ca -0.15 -0.80 0.03 0.00 0.34 0.00 0.00 59.36 58.78 1gpy h GLU 796 Cb 1.77 0.27 -0.06 0.00 -0.10 0.00 0.00 28.75 30.62 1gpy h GLU 796 CO 0.21 1.36 -0.47 2.35 -1.16 0.00 0.00 179.01 181.30 1gpy h TRP 797 N 0.24 -1.37 -0.41 4.33 7.01 -1.39 -2.09 115.95 122.27 1gpy h TRP 797 Ca -0.19 0.05 0.03 0.00 2.11 0.00 0.00 58.89 60.89 1gpy h TRP 797 Cb 1.94 0.61 -0.02 0.00 -2.10 0.00 0.00 29.16 29.59 1gpy h TRP 797 CO 0.11 -0.52 0.27 1.15 -2.79 0.00 0.00 178.44 176.66 1gpy h THR 798 N -0.57 1.04 0.00 2.65 2.02 -1.46 -1.60 112.91 114.99 1gpy h THR 798 Ca 0.05 -0.15 -0.05 0.00 0.77 0.00 0.00 66.41 67.02 1gpy h THR 798 Cb 0.67 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 67.62 1gpy h THR 798 CO -0.39 0.08 -0.25 0.03 0.37 0.00 0.00 175.52 175.37 1gpy h ARG 799 N 0.44 0.00 -0.11 6.66 3.08 -0.60 -0.27 114.38 123.59 1gpy h ARG 799 Ca 0.16 0.00 -0.04 0.00 0.07 0.00 0.00 59.98 60.17 1gpy h ARG 799 Cb 0.10 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.15 1gpy h ARG 799 CO -0.04 0.25 -0.10 1.98 -1.07 0.00 0.00 179.97 180.99 1gpy h MET 800 N 0.00 0.26 -0.65 0.04 4.05 -1.02 -2.64 114.93 114.97 1gpy h MET 800 Ca -0.00 -0.13 0.14 0.00 -0.28 0.00 0.00 59.70 59.42 1gpy h MET 800 Cb 0.91 0.00 -0.10 0.00 -0.80 0.00 0.00 31.60 31.61 1gpy h MET 800 CO 0.03 0.67 0.09 0.28 0.23 0.00 0.00 176.91 178.21 1gpy h VAL 801 N -0.14 0.53 -0.36 -5.77 2.07 -1.15 -2.09 116.25 109.35 1gpy h VAL 801 Ca 0.02 -0.07 -0.06 0.00 0.82 0.00 0.00 66.70 67.41 1gpy h VAL 801 Cb 0.62 0.31 -0.02 0.00 -1.52 0.00 0.00 31.29 30.68 1gpy h VAL 801 CO 0.03 0.04 -0.03 0.40 0.02 0.00 0.00 177.57 178.02 1gpy h ILE 802 N 0.20 1.21 0.00 4.57 2.04 -0.91 -1.43 117.51 123.21 1gpy h ILE 802 Ca 0.35 -0.88 0.00 0.00 1.00 0.00 0.00 64.86 65.33 1gpy h ILE 802 Cb 0.57 0.98 0.00 0.00 -0.74 0.00 0.00 36.82 37.63 1gpy h ILE 802 CO -0.49 0.30 0.00 0.03 0.00 0.00 0.00 178.15 177.99 1gpy h ARG 803 N 0.54 0.00 0.00 2.37 3.08 -1.03 0.20 114.38 119.55 1gpy h ARG 803 Ca 0.11 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 60.00 1gpy h ARG 803 Cb 0.39 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.42 1gpy h ARG 803 CO 0.02 0.00 -0.90 -0.91 -1.07 0.00 0.00 179.97 177.11 1gpy h ASN 804 N 0.00 0.00 -0.15 7.04 2.35 -0.78 -3.29 115.58 120.76 1gpy h ASN 804 Ca 0.00 -0.62 0.01 0.00 -0.55 0.00 0.00 56.30 55.14 1gpy h ASN 804 Cb 0.56 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.92 1gpy h ASN 804 CO 0.00 1.33 0.06 0.40 -1.65 0.00 0.00 177.43 177.57 1gpy h ILE 805 N -1.00 0.98 0.00 2.81 2.04 -1.29 -2.02 117.51 119.03 1gpy h ILE 805 Ca -0.24 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 65.57 1gpy h ILE 805 Cb 1.19 0.83 0.00 0.00 -0.74 0.00 0.00 36.82 38.10 1gpy h ILE 805 CO -0.15 0.03 0.00 0.00 0.00 0.00 0.00 178.15 178.03 1gpy n ALA 806 N -2.18 1.22 -0.33 1.87 0.00 0.06 -2.50 120.51 118.65 1gpy n ALA 806 Ca -0.04 -0.02 0.05 0.00 0.00 0.00 0.00 53.44 53.44 1gpy n ALA 806 Cb 0.05 -1.08 0.15 0.00 0.00 0.00 0.00 19.45 18.57 1gpy n ALA 806 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1gpy n THR 807 N -1.50 1.26 0.62 0.00 5.66 -0.77 -1.79 114.28 117.77 1gpy n THR 807 Ca 0.01 -1.20 0.10 0.00 -3.05 0.00 0.00 64.05 59.91 1gpy n THR 807 Cb 0.06 0.34 0.27 0.00 -1.55 0.00 0.00 70.33 69.44 1gpy n THR 807 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 1gpy n SER 808 N 0.10 2.65 -0.38 1.09 3.41 -1.04 -4.31 113.62 115.15 1gpy n SER 808 Ca 0.12 -1.91 0.29 0.00 -0.26 0.00 0.00 58.87 57.12 1gpy n SER 808 Cb 0.49 -0.24 0.57 0.00 -0.26 0.00 0.00 64.21 64.77 1gpy n SER 808 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1gpy h GLY 809 N 4.81 1.46 2.00 5.00 0.00 -1.82 0.59 103.07 115.11 1gpy h GLY 809 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.16 1gpy h GLY 809 CO 0.00 -0.34 0.00 1.17 0.00 0.00 0.00 176.54 177.37 1gpy n LYS 810 N -4.76 0.05 -1.32 4.80 4.81 -1.26 -2.96 118.16 117.51 1gpy n LYS 810 Ca 0.32 0.22 -0.24 0.00 -0.87 0.00 0.00 58.31 57.74 1gpy n LYS 810 Cb 1.15 -1.58 0.12 0.00 0.02 0.00 0.00 35.03 34.74 1gpy n LYS 810 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 1gpy n PHE 811 N -1.67 2.68 -3.71 5.64 3.72 0.20 -4.84 117.46 119.48 1gpy n PHE 811 Ca 0.04 -2.34 -0.35 0.00 -0.05 0.00 0.00 57.45 54.75 1gpy n PHE 811 Cb 0.23 -0.96 -0.05 0.00 -0.94 0.00 0.00 39.48 37.76 1gpy n PHE 811 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1gpy s SER 812 N -2.16 6.54 0.29 4.37 0.15 -1.16 -1.39 113.70 120.34 1gpy s SER 812 Ca 0.57 0.63 0.25 0.00 0.70 0.00 0.00 55.95 58.09 1gpy s SER 812 Cb 0.47 -2.12 0.99 0.00 -1.71 0.00 0.00 66.02 63.65 1gpy s SER 812 CO 0.03 0.25 1.75 0.77 1.20 0.00 0.00 173.24 177.24 1gpy h SER 813 N 4.06 0.00 0.34 5.45 4.64 0.27 -2.52 113.55 125.78 1gpy h SER 813 Ca -0.50 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 60.74 1gpy h SER 813 Cb 1.20 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.28 1gpy h SER 813 CO 0.65 0.00 -0.35 0.44 -0.87 0.00 0.00 176.83 176.71 1gpy h ASP 814 N 0.00 0.02 0.05 4.97 3.32 -1.91 -0.04 116.42 122.83 1gpy h ASP 814 Ca 0.00 -0.01 -0.12 0.00 0.02 0.00 0.00 57.03 56.93 1gpy h ASP 814 Cb 0.45 -0.00 0.01 0.00 0.22 0.00 0.00 39.33 40.01 1gpy h ASP 814 CO 0.00 0.36 -0.49 -0.09 -1.72 0.00 0.00 179.24 177.30 1gpy h ARG 815 N 0.02 0.25 -0.19 3.56 1.12 -1.79 -1.65 114.38 115.70 1gpy h ARG 815 Ca -0.00 -0.33 0.05 0.00 -1.11 0.00 0.00 59.98 58.58 1gpy h ARG 815 Cb 0.62 0.11 -0.07 0.00 -0.01 0.00 0.00 29.97 30.62 1gpy h ARG 815 CO 0.05 1.09 -0.44 1.15 -3.11 0.00 0.00 179.97 178.70 1gpy h THR 816 N -0.43 0.12 -0.15 0.20 2.02 -1.44 0.83 112.91 114.06 1gpy h THR 816 Ca -0.08 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.08 1gpy h THR 816 Cb 1.30 0.12 -0.01 0.00 -1.74 0.00 0.00 68.15 67.82 1gpy h THR 816 CO 0.09 0.00 0.01 0.40 0.37 0.00 0.00 175.52 176.40 1gpy h ILE 817 N -0.47 1.24 -0.85 3.11 1.08 -1.12 -0.24 117.51 120.27 1gpy h ILE 817 Ca 0.08 -0.78 0.14 0.00 -0.39 0.00 0.00 64.86 63.92 1gpy h ILE 817 Cb 0.62 1.46 -0.06 0.00 -3.07 0.00 0.00 36.82 35.77 1gpy h ILE 817 CO -0.44 0.23 0.55 0.00 -0.69 0.00 0.00 178.15 177.81 1gpy h ALA 818 N 0.79 1.91 -0.30 1.87 0.00 -1.00 -0.04 119.26 122.48 1gpy h ALA 818 Ca 0.05 0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.82 1gpy h ALA 818 Cb 0.34 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 1gpy h ALA 818 CO 0.01 -0.14 -0.37 1.96 0.00 0.00 0.00 179.25 180.70 1gpy h GLN 819 N 0.61 0.79 -0.42 0.00 4.20 -0.42 -2.97 115.11 116.90 1gpy h GLN 819 Ca 0.42 -0.44 0.01 0.00 0.06 0.00 0.00 58.65 58.70 1gpy h GLN 819 Cb 0.75 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.53 1gpy h GLN 819 CO -0.18 1.07 0.26 1.88 -0.67 0.00 0.00 178.83 181.20 1gpy h TYR 820 N 0.55 0.49 -0.59 2.96 -1.99 -0.11 -2.12 116.97 116.16 1gpy h TYR 820 Ca 0.04 0.01 0.00 0.00 2.00 0.00 0.00 58.73 60.79 1gpy h TYR 820 Cb 0.96 -0.16 -0.03 0.00 2.00 0.00 0.00 36.73 39.50 1gpy h TYR 820 CO 0.07 0.29 0.38 0.00 -0.00 0.00 0.00 178.16 178.91 1gpy h ALA 821 N 1.17 1.56 0.03 3.88 0.00 -1.09 -0.04 119.26 124.77 1gpy h ALA 821 Ca 0.16 -0.05 -0.30 0.00 0.00 0.00 0.00 54.91 54.72 1gpy h ALA 821 Cb -0.02 -0.24 -0.04 0.00 0.00 0.00 0.00 17.79 17.49 1gpy h ALA 821 CO -0.06 0.40 -1.73 -0.09 0.00 0.00 0.00 179.25 177.76 1gpy h ARG 822 N 0.80 0.06 0.00 0.00 2.43 -1.41 1.17 114.38 117.42 1gpy h ARG 822 Ca 0.22 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.29 1gpy h ARG 822 Cb -0.08 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.51 1gpy h ARG 822 CO -0.05 0.66 0.00 0.39 -1.51 0.00 0.00 179.97 179.46 1gpy n GLU 823 N -3.15 0.43 0.01 0.20 1.02 -0.81 -4.41 120.64 113.93 1gpy n GLU 823 Ca -0.19 -0.40 0.00 0.00 -0.02 0.00 0.00 57.16 56.55 1gpy n GLU 823 Cb 1.05 -0.89 0.00 0.00 -0.02 0.00 0.00 31.44 31.57 1gpy n GLU 823 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 1gpy n ILE 824 N -0.17 0.14 0.10 -3.67 5.41 -0.80 -4.91 119.36 115.45 1gpy n ILE 824 Ca 0.00 0.05 0.11 0.00 1.00 0.00 0.00 62.75 63.91 1gpy n ILE 824 Cb 0.01 -1.40 -0.02 0.00 -0.71 0.00 0.00 39.64 37.51 1gpy n ILE 824 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 176.55 177.34 1gpy n TRP 825 N -3.02 0.84 -2.70 1.39 8.01 -0.09 -5.00 117.44 116.86 1gpy n TRP 825 Ca 0.00 0.24 -0.08 0.00 -1.31 0.00 0.00 57.50 56.35 1gpy n TRP 825 Cb 0.39 -0.89 0.04 0.00 -2.01 0.00 0.00 31.31 28.84 1gpy n TRP 825 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1gpy n GLY 826 N 1.19 0.12 3.06 6.99 0.00 0.37 -4.96 105.19 111.97 1gpy n GLY 826 Ca -0.00 -0.23 -0.08 0.00 0.00 0.00 0.00 46.02 45.70 1gpy n GLY 826 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1gpy s VAL 827 N -3.16 0.16 -0.22 1.61 -7.23 0.81 -4.99 120.40 107.38 1gpy s VAL 827 Ca 0.05 -1.29 -0.10 0.00 -1.81 0.00 0.00 61.98 58.83 1gpy s VAL 827 Cb -0.02 -0.91 -0.05 0.00 0.56 0.00 0.00 36.38 35.96 1gpy s VAL 827 CO 0.33 -0.71 0.14 -1.61 -0.31 0.00 0.00 175.10 172.94 1gpy s GLU 828 N -2.70 4.13 0.73 4.82 0.41 -1.26 -3.81 118.70 121.02 1gpy s GLU 828 Ca -0.04 -0.25 -0.16 0.00 -0.41 0.00 0.00 54.97 54.11 1gpy s GLU 828 Cb -0.01 -3.46 -0.06 0.00 -1.78 0.00 0.00 34.13 28.82 1gpy s GLU 828 CO -0.05 0.19 0.34 -2.30 -0.49 0.00 0.00 175.26 172.95 1gpy n PRO 829 N 3.85 0.21 -3.98 0.39 -0.02 -1.26 -4.95 135.00 129.24 1gpy n PRO 829 Ca -0.16 0.10 -0.22 0.00 -2.02 0.00 0.00 63.50 61.21 1gpy n PRO 829 Cb 0.52 -1.67 -0.17 0.00 -0.02 0.00 0.00 33.50 32.17 1gpy n PRO 829 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1gpy s SER 830 N -1.41 1.33 0.03 2.55 0.15 -0.15 -5.01 113.70 111.18 1gpy s SER 830 Ca 0.62 -0.13 0.05 0.00 0.70 0.00 0.00 55.95 57.19 1gpy s SER 830 Cb -0.34 -0.49 -0.24 0.00 -1.71 0.00 0.00 66.02 63.24 1gpy s SER 830 CO 0.62 -0.12 0.96 -0.09 1.20 0.00 0.00 173.24 175.81 1gpy h ARG 831 N 7.73 0.08 -7.31 5.44 2.43 -1.82 -3.07 114.38 117.86 1gpy h ARG 831 Ca -0.30 -0.14 -0.48 0.00 -0.81 0.00 0.00 59.98 58.26 1gpy h ARG 831 Cb 1.14 0.05 0.16 0.00 -0.42 0.00 0.00 29.97 30.90 1gpy h ARG 831 CO 0.38 0.88 0.22 1.14 -1.51 0.00 0.00 179.97 181.08 1gpy s GLN 832 N -2.65 0.94 0.11 0.20 -2.07 -1.26 -4.94 119.66 109.99 1gpy s GLN 832 Ca -0.04 0.86 -0.30 0.00 -1.82 0.00 0.00 55.36 54.06 1gpy s GLN 832 Cb 0.08 -1.77 -0.06 0.00 -1.09 0.00 0.00 33.01 30.17 1gpy s GLN 832 CO 0.83 -2.47 1.16 1.03 -1.32 0.00 0.00 175.29 174.53 1gpy s ARG 833 N -4.86 4.49 0.68 9.60 3.00 -1.26 -4.95 118.95 125.65 1gpy s ARG 833 Ca 0.64 1.76 -0.11 0.00 0.00 0.00 0.00 55.73 58.02 1gpy s ARG 833 Cb -0.19 -3.32 -0.00 0.00 0.00 0.00 0.00 34.95 31.44 1gpy s ARG 833 CO 0.58 -0.13 1.07 -1.17 0.00 0.00 0.00 175.30 175.65 1gpy s LEU 834 N 0.47 3.00 -0.49 2.53 2.96 -0.18 -5.02 118.68 121.95 1gpy s LEU 834 Ca 0.55 1.27 0.03 0.00 -0.22 0.00 0.00 54.13 55.75 1gpy s LEU 834 Cb -0.30 -4.14 0.56 0.00 0.50 0.00 0.00 46.19 42.81 1gpy s LEU 834 CO 0.32 -1.23 1.83 -0.81 -1.32 0.00 0.00 176.35 175.14 1gpy n PRO 835 N -2.96 2.42 -0.76 0.98 -0.05 -1.26 -4.52 135.00 128.85 1gpy n PRO 835 Ca 0.07 -3.22 -0.30 0.00 -0.05 0.00 0.00 63.50 60.00 1gpy n PRO 835 Cb 0.56 -2.16 0.27 0.00 -0.05 0.00 0.00 33.50 32.11 1gpy n PRO 835 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 1gpy n ALA 836 N -1.04 -4.10 -1.00 0.55 0.00 -1.26 -4.95 120.51 108.72 1gpy n ALA 836 Ca 0.55 -1.61 0.00 0.00 0.00 0.00 0.00 53.44 52.39 1gpy n ALA 836 Cb 1.19 -0.12 0.00 0.00 0.00 0.00 0.00 19.45 20.52 1gpy n ALA 836 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1gpy n PRO 837 N -5.21 0.00 -0.12 0.00 -0.04 -1.26 -4.92 135.00 123.45 1gpy n PRO 837 Ca 0.15 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.61 1gpy n PRO 837 Cb 0.60 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.06 1gpy n PRO 837 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1gpy n ASP 838 N 0.00 0.00 -3.98 3.54 5.68 -1.26 -4.45 116.55 116.08 1gpy n ASP 838 Ca 0.00 -0.36 -0.19 0.00 -0.50 0.00 0.00 54.79 53.75 1gpy n ASP 838 Cb 0.00 0.00 -0.15 0.00 -1.14 0.00 0.00 41.12 39.83 1gpy n ASP 838 CO 0.00 0.00 0.00 -1.83 -1.33 0.00 0.00 177.20 174.04 1gpy s GLU 839 N -0.32 0.73 -0.80 0.11 1.03 -1.26 -5.04 118.70 113.14 1gpy s GLU 839 Ca 0.00 -0.24 -0.05 0.00 0.03 0.00 0.00 54.97 54.70 1gpy s GLU 839 Cb 0.00 -0.70 0.20 0.00 -0.80 0.00 0.00 34.13 32.83 1gpy s GLU 839 CO 0.00 0.10 0.68 0.15 -1.33 0.00 0.00 175.26 174.86 1gpy s LYS 840 N 0.12 3.17 0.00 -4.83 1.02 -1.26 -5.23 119.74 112.73 1gpy s LYS 840 Ca -0.01 -2.83 0.31 0.00 0.02 0.00 0.00 55.97 53.46 1gpy s LYS 840 Cb -0.07 -4.03 1.75 0.00 -0.52 0.00 0.00 37.83 34.96 1gpy s LYS 840 CO -0.00 -1.23 2.14 -0.89 -0.92 0.00 0.00 175.35 174.44