#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ggy n GLY 9 N 0.00 3.10 2.83 7.13 0.00 -1.26 -4.27 105.19 112.72 1ggy n GLY 9 Ca 0.00 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 45.13 1ggy n GLY 9 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ggy n GLY 10 N 0.00 2.05 0.18 -0.02 0.00 -1.26 -4.39 105.19 101.76 1ggy n GLY 10 Ca 0.00 -0.28 -0.19 0.00 0.00 0.00 0.00 46.02 45.56 1ggy n GLY 10 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1ggy h ARG 11 N 0.00 0.62 -1.99 1.61 9.65 -2.02 -3.47 114.38 118.79 1ggy h ARG 11 Ca 0.00 -0.63 -0.05 0.00 -1.10 0.00 0.00 59.98 58.20 1ggy h ARG 11 Cb 0.00 0.17 -0.20 0.00 -1.39 0.00 0.00 29.97 28.55 1ggy h ARG 11 CO 0.00 1.23 0.18 -0.98 2.80 0.00 0.00 179.97 183.20 1ggy s ARG 12 N -3.38 0.95 0.12 0.20 1.70 -1.26 -5.06 118.95 112.22 1ggy s ARG 12 Ca -0.11 0.58 -0.26 0.00 -0.47 0.00 0.00 55.73 55.47 1ggy s ARG 12 Cb 0.06 0.45 -0.06 0.00 -0.57 0.00 0.00 34.95 34.84 1ggy s ARG 12 CO 0.88 -0.23 1.64 0.00 -1.08 0.00 0.00 175.30 176.52 1ggy h ALA 13 N 3.86 -0.34 -3.63 7.88 0.00 -1.91 -3.39 119.26 121.72 1ggy h ALA 13 Ca -0.28 -0.01 -0.67 0.00 0.00 0.00 0.00 54.91 53.95 1ggy h ALA 13 Cb 1.15 0.42 -0.26 0.00 0.00 0.00 0.00 17.79 19.11 1ggy h ALA 13 CO 0.24 -0.75 -0.77 0.54 0.00 0.00 0.00 179.25 178.51 1ggy s VAL 14 N -6.07 3.00 1.05 0.00 0.11 -1.26 -4.78 120.40 112.44 1ggy s VAL 14 Ca -0.15 -0.71 -0.14 0.00 -2.93 0.00 0.00 61.98 58.05 1ggy s VAL 14 Cb 0.09 -2.22 0.13 0.00 -1.53 0.00 0.00 36.38 32.85 1ggy s VAL 14 CO 0.66 0.55 0.50 -2.65 -3.33 0.00 0.00 175.10 170.83 1ggy n PRO 15 N 3.01 -1.19 -2.20 1.54 -0.02 -1.26 -4.89 135.00 129.99 1ggy n PRO 15 Ca -0.18 -0.31 -0.42 0.00 -2.02 0.00 0.00 63.50 60.57 1ggy n PRO 15 Cb 0.52 -1.94 -0.03 0.00 -0.02 0.00 0.00 33.50 32.03 1ggy n PRO 15 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1ggy s PRO 16 N -3.87 4.31 -0.75 0.52 0.04 -1.26 -4.94 135.00 129.05 1ggy s PRO 16 Ca 0.60 2.02 -0.22 0.00 0.04 0.00 0.00 61.00 63.44 1ggy s PRO 16 Cb -0.19 -3.39 0.08 0.00 0.04 0.00 0.00 34.50 31.04 1ggy s PRO 16 CO 0.65 -0.48 1.06 1.21 0.04 0.00 0.00 177.00 179.48 1ggy s ASN 17 N 1.42 6.30 -0.01 6.66 2.47 -1.26 -4.80 114.94 125.72 1ggy s ASN 17 Ca 0.64 -1.23 0.24 0.00 0.42 0.00 0.00 52.86 52.93 1ggy s ASN 17 Cb -0.34 -2.43 0.40 0.00 -1.45 0.00 0.00 41.25 37.43 1ggy s ASN 17 CO 0.29 -1.39 1.16 -0.46 -3.72 0.00 0.00 177.10 172.98 1ggy n ASN 18 N 7.63 0.87 -3.94 -4.21 0.23 -1.26 -2.21 115.26 112.38 1ggy n ASN 18 Ca 0.06 -2.00 -0.14 0.00 -0.53 0.00 0.00 54.58 51.97 1ggy n ASN 18 Cb 0.47 -0.26 -0.14 0.00 -2.08 0.00 0.00 39.78 37.77 1ggy n ASN 18 CO 0.00 0.00 0.00 -0.55 -0.93 0.00 0.00 177.26 175.78 1ggy s SER 19 N -2.00 0.37 0.03 0.53 0.15 -1.26 -3.90 113.70 107.62 1ggy s SER 19 Ca 0.31 -0.14 0.20 0.00 0.70 0.00 0.00 55.95 57.02 1ggy s SER 19 Cb 0.36 -0.02 -0.18 0.00 -1.71 0.00 0.00 66.02 64.47 1ggy s SER 19 CO -0.15 -0.02 0.66 -3.20 1.20 0.00 0.00 173.24 171.73 1ggy n ASN 20 N 2.74 0.47 -0.01 5.45 4.05 -1.26 -4.23 115.26 122.47 1ggy n ASN 20 Ca -0.14 0.20 -0.17 0.00 0.45 0.00 0.00 54.58 54.91 1ggy n ASN 20 Cb 0.58 0.91 -0.10 0.00 1.23 0.00 0.00 39.78 42.41 1ggy n ASN 20 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1ggy h ALA 21 N 1.67 0.14 -2.62 5.20 0.00 -1.95 -3.40 119.26 118.30 1ggy h ALA 21 Ca -0.13 -0.55 -0.55 0.00 0.00 0.00 0.00 54.91 53.67 1ggy h ALA 21 Cb 1.37 0.02 0.09 0.00 0.00 0.00 0.00 17.79 19.26 1ggy h ALA 21 CO 0.02 0.41 0.74 0.00 0.00 0.00 0.00 179.25 180.41 1ggy n ALA 22 N -2.58 1.92 -3.07 0.00 0.00 -1.26 -4.98 120.51 110.54 1ggy n ALA 22 Ca -0.09 0.38 -0.11 0.00 0.00 0.00 0.00 53.44 53.62 1ggy n ALA 22 Cb 0.66 -2.37 -0.11 0.00 0.00 0.00 0.00 19.45 17.64 1ggy n ALA 22 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1ggy s GLU 23 N -0.82 0.39 0.26 0.00 -1.05 -1.26 -1.99 118.70 114.23 1ggy s GLU 23 Ca 0.63 -0.30 0.06 0.00 -0.15 0.00 0.00 54.97 55.21 1ggy s GLU 23 Cb -0.55 0.16 -0.03 0.00 -0.44 0.00 0.00 34.13 33.27 1ggy s GLU 23 CO 0.52 -0.08 0.28 0.16 0.95 0.00 0.00 175.26 177.09 1ggy s ASP 24 N -1.07 5.80 -0.12 0.83 -4.77 -1.25 -4.77 116.67 111.32 1ggy s ASP 24 Ca -0.12 -0.16 -0.06 0.00 -3.30 0.00 0.00 52.55 48.91 1ggy s ASP 24 Cb -0.06 -1.50 -0.04 0.00 -1.09 0.00 0.00 42.92 40.23 1ggy s ASP 24 CO 0.01 -0.11 0.11 -0.62 0.70 0.00 0.00 175.17 175.25 1ggy s ASP 25 N -3.93 6.09 0.02 2.11 2.15 -1.26 -5.01 116.67 116.84 1ggy s ASP 25 Ca 0.35 0.37 -0.10 0.00 0.43 0.00 0.00 52.55 53.60 1ggy s ASP 25 Cb -0.08 -1.94 -0.05 0.00 -0.30 0.00 0.00 42.92 40.55 1ggy s ASP 25 CO 0.27 0.38 0.34 -0.76 -0.17 0.00 0.00 175.17 175.23 1ggy s LEU 26 N -0.85 4.39 0.22 -1.34 1.43 -1.26 -5.05 118.68 116.22 1ggy s LEU 26 Ca 0.14 0.74 -0.31 0.00 -1.03 0.00 0.00 54.13 53.67 1ggy s LEU 26 Cb -0.12 -2.71 -0.10 0.00 0.03 0.00 0.00 46.19 43.29 1ggy s LEU 26 CO 0.03 0.26 1.54 -2.16 0.23 0.00 0.00 176.35 176.24 1ggy s PRO 27 N -1.58 4.21 0.50 1.29 0.04 -1.26 -4.85 135.00 133.35 1ggy s PRO 27 Ca 0.27 2.39 0.27 0.00 0.04 0.00 0.00 61.00 63.97 1ggy s PRO 27 Cb -0.14 -3.11 1.28 0.00 0.04 0.00 0.00 34.50 32.57 1ggy s PRO 27 CO 0.15 -0.55 1.99 1.79 0.04 0.00 0.00 177.00 180.41 1ggy h THR 28 N 3.73 0.54 -3.11 1.26 1.35 -1.83 -3.42 112.91 111.42 1ggy h THR 28 Ca -0.45 -0.73 -0.16 0.00 -0.55 0.00 0.00 66.41 64.52 1ggy h THR 28 Cb 1.21 1.49 -0.25 0.00 -1.73 0.00 0.00 68.15 68.87 1ggy h THR 28 CO 0.85 0.15 -0.40 -0.69 -0.25 0.00 0.00 175.52 175.17 1ggy s VAL 29 N -3.98 0.01 -0.29 6.82 1.01 -1.26 -0.03 120.40 122.67 1ggy s VAL 29 Ca -0.02 -0.07 0.03 0.00 0.00 0.00 0.00 61.98 61.93 1ggy s VAL 29 Cb 0.12 -0.39 0.19 0.00 0.00 0.00 0.00 36.38 36.29 1ggy s VAL 29 CO 0.60 -0.04 0.55 -1.83 0.00 0.00 0.00 175.10 174.38 1ggy s GLU 30 N -0.04 0.52 0.20 2.72 -1.05 -0.33 -5.01 118.70 115.71 1ggy s GLU 30 Ca -0.02 0.59 0.10 0.00 -0.15 0.00 0.00 54.97 55.49 1ggy s GLU 30 Cb -0.02 0.18 -0.04 0.00 -0.44 0.00 0.00 34.13 33.80 1ggy s GLU 30 CO 0.01 -0.91 -0.13 -0.51 0.95 0.00 0.00 175.26 174.66 1ggy s LEU 31 N 2.77 2.82 -0.25 1.83 1.43 -1.26 -1.16 118.68 124.85 1ggy s LEU 31 Ca 0.13 -0.71 -0.02 0.00 -1.03 0.00 0.00 54.13 52.50 1ggy s LEU 31 Cb -0.12 -1.48 0.14 0.00 0.03 0.00 0.00 46.19 44.77 1ggy s LEU 31 CO -0.25 0.09 0.41 -1.58 0.23 0.00 0.00 176.35 175.25 1ggy s GLN 32 N -2.95 0.38 0.00 1.70 0.74 -0.36 -4.98 119.66 114.19 1ggy s GLN 32 Ca 0.25 0.58 0.00 0.00 0.05 0.00 0.00 55.36 56.24 1ggy s GLN 32 Cb -0.08 -0.33 0.00 0.00 1.10 0.00 0.00 33.01 33.70 1ggy s GLN 32 CO 0.14 -0.66 0.00 0.41 -0.55 0.00 0.00 175.29 174.63 1ggy n GLY 33 N 5.37 3.52 3.15 2.59 0.00 -1.26 -4.86 105.19 113.70 1ggy n GLY 33 Ca -0.03 -0.69 0.04 0.00 0.00 0.00 0.00 46.02 45.34 1ggy n GLY 33 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ggy s GLN 42 N 0.00 0.48 -0.18 1.61 -1.52 -1.26 -5.20 119.66 113.59 1ggy s GLN 42 Ca 0.00 0.45 0.14 0.00 -1.95 0.00 0.00 55.36 53.99 1ggy s GLN 42 Cb 0.00 0.21 0.33 0.00 -0.22 0.00 0.00 33.01 33.32 1ggy s GLN 42 CO 0.00 -0.89 1.25 -0.85 -0.25 0.00 0.00 175.29 174.56 1ggy n GLU 43 N 5.33 0.87 0.00 2.91 0.00 -1.26 -4.95 120.64 123.54 1ggy n GLU 43 Ca 0.06 -1.77 0.10 0.00 0.00 0.00 0.00 57.16 55.55 1ggy n GLU 43 Cb 0.55 -0.05 0.50 0.00 0.00 0.00 0.00 31.44 32.44 1ggy n GLU 43 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 1ggy n PHE 44 N -0.62 0.00 0.00 -1.84 3.01 -1.26 -4.90 117.46 111.84 1ggy n PHE 44 Ca -0.12 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.34 1ggy n PHE 44 Cb 0.86 -0.34 0.00 0.00 -0.01 0.00 0.00 39.48 39.99 1ggy n PHE 44 CO 0.00 0.00 0.00 -0.11 1.01 0.00 0.00 176.76 177.66 1ggy n LEU 45 N -1.34 0.00 -3.71 4.37 7.94 -1.26 -4.62 117.00 118.38 1ggy n LEU 45 Ca 0.09 0.00 -0.13 0.00 -1.11 0.00 0.00 56.01 54.85 1ggy n LEU 45 Cb 0.18 0.00 -0.09 0.00 0.53 0.00 0.00 43.42 44.04 1ggy n LEU 45 CO 0.17 0.00 0.15 0.20 -1.11 0.00 0.00 177.39 176.79 1ggy s ASN 46 N 0.00 -0.48 -0.02 1.96 0.01 -1.26 -4.92 114.94 110.22 1ggy s ASN 46 Ca 0.00 0.92 -0.23 0.00 -0.71 0.00 0.00 52.86 52.84 1ggy s ASN 46 Cb 0.00 0.94 -0.05 0.00 0.41 0.00 0.00 41.25 42.55 1ggy s ASN 46 CO 0.00 -0.17 0.69 0.68 -1.51 0.00 0.00 177.10 176.79 1ggy s VAL 47 N 0.21 4.93 -0.16 1.60 -7.23 -1.26 -1.38 120.40 117.11 1ggy s VAL 47 Ca -0.00 1.44 0.18 0.00 -1.81 0.00 0.00 61.98 61.79 1ggy s VAL 47 Cb -0.03 -4.03 -0.26 0.00 0.56 0.00 0.00 36.38 32.62 1ggy s VAL 47 CO 0.01 0.32 0.21 0.35 -0.31 0.00 0.00 175.10 175.68 1ggy n THR 48 N 3.27 1.15 -3.51 5.32 -2.24 0.22 -4.93 114.28 113.56 1ggy n THR 48 Ca -0.03 -0.79 -0.11 0.00 -2.27 0.00 0.00 64.05 60.85 1ggy n THR 48 Cb 0.51 -0.43 -0.03 0.00 -2.10 0.00 0.00 70.33 68.28 1ggy n THR 48 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1ggy s SER 49 N -5.37 -0.45 -0.07 3.42 1.04 -1.03 -5.01 113.70 106.23 1ggy s SER 49 Ca -0.09 0.23 0.03 0.00 0.48 0.00 0.00 55.95 56.60 1ggy s SER 49 Cb 0.08 0.43 0.01 0.00 0.10 0.00 0.00 66.02 66.63 1ggy s SER 49 CO 0.84 -0.61 -0.16 -0.69 0.98 0.00 0.00 173.24 173.61 1ggy s VAL 50 N -2.39 1.38 -0.20 5.02 1.01 -1.26 0.19 120.40 124.16 1ggy s VAL 50 Ca -0.00 -0.64 0.01 0.00 0.00 0.00 0.00 61.98 61.36 1ggy s VAL 50 Cb -0.01 -1.22 0.03 0.00 0.00 0.00 0.00 36.38 35.18 1ggy s VAL 50 CO -0.04 0.41 -0.15 -1.00 0.00 0.00 0.00 175.10 174.32 1ggy s HIS 51 N 0.47 2.71 -0.47 5.22 3.76 0.15 -4.97 115.29 122.16 1ggy s HIS 51 Ca -0.13 -1.72 -0.08 0.00 -0.15 0.00 0.00 55.06 52.98 1ggy s HIS 51 Cb -0.15 -1.80 0.12 0.00 1.11 0.00 0.00 32.58 31.85 1ggy s HIS 51 CO 0.04 -0.79 0.33 -0.51 -0.85 0.00 0.00 174.74 172.96 1ggy s LEU 52 N 1.30 5.63 -0.89 0.89 1.43 -1.26 0.91 118.68 126.69 1ggy s LEU 52 Ca 0.00 -1.95 -0.22 0.00 -1.03 0.00 0.00 54.13 50.93 1ggy s LEU 52 Cb -0.15 -1.98 -0.20 0.00 0.03 0.00 0.00 46.19 43.89 1ggy s LEU 52 CO -0.10 -0.66 1.98 0.49 0.23 0.00 0.00 176.35 178.29 1ggy n PHE 53 N 4.83 0.77 0.00 0.29 3.72 -1.11 -4.69 117.46 121.27 1ggy n PHE 53 Ca -0.07 -0.12 0.00 0.00 -0.05 0.00 0.00 57.45 57.22 1ggy n PHE 53 Cb 0.41 -2.25 0.00 0.00 -0.94 0.00 0.00 39.48 36.69 1ggy n PHE 53 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1ggy n LYS 54 N 7.60 0.00 -0.44 -1.08 5.02 -1.26 -3.83 118.16 124.17 1ggy n LYS 54 Ca 0.36 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.65 1ggy n LYS 54 Cb 0.46 -0.08 0.00 0.00 -0.02 0.00 0.00 35.03 35.39 1ggy n LYS 54 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1ggy n GLU 55 N 0.00 0.00 -0.31 1.97 -0.58 -1.26 -4.00 120.64 116.45 1ggy n GLU 55 Ca 0.00 0.00 0.01 0.00 -0.42 0.00 0.00 57.16 56.75 1ggy n GLU 55 Cb 0.00 -0.15 0.08 0.00 -0.57 0.00 0.00 31.44 30.81 1ggy n GLU 55 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1ggy h ARG 56 N 0.97 -0.02 -0.00 3.49 2.47 -1.95 0.25 114.38 119.59 1ggy h ARG 56 Ca 0.00 0.00 -0.08 0.00 -1.26 0.00 0.00 59.98 58.65 1ggy h ARG 56 Cb 0.00 0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 28.31 1ggy h ARG 56 CO 0.00 -0.02 -0.36 0.11 0.56 0.00 0.00 179.97 180.27 1ggy h TRP 57 N -0.02 0.01 -3.14 3.04 0.09 -1.93 -3.39 115.95 110.60 1ggy h TRP 57 Ca 0.38 -0.00 -0.46 0.00 0.09 0.00 0.00 58.89 58.90 1ggy h TRP 57 Cb 0.62 -0.00 0.22 0.00 0.08 0.00 0.00 29.16 30.08 1ggy h TRP 57 CO -0.73 0.37 -0.26 -3.47 0.09 0.00 0.00 178.44 174.44 1ggy n ASP 58 N -4.11 -1.68 0.04 0.11 -0.08 0.88 -4.87 116.55 106.84 1ggy n ASP 58 Ca -0.02 -0.06 -0.05 0.00 -1.51 0.00 0.00 54.79 53.15 1ggy n ASP 58 Cb 0.40 -1.21 -0.03 0.00 2.34 0.00 0.00 41.12 42.62 1ggy n ASP 58 CO 0.00 0.00 0.00 0.74 0.12 0.00 0.00 177.20 178.06 1ggy h THR 59 N -2.41 0.00 -0.00 5.18 2.02 -1.83 -3.17 112.91 112.70 1ggy h THR 59 Ca -0.57 0.00 0.00 0.00 0.77 0.00 0.00 66.41 66.61 1ggy h THR 59 Cb 1.33 0.00 -0.00 0.00 -1.74 0.00 0.00 68.15 67.74 1ggy h THR 59 CO 0.45 0.00 -0.00 0.78 0.37 0.00 0.00 175.52 177.12 1ggy h ASN 60 N -0.22 -0.00 -0.72 4.18 2.35 -1.82 -1.79 115.58 117.57 1ggy h ASN 60 Ca -0.00 0.00 0.06 0.00 -0.55 0.00 0.00 56.30 55.80 1ggy h ASN 60 Cb 0.21 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.53 1ggy h ASN 60 CO -0.07 -0.00 0.42 0.11 -1.65 0.00 0.00 177.43 176.24 1ggy h LYS 61 N -0.00 0.74 0.19 0.81 1.57 -1.70 -0.73 116.57 117.45 1ggy h LYS 61 Ca 0.00 -0.04 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 1ggy h LYS 61 Cb 0.00 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 32.14 1ggy h LYS 61 CO -0.00 0.49 -0.09 0.28 -0.57 0.00 0.00 179.45 179.56 1ggy h VAL 62 N 0.77 0.85 0.00 0.50 2.07 -1.50 -0.00 116.25 118.93 1ggy h VAL 62 Ca 0.32 -0.13 0.00 0.00 0.82 0.00 0.00 66.70 67.71 1ggy h VAL 62 Cb 0.18 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 30.87 1ggy h VAL 62 CO -0.18 0.03 0.00 0.44 0.02 0.00 0.00 177.57 177.88 1ggy h ASP 63 N -0.31 0.00 -0.50 0.57 5.19 -1.17 0.01 116.42 120.20 1ggy h ASP 63 Ca -0.03 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.38 1ggy h ASP 63 Cb 0.24 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.75 1ggy h ASP 63 CO 0.04 0.00 0.00 1.41 -3.12 0.00 0.00 179.24 177.57 1ggy n HIS 64 N -3.07 0.66 -1.11 4.55 8.25 -0.29 -4.94 115.22 119.25 1ggy n HIS 64 Ca -0.01 -0.33 -0.04 0.00 -0.26 0.00 0.00 57.72 57.08 1ggy n HIS 64 Cb 0.19 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.29 1ggy n HIS 64 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1ggy n HIS 65 N 1.54 0.00 1.19 4.41 8.25 -0.01 -4.58 115.22 126.02 1ggy n HIS 65 Ca 0.21 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.80 1ggy n HIS 65 Cb 0.61 -2.28 0.26 0.00 1.12 0.00 0.00 29.99 29.70 1ggy n HIS 65 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1ggy n THR 66 N -2.07 0.00 0.04 1.59 -2.24 -0.19 -4.26 114.28 107.15 1ggy n THR 66 Ca -0.04 -0.32 0.02 0.00 -2.27 0.00 0.00 64.05 61.44 1ggy n THR 66 Cb 0.53 0.97 0.11 0.00 -2.10 0.00 0.00 70.33 69.85 1ggy n THR 66 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1ggy n ASP 67 N 0.43 0.11 0.01 3.42 5.68 -0.76 -2.45 116.55 122.99 1ggy n ASP 67 Ca 0.14 0.48 -0.11 0.00 -0.50 0.00 0.00 54.79 54.81 1ggy n ASP 67 Cb 0.46 -0.48 -0.14 0.00 -1.14 0.00 0.00 41.12 39.82 1ggy n ASP 67 CO 0.00 0.00 0.00 0.50 -1.33 0.00 0.00 177.20 176.37 1ggy h LYS 68 N 0.00 0.06 -6.62 0.11 3.64 -1.89 -3.47 116.57 108.40 1ggy h LYS 68 Ca 0.00 -0.10 -0.58 0.00 -1.27 0.00 0.00 60.65 58.70 1ggy h LYS 68 Cb 0.19 0.04 0.09 0.00 -0.41 0.00 0.00 32.23 32.13 1ggy h LYS 68 CO 0.00 0.76 0.58 0.66 -2.27 0.00 0.00 179.45 179.18 1ggy n TYR 69 N -3.21 2.18 -1.75 1.91 4.02 -1.03 -4.86 117.16 114.42 1ggy n TYR 69 Ca -0.14 0.46 -0.42 0.00 -0.01 0.00 0.00 57.90 57.79 1ggy n TYR 69 Cb 1.03 -2.45 -0.00 0.00 -0.02 0.00 0.00 39.34 37.90 1ggy n TYR 69 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 176.86 173.94 1ggy n GLU 70 N 1.67 2.92 -3.82 -0.72 4.07 -0.72 -4.85 120.64 119.19 1ggy n GLU 70 Ca 0.10 -2.64 -0.12 0.00 -0.06 0.00 0.00 57.16 54.43 1ggy n GLU 70 Cb 0.33 -3.26 -0.11 0.00 -0.06 0.00 0.00 31.44 28.34 1ggy n GLU 70 CO 0.00 0.00 0.00 1.21 -0.06 0.00 0.00 177.13 178.28 1ggy s ASN 71 N 3.03 -0.12 0.01 4.31 3.84 -1.26 -4.39 114.94 120.35 1ggy s ASN 71 Ca 0.47 0.15 0.11 0.00 0.21 0.00 0.00 52.86 53.81 1ggy s ASN 71 Cb 0.14 0.33 -0.22 0.00 -0.55 0.00 0.00 41.25 40.95 1ggy s ASN 71 CO -0.08 -0.22 0.84 0.78 -2.79 0.00 0.00 177.10 175.62 1ggy h ASN 72 N 5.04 0.00 -4.43 -4.21 -0.26 -2.02 -3.47 115.58 106.23 1ggy h ASN 72 Ca -0.28 0.00 -0.48 0.00 -0.56 0.00 0.00 56.30 54.98 1ggy h ASN 72 Cb 1.19 0.00 0.10 0.00 -1.06 0.00 0.00 38.32 38.55 1ggy h ASN 72 CO 0.39 0.97 0.38 -0.54 -1.06 0.00 0.00 177.43 177.57 1ggy s LYS 73 N -2.65 2.32 0.07 0.81 -0.14 -1.26 -4.90 119.74 114.00 1ggy s LYS 73 Ca -0.03 0.44 -0.31 0.00 -1.36 0.00 0.00 55.97 54.71 1ggy s LYS 73 Cb 0.08 -1.96 -0.06 0.00 -1.68 0.00 0.00 37.83 34.21 1ggy s LYS 73 CO 0.82 -1.41 1.28 -1.17 -0.76 0.00 0.00 175.35 174.11 1ggy s LEU 74 N -5.58 4.36 -0.05 3.17 2.96 -1.25 -4.94 118.68 117.35 1ggy s LEU 74 Ca 0.60 2.12 0.04 0.00 -0.22 0.00 0.00 54.13 56.68 1ggy s LEU 74 Cb -0.12 -3.58 -0.02 0.00 0.50 0.00 0.00 46.19 42.96 1ggy s LEU 74 CO 0.52 -0.56 -0.17 -0.63 -1.32 0.00 0.00 176.35 174.19 1ggy s ILE 75 N 1.22 2.81 0.07 6.68 1.01 -1.26 -0.80 121.20 130.93 1ggy s ILE 75 Ca 0.61 -0.81 -0.11 0.00 0.00 0.00 0.00 60.65 60.33 1ggy s ILE 75 Cb -0.32 -2.08 0.01 0.00 0.01 0.00 0.00 42.46 40.08 1ggy s ILE 75 CO 0.29 0.58 0.26 -0.69 0.00 0.00 0.00 174.94 175.38 1ggy s VAL 76 N -0.57 0.11 -0.07 2.92 1.01 0.13 -4.64 120.40 119.29 1ggy s VAL 76 Ca 0.08 -0.88 -0.02 0.00 0.00 0.00 0.00 61.98 61.17 1ggy s VAL 76 Cb -0.11 -1.11 -0.03 0.00 0.00 0.00 0.00 36.38 35.13 1ggy s VAL 76 CO 0.01 -0.49 0.01 -0.13 0.00 0.00 0.00 175.10 174.51 1ggy s ARG 77 N -3.19 2.99 1.09 2.72 0.52 -1.26 0.40 118.95 122.21 1ggy s ARG 77 Ca -0.00 -0.42 -0.17 0.00 -0.52 0.00 0.00 55.73 54.61 1ggy s ARG 77 Cb 0.02 -2.80 0.10 0.00 0.52 0.00 0.00 34.95 32.78 1ggy s ARG 77 CO -0.07 0.69 0.11 2.89 0.02 0.00 0.00 175.30 178.94 1ggy n ARG 78 N 1.96 -1.38 -0.68 3.54 1.85 0.65 -3.59 116.66 119.01 1ggy n ARG 78 Ca -0.18 -0.38 0.00 0.00 -1.00 0.00 0.00 57.85 56.29 1ggy n ARG 78 Cb 0.53 -1.74 0.00 0.00 -1.05 0.00 0.00 32.46 30.20 1ggy n ARG 78 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1ggy n GLY 79 N 1.90 0.00 3.20 2.89 0.00 -0.81 -4.66 105.19 107.71 1ggy n GLY 79 Ca 0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.79 1ggy n GLY 79 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ggy s GLN 80 N -1.37 1.37 0.30 1.61 0.74 -1.24 -4.77 119.66 116.31 1ggy s GLN 80 Ca 0.00 -0.77 -0.28 0.00 0.05 0.00 0.00 55.36 54.35 1ggy s GLN 80 Cb 0.00 -1.39 -0.09 0.00 1.10 0.00 0.00 33.01 32.63 1ggy s GLN 80 CO 0.00 0.37 1.06 -1.54 -0.55 0.00 0.00 175.29 174.63 1ggy s SER 81 N -0.81 7.20 0.29 6.67 1.04 -1.26 -3.87 113.70 122.97 1ggy s SER 81 Ca 0.06 2.17 0.03 0.00 0.48 0.00 0.00 55.95 58.69 1ggy s SER 81 Cb -0.08 -2.61 -0.06 0.00 0.10 0.00 0.00 66.02 63.37 1ggy s SER 81 CO 0.01 -0.18 0.07 0.72 0.98 0.00 0.00 173.24 174.83 1ggy s PHE 82 N -1.29 1.76 -0.08 5.02 -0.71 0.35 -4.94 117.98 118.10 1ggy s PHE 82 Ca 0.47 -1.04 -0.00 0.00 -1.04 0.00 0.00 56.93 55.32 1ggy s PHE 82 Cb -0.29 -1.10 -0.03 0.00 -1.21 0.00 0.00 43.02 40.39 1ggy s PHE 82 CO 0.36 -0.13 -0.05 0.71 -1.34 0.00 0.00 175.22 174.78 1ggy s TYR 83 N -3.48 3.01 0.03 3.49 2.02 -1.26 -1.16 117.35 119.98 1ggy s TYR 83 Ca 0.36 0.06 -0.11 0.00 -0.37 0.00 0.00 57.07 57.01 1ggy s TYR 83 Cb 0.08 -1.74 0.01 0.00 -0.40 0.00 0.00 41.96 39.91 1ggy s TYR 83 CO 0.14 0.36 0.24 0.14 -1.57 0.00 0.00 175.55 174.86 1ggy s VAL 84 N -0.78 0.09 -0.07 0.71 -7.23 -0.99 -2.73 120.40 109.39 1ggy s VAL 84 Ca 0.12 -0.74 0.02 0.00 -1.81 0.00 0.00 61.98 59.57 1ggy s VAL 84 Cb -0.11 -0.82 0.01 0.00 0.56 0.00 0.00 36.38 36.02 1ggy s VAL 84 CO 0.02 -0.41 -0.13 -1.58 -0.31 0.00 0.00 175.10 172.69 1ggy s GLN 85 N -2.22 1.84 -0.22 4.82 0.74 0.26 0.24 119.66 125.12 1ggy s GLN 85 Ca -0.08 -0.46 -0.05 0.00 0.05 0.00 0.00 55.36 54.83 1ggy s GLN 85 Cb -0.02 -1.51 -0.02 0.00 1.10 0.00 0.00 33.01 32.56 1ggy s GLN 85 CO -0.02 0.04 -0.00 0.42 -0.55 0.00 0.00 175.29 175.17 1ggy s ILE 86 N 0.66 3.74 -0.35 -2.34 1.01 0.97 0.34 121.20 125.23 1ggy s ILE 86 Ca -0.15 -0.37 -0.17 0.00 0.00 0.00 0.00 60.65 59.96 1ggy s ILE 86 Cb -0.16 -2.71 -0.01 0.00 0.01 0.00 0.00 42.46 39.59 1ggy s ILE 86 CO 0.04 0.40 0.47 -1.81 0.00 0.00 0.00 174.94 174.04 1ggy s ASP 87 N 1.39 6.28 0.56 3.58 1.01 0.13 -1.26 116.67 128.37 1ggy s ASP 87 Ca 0.05 -0.08 0.02 0.00 0.71 0.00 0.00 52.55 53.24 1ggy s ASP 87 Cb -0.15 -2.25 0.05 0.00 1.01 0.00 0.00 42.92 41.58 1ggy s ASP 87 CO -0.00 -0.44 0.79 -0.36 0.21 0.00 0.00 175.17 175.37 1ggy s PHE 88 N 2.29 2.64 -2.44 4.23 0.08 0.13 0.70 117.98 125.60 1ggy s PHE 88 Ca 0.17 -0.10 0.28 0.00 0.12 0.00 0.00 56.93 57.40 1ggy s PHE 88 Cb -0.16 -2.74 1.10 0.00 -0.57 0.00 0.00 43.02 40.65 1ggy s PHE 88 CO 0.13 -0.96 1.77 -1.13 -0.10 0.00 0.00 175.22 174.93 1ggy n SER 89 N -2.37 1.38 -3.61 1.36 3.41 -0.48 -4.66 113.62 108.65 1ggy n SER 89 Ca 0.09 -1.47 -0.06 0.00 -0.26 0.00 0.00 58.87 57.17 1ggy n SER 89 Cb 0.60 -0.01 -0.05 0.00 -0.26 0.00 0.00 64.21 64.49 1ggy n SER 89 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ggy s ARG 90 N -1.99 0.33 0.18 4.33 1.70 -1.26 -5.01 118.95 117.23 1ggy s ARG 90 Ca 0.38 0.11 -0.32 0.00 -0.47 0.00 0.00 55.73 55.43 1ggy s ARG 90 Cb 0.21 0.15 -0.15 0.00 -0.57 0.00 0.00 34.95 34.59 1ggy s ARG 90 CO 0.33 -0.10 1.20 -0.35 -1.08 0.00 0.00 175.30 175.30 1ggy n PRO 91 N 0.76 1.29 -2.14 3.89 -0.04 -1.26 -4.62 135.00 132.89 1ggy n PRO 91 Ca -0.06 0.46 -0.42 0.00 -0.04 0.00 0.00 63.50 63.44 1ggy n PRO 91 Cb 0.58 -1.98 -0.03 0.00 -0.04 0.00 0.00 33.50 32.03 1ggy n PRO 91 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 1ggy s TYR 92 N -0.18 2.90 -0.31 0.54 5.04 -1.26 -4.94 117.35 119.14 1ggy s TYR 92 Ca 0.72 0.75 -0.03 0.00 -2.44 0.00 0.00 57.07 56.08 1ggy s TYR 92 Cb -0.82 -3.74 0.05 0.00 0.35 0.00 0.00 41.96 37.80 1ggy s TYR 92 CO 0.52 -2.75 0.03 0.34 -1.34 0.00 0.00 175.55 172.35 1ggy s ASP 93 N 1.71 4.99 0.23 4.32 2.15 -1.26 -4.96 116.67 123.84 1ggy s ASP 93 Ca 0.66 -1.21 0.18 0.00 0.43 0.00 0.00 52.55 52.61 1ggy s ASP 93 Cb -0.35 -1.76 0.88 0.00 -0.30 0.00 0.00 42.92 41.39 1ggy s ASP 93 CO 0.29 -0.27 1.55 -0.81 -0.17 0.00 0.00 175.17 175.75 1ggy n PRO 94 N 4.68 0.12 0.07 4.34 -0.04 -1.26 -0.64 135.00 142.26 1ggy n PRO 94 Ca -0.13 0.53 -0.04 0.00 -0.04 0.00 0.00 63.50 63.82 1ggy n PRO 94 Cb 0.44 -1.82 -0.08 0.00 -0.04 0.00 0.00 33.50 32.00 1ggy n PRO 94 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ggy h ARG 95 N 0.00 0.00 0.00 0.54 -0.00 -2.02 -3.42 114.38 109.48 1ggy h ARG 95 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.48 1ggy h ARG 95 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.08 1ggy h ARG 95 CO 0.00 0.71 -0.84 0.54 0.00 0.00 0.00 179.97 180.38 1ggy n ARG 96 N -3.22 1.31 -1.58 0.04 1.74 -0.85 -5.10 116.66 109.00 1ggy n ARG 96 Ca -0.03 0.00 -0.29 0.00 -0.77 0.00 0.00 57.85 56.76 1ggy n ARG 96 Cb 0.89 -0.92 0.15 0.00 -1.02 0.00 0.00 32.46 31.56 1ggy n ARG 96 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1ggy s ASP 97 N -3.38 3.24 -0.29 0.55 1.01 0.19 -5.05 116.67 112.93 1ggy s ASP 97 Ca 0.00 0.79 -0.18 0.00 0.71 0.00 0.00 52.55 53.87 1ggy s ASP 97 Cb 0.00 -1.23 0.12 0.00 1.01 0.00 0.00 42.92 42.82 1ggy s ASP 97 CO 0.00 -2.70 0.92 -0.22 0.21 0.00 0.00 175.17 173.37 1ggy s LEU 98 N -6.07 -0.60 0.38 1.23 1.98 -1.26 -4.86 118.68 109.48 1ggy s LEU 98 Ca 0.66 0.99 -0.16 0.00 -2.89 0.00 0.00 54.13 52.73 1ggy s LEU 98 Cb -0.12 1.93 0.06 0.00 0.66 0.00 0.00 46.19 48.71 1ggy s LEU 98 CO 0.53 -0.16 0.81 0.72 -1.89 0.00 0.00 176.35 176.36 1ggy s PHE 99 N 1.16 0.13 -0.03 5.38 -0.71 -1.26 -0.84 117.98 121.81 1ggy s PHE 99 Ca -0.07 -0.80 -0.29 0.00 -1.04 0.00 0.00 56.93 54.73 1ggy s PHE 99 Cb -0.04 0.84 0.09 0.00 -1.21 0.00 0.00 43.02 42.70 1ggy s PHE 99 CO -0.14 -1.55 0.79 -0.98 -1.34 0.00 0.00 175.22 172.00 1ggy s ARG 100 N -2.23 0.93 0.12 1.99 1.70 -0.83 -4.45 118.95 116.18 1ggy s ARG 100 Ca 0.16 -0.04 -0.14 0.00 -0.47 0.00 0.00 55.73 55.24 1ggy s ARG 100 Cb -0.05 0.43 -0.07 0.00 -0.57 0.00 0.00 34.95 34.70 1ggy s ARG 100 CO 0.11 -0.34 0.52 0.08 -1.08 0.00 0.00 175.30 174.59 1ggy s VAL 101 N -2.10 4.90 0.05 4.99 1.01 -1.15 -1.12 120.40 126.98 1ggy s VAL 101 Ca -0.03 0.79 0.08 0.00 0.00 0.00 0.00 61.98 62.82 1ggy s VAL 101 Cb -0.01 -3.73 -0.03 0.00 0.00 0.00 0.00 36.38 32.62 1ggy s VAL 101 CO -0.01 0.29 -0.22 -1.61 0.00 0.00 0.00 175.10 173.55 1ggy s GLU 102 N -1.85 1.48 -0.04 2.72 2.02 0.11 -3.76 118.70 119.37 1ggy s GLU 102 Ca 0.36 -1.00 0.01 0.00 0.02 0.00 0.00 54.97 54.36 1ggy s GLU 102 Cb -0.15 -1.62 0.02 0.00 0.10 0.00 0.00 34.13 32.48 1ggy s GLU 102 CO 0.19 0.41 -0.04 0.71 0.02 0.00 0.00 175.26 176.55 1ggy s TYR 103 N -0.82 0.68 0.02 1.61 2.02 -0.28 -1.47 117.35 119.11 1ggy s TYR 103 Ca 0.09 -0.17 0.01 0.00 -0.37 0.00 0.00 57.07 56.62 1ggy s TYR 103 Cb -0.09 -0.63 -0.02 0.00 -0.40 0.00 0.00 41.96 40.82 1ggy s TYR 103 CO 0.02 -0.19 -0.03 0.14 -1.57 0.00 0.00 175.55 173.92 1ggy s VAL 104 N 0.97 0.19 -0.03 0.71 -7.23 -0.31 0.51 120.40 115.20 1ggy s VAL 104 Ca -0.10 -0.71 0.03 0.00 -1.81 0.00 0.00 61.98 59.39 1ggy s VAL 104 Cb -0.14 -0.28 -0.00 0.00 0.56 0.00 0.00 36.38 36.52 1ggy s VAL 104 CO -0.00 -0.34 -0.13 -0.63 -0.31 0.00 0.00 175.10 173.69 1ggy s ILE 105 N -1.06 1.06 0.00 -0.62 1.09 -0.10 -0.86 121.20 120.71 1ggy s ILE 105 Ca -0.10 -0.52 0.00 0.00 -1.10 0.00 0.00 60.65 58.93 1ggy s ILE 105 Cb -0.07 -0.92 0.00 0.00 -1.06 0.00 0.00 42.46 40.41 1ggy s ILE 105 CO -0.00 0.31 0.00 0.61 -0.10 0.00 0.00 174.94 175.76 1ggy n GLY 106 N 3.16 -1.65 0.24 6.18 0.00 -1.24 -4.16 105.19 107.71 1ggy n GLY 106 Ca -0.18 -1.53 -0.03 0.00 0.00 0.00 0.00 46.02 44.28 1ggy n GLY 106 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1ggy h ARG 107 N 0.00 0.49 -2.28 1.61 2.43 -1.63 -3.34 114.38 111.66 1ggy h ARG 107 Ca 0.00 -0.17 -0.59 0.00 -0.81 0.00 0.00 59.98 58.40 1ggy h ARG 107 Cb 0.00 -0.03 -0.42 0.00 -0.42 0.00 0.00 29.97 29.10 1ggy h ARG 107 CO 0.00 0.68 -0.62 0.66 -1.51 0.00 0.00 179.97 179.18 1ggy n TYR 108 N -4.14 4.01 -1.11 2.20 4.01 -1.26 -4.23 117.16 116.64 1ggy n TYR 108 Ca -0.00 -4.01 -0.37 0.00 -0.16 0.00 0.00 57.90 53.36 1ggy n TYR 108 Cb 0.39 -0.50 0.05 0.00 -0.31 0.00 0.00 39.34 38.96 1ggy n TYR 108 CO 0.00 0.00 0.00 -2.30 -0.46 0.00 0.00 176.86 174.10 1ggy n PRO 109 N -0.12 0.05 -3.15 -0.72 -0.02 -1.26 -4.87 135.00 124.92 1ggy n PRO 109 Ca 0.31 0.03 0.05 0.00 -2.02 0.00 0.00 63.50 61.87 1ggy n PRO 109 Cb 0.39 -1.32 -0.01 0.00 -0.02 0.00 0.00 33.50 32.54 1ggy n PRO 109 CO 0.00 0.00 0.00 -1.14 1.98 0.00 0.00 175.50 176.34 1ggy s GLN 110 N -2.12 0.29 0.33 -0.52 0.74 -1.26 -4.87 119.66 112.26 1ggy s GLN 110 Ca 0.53 0.44 0.12 0.00 0.05 0.00 0.00 55.36 56.50 1ggy s GLN 110 Cb -0.31 0.23 0.98 0.00 1.10 0.00 0.00 33.01 35.01 1ggy s GLN 110 CO 0.70 -0.40 1.70 1.49 -0.55 0.00 0.00 175.29 178.23 1ggy h GLU 111 N 7.83 0.45 0.00 1.67 4.81 -1.90 0.28 114.58 127.72 1ggy h GLU 111 Ca -0.13 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.08 1ggy h GLU 111 Cb 1.17 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 30.45 1ggy h GLU 111 CO -0.00 0.30 0.00 -1.71 -0.73 0.00 0.00 179.01 176.87 1ggy n ASN 112 N -4.95 0.00 -1.17 1.04 4.05 -1.26 -1.83 115.26 111.14 1ggy n ASN 112 Ca 0.29 0.18 0.02 0.00 0.45 0.00 0.00 54.58 55.53 1ggy n ASN 112 Cb 0.86 -0.21 0.01 0.00 1.23 0.00 0.00 39.78 41.67 1ggy n ASN 112 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 177.26 174.50 1ggy n LYS 113 N -1.21 0.00 -1.41 1.20 5.02 0.98 -5.00 118.16 117.74 1ggy n LYS 113 Ca 0.01 -1.64 -0.15 0.00 -2.02 0.00 0.00 58.31 54.51 1ggy n LYS 113 Cb 0.01 -0.13 -0.06 0.00 -0.02 0.00 0.00 35.03 34.82 1ggy n LYS 113 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ggy n GLY 114 N 0.33 1.43 0.02 0.72 0.00 -0.76 -4.74 105.19 102.18 1ggy n GLY 114 Ca 0.03 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.16 1ggy n GLY 114 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ggy n THR 115 N -2.10 0.07 -3.88 2.61 -2.24 -1.08 -4.74 114.28 102.92 1ggy n THR 115 Ca -0.15 -0.18 -0.25 0.00 -2.27 0.00 0.00 64.05 61.20 1ggy n THR 115 Cb 0.56 0.44 -0.17 0.00 -2.10 0.00 0.00 70.33 69.06 1ggy n THR 115 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1ggy s TYR 116 N -3.16 1.13 -0.17 4.78 5.04 -1.24 -0.92 117.35 122.80 1ggy s TYR 116 Ca 0.04 -0.48 0.00 0.00 -2.44 0.00 0.00 57.07 54.19 1ggy s TYR 116 Cb 0.15 -1.03 0.03 0.00 0.35 0.00 0.00 41.96 41.46 1ggy s TYR 116 CO 0.83 -0.42 -0.11 0.42 -1.34 0.00 0.00 175.55 174.93 1ggy s ILE 117 N 1.76 1.52 0.09 3.14 1.01 0.18 -3.74 121.20 125.16 1ggy s ILE 117 Ca 0.04 -0.78 -0.21 0.00 0.00 0.00 0.00 60.65 59.70 1ggy s ILE 117 Cb -0.13 -1.54 -0.11 0.00 0.01 0.00 0.00 42.46 40.70 1ggy s ILE 117 CO -0.06 0.29 1.64 -0.65 0.00 0.00 0.00 174.94 176.15 1ggy h PRO 118 N 8.03 0.22 -6.07 2.79 0.11 -1.84 -0.72 132.00 134.51 1ggy h PRO 118 Ca -0.31 -0.04 -0.25 0.00 0.11 0.00 0.00 66.00 65.51 1ggy h PRO 118 Cb 1.12 -0.04 0.01 0.00 0.11 0.00 0.00 31.00 32.20 1ggy h PRO 118 CO 0.48 0.29 -0.85 0.28 -0.21 0.00 0.00 178.00 177.99 1ggy n VAL 119 N -4.89 -6.72 -2.92 3.15 0.31 -1.25 -3.52 118.33 102.48 1ggy n VAL 119 Ca -0.05 0.29 -0.33 0.00 -0.01 0.00 0.00 64.34 64.24 1ggy n VAL 119 Cb 0.11 -4.98 -0.07 0.00 -0.91 0.00 0.00 33.84 27.99 1ggy n VAL 119 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 1ggy s PRO 120 N -2.92 4.16 0.19 5.55 0.04 -1.26 -2.93 135.00 137.82 1ggy s PRO 120 Ca 0.25 0.97 -0.30 0.00 0.04 0.00 0.00 61.00 61.96 1ggy s PRO 120 Cb -0.04 -2.27 -0.08 0.00 0.04 0.00 0.00 34.50 32.15 1ggy s PRO 120 CO 0.83 0.03 1.26 0.96 0.04 0.00 0.00 177.00 180.13 1ggy s ILE 121 N -2.11 3.38 0.14 0.56 -0.00 -1.26 -1.95 121.20 119.96 1ggy s ILE 121 Ca 0.59 1.14 0.06 0.00 -0.00 0.00 0.00 60.65 62.45 1ggy s ILE 121 Cb -0.09 -3.73 -0.04 0.00 -0.00 0.00 0.00 42.46 38.59 1ggy s ILE 121 CO 0.15 0.18 -0.14 0.54 -0.00 0.00 0.00 174.94 175.66 1ggy s VAL 122 N 0.04 1.44 0.08 8.37 0.11 0.35 -4.82 120.40 125.97 1ggy s VAL 122 Ca 0.55 -1.84 -0.27 0.00 -2.93 0.00 0.00 61.98 57.49 1ggy s VAL 122 Cb -0.35 -1.67 -0.16 0.00 -1.53 0.00 0.00 36.38 32.67 1ggy s VAL 122 CO 0.38 -0.45 1.69 0.77 -3.33 0.00 0.00 175.10 174.15 1ggy h SER 123 N 3.29 -0.27 -3.76 3.54 4.64 -1.95 -3.36 113.55 115.69 1ggy h SER 123 Ca -0.40 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 60.68 1ggy h SER 123 Cb 1.20 0.07 -0.28 0.00 -0.31 0.00 0.00 62.40 63.08 1ggy h SER 123 CO 0.53 -0.19 -0.73 -0.70 -0.87 0.00 0.00 176.83 174.88 1ggy s GLU 124 N -6.11 0.08 0.30 4.77 2.56 -1.26 -4.83 118.70 114.22 1ggy s GLU 124 Ca -0.15 -0.03 -0.29 0.00 0.00 0.00 0.00 54.97 54.50 1ggy s GLU 124 Cb 0.05 -0.09 -0.10 0.00 2.00 0.00 0.00 34.13 35.99 1ggy s GLU 124 CO 0.64 0.02 1.26 -0.51 -0.56 0.00 0.00 175.26 176.11 1ggy s LEU 125 N 0.02 4.45 0.44 2.70 1.43 -1.26 -5.01 118.68 121.45 1ggy s LEU 125 Ca 0.00 2.56 0.07 0.00 -1.03 0.00 0.00 54.13 55.74 1ggy s LEU 125 Cb -0.01 -3.64 -0.01 0.00 0.03 0.00 0.00 46.19 42.56 1ggy s LEU 125 CO -0.00 -0.45 0.40 -1.58 0.23 0.00 0.00 176.35 174.95 1ggy s GLN 126 N -1.50 2.48 -0.09 1.70 2.00 -1.26 -5.05 119.66 117.94 1ggy s GLN 126 Ca 0.49 -1.61 -0.33 0.00 -2.00 0.00 0.00 55.36 51.92 1ggy s GLN 126 Cb -0.38 -2.35 -0.10 0.00 0.80 0.00 0.00 33.01 30.98 1ggy s GLN 126 CO 0.48 -0.27 1.96 -1.13 -0.50 0.00 0.00 175.29 175.83 1ggy n SER 127 N -1.60 3.53 -4.14 6.67 3.41 -1.26 -3.43 113.62 116.79 1ggy n SER 127 Ca 0.03 0.84 -0.29 0.00 -0.26 0.00 0.00 58.87 59.20 1ggy n SER 127 Cb 0.62 -1.42 -0.08 0.00 -0.26 0.00 0.00 64.21 63.07 1ggy n SER 127 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ggy n GLY 128 N 4.72 -0.15 3.04 5.00 0.00 -1.26 -4.95 105.19 111.60 1ggy n GLY 128 Ca 0.24 0.17 -0.16 0.00 0.00 0.00 0.00 46.02 46.27 1ggy n GLY 128 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ggy s LYS 129 N -7.00 0.61 0.42 1.61 1.02 -1.22 -4.60 119.74 110.58 1ggy s LYS 129 Ca 0.03 -0.53 -0.24 0.00 0.02 0.00 0.00 55.97 55.25 1ggy s LYS 129 Cb -0.02 -0.53 -0.08 0.00 -0.52 0.00 0.00 37.83 36.69 1ggy s LYS 129 CO 0.91 0.13 1.13 -1.58 -0.92 0.00 0.00 175.35 175.02 1ggy s TRP 130 N -0.73 3.05 0.00 3.18 0.52 -1.26 -4.64 118.94 119.05 1ggy s TRP 130 Ca -0.02 1.57 0.00 0.00 0.02 0.00 0.00 56.10 57.67 1ggy s TRP 130 Cb -0.06 -3.31 0.00 0.00 -1.15 0.00 0.00 33.47 28.95 1ggy s TRP 130 CO 0.00 -1.19 0.00 0.41 0.02 0.00 0.00 176.95 176.19 1ggy n GLY 131 N 0.47 0.80 2.91 0.98 0.00 -1.22 -4.67 105.19 104.46 1ggy n GLY 131 Ca 0.06 -0.77 -0.15 0.00 0.00 0.00 0.00 46.02 45.16 1ggy n GLY 131 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ggy s ALA 132 N -2.00 -0.29 -0.10 4.61 0.00 -0.82 -1.26 121.76 121.90 1ggy s ALA 132 Ca 0.00 0.70 -0.13 0.00 0.00 0.00 0.00 51.96 52.53 1ggy s ALA 132 Cb 0.00 -0.71 -0.05 0.00 0.00 0.00 0.00 23.12 22.36 1ggy s ALA 132 CO 0.00 -0.41 0.32 0.21 0.00 0.00 0.00 175.76 175.88 1ggy s LYS 133 N 1.85 4.02 -0.04 0.00 2.20 -0.55 0.13 119.74 127.35 1ggy s LYS 133 Ca -0.02 0.20 -0.30 0.00 -0.36 0.00 0.00 55.97 55.48 1ggy s LYS 133 Cb -0.12 -3.32 -0.04 0.00 -1.51 0.00 0.00 37.83 32.84 1ggy s LYS 133 CO -0.07 0.47 1.28 0.42 -0.36 0.00 0.00 175.35 177.10 1ggy s ILE 134 N -0.28 4.04 -0.12 5.43 1.01 -1.26 -1.98 121.20 128.04 1ggy s ILE 134 Ca 0.19 1.38 0.11 0.00 0.00 0.00 0.00 60.65 62.34 1ggy s ILE 134 Cb -0.14 -3.89 -0.16 0.00 0.01 0.00 0.00 42.46 38.27 1ggy s ILE 134 CO 0.08 -0.01 0.29 0.55 0.00 0.00 0.00 174.94 175.85 1ggy n VAL 135 N 4.67 0.00 -3.57 2.92 3.14 -0.13 -4.96 118.33 120.40 1ggy n VAL 135 Ca 0.12 -0.26 -0.15 0.00 -2.96 0.00 0.00 64.34 61.09 1ggy n VAL 135 Cb 0.45 0.40 -0.06 0.00 -1.06 0.00 0.00 33.84 33.57 1ggy n VAL 135 CO 0.00 0.00 0.00 -0.32 -6.46 0.00 0.00 176.83 170.05 1ggy s MET 136 N -2.63 0.87 -0.09 1.45 -2.45 -1.14 -4.97 119.30 110.35 1ggy s MET 136 Ca -0.02 0.45 -0.02 0.00 -1.25 0.00 0.00 55.69 54.84 1ggy s MET 136 Cb 0.07 0.42 0.04 0.00 1.25 0.00 0.00 34.83 36.61 1ggy s MET 136 CO 0.47 -0.22 0.03 1.03 1.05 0.00 0.00 175.02 177.38 1ggy s ARG 137 N -0.66 0.36 0.00 4.11 0.52 -1.26 -0.90 118.95 121.11 1ggy s ARG 137 Ca -0.05 0.09 0.00 0.00 -0.52 0.00 0.00 55.73 55.24 1ggy s ARG 137 Cb -0.02 -1.10 0.00 0.00 0.52 0.00 0.00 34.95 34.35 1ggy s ARG 137 CO 0.05 -0.40 0.00 0.39 0.02 0.00 0.00 175.30 175.36 1ggy n GLU 138 N 5.19 2.24 -2.17 3.54 -0.58 -0.36 -4.98 120.64 123.52 1ggy n GLU 138 Ca -0.06 0.00 -0.43 0.00 -0.42 0.00 0.00 57.16 56.25 1ggy n GLU 138 Cb 0.49 0.00 -0.02 0.00 -0.57 0.00 0.00 31.44 31.34 1ggy n GLU 138 CO 0.00 0.00 0.00 0.16 -0.48 0.00 0.00 177.13 176.81 1ggy s ASP 139 N -0.62 6.20 -1.43 1.62 1.47 -1.26 -3.20 116.67 119.45 1ggy s ASP 139 Ca 0.00 1.21 0.00 0.00 1.18 0.00 0.00 52.55 54.94 1ggy s ASP 139 Cb 0.00 -2.53 0.00 0.00 -0.34 0.00 0.00 42.92 40.05 1ggy s ASP 139 CO 0.00 -1.47 0.00 0.54 0.68 0.00 0.00 175.17 174.92 1ggy n ARG 140 N 8.07 -1.10 -3.82 2.11 1.74 -1.26 -4.94 116.66 117.46 1ggy n ARG 140 Ca 0.19 0.88 -0.12 0.00 -0.77 0.00 0.00 57.85 58.03 1ggy n ARG 140 Cb 0.47 -5.10 -0.13 0.00 -1.02 0.00 0.00 32.46 26.68 1ggy n ARG 140 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1ggy s SER 141 N -2.60 -0.16 -0.07 0.55 0.01 -1.19 0.17 113.70 110.40 1ggy s SER 141 Ca 0.00 0.30 0.03 0.00 1.31 0.00 0.00 55.95 57.59 1ggy s SER 141 Cb 0.00 0.30 0.01 0.00 0.21 0.00 0.00 66.02 66.54 1ggy s SER 141 CO 0.00 -0.05 -0.15 0.68 0.41 0.00 0.00 173.24 174.13 1ggy s VAL 142 N 0.11 1.34 -0.31 3.43 -7.23 -0.39 -1.23 120.40 116.13 1ggy s VAL 142 Ca -0.00 -0.60 -0.12 0.00 -1.81 0.00 0.00 61.98 59.45 1ggy s VAL 142 Cb -0.01 -1.20 -0.04 0.00 0.56 0.00 0.00 36.38 35.69 1ggy s VAL 142 CO 0.00 0.40 0.21 -0.60 -0.31 0.00 0.00 175.10 174.80 1ggy s ARG 143 N 0.60 3.75 0.19 4.82 6.06 -0.08 -0.02 118.95 134.25 1ggy s ARG 143 Ca -0.15 -0.46 0.06 0.00 -2.50 0.00 0.00 55.73 52.68 1ggy s ARG 143 Cb -0.16 -3.72 -0.04 0.00 0.06 0.00 0.00 34.95 31.09 1ggy s ARG 143 CO 0.05 -0.29 0.09 -0.51 -2.50 0.00 0.00 175.30 172.14 1ggy s LEU 144 N 1.74 3.61 -0.33 -0.88 1.43 0.14 -0.96 118.68 123.42 1ggy s LEU 144 Ca 0.07 -0.26 0.04 0.00 -1.03 0.00 0.00 54.13 52.94 1ggy s LEU 144 Cb -0.17 -2.22 0.10 0.00 0.03 0.00 0.00 46.19 43.93 1ggy s LEU 144 CO 0.11 0.06 0.04 -0.55 0.23 0.00 0.00 176.35 176.23 1ggy s SER 145 N -3.18 4.71 -0.06 2.29 0.15 -0.84 -2.36 113.70 114.41 1ggy s SER 145 Ca 0.30 -2.08 -0.13 0.00 0.70 0.00 0.00 55.95 54.74 1ggy s SER 145 Cb -0.09 -1.59 -0.05 0.00 -1.71 0.00 0.00 66.02 62.58 1ggy s SER 145 CO 0.22 -0.37 0.35 -0.63 1.20 0.00 0.00 173.24 174.01 1ggy s ILE 146 N 0.95 5.17 -0.14 6.45 1.01 -0.31 -1.48 121.20 132.84 1ggy s ILE 146 Ca 0.09 0.69 0.01 0.00 0.00 0.00 0.00 60.65 61.45 1ggy s ILE 146 Cb -0.19 -3.65 0.00 0.00 0.01 0.00 0.00 42.46 38.63 1ggy s ILE 146 CO -0.09 0.54 -0.18 -1.58 0.00 0.00 0.00 174.94 173.64 1ggy s GLN 147 N -0.69 3.16 0.96 2.79 0.74 -0.39 -0.50 119.66 125.74 1ggy s GLN 147 Ca 0.21 -0.78 -0.15 0.00 0.05 0.00 0.00 55.36 54.69 1ggy s GLN 147 Cb -0.15 -2.55 0.18 0.00 1.10 0.00 0.00 33.01 31.58 1ggy s GLN 147 CO 0.10 0.04 1.22 -1.12 -0.55 0.00 0.00 175.29 174.98 1ggy s SER 148 N 0.74 3.13 0.04 6.67 0.01 -1.25 -3.41 113.70 119.63 1ggy s SER 148 Ca -0.07 0.58 -0.00 0.00 1.31 0.00 0.00 55.95 57.77 1ggy s SER 148 Cb -0.16 -0.86 -0.04 0.00 0.21 0.00 0.00 66.02 65.17 1ggy s SER 148 CO 0.01 -2.75 0.18 -0.55 0.41 0.00 0.00 173.24 170.53 1ggy s SER 149 N -4.48 6.19 0.00 2.44 0.15 -1.26 -4.10 113.70 112.64 1ggy s SER 149 Ca 0.69 0.24 0.16 0.00 0.70 0.00 0.00 55.95 57.74 1ggy s SER 149 Cb -0.09 -1.88 0.75 0.00 -1.71 0.00 0.00 66.02 63.10 1ggy s SER 149 CO 0.53 0.20 1.50 -0.81 1.20 0.00 0.00 173.24 175.85 1ggy n PRO 150 N 0.52 0.11 -0.21 5.44 -0.04 -1.26 -1.93 135.00 137.63 1ggy n PRO 150 Ca -0.07 0.18 0.07 0.00 -0.04 0.00 0.00 63.50 63.64 1ggy n PRO 150 Cb 0.52 -1.50 0.19 0.00 -0.04 0.00 0.00 33.50 32.66 1ggy n PRO 150 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1ggy n LYS 151 N -1.40 2.68 -1.90 0.54 5.02 -1.26 -4.52 118.16 117.31 1ggy n LYS 151 Ca 0.06 -2.15 -0.39 0.00 -2.02 0.00 0.00 58.31 53.81 1ggy n LYS 151 Cb 0.16 -1.35 0.02 0.00 -0.02 0.00 0.00 35.03 33.84 1ggy n LYS 151 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ggy n ILE 153 N -0.56 0.00 -4.87 0.00 5.41 -1.26 -4.55 119.36 113.53 1ggy n ILE 153 Ca 0.08 -0.16 -0.33 0.00 1.00 0.00 0.00 62.75 63.34 1ggy n ILE 153 Cb 0.44 -0.84 -0.16 0.00 -0.71 0.00 0.00 39.64 38.38 1ggy n ILE 153 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 1ggy s VAL 154 N -2.49 2.56 0.00 1.39 1.01 -1.03 -4.85 120.40 117.00 1ggy s VAL 154 Ca 0.63 -0.83 0.00 0.00 0.00 0.00 0.00 61.98 61.78 1ggy s VAL 154 Cb -0.22 -2.04 0.00 0.00 0.00 0.00 0.00 36.38 34.12 1ggy s VAL 154 CO 0.63 0.54 0.00 0.61 0.00 0.00 0.00 175.10 176.88 1ggy n GLY 155 N 3.68 -0.19 3.59 4.51 0.00 -1.11 -4.88 105.19 110.79 1ggy n GLY 155 Ca -0.19 -1.31 -0.43 0.00 0.00 0.00 0.00 46.02 44.10 1ggy n GLY 155 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ggy s LYS 156 N -1.96 3.70 0.31 1.61 2.20 -1.26 -2.57 119.74 121.77 1ggy s LYS 156 Ca 0.00 0.41 -0.00 0.00 -0.36 0.00 0.00 55.97 56.02 1ggy s LYS 156 Cb 0.00 -3.87 -0.04 0.00 -1.51 0.00 0.00 37.83 32.41 1ggy s LYS 156 CO 0.00 -1.13 0.52 -0.06 -0.36 0.00 0.00 175.35 174.32 1ggy s PHE 157 N 3.75 3.49 -0.12 4.03 0.40 0.09 -4.85 117.98 124.77 1ggy s PHE 157 Ca 0.39 0.38 -0.05 0.00 -0.60 0.00 0.00 56.93 57.06 1ggy s PHE 157 Cb -0.10 -1.91 -0.04 0.00 0.51 0.00 0.00 43.02 41.48 1ggy s PHE 157 CO 0.24 0.18 0.07 1.03 0.70 0.00 0.00 175.22 177.44 1ggy s ARG 158 N -4.01 3.40 0.02 0.44 0.52 -0.04 -2.17 118.95 117.11 1ggy s ARG 158 Ca 0.40 -0.29 -0.00 0.00 -0.52 0.00 0.00 55.73 55.32 1ggy s ARG 158 Cb -0.10 -3.04 -0.04 0.00 0.52 0.00 0.00 34.95 32.29 1ggy s ARG 158 CO 0.34 0.62 0.13 1.41 0.02 0.00 0.00 175.30 177.82 1ggy s MET 159 N -0.62 3.20 -0.02 3.54 1.75 -1.26 -1.17 119.30 124.72 1ggy s MET 159 Ca 0.11 -0.47 -0.19 0.00 -1.25 0.00 0.00 55.69 53.89 1ggy s MET 159 Cb -0.12 -2.93 0.04 0.00 2.84 0.00 0.00 34.83 34.66 1ggy s MET 159 CO 0.02 0.63 0.40 0.71 -0.65 0.00 0.00 175.02 176.14 1ggy s TYR 160 N -1.33 -0.31 -0.12 4.11 2.02 -0.54 -4.78 117.35 116.41 1ggy s TYR 160 Ca 0.28 0.50 0.03 0.00 -0.37 0.00 0.00 57.07 57.50 1ggy s TYR 160 Cb -0.12 0.18 0.00 0.00 -0.40 0.00 0.00 41.96 41.62 1ggy s TYR 160 CO 0.19 -0.44 -0.23 0.08 -1.57 0.00 0.00 175.55 173.58 1ggy s VAL 161 N -1.27 2.09 -0.24 0.71 1.01 -1.26 0.05 120.40 121.49 1ggy s VAL 161 Ca -0.13 -0.99 0.01 0.00 0.00 0.00 0.00 61.98 60.88 1ggy s VAL 161 Cb -0.04 -1.82 0.04 0.00 0.00 0.00 0.00 36.38 34.57 1ggy s VAL 161 CO 0.06 0.55 -0.12 0.00 0.00 0.00 0.00 175.10 175.59 1ggy s ALA 162 N 0.59 2.54 0.02 5.51 0.00 -0.27 -1.96 121.76 128.18 1ggy s ALA 162 Ca -0.13 -1.57 -0.23 0.00 0.00 0.00 0.00 51.96 50.03 1ggy s ALA 162 Cb -0.17 -1.51 -0.05 0.00 0.00 0.00 0.00 23.12 21.39 1ggy s ALA 162 CO 0.03 -0.91 0.70 0.08 0.00 0.00 0.00 175.76 175.67 1ggy s VAL 163 N 1.20 4.81 -0.32 0.00 1.01 0.08 -1.96 120.40 125.21 1ggy s VAL 163 Ca -0.03 1.49 -0.12 0.00 0.00 0.00 0.00 61.98 63.32 1ggy s VAL 163 Cb -0.17 -4.05 -0.03 0.00 0.00 0.00 0.00 36.38 32.13 1ggy s VAL 163 CO -0.07 0.38 0.21 0.26 0.00 0.00 0.00 175.10 175.88 1ggy s TRP 164 N -0.06 3.22 0.14 5.22 0.52 -0.02 -2.12 118.94 125.84 1ggy s TRP 164 Ca 0.36 -0.12 0.03 0.00 0.02 0.00 0.00 56.10 56.38 1ggy s TRP 164 Cb -0.20 -2.43 -0.04 0.00 -1.15 0.00 0.00 33.47 29.66 1ggy s TRP 164 CO 0.21 -0.30 0.24 0.95 0.02 0.00 0.00 176.95 178.08 1ggy s THR 165 N 1.73 5.15 -0.78 2.01 -4.23 0.23 -4.61 115.64 115.13 1ggy s THR 165 Ca 0.06 -0.75 0.11 0.00 -1.18 0.00 0.00 61.69 59.94 1ggy s THR 165 Cb -0.17 -3.63 0.11 0.00 1.34 0.00 0.00 72.50 70.14 1ggy s THR 165 CO 0.10 -0.07 1.34 -0.81 -0.54 0.00 0.00 174.62 174.64 1ggy n PRO 166 N -0.43 0.05 -0.21 3.99 -0.04 -1.26 -1.44 135.00 135.66 1ggy n PRO 166 Ca -0.07 0.45 0.10 0.00 -0.04 0.00 0.00 63.50 63.94 1ggy n PRO 166 Cb 0.54 -1.64 0.21 0.00 -0.04 0.00 0.00 33.50 32.57 1ggy n PRO 166 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1ggy n TYR 167 N -1.74 0.55 0.00 0.54 4.01 -1.26 -5.03 117.16 114.23 1ggy n TYR 167 Ca 0.01 -0.34 0.00 0.00 -0.16 0.00 0.00 57.90 57.41 1ggy n TYR 167 Cb 0.08 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.11 1ggy n TYR 167 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ggy n GLY 168 N 1.22 0.71 3.30 2.72 0.00 -0.52 -1.22 105.19 111.40 1ggy n GLY 168 Ca 0.17 -1.75 -0.19 0.00 0.00 0.00 0.00 46.02 44.25 1ggy n GLY 168 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1ggy s VAL 169 N -3.05 1.61 -0.08 1.61 -7.23 -0.31 -0.60 120.40 112.35 1ggy s VAL 169 Ca 0.00 -1.94 0.03 0.00 -1.81 0.00 0.00 61.98 58.26 1ggy s VAL 169 Cb 0.00 -1.80 0.01 0.00 0.56 0.00 0.00 36.38 35.15 1ggy s VAL 169 CO 0.00 -0.44 -0.15 -0.76 -0.31 0.00 0.00 175.10 173.44 1ggy s LEU 170 N -2.79 1.75 0.04 1.32 1.43 -0.90 -1.19 118.68 118.34 1ggy s LEU 170 Ca 0.15 -0.36 -0.04 0.00 -1.03 0.00 0.00 54.13 52.85 1ggy s LEU 170 Cb -0.04 -0.97 -0.02 0.00 0.03 0.00 0.00 46.19 45.19 1ggy s LEU 170 CO 0.05 0.06 0.06 0.00 0.23 0.00 0.00 176.35 176.75 1ggy s ARG 171 N 0.61 0.59 1.30 1.70 1.70 0.95 -0.74 118.95 125.05 1ggy s ARG 171 Ca -0.15 -0.89 -0.20 0.00 -0.47 0.00 0.00 55.73 54.02 1ggy s ARG 171 Cb -0.16 0.22 0.31 0.00 -0.57 0.00 0.00 34.95 34.75 1ggy s ARG 171 CO 0.05 -0.14 0.69 2.41 -1.08 0.00 0.00 175.30 177.23 1ggy n THR 172 N 0.60 0.00 -4.37 4.99 -1.04 -0.83 -4.46 114.28 109.17 1ggy n THR 172 Ca -0.18 -0.03 -0.25 0.00 -2.04 0.00 0.00 64.05 61.55 1ggy n THR 172 Cb 0.59 -0.81 -0.09 0.00 -1.82 0.00 0.00 70.33 68.21 1ggy n THR 172 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1ggy s SER 173 N -2.66 4.10 -0.35 8.00 1.04 -1.26 -4.66 113.70 117.91 1ggy s SER 173 Ca 0.55 -1.04 -0.40 0.00 0.48 0.00 0.00 55.95 55.55 1ggy s SER 173 Cb -0.10 -0.50 -0.15 0.00 0.10 0.00 0.00 66.02 65.37 1ggy s SER 173 CO 0.47 -0.24 1.93 -1.14 0.98 0.00 0.00 173.24 175.24 1ggy n ARG 174 N -0.93 0.86 -3.68 4.02 3.00 -1.26 -4.91 116.66 113.76 1ggy n ARG 174 Ca -0.04 0.29 -0.30 0.00 -0.00 0.00 0.00 57.85 57.80 1ggy n ARG 174 Cb 0.63 -2.06 -0.14 0.00 0.00 0.00 0.00 32.46 30.88 1ggy n ARG 174 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.63 178.84 1ggy s ASN 175 N 4.98 3.83 0.62 6.15 2.47 -1.26 -5.02 114.94 126.70 1ggy s ASN 175 Ca 1.06 -1.77 0.32 0.00 0.42 0.00 0.00 52.86 52.88 1ggy s ASN 175 Cb -1.11 -0.79 1.78 0.00 -1.45 0.00 0.00 41.25 39.68 1ggy s ASN 175 CO 0.62 -0.39 2.10 -0.65 -3.72 0.00 0.00 177.10 175.07 1ggy h PRO 176 N 7.86 0.00 0.00 0.43 0.11 -1.98 -2.62 132.00 135.80 1ggy h PRO 176 Ca -0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.00 1ggy h PRO 176 Cb 1.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.11 1ggy h PRO 176 CO 0.45 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.63 1ggy n GLU 177 N -3.51 0.22 -0.07 1.05 -0.58 -1.26 -3.08 120.64 113.42 1ggy n GLU 177 Ca 0.00 0.35 0.12 0.00 -0.42 0.00 0.00 57.16 57.21 1ggy n GLU 177 Cb 0.31 -1.85 0.16 0.00 -0.57 0.00 0.00 31.44 29.49 1ggy n GLU 177 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 1ggy n THR 178 N -2.25 0.18 -1.74 2.62 -2.24 -0.99 -4.77 114.28 105.10 1ggy n THR 178 Ca 0.03 -0.58 -0.42 0.00 -2.27 0.00 0.00 64.05 60.82 1ggy n THR 178 Cb 0.30 1.27 -0.02 0.00 -2.10 0.00 0.00 70.33 69.78 1ggy n THR 178 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1ggy s ASP 179 N -1.82 6.36 -0.06 3.42 1.01 -1.18 -4.43 116.67 119.98 1ggy s ASP 179 Ca 0.32 2.93 0.04 0.00 0.71 0.00 0.00 52.55 56.55 1ggy s ASP 179 Cb 0.21 -2.62 -0.02 0.00 1.01 0.00 0.00 42.92 41.50 1ggy s ASP 179 CO 0.31 -0.96 -0.15 -0.89 0.21 0.00 0.00 175.17 173.69 1ggy s THR 180 N 0.54 3.00 -0.16 -1.27 2.01 -0.92 -3.77 115.64 115.06 1ggy s THR 180 Ca 0.69 -0.74 -0.07 0.00 0.31 0.00 0.00 61.69 61.87 1ggy s THR 180 Cb -0.49 -2.17 -0.04 0.00 0.01 0.00 0.00 72.50 69.80 1ggy s THR 180 CO 0.41 0.58 0.09 -0.31 -0.69 0.00 0.00 174.62 174.70 1ggy s TYR 181 N -0.62 3.36 -0.27 4.92 1.51 0.02 -0.73 117.35 125.54 1ggy s TYR 181 Ca 0.09 0.26 -0.01 0.00 -1.01 0.00 0.00 57.07 56.40 1ggy s TYR 181 Cb -0.11 -2.03 0.04 0.00 -0.11 0.00 0.00 41.96 39.75 1ggy s TYR 181 CO 0.01 0.36 -0.04 0.42 -1.11 0.00 0.00 175.55 175.19 1ggy s ILE 182 N -0.10 2.83 0.50 2.71 1.01 -1.06 0.19 121.20 127.27 1ggy s ILE 182 Ca 0.08 -1.27 0.09 0.00 0.00 0.00 0.00 60.65 59.55 1ggy s ILE 182 Cb -0.12 -2.55 0.05 0.00 0.01 0.00 0.00 42.46 39.85 1ggy s ILE 182 CO 0.01 0.03 0.66 -0.76 0.00 0.00 0.00 174.94 174.88 1ggy s LEU 183 N 1.26 3.36 0.80 2.97 1.43 0.16 -2.75 118.68 125.92 1ggy s LEU 183 Ca -0.03 -0.66 -0.11 0.00 -1.03 0.00 0.00 54.13 52.30 1ggy s LEU 183 Cb -0.18 -2.11 0.07 0.00 0.03 0.00 0.00 46.19 44.00 1ggy s LEU 183 CO -0.03 -1.04 1.09 -0.36 0.23 0.00 0.00 176.35 176.24 1ggy s PHE 184 N -2.52 2.56 -0.43 0.29 0.08 -0.78 -0.26 117.98 116.94 1ggy s PHE 184 Ca 0.57 1.43 0.02 0.00 0.12 0.00 0.00 56.93 59.08 1ggy s PHE 184 Cb -0.08 -3.07 0.13 0.00 -0.57 0.00 0.00 43.02 39.43 1ggy s PHE 184 CO 0.35 -1.92 0.21 1.21 -0.10 0.00 0.00 175.22 174.97 1ggy s ASN 185 N -3.47 3.86 0.57 1.36 2.47 -1.26 -4.54 114.94 113.94 1ggy s ASN 185 Ca 0.61 -2.52 0.33 0.00 0.42 0.00 0.00 52.86 51.70 1ggy s ASN 185 Cb -0.17 -1.13 1.75 0.00 -1.45 0.00 0.00 41.25 40.25 1ggy s ASN 185 CO 0.56 -0.29 2.17 -0.65 -3.72 0.00 0.00 177.10 175.17 1ggy h PRO 186 N 6.93 0.00 -0.01 0.43 0.11 -1.76 -2.11 132.00 135.59 1ggy h PRO 186 Ca -0.04 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.07 1ggy h PRO 186 Cb 0.94 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.05 1ggy h PRO 186 CO 0.51 0.05 -0.12 0.91 -0.21 0.00 0.00 178.00 179.14 1ggy n TRP 187 N -3.46 0.00 -3.72 0.65 8.01 -1.26 -1.38 117.44 116.28 1ggy n TRP 187 Ca -0.02 0.00 -0.37 0.00 -1.31 0.00 0.00 57.50 55.80 1ggy n TRP 187 Cb 0.18 -0.11 -0.12 0.00 -2.01 0.00 0.00 31.31 29.25 1ggy n TRP 187 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1ggy h GLU 189 N 8.10 0.00 -0.01 0.00 4.81 -1.88 -0.75 114.58 124.86 1ggy h GLU 189 Ca -0.37 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.86 1ggy h GLU 189 Cb 1.18 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.56 1ggy h GLU 189 CO 0.58 0.00 -0.15 -0.25 -0.73 0.00 0.00 179.01 178.46 1ggy n ASP 190 N -2.34 1.34 -4.72 1.04 8.00 -1.26 -4.97 116.55 113.64 1ggy n ASP 190 Ca -0.01 -1.17 -0.42 0.00 0.71 0.00 0.00 54.79 53.90 1ggy n ASP 190 Cb 0.48 0.35 -0.04 0.00 -0.02 0.00 0.00 41.12 41.90 1ggy n ASP 190 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1ggy s ASP 191 N -1.20 7.32 0.62 -2.24 -1.08 -0.29 -4.83 116.67 114.97 1ggy s ASP 191 Ca 0.09 1.86 0.31 0.00 -0.52 0.00 0.00 52.55 54.29 1ggy s ASP 191 Cb 0.08 -2.58 1.73 0.00 -1.46 0.00 0.00 42.92 40.68 1ggy s ASP 191 CO 0.21 -0.24 2.07 0.00 0.52 0.00 0.00 175.17 177.73 1ggy h ALA 192 N 6.12 1.64 -0.44 3.66 0.00 -1.88 0.14 119.26 128.51 1ggy h ALA 192 Ca -0.42 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.48 1ggy h ALA 192 Cb 1.21 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1ggy h ALA 192 CO 0.75 -0.32 0.00 1.55 0.00 0.00 0.00 179.25 181.22 1ggy n VAL 193 N -3.48 2.01 -2.00 0.00 3.14 -1.26 -1.96 118.33 114.77 1ggy n VAL 193 Ca 0.01 -1.04 -0.42 0.00 -2.96 0.00 0.00 64.34 59.94 1ggy n VAL 193 Cb 0.35 -0.30 -0.02 0.00 -1.06 0.00 0.00 33.84 32.81 1ggy n VAL 193 CO 0.00 0.00 0.00 -0.47 -6.46 0.00 0.00 176.83 169.90 1ggy s TYR 194 N -2.27 3.04 -0.18 1.45 5.04 0.04 -4.31 117.35 120.16 1ggy s TYR 194 Ca 0.41 0.93 -0.01 0.00 -2.44 0.00 0.00 57.07 55.96 1ggy s TYR 194 Cb 0.31 -3.84 -0.00 0.00 0.35 0.00 0.00 41.96 38.78 1ggy s TYR 194 CO 0.13 -2.82 -0.11 -0.51 -1.34 0.00 0.00 175.55 170.90 1ggy s LEU 195 N 0.04 2.62 0.50 6.97 1.43 -0.48 -4.97 118.68 124.79 1ggy s LEU 195 Ca 0.62 -0.45 0.36 0.00 -1.03 0.00 0.00 54.13 53.63 1ggy s LEU 195 Cb -0.42 -1.63 1.51 0.00 0.03 0.00 0.00 46.19 45.68 1ggy s LEU 195 CO 0.40 0.04 1.69 -0.78 0.23 0.00 0.00 176.35 177.93 1ggy h ASP 196 N 7.67 0.12 -5.04 2.29 1.82 -1.96 -3.44 116.42 117.88 1ggy h ASP 196 Ca -0.38 0.05 -0.07 0.00 -0.39 0.00 0.00 57.03 56.24 1ggy h ASP 196 Cb 1.17 0.04 -0.16 0.00 0.68 0.00 0.00 39.33 41.06 1ggy h ASP 196 CO 0.60 -0.04 -0.09 0.54 -1.61 0.00 0.00 179.24 178.64 1ggy s ASN 197 N -4.66 -0.28 0.24 2.28 2.20 -1.26 -5.07 114.94 108.39 1ggy s ASN 197 Ca -0.06 -0.05 -0.05 0.00 -0.94 0.00 0.00 52.86 51.76 1ggy s ASN 197 Cb 0.26 0.44 0.40 0.00 -2.00 0.00 0.00 41.25 40.35 1ggy s ASN 197 CO 0.83 -0.70 1.78 -0.08 -2.94 0.00 0.00 177.10 175.99 1ggy h GLU 198 N 2.88 0.63 -0.37 3.55 4.57 -1.98 -2.34 114.58 121.51 1ggy h GLU 198 Ca -0.32 -0.04 0.08 0.00 -1.18 0.00 0.00 59.36 57.91 1ggy h GLU 198 Cb 1.21 -0.14 -0.08 0.00 -0.16 0.00 0.00 28.75 29.58 1ggy h GLU 198 CO 0.44 0.41 -0.23 0.87 -1.18 0.00 0.00 179.01 179.32 1ggy h LYS 199 N 0.65 -0.17 0.54 1.92 1.79 -1.99 0.36 116.57 119.67 1ggy h LYS 199 Ca 0.39 0.01 -0.03 0.00 -2.18 0.00 0.00 60.65 58.85 1ggy h LYS 199 Cb 0.44 0.04 0.01 0.00 -1.58 0.00 0.00 32.23 31.14 1ggy h LYS 199 CO -0.29 -0.11 -0.26 0.93 -1.08 0.00 0.00 179.45 178.64 1ggy h GLU 200 N -0.17 -0.69 -0.90 3.15 5.08 -1.93 -1.81 114.58 117.30 1ggy h GLU 200 Ca 0.18 0.05 0.23 0.00 -1.00 0.00 0.00 59.36 58.82 1ggy h GLU 200 Cb 0.46 0.16 -0.13 0.00 0.50 0.00 0.00 28.75 29.74 1ggy h GLU 200 CO -0.47 -0.39 0.39 0.00 -1.00 0.00 0.00 179.01 177.53 1ggy h ARG 201 N -0.97 0.36 0.25 2.33 3.08 -1.08 0.63 114.38 118.97 1ggy h ARG 201 Ca -0.07 -0.02 -0.01 0.00 0.07 0.00 0.00 59.98 59.94 1ggy h ARG 201 Cb 0.63 -0.08 0.00 0.00 0.08 0.00 0.00 29.97 30.60 1ggy h ARG 201 CO 0.12 0.24 -0.12 0.93 -1.07 0.00 0.00 179.97 180.07 1ggy h GLU 202 N 0.37 -0.32 0.76 0.04 5.08 -0.21 -1.63 114.58 118.66 1ggy h GLU 202 Ca 0.57 0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.92 1ggy h GLU 202 Cb 1.12 0.07 0.01 0.00 0.50 0.00 0.00 28.75 30.45 1ggy h GLU 202 CO -0.55 -0.14 -0.36 1.49 -1.00 0.00 0.00 179.01 178.45 1ggy h GLU 203 N -0.44 -0.98 0.00 2.33 4.57 0.63 0.22 114.58 120.91 1ggy h GLU 203 Ca -0.03 0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.21 1ggy h GLU 203 Cb 0.33 0.22 0.00 0.00 -0.16 0.00 0.00 28.75 29.14 1ggy h GLU 203 CO 0.06 -0.65 0.00 1.88 -1.18 0.00 0.00 179.01 179.12 1ggy h TYR 204 N -1.26 0.00 0.00 0.92 0.05 -0.10 -3.17 116.97 113.41 1ggy h TYR 204 Ca -0.10 0.00 -0.00 0.00 0.05 0.00 0.00 58.73 58.68 1ggy h TYR 204 Cb 0.78 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.52 1ggy h TYR 204 CO 0.00 0.00 -0.21 0.28 -1.05 0.00 0.00 178.16 177.18 1ggy n VAL 205 N -2.34 1.00 0.28 -2.88 0.31 -0.66 -2.08 118.33 111.96 1ggy n VAL 205 Ca 0.03 0.33 0.16 0.00 -0.01 0.00 0.00 64.34 64.84 1ggy n VAL 205 Cb 0.28 -1.58 0.55 0.00 -0.91 0.00 0.00 33.84 32.18 1ggy n VAL 205 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1ggy h LEU 206 N -0.01 0.00 -9.43 7.52 4.07 -0.15 -3.45 115.31 113.86 1ggy h LEU 206 Ca -0.00 0.00 -0.54 0.00 0.08 0.00 0.00 57.88 57.42 1ggy h LEU 206 Cb 0.21 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 41.92 1ggy h LEU 206 CO -0.00 0.00 0.31 0.21 -1.08 0.00 0.00 178.44 177.88 1ggy s ASN 207 N -5.73 7.32 -0.18 -0.43 3.84 0.02 -4.93 114.94 114.85 1ggy s ASN 207 Ca 0.03 1.59 0.16 0.00 0.21 0.00 0.00 52.86 54.85 1ggy s ASN 207 Cb 0.08 -2.54 0.63 0.00 -0.55 0.00 0.00 41.25 38.87 1ggy s ASN 207 CO 0.57 -0.19 1.54 -0.90 -2.79 0.00 0.00 177.10 175.33 1ggy n ASP 208 N 3.66 4.54 -3.87 -4.21 5.75 -1.26 -4.92 116.55 116.23 1ggy n ASP 208 Ca 0.04 -2.87 -0.11 0.00 -0.01 0.00 0.00 54.79 51.83 1ggy n ASP 208 Cb 0.51 -0.58 -0.12 0.00 -1.03 0.00 0.00 41.12 39.90 1ggy n ASP 208 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1ggy s ILE 209 N -2.60 0.03 0.16 2.12 1.01 -1.26 -1.14 121.20 119.53 1ggy s ILE 209 Ca 0.46 -0.28 -0.06 0.00 0.00 0.00 0.00 60.65 60.78 1ggy s ILE 209 Cb 0.35 -0.20 -0.02 0.00 0.01 0.00 0.00 42.46 42.60 1ggy s ILE 209 CO 0.13 -0.15 0.21 -0.83 0.00 0.00 0.00 174.94 174.30 1ggy s GLY 210 N -0.46 0.76 -0.02 6.18 0.00 -0.20 -4.91 107.32 108.66 1ggy s GLY 210 Ca -0.05 -1.17 0.02 0.00 0.00 0.00 0.00 44.72 43.52 1ggy s GLY 210 CO 0.00 -1.05 -0.06 -1.34 0.00 0.00 0.00 173.10 170.65 1ggy s VAL 211 N -4.02 3.74 -0.15 1.40 -7.23 -1.26 0.04 120.40 112.91 1ggy s VAL 211 Ca 0.22 -0.65 -0.00 0.00 -1.81 0.00 0.00 61.98 59.74 1ggy s VAL 211 Cb 0.05 -2.60 -0.00 0.00 0.56 0.00 0.00 36.38 34.38 1ggy s VAL 211 CO 0.03 0.46 -0.14 -0.63 -0.31 0.00 0.00 175.10 174.50 1ggy s ILE 212 N -0.95 2.78 -0.24 -0.62 1.01 0.64 -4.65 121.20 119.16 1ggy s ILE 212 Ca 0.16 -0.73 -0.17 0.00 0.00 0.00 0.00 60.65 59.90 1ggy s ILE 212 Cb -0.11 -2.18 -0.03 0.00 0.01 0.00 0.00 42.46 40.15 1ggy s ILE 212 CO 0.06 0.51 0.46 -0.36 0.00 0.00 0.00 174.94 175.61 1ggy s PHE 213 N 0.76 3.30 0.00 3.97 0.08 -1.26 -1.52 117.98 123.31 1ggy s PHE 213 Ca -0.06 0.60 0.00 0.00 0.12 0.00 0.00 56.93 57.59 1ggy s PHE 213 Cb -0.15 -2.64 0.00 0.00 -0.57 0.00 0.00 43.02 39.65 1ggy s PHE 213 CO 0.01 -0.20 0.00 2.48 -0.10 0.00 0.00 175.22 177.41 1ggy n TYR 214 N 5.19 0.00 -1.93 0.36 4.11 -0.14 -4.82 117.16 119.93 1ggy n TYR 214 Ca -0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.90 57.84 1ggy n TYR 214 Cb 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 39.34 39.84 1ggy n TYR 214 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 1ggy n GLY 215 N 2.92 1.61 3.24 -7.48 0.00 -1.26 -2.77 105.19 101.44 1ggy n GLY 215 Ca 0.00 -0.55 -0.11 0.00 0.00 0.00 0.00 46.02 45.36 1ggy n GLY 215 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ggy s GLU 216 N 0.00 0.79 0.26 1.61 4.04 -1.20 -4.51 118.70 119.68 1ggy s GLU 216 Ca 0.00 -0.54 0.10 0.00 0.04 0.00 0.00 54.97 54.57 1ggy s GLU 216 Cb 0.00 0.34 0.83 0.00 0.02 0.00 0.00 34.13 35.32 1ggy s GLU 216 CO 0.00 -0.25 1.16 0.28 -1.84 0.00 0.00 175.26 174.61 1ggy n VAL 217 N 0.59 -0.31 -0.50 1.83 0.31 -1.26 -0.48 118.33 118.51 1ggy n VAL 217 Ca -0.19 1.55 -0.09 0.00 -0.01 0.00 0.00 64.34 65.60 1ggy n VAL 217 Cb 0.59 -2.41 0.18 0.00 -0.91 0.00 0.00 33.84 31.30 1ggy n VAL 217 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 1ggy n ASN 218 N -4.81 3.83 -2.65 4.52 5.03 -1.26 -4.17 115.26 115.75 1ggy n ASN 218 Ca 0.24 -2.97 -0.02 0.00 0.87 0.00 0.00 54.58 52.69 1ggy n ASN 218 Cb 0.80 -0.70 0.12 0.00 -1.02 0.00 0.00 39.78 38.98 1ggy n ASN 218 CO 0.00 0.00 0.00 -0.67 -1.83 0.00 0.00 177.26 174.76 1ggy n ASP 219 N -0.28 -1.00 -4.68 6.41 2.03 0.37 -5.04 116.55 114.35 1ggy n ASP 219 Ca 0.35 -1.50 -0.42 0.00 0.52 0.00 0.00 54.79 53.73 1ggy n ASP 219 Cb 1.19 1.00 -0.03 0.00 -0.72 0.00 0.00 41.12 42.56 1ggy n ASP 219 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1ggy s ILE 220 N 0.00 2.99 0.13 5.18 1.01 -0.97 -3.25 121.20 126.29 1ggy s ILE 220 Ca 0.20 0.32 0.06 0.00 0.00 0.00 0.00 60.65 61.23 1ggy s ILE 220 Cb 0.30 -3.20 -0.04 0.00 0.01 0.00 0.00 42.46 39.52 1ggy s ILE 220 CO -0.23 -0.01 -0.01 -0.54 0.00 0.00 0.00 174.94 174.15 1ggy s LYS 221 N 3.25 2.43 0.10 2.79 1.02 -1.12 -4.98 119.74 123.22 1ggy s LYS 221 Ca 0.79 -0.97 0.04 0.00 0.02 0.00 0.00 55.97 55.84 1ggy s LYS 221 Cb -0.41 -2.43 -0.04 0.00 -0.52 0.00 0.00 37.83 34.43 1ggy s LYS 221 CO 0.35 0.50 -0.10 0.95 -0.92 0.00 0.00 175.35 176.13 1ggy s THR 222 N -1.46 0.93 -0.05 2.17 -4.23 -1.26 -0.96 115.64 110.77 1ggy s THR 222 Ca 0.26 -1.63 -0.13 0.00 -1.18 0.00 0.00 61.69 59.00 1ggy s THR 222 Cb -0.11 -1.35 0.03 0.00 1.34 0.00 0.00 72.50 72.41 1ggy s THR 222 CO 0.18 -0.56 0.31 -0.60 -0.54 0.00 0.00 174.62 173.41 1ggy s ARG 223 N -2.78 0.56 0.22 3.99 3.00 -0.57 -4.95 118.95 118.42 1ggy s ARG 223 Ca 0.05 0.02 -0.25 0.00 -1.00 0.00 0.00 55.73 54.55 1ggy s ARG 223 Cb -0.03 0.25 -0.09 0.00 0.00 0.00 0.00 34.95 35.09 1ggy s ARG 223 CO -0.00 -0.13 0.83 -1.12 0.00 0.00 0.00 175.30 174.88 1ggy s SER 224 N -0.81 7.36 -0.04 -2.12 0.01 -1.26 -0.26 113.70 116.58 1ggy s SER 224 Ca -0.09 1.70 0.03 0.00 1.31 0.00 0.00 55.95 58.90 1ggy s SER 224 Cb -0.04 -2.52 0.00 0.00 0.21 0.00 0.00 66.02 63.67 1ggy s SER 224 CO 0.03 0.11 -0.14 0.86 0.41 0.00 0.00 173.24 174.51 1ggy s TRP 225 N -1.33 1.42 -0.38 2.43 -0.11 0.11 -4.91 118.94 116.17 1ggy s TRP 225 Ca 0.41 -0.41 -0.20 0.00 1.22 0.00 0.00 56.10 57.13 1ggy s TRP 225 Cb -0.21 -0.98 0.01 0.00 -1.50 0.00 0.00 33.47 30.78 1ggy s TRP 225 CO 0.26 -0.16 0.61 0.45 -4.62 0.00 0.00 176.95 173.50 1ggy s SER 226 N 0.17 6.38 0.06 5.86 0.15 -0.97 -1.03 113.70 124.31 1ggy s SER 226 Ca -0.05 -0.01 -0.15 0.00 0.70 0.00 0.00 55.95 56.43 1ggy s SER 226 Cb -0.11 -2.31 -0.23 0.00 -1.71 0.00 0.00 66.02 61.66 1ggy s SER 226 CO 0.02 -0.62 1.17 1.88 1.20 0.00 0.00 173.24 176.89 1ggy h TYR 227 N 8.57 0.94 -6.27 3.44 0.05 -1.48 0.64 116.97 122.86 1ggy h TYR 227 Ca -0.26 -0.50 -0.48 0.00 0.05 0.00 0.00 58.73 57.53 1ggy h TYR 227 Cb 1.11 -0.11 -0.08 0.00 1.01 0.00 0.00 36.73 38.66 1ggy h TYR 227 CO 0.74 1.34 -0.75 0.41 -1.05 0.00 0.00 178.16 178.85 1ggy n GLY 228 N 1.05 -0.49 0.01 3.88 0.00 -0.84 -4.35 105.19 104.46 1ggy n GLY 228 Ca -0.11 0.17 0.06 0.00 0.00 0.00 0.00 46.02 46.14 1ggy n GLY 228 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ggy n GLN 229 N -4.49 0.01 -0.20 1.61 0.00 -1.26 -2.12 117.38 110.93 1ggy n GLN 229 Ca 0.04 0.33 0.07 0.00 0.00 0.00 0.00 57.00 57.44 1ggy n GLN 229 Cb 0.52 -1.52 0.18 0.00 0.00 0.00 0.00 30.24 29.41 1ggy n GLN 229 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.06 178.25 1ggy n PHE 230 N -1.54 0.53 -1.71 2.61 3.72 -1.26 -4.49 117.46 115.31 1ggy n PHE 230 Ca 0.02 -0.45 -0.31 0.00 -0.05 0.00 0.00 57.45 56.66 1ggy n PHE 230 Cb 0.13 -0.02 0.04 0.00 -0.94 0.00 0.00 39.48 38.69 1ggy n PHE 230 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 1ggy s GLU 231 N -1.02 3.15 0.13 -1.08 0.41 -0.90 -1.75 118.70 117.65 1ggy s GLU 231 Ca 0.28 0.82 -0.33 0.00 -0.41 0.00 0.00 54.97 55.33 1ggy s GLU 231 Cb 0.15 -2.02 -0.13 0.00 -1.78 0.00 0.00 34.13 30.35 1ggy s GLU 231 CO 0.20 -0.91 1.68 -3.47 -0.49 0.00 0.00 175.26 172.27 1ggy n ASP 232 N -2.98 3.43 0.00 -0.19 2.03 -1.26 -2.79 116.55 114.78 1ggy n ASP 232 Ca 0.07 1.05 0.00 0.00 0.52 0.00 0.00 54.79 56.43 1ggy n ASP 232 Cb 0.54 -1.46 0.00 0.00 -0.72 0.00 0.00 41.12 39.48 1ggy n ASP 232 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1ggy n GLY 233 N 3.75 2.91 0.09 0.27 0.00 -1.26 -4.91 105.19 106.04 1ggy n GLY 233 Ca 0.18 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.09 1ggy n GLY 233 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1ggy h ILE 234 N 0.00 1.03 -0.91 -0.61 1.08 -1.86 0.42 117.51 116.67 1ggy h ILE 234 Ca 0.00 -0.07 0.10 0.00 -0.39 0.00 0.00 64.86 64.50 1ggy h ILE 234 Cb 0.00 0.82 -0.08 0.00 -3.07 0.00 0.00 36.82 34.50 1ggy h ILE 234 CO 0.00 0.04 0.55 0.25 -0.69 0.00 0.00 178.15 178.29 1ggy h LEU 235 N 0.19 0.80 -0.71 1.44 6.46 -1.79 -1.02 115.31 120.69 1ggy h LEU 235 Ca 0.05 0.04 -0.13 0.00 -0.12 0.00 0.00 57.88 57.73 1ggy h LEU 235 Cb -0.02 -0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 39.79 1ggy h LEU 235 CO -0.02 0.45 -0.43 0.44 -0.62 0.00 0.00 178.44 178.27 1ggy h ASP 236 N 0.90 0.51 -0.54 1.25 3.32 -1.76 -3.02 116.42 117.08 1ggy h ASP 236 Ca 0.44 -0.23 -0.07 0.00 0.02 0.00 0.00 57.03 57.19 1ggy h ASP 236 Cb 0.39 -0.14 -0.02 0.00 0.22 0.00 0.00 39.33 39.77 1ggy h ASP 236 CO -0.25 0.88 0.09 0.74 -1.72 0.00 0.00 179.24 178.98 1ggy h THR 237 N 0.39 1.25 -0.05 0.35 2.02 0.34 -2.30 112.91 114.91 1ggy h THR 237 Ca 0.03 -0.96 -0.02 0.00 0.77 0.00 0.00 66.41 66.23 1ggy h THR 237 Cb 0.91 0.70 -0.01 0.00 -1.74 0.00 0.00 68.15 68.02 1ggy h THR 237 CO 0.08 0.35 -0.08 0.00 0.37 0.00 0.00 175.52 176.24 1ggy h LEU 239 N 0.08 0.46 -0.56 0.00 3.38 -1.46 -3.15 115.31 114.06 1ggy h LEU 239 Ca 0.02 -0.43 -0.03 0.00 0.09 0.00 0.00 57.88 57.52 1ggy h LEU 239 Cb 0.19 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1ggy h LEU 239 CO 0.01 1.28 0.23 0.22 0.09 0.00 0.00 178.44 180.27 1ggy h TYR 240 N 0.14 0.85 -0.64 1.13 3.20 -0.56 -0.80 116.97 120.29 1ggy h TYR 240 Ca -0.11 -0.06 0.04 0.00 3.14 0.00 0.00 58.73 61.74 1ggy h TYR 240 Cb 1.78 -0.26 -0.05 0.00 1.54 0.00 0.00 36.73 39.75 1ggy h TYR 240 CO 0.06 0.69 0.38 0.28 -1.64 0.00 0.00 178.16 177.93 1ggy h VAL 241 N 0.77 1.04 -0.06 1.81 2.07 -0.55 0.53 116.25 121.85 1ggy h VAL 241 Ca 0.19 -0.25 -0.07 0.00 0.82 0.00 0.00 66.70 67.38 1ggy h VAL 241 Cb 0.19 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.19 1ggy h VAL 241 CO -0.02 0.13 -0.30 0.24 0.02 0.00 0.00 177.57 177.65 1ggy h MET 242 N 0.74 0.11 -0.09 1.57 2.86 -1.35 -2.32 114.93 116.45 1ggy h MET 242 Ca 0.27 -0.04 -0.17 0.00 -2.06 0.00 0.00 59.70 57.70 1ggy h MET 242 Cb 0.08 -0.01 0.01 0.00 0.06 0.00 0.00 31.60 31.74 1ggy h MET 242 CO -0.13 0.41 -0.62 -0.44 1.06 0.00 0.00 176.91 177.18 1ggy h ASP 243 N 0.10 0.69 0.33 1.22 3.32 -0.03 -0.98 116.42 121.08 1ggy h ASP 243 Ca 0.01 -0.67 0.00 0.00 0.02 0.00 0.00 57.03 56.40 1ggy h ASP 243 Cb 0.59 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.93 1ggy h ASP 243 CO 0.04 1.25 0.00 0.03 -1.72 0.00 0.00 179.24 178.85 1ggy h ARG 244 N 0.18 0.00 -0.52 3.56 2.47 0.36 0.13 114.38 120.56 1ggy h ARG 244 Ca -0.05 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.67 1ggy h ARG 244 Cb 1.27 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.59 1ggy h ARG 244 CO 0.13 0.00 0.00 0.00 0.56 0.00 0.00 179.97 180.66 1ggy n ALA 245 N -2.06 2.42 -3.93 0.04 0.00 -0.90 -4.92 120.51 111.15 1ggy n ALA 245 Ca -0.02 -0.97 -0.31 0.00 0.00 0.00 0.00 53.44 52.14 1ggy n ALA 245 Cb 0.14 -0.96 -0.00 0.00 0.00 0.00 0.00 19.45 18.64 1ggy n ALA 245 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1ggy n GLN 246 N 1.15 -4.09 -2.20 0.00 6.02 0.45 -4.84 117.38 113.88 1ggy n GLN 246 Ca 0.19 0.48 -0.42 0.00 -0.01 0.00 0.00 57.00 57.23 1ggy n GLN 246 Cb 0.49 -5.27 -0.03 0.00 1.02 0.00 0.00 30.24 26.45 1ggy n GLN 246 CO 0.00 0.00 0.00 1.41 -1.01 0.00 0.00 177.06 177.46 1ggy s MET 247 N -6.63 4.23 0.03 -1.09 1.75 -0.40 -4.89 119.30 112.30 1ggy s MET 247 Ca 0.65 1.96 -0.35 0.00 -1.25 0.00 0.00 55.69 56.70 1ggy s MET 247 Cb -0.34 -3.79 -0.13 0.00 2.84 0.00 0.00 34.83 33.41 1ggy s MET 247 CO 0.80 -0.72 1.70 -3.47 -0.65 0.00 0.00 175.02 172.67 1ggy n ASP 248 N 6.43 3.10 -0.11 1.11 2.03 -1.26 -4.49 116.55 123.35 1ggy n ASP 248 Ca 0.15 1.04 0.14 0.00 0.52 0.00 0.00 54.79 56.64 1ggy n ASP 248 Cb 0.44 -1.37 0.52 0.00 -0.72 0.00 0.00 41.12 39.98 1ggy n ASP 248 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1ggy h LEU 249 N 7.26 0.35 0.00 -2.67 3.38 -1.74 -0.04 115.31 121.86 1ggy h LEU 249 Ca -0.47 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.52 1ggy h LEU 249 Cb 1.27 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.96 1ggy h LEU 249 CO 0.91 0.20 0.00 -1.20 0.09 0.00 0.00 178.44 178.44 1ggy n SER 250 N -4.47 0.00 -0.48 -0.43 7.64 -1.26 -1.66 113.62 112.96 1ggy n SER 250 Ca 0.12 0.27 0.07 0.00 1.01 0.00 0.00 58.87 60.33 1ggy n SER 250 Cb 0.45 -0.37 0.04 0.00 -1.01 0.00 0.00 64.21 63.32 1ggy n SER 250 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ggy n GLY 251 N -0.28 -0.07 0.00 0.23 0.00 -0.03 -4.53 105.19 100.52 1ggy n GLY 251 Ca 0.05 -0.39 0.06 0.00 0.00 0.00 0.00 46.02 45.73 1ggy n GLY 251 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ggy n ARG 252 N 0.48 0.85 -0.07 1.61 1.74 -0.67 -1.95 116.66 118.67 1ggy n ARG 252 Ca 0.07 0.00 0.09 0.00 -0.77 0.00 0.00 57.85 57.24 1ggy n ARG 252 Cb 0.33 -1.22 0.11 0.00 -1.02 0.00 0.00 32.46 30.65 1ggy n ARG 252 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ggy n GLY 253 N 0.51 0.86 3.34 -0.13 0.00 -1.26 -2.45 105.19 106.05 1ggy n GLY 253 Ca 0.09 -0.52 -0.40 0.00 0.00 0.00 0.00 46.02 45.20 1ggy n GLY 253 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1ggy s ASN 254 N -1.33 5.60 0.47 1.61 3.84 -0.82 -4.87 114.94 119.44 1ggy s ASN 254 Ca 0.24 -1.06 0.12 0.00 0.21 0.00 0.00 52.86 52.37 1ggy s ASN 254 Cb 0.15 -1.97 1.07 0.00 -0.55 0.00 0.00 41.25 39.96 1ggy s ASN 254 CO 0.22 -0.37 2.09 -0.65 -2.79 0.00 0.00 177.10 175.61 1ggy h PRO 255 N 8.36 0.22 0.23 0.43 0.11 -1.90 0.26 132.00 139.72 1ggy h PRO 255 Ca -0.24 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.84 1ggy h PRO 255 Cb 1.10 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1ggy h PRO 255 CO 0.65 0.17 -0.11 0.82 -0.21 0.00 0.00 178.00 179.31 1ggy h ILE 256 N 0.23 0.79 -0.02 4.15 2.04 -1.94 -1.18 117.51 121.58 1ggy h ILE 256 Ca 0.06 -0.08 -0.09 0.00 1.00 0.00 0.00 64.86 65.75 1ggy h ILE 256 Cb 0.01 0.84 -0.01 0.00 -0.74 0.00 0.00 36.82 36.92 1ggy h ILE 256 CO -0.01 0.02 -0.40 0.50 0.00 0.00 0.00 178.15 178.26 1ggy h LYS 257 N -0.35 0.05 -0.13 2.37 3.64 -1.73 0.20 116.57 120.62 1ggy h LYS 257 Ca -0.03 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.30 1ggy h LYS 257 Cb 0.27 -0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.09 1ggy h LYS 257 CO 0.05 0.44 -0.04 0.28 -2.27 0.00 0.00 179.45 177.92 1ggy h VAL 258 N 0.04 1.29 -0.09 2.00 2.07 -0.71 -0.26 116.25 120.59 1ggy h VAL 258 Ca 0.00 -1.00 -0.14 0.00 0.82 0.00 0.00 66.70 66.38 1ggy h VAL 258 Cb 0.72 1.69 -0.01 0.00 -1.52 0.00 0.00 31.29 32.17 1ggy h VAL 258 CO 0.05 0.29 -0.57 0.77 0.02 0.00 0.00 177.57 178.13 1ggy h SER 259 N -0.06 0.32 -0.17 0.57 4.64 -1.06 0.72 113.55 118.50 1ggy h SER 259 Ca 0.03 -0.17 -0.10 0.00 -0.47 0.00 0.00 61.79 61.08 1ggy h SER 259 Cb 0.47 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 62.45 1ggy h SER 259 CO 0.01 0.82 -0.21 -0.09 -0.87 0.00 0.00 176.83 176.50 1ggy h ARG 260 N 0.22 0.61 0.10 4.77 9.65 -0.50 -2.73 114.38 126.50 1ggy h ARG 260 Ca -0.00 -0.22 -0.33 0.00 -1.10 0.00 0.00 59.98 58.32 1ggy h ARG 260 Cb 1.07 -0.04 -0.02 0.00 -1.39 0.00 0.00 29.97 29.59 1ggy h ARG 260 CO 0.09 0.78 -1.81 0.28 2.80 0.00 0.00 179.97 182.11 1ggy h VAL 261 N 0.54 0.72 -0.74 0.20 2.07 -0.82 -3.31 116.25 114.90 1ggy h VAL 261 Ca 0.08 -2.32 0.02 0.00 0.82 0.00 0.00 66.70 65.30 1ggy h VAL 261 Cb 0.66 2.47 -0.04 0.00 -1.52 0.00 0.00 31.29 32.86 1ggy h VAL 261 CO 0.05 0.77 0.49 1.23 0.02 0.00 0.00 177.57 180.13 1ggy h GLY 262 N 0.58 1.04 0.92 2.17 0.00 0.36 -2.62 103.07 105.53 1ggy h GLY 262 Ca -0.40 -0.38 -0.07 0.00 0.00 0.00 0.00 47.33 46.48 1ggy h GLY 262 CO 0.03 0.36 -0.07 1.48 0.00 0.00 0.00 176.54 178.33 1ggy h SER 263 N 0.97 0.65 0.22 0.19 4.64 -1.67 -2.87 113.55 115.69 1ggy h SER 263 Ca 0.28 -0.36 -0.01 0.00 -0.47 0.00 0.00 61.79 61.23 1ggy h SER 263 Cb -0.06 -0.18 -0.00 0.00 -0.31 0.00 0.00 62.40 61.85 1ggy h SER 263 CO -0.07 0.86 -0.04 0.00 -0.87 0.00 0.00 176.83 176.71 1ggy h ALA 264 N 0.81 1.22 0.00 5.18 0.00 -1.57 -2.17 119.26 122.74 1ggy h ALA 264 Ca 0.09 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1ggy h ALA 264 Cb 0.57 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1ggy h ALA 264 CO 0.03 0.05 -0.22 0.52 0.00 0.00 0.00 179.25 179.63 1ggy h MET 265 N 0.00 0.00 -0.45 0.00 2.86 -1.26 -3.36 114.93 112.72 1ggy h MET 265 Ca -0.00 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.61 1ggy h MET 265 Cb 0.16 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.80 1ggy h MET 265 CO 0.00 0.00 0.18 0.28 1.06 0.00 0.00 176.91 178.43 1ggy h VAL 266 N 0.00 1.20 -3.51 -2.22 2.07 -1.34 0.21 116.25 112.67 1ggy h VAL 266 Ca 0.00 -0.63 -0.69 0.00 0.82 0.00 0.00 66.70 66.20 1ggy h VAL 266 Cb 0.85 0.79 -0.18 0.00 -1.52 0.00 0.00 31.29 31.23 1ggy h VAL 266 CO 0.00 0.23 -0.16 0.21 0.02 0.00 0.00 177.57 177.88 1ggy s ASN 267 N -5.91 6.21 -0.81 0.57 2.47 -1.26 -1.07 114.94 115.14 1ggy s ASN 267 Ca -0.13 -0.68 -0.26 0.00 0.42 0.00 0.00 52.86 52.21 1ggy s ASN 267 Cb 0.11 -2.24 -0.13 0.00 -1.45 0.00 0.00 41.25 37.54 1ggy s ASN 267 CO 0.76 -0.63 2.36 0.00 -3.72 0.00 0.00 177.10 175.87 1ggy s ALA 268 N 2.23 0.78 -0.07 1.71 0.00 0.11 -4.54 121.76 121.98 1ggy s ALA 268 Ca 0.13 -0.88 -0.30 0.00 0.00 0.00 0.00 51.96 50.91 1ggy s ALA 268 Cb -0.17 -4.58 -0.04 0.00 0.00 0.00 0.00 23.12 18.33 1ggy s ALA 268 CO 0.14 -5.82 1.42 0.15 0.00 0.00 0.00 175.76 171.64 1ggy s LYS 269 N 8.70 4.24 6.48 0.00 1.02 -1.26 -4.52 119.74 134.40 1ggy s LYS 269 Ca 0.90 1.91 0.00 0.00 0.02 0.00 0.00 55.97 58.81 1ggy s LYS 269 Cb -0.12 -3.76 0.00 0.00 -0.52 0.00 0.00 37.83 33.43 1ggy s LYS 269 CO 0.07 -0.69 0.00 -0.25 -0.92 0.00 0.00 175.35 173.56 1ggy n ASP 270 N 6.31 0.00 -3.14 2.83 8.00 -1.26 -3.19 116.55 126.09 1ggy n ASP 270 Ca 0.14 0.00 -0.19 0.00 0.71 0.00 0.00 54.79 55.46 1ggy n ASP 270 Cb 0.44 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.51 1ggy n ASP 270 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1ggy n ASP 271 N 11.00 0.26 0.00 -2.24 8.00 -1.26 -4.89 116.55 127.41 1ggy n ASP 271 Ca 0.00 -2.97 0.00 0.00 0.71 0.00 0.00 54.79 52.53 1ggy n ASP 271 Cb 0.00 -0.35 0.00 0.00 -0.02 0.00 0.00 41.12 40.75 1ggy n ASP 271 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 1ggy n GLU 272 N 0.69 0.00 0.00 -1.24 2.13 -1.19 -4.75 120.64 116.27 1ggy n GLU 272 Ca 0.22 0.00 0.00 0.00 0.66 0.00 0.00 57.16 58.04 1ggy n GLU 272 Cb 0.62 -0.91 0.00 0.00 0.27 0.00 0.00 31.44 31.42 1ggy n GLU 272 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1ggy n GLY 273 N 3.16 -1.82 0.08 8.31 0.00 -1.26 -4.73 105.19 108.94 1ggy n GLY 273 Ca 0.00 -1.53 -0.12 0.00 0.00 0.00 0.00 46.02 44.37 1ggy n GLY 273 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1ggy h VAL 274 N -1.02 1.40 -4.27 1.61 2.07 -0.93 -3.23 116.25 111.88 1ggy h VAL 274 Ca 0.00 -1.66 -0.70 0.00 0.82 0.00 0.00 66.70 65.16 1ggy h VAL 274 Cb 0.00 2.47 -0.26 0.00 -1.52 0.00 0.00 31.29 31.97 1ggy h VAL 274 CO 0.00 0.41 -0.88 -0.76 0.02 0.00 0.00 177.57 176.36 1ggy s LEU 275 N -8.71 2.19 -0.36 2.57 1.43 -0.24 0.20 118.68 115.76 1ggy s LEU 275 Ca -0.16 -0.60 -0.14 0.00 -1.03 0.00 0.00 54.13 52.20 1ggy s LEU 275 Cb -0.01 -1.29 -0.00 0.00 0.03 0.00 0.00 46.19 44.92 1ggy s LEU 275 CO 0.61 0.25 0.31 -0.69 0.23 0.00 0.00 176.35 177.07 1ggy s VAL 276 N -0.83 5.22 0.04 -1.59 1.01 0.82 0.09 120.40 125.17 1ggy s VAL 276 Ca 0.12 -0.25 -0.30 0.00 0.00 0.00 0.00 61.98 61.55 1ggy s VAL 276 Cb -0.10 -3.83 -0.05 0.00 0.00 0.00 0.00 36.38 32.40 1ggy s VAL 276 CO 0.02 -0.14 1.14 -0.83 0.00 0.00 0.00 175.10 175.29 1ggy s GLY 277 N 1.73 2.54 -0.14 4.51 0.00 -1.26 -1.45 107.32 113.24 1ggy s GLY 277 Ca 0.08 0.77 -0.05 0.00 0.00 0.00 0.00 44.72 45.51 1ggy s GLY 277 CO 0.11 1.95 0.30 -0.45 0.00 0.00 0.00 173.10 175.00 1ggy s SER 278 N 1.05 0.18 -0.29 1.64 0.15 -0.99 -4.89 113.70 110.55 1ggy s SER 278 Ca 0.57 0.68 0.09 0.00 0.70 0.00 0.00 55.95 57.99 1ggy s SER 278 Cb -0.27 0.82 0.52 0.00 -1.71 0.00 0.00 66.02 65.37 1ggy s SER 278 CO 0.29 -0.23 1.48 0.79 1.20 0.00 0.00 173.24 176.77 1ggy n TRP 279 N 5.28 1.17 1.72 3.44 8.01 -1.26 -4.75 117.44 131.05 1ggy n TRP 279 Ca -0.08 -1.56 0.15 0.00 -1.31 0.00 0.00 57.50 54.70 1ggy n TRP 279 Cb 0.50 -0.50 0.85 0.00 -2.01 0.00 0.00 31.31 30.15 1ggy n TRP 279 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.69 176.28 1ggy n ASP 280 N -1.08 0.02 0.00 -0.99 5.75 -1.26 -4.91 116.55 114.07 1ggy n ASP 280 Ca 0.34 -0.60 0.00 0.00 -0.01 0.00 0.00 54.79 54.52 1ggy n ASP 280 Cb 1.06 -0.13 0.00 0.00 -1.03 0.00 0.00 41.12 41.01 1ggy n ASP 280 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1ggy n ASN 281 N -1.12 -5.01 0.02 -1.12 5.15 -1.26 -4.71 115.26 107.20 1ggy n ASN 281 Ca 0.19 0.00 -0.02 0.00 -0.60 0.00 0.00 54.58 54.15 1ggy n ASN 281 Cb 0.17 -2.92 -0.01 0.00 -0.53 0.00 0.00 39.78 36.49 1ggy n ASN 281 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 1ggy n ILE 282 N -2.15 1.26 -2.93 -1.44 2.08 -1.26 -5.03 119.36 109.89 1ggy n ILE 282 Ca 0.00 0.34 -0.01 0.00 0.56 0.00 0.00 62.75 63.64 1ggy n ILE 282 Cb 0.38 -1.74 0.00 0.00 -0.75 0.00 0.00 39.64 37.53 1ggy n ILE 282 CO 0.00 0.00 0.00 -1.22 0.56 0.00 0.00 176.55 175.89 1ggy n TYR 283 N -3.68 -2.86 0.00 1.39 4.01 -1.26 -4.98 117.16 109.77 1ggy n TYR 283 Ca -0.03 1.10 0.00 0.00 -0.16 0.00 0.00 57.90 58.81 1ggy n TYR 283 Cb 0.12 -3.95 0.00 0.00 -0.31 0.00 0.00 39.34 35.20 1ggy n TYR 283 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1ggy n ALA 284 N -1.53 0.00 -3.43 -0.72 0.00 -1.26 -3.81 120.51 109.76 1ggy n ALA 284 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.16 1ggy n ALA 284 Cb 0.49 0.20 -0.07 0.00 0.00 0.00 0.00 19.45 20.06 1ggy n ALA 284 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1ggy n TYR 285 N -0.84 3.48 -3.65 0.00 4.01 -1.26 -5.01 117.16 113.89 1ggy n TYR 285 Ca 0.00 -3.99 -0.00 0.00 -0.16 0.00 0.00 57.90 53.75 1ggy n TYR 285 Cb 0.00 -0.67 0.00 0.00 -0.31 0.00 0.00 39.34 38.36 1ggy n TYR 285 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ggy n GLY 286 N 1.07 0.95 3.84 2.72 0.00 -1.25 -4.90 105.19 107.62 1ggy n GLY 286 Ca 0.28 -0.94 -0.37 0.00 0.00 0.00 0.00 46.02 44.99 1ggy n GLY 286 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ggy s VAL 287 N -2.35 5.47 0.12 1.61 1.01 -0.16 -4.88 120.40 121.23 1ggy s VAL 287 Ca 0.06 0.23 -0.31 0.00 0.00 0.00 0.00 61.98 61.95 1ggy s VAL 287 Cb -0.00 -3.43 -0.08 0.00 0.00 0.00 0.00 36.38 32.86 1ggy s VAL 287 CO 0.01 0.57 1.46 -2.84 0.00 0.00 0.00 175.10 174.30 1ggy s PRO 288 N -0.66 4.28 0.55 2.72 0.02 -1.26 -1.19 135.00 139.45 1ggy s PRO 288 Ca 0.14 2.17 0.43 0.00 0.02 0.00 0.00 61.00 63.76 1ggy s PRO 288 Cb -0.12 -3.27 1.65 0.00 0.02 0.00 0.00 34.50 32.78 1ggy s PRO 288 CO 0.03 -0.52 1.69 -1.35 -0.33 0.00 0.00 177.00 176.52 1ggy h PRO 289 N 6.98 0.00 0.00 5.54 0.11 -1.90 0.29 132.00 143.03 1ggy h PRO 289 Ca -0.42 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1ggy h PRO 289 Cb 1.21 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1ggy h PRO 289 CO 0.89 0.00 0.00 0.77 -0.21 0.00 0.00 178.00 179.45 1ggy h SER 290 N 0.00 0.00 0.77 -2.05 0.02 -1.90 -3.28 113.55 107.11 1ggy h SER 290 Ca 0.75 0.00 -0.25 0.00 -0.84 0.00 0.00 61.79 61.46 1ggy h SER 290 Cb 3.02 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 65.53 1ggy h SER 290 CO -0.02 0.00 -1.27 0.00 -1.14 0.00 0.00 176.83 174.41 1ggy h ALA 291 N 2.34 0.41 -2.11 3.77 0.00 -0.71 -3.42 119.26 119.53 1ggy h ALA 291 Ca 0.00 -1.07 -0.61 0.00 0.00 0.00 0.00 54.91 53.24 1ggy h ALA 291 Cb 0.61 0.07 0.07 0.00 0.00 0.00 0.00 17.79 18.54 1ggy h ALA 291 CO 0.00 1.28 0.57 0.91 0.00 0.00 0.00 179.25 182.01 1ggy n TRP 292 N -3.31 1.93 0.78 0.00 7.02 -1.24 -4.83 117.44 117.78 1ggy n TRP 292 Ca -0.07 0.47 0.10 0.00 -1.02 0.00 0.00 57.50 56.98 1ggy n TRP 292 Cb 0.99 -2.43 -0.10 0.00 -2.42 0.00 0.00 31.31 27.35 1ggy n TRP 292 CO 0.00 0.00 0.00 0.25 -2.02 0.00 0.00 177.69 175.92 1ggy n THR 293 N 2.29 0.01 0.00 -0.99 -2.24 -1.26 -5.04 114.28 107.05 1ggy n THR 293 Ca 0.15 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 1ggy n THR 293 Cb 0.28 0.71 0.00 0.00 -2.10 0.00 0.00 70.33 69.22 1ggy n THR 293 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ggy n GLY 294 N 1.44 -1.04 0.27 3.38 0.00 -1.26 -2.29 105.19 105.70 1ggy n GLY 294 Ca 0.02 -1.05 -0.08 0.00 0.00 0.00 0.00 46.02 44.92 1ggy n GLY 294 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1ggy h SER 295 N 0.00 0.83 -0.50 1.61 0.02 -1.08 -3.37 113.55 111.05 1ggy h SER 295 Ca 0.00 -0.28 0.09 0.00 -0.84 0.00 0.00 61.79 60.76 1ggy h SER 295 Cb 0.00 -0.23 -0.10 0.00 0.14 0.00 0.00 62.40 62.21 1ggy h SER 295 CO 0.00 1.00 -0.32 0.58 -1.14 0.00 0.00 176.83 176.95 1ggy h VAL 296 N 0.73 0.21 -0.06 2.27 2.07 -1.76 -2.24 116.25 117.46 1ggy h VAL 296 Ca 0.11 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.66 1ggy h VAL 296 Cb 0.69 0.21 -0.06 0.00 -1.52 0.00 0.00 31.29 30.61 1ggy h VAL 296 CO 0.05 0.00 -0.44 0.44 0.02 0.00 0.00 177.57 177.64 1ggy h ASP 297 N -0.19 -1.37 0.07 0.57 3.32 -1.97 -1.82 116.42 115.03 1ggy h ASP 297 Ca 0.21 0.17 0.00 0.00 0.02 0.00 0.00 57.03 57.43 1ggy h ASP 297 Cb 0.54 0.54 -0.02 0.00 0.22 0.00 0.00 39.33 40.61 1ggy h ASP 297 CO -0.61 -0.46 -0.19 0.40 -1.72 0.00 0.00 179.24 176.66 1ggy h ILE 298 N -0.56 0.00 -0.76 0.35 2.04 -1.70 0.18 117.51 117.07 1ggy h ILE 298 Ca 0.05 0.00 0.17 0.00 1.00 0.00 0.00 64.86 66.08 1ggy h ILE 298 Cb 0.66 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 36.62 1ggy h ILE 298 CO -0.36 0.00 0.21 -0.07 0.00 0.00 0.00 178.15 177.93 1ggy h LEU 299 N -0.29 0.07 -0.30 1.44 3.38 -1.39 0.28 115.31 118.51 1ggy h LEU 299 Ca -0.01 0.15 -0.15 0.00 0.09 0.00 0.00 57.88 57.96 1ggy h LEU 299 Cb 0.29 0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.22 1ggy h LEU 299 CO -0.09 -0.03 -0.38 -0.07 0.09 0.00 0.00 178.44 177.96 1ggy h LEU 300 N 0.30 0.85 -1.77 1.67 3.38 -1.18 -1.56 115.31 116.99 1ggy h LEU 300 Ca 0.44 -0.50 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 1ggy h LEU 300 Cb 0.76 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.26 1ggy h LEU 300 CO -0.51 1.18 -0.13 -0.08 0.09 0.00 0.00 178.44 178.99 1ggy h GLU 301 N 0.54 0.00 -0.07 1.13 4.22 0.68 -0.11 114.58 120.97 1ggy h GLU 301 Ca 0.04 0.00 -0.06 0.00 0.08 0.00 0.00 59.36 59.41 1ggy h GLU 301 Cb 0.97 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.23 1ggy h GLU 301 CO 0.09 0.13 -0.21 -0.92 -2.18 0.00 0.00 179.01 175.92 1ggy h TYR 302 N 0.00 0.34 -0.47 0.92 3.20 -0.19 -2.87 116.97 117.91 1ggy h TYR 302 Ca -0.00 -0.14 0.06 0.00 3.14 0.00 0.00 58.73 61.79 1ggy h TYR 302 Cb 0.24 -0.06 -0.05 0.00 1.54 0.00 0.00 36.73 38.40 1ggy h TYR 302 CO 0.00 0.82 0.19 -0.09 -1.64 0.00 0.00 178.16 177.44 1ggy h ARG 303 N -0.24 0.37 0.00 1.82 9.65 -0.27 0.74 114.38 126.45 1ggy h ARG 303 Ca -0.01 -0.02 -0.06 0.00 -1.10 0.00 0.00 59.98 58.79 1ggy h ARG 303 Cb 0.83 -0.08 -0.01 0.00 -1.39 0.00 0.00 29.97 29.32 1ggy h ARG 303 CO 0.04 0.24 -0.28 0.77 2.80 0.00 0.00 179.97 183.55 1ggy h SER 304 N 0.38 0.00 0.00 -3.80 0.02 -1.10 -3.18 113.55 105.87 1ggy h SER 304 Ca 0.22 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.16 1ggy h SER 304 Cb 0.20 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.74 1ggy h SER 304 CO -0.20 0.28 -1.78 -1.54 -1.14 0.00 0.00 176.83 172.45 1ggy n SER 305 N -4.08 1.14 -1.80 3.07 3.41 -0.95 -4.96 113.62 109.45 1ggy n SER 305 Ca -0.02 0.00 -0.20 0.00 -0.26 0.00 0.00 58.87 58.39 1ggy n SER 305 Cb 0.34 1.75 -0.06 0.00 -0.26 0.00 0.00 64.21 65.98 1ggy n SER 305 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1ggy n GLU 306 N -2.10 -1.52 -4.17 4.33 1.02 0.25 -4.94 120.64 113.52 1ggy n GLU 306 Ca -0.04 1.10 -0.18 0.00 -0.02 0.00 0.00 57.16 58.03 1ggy n GLU 306 Cb 0.45 -5.55 -0.12 0.00 -0.02 0.00 0.00 31.44 26.20 1ggy n GLU 306 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 1ggy s ASN 307 N -2.50 1.63 0.19 1.62 0.01 -1.24 -5.06 114.94 109.58 1ggy s ASN 307 Ca 0.00 -0.61 -0.33 0.00 -0.71 0.00 0.00 52.86 51.21 1ggy s ASN 307 Cb 0.00 -0.04 -0.13 0.00 0.41 0.00 0.00 41.25 41.49 1ggy s ASN 307 CO 0.00 -0.08 1.68 -2.65 -1.51 0.00 0.00 177.10 174.53 1ggy n PRO 308 N 1.30 2.56 -2.65 -0.60 -0.02 -1.22 -4.65 135.00 129.72 1ggy n PRO 308 Ca -0.21 0.92 -0.41 0.00 -2.02 0.00 0.00 63.50 61.78 1ggy n PRO 308 Cb 0.54 -2.75 -0.04 0.00 -0.02 0.00 0.00 33.50 31.23 1ggy n PRO 308 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1ggy s VAL 309 N 1.12 4.29 -0.11 -1.45 1.01 0.54 -4.76 120.40 121.04 1ggy s VAL 309 Ca 0.77 1.91 0.01 0.00 0.00 0.00 0.00 61.98 64.67 1ggy s VAL 309 Cb -0.56 -4.22 -0.01 0.00 0.00 0.00 0.00 36.38 31.58 1ggy s VAL 309 CO 0.34 0.29 -0.15 -0.13 0.00 0.00 0.00 175.10 175.45 1ggy s ARG 310 N -0.05 3.16 0.26 2.72 0.52 -1.26 -0.12 118.95 124.17 1ggy s ARG 310 Ca 0.48 -0.72 0.03 0.00 -0.52 0.00 0.00 55.73 55.00 1ggy s ARG 310 Cb -0.25 -2.52 -0.05 0.00 0.52 0.00 0.00 34.95 32.64 1ggy s ARG 310 CO 0.31 0.28 0.03 0.71 0.02 0.00 0.00 175.30 176.65 1ggy s TYR 311 N 0.15 1.68 0.11 -0.53 2.02 -0.33 -0.98 117.35 119.46 1ggy s TYR 311 Ca -0.08 -0.96 0.00 0.00 -0.37 0.00 0.00 57.07 55.66 1ggy s TYR 311 Cb -0.15 -1.01 -0.04 0.00 -0.40 0.00 0.00 41.96 40.36 1ggy s TYR 311 CO 0.05 -0.06 0.00 0.20 -1.57 0.00 0.00 175.55 174.17 1ggy s GLY 312 N -3.36 0.87 0.09 0.71 0.00 -0.53 -3.90 107.32 101.20 1ggy s GLY 312 Ca 0.32 -1.41 -0.03 0.00 0.00 0.00 0.00 44.72 43.60 1ggy s GLY 312 CO 0.11 -1.40 0.06 1.20 0.00 0.00 0.00 173.10 173.07 1ggy s GLN 313 N -3.95 0.78 0.14 2.90 -0.21 -1.26 -2.33 119.66 115.72 1ggy s GLN 313 Ca 0.18 -1.22 0.09 0.00 0.02 0.00 0.00 55.36 54.43 1ggy s GLN 313 Cb 0.07 0.26 0.50 0.00 1.00 0.00 0.00 33.01 34.84 1ggy s GLN 313 CO -0.02 -0.20 0.56 0.00 -2.12 0.00 0.00 175.29 173.51 1ggy h TRP 315 N 0.00 0.17 -0.11 0.00 0.09 -1.97 -2.27 115.95 111.87 1ggy h TRP 315 Ca 0.31 -0.13 -0.18 0.00 0.09 0.00 0.00 58.89 58.98 1ggy h TRP 315 Cb 0.88 -0.01 -0.00 0.00 0.08 0.00 0.00 29.16 30.11 1ggy h TRP 315 CO -0.00 1.09 -0.69 0.28 0.09 0.00 0.00 178.44 179.21 1ggy h VAL 316 N 0.03 1.35 -0.46 0.12 2.07 -0.98 0.11 116.25 118.48 1ggy h VAL 316 Ca -0.05 -2.04 -0.13 0.00 0.82 0.00 0.00 66.70 65.30 1ggy h VAL 316 Cb 1.83 2.02 -0.01 0.00 -1.52 0.00 0.00 31.29 33.60 1ggy h VAL 316 CO 0.15 0.62 -0.23 -0.26 0.02 0.00 0.00 177.57 177.88 1ggy h PHE 317 N 0.34 1.11 -0.02 1.57 0.04 -1.56 -2.23 116.94 116.19 1ggy h PHE 317 Ca -0.02 -0.27 -0.15 0.00 2.80 0.00 0.00 57.97 60.32 1ggy h PHE 317 Cb 1.26 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 39.14 1ggy h PHE 317 CO 0.05 1.09 -0.69 0.00 -0.60 0.00 0.00 178.31 178.16 1ggy h ALA 318 N 0.90 0.82 0.59 2.45 0.00 -1.32 -2.25 119.26 120.45 1ggy h ALA 318 Ca 0.11 -0.61 -0.03 0.00 0.00 0.00 0.00 54.91 54.37 1ggy h ALA 318 Cb 0.80 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.50 1ggy h ALA 318 CO 0.07 0.83 -0.28 0.78 0.00 0.00 0.00 179.25 180.64 1ggy h GLY 319 N 1.86 -0.82 -0.09 0.00 0.00 -0.64 -2.33 103.07 101.06 1ggy h GLY 319 Ca -0.01 0.31 0.15 0.00 0.00 0.00 0.00 47.33 47.77 1ggy h GLY 319 CO 0.10 -0.30 0.12 -2.08 0.00 0.00 0.00 176.54 174.37 1ggy h VAL 320 N -1.10 0.50 -0.04 4.60 2.07 -1.48 0.55 116.25 121.35 1ggy h VAL 320 Ca -0.08 -0.07 -0.07 0.00 0.82 0.00 0.00 66.70 67.30 1ggy h VAL 320 Cb 0.60 0.26 -0.01 0.00 -1.52 0.00 0.00 31.29 30.63 1ggy h VAL 320 CO 0.13 0.04 -0.30 0.15 0.02 0.00 0.00 177.57 177.62 1ggy h PHE 321 N 0.21 0.07 -0.10 1.57 3.57 -1.47 -1.08 116.94 119.71 1ggy h PHE 321 Ca 0.39 -0.01 -0.16 0.00 3.53 0.00 0.00 57.97 61.72 1ggy h PHE 321 Cb 0.66 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.37 1ggy h PHE 321 CO -0.30 0.36 -0.61 -0.97 -2.23 0.00 0.00 178.31 174.55 1ggy h ASN 322 N 0.06 0.40 -0.17 0.41 -1.24 -0.34 -0.79 115.58 113.91 1ggy h ASN 322 Ca 0.01 -0.23 -0.02 0.00 0.71 0.00 0.00 56.30 56.77 1ggy h ASN 322 Cb 0.56 -0.12 -0.01 0.00 0.73 0.00 0.00 38.32 39.48 1ggy h ASN 322 CO 0.04 0.92 0.04 0.74 -1.29 0.00 0.00 177.43 177.87 1ggy h THR 323 N 0.26 1.21 0.14 -3.57 2.02 -0.79 -2.43 112.91 109.76 1ggy h THR 323 Ca -0.01 -0.66 0.00 0.00 0.77 0.00 0.00 66.41 66.52 1ggy h THR 323 Cb 1.14 1.32 -0.02 0.00 -1.74 0.00 0.00 68.15 68.85 1ggy h THR 323 CO 0.10 0.20 -0.31 0.15 0.37 0.00 0.00 175.52 176.04 1ggy h PHE 324 N 0.08 -0.87 -0.35 3.16 3.04 -0.82 -0.16 116.94 121.02 1ggy h PHE 324 Ca 0.05 0.02 0.08 0.00 3.98 0.00 0.00 57.97 62.10 1ggy h PHE 324 Cb 0.27 0.36 -0.08 0.00 2.56 0.00 0.00 35.95 39.06 1ggy h PHE 324 CO 0.01 -0.36 -0.19 -0.07 -2.02 0.00 0.00 178.31 175.67 1ggy h LEU 325 N -0.49 -0.65 -0.94 0.59 3.38 -1.19 -2.42 115.31 113.59 1ggy h LEU 325 Ca -0.01 0.14 -0.05 0.00 0.09 0.00 0.00 57.88 58.04 1ggy h LEU 325 Cb 0.46 0.34 -0.03 0.00 0.09 0.00 0.00 40.66 41.53 1ggy h LEU 325 CO -0.13 -0.23 0.15 0.03 0.09 0.00 0.00 178.44 178.36 1ggy h ARG 326 N -0.14 0.93 -0.07 1.13 3.08 -1.34 0.14 114.38 118.12 1ggy h ARG 326 Ca 0.18 -0.19 -0.02 0.00 0.07 0.00 0.00 59.98 60.02 1ggy h ARG 326 Cb 0.41 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.32 1ggy h ARG 326 CO -0.44 0.82 -0.04 0.00 -1.07 0.00 0.00 179.97 179.25 1ggy n LEU 328 N -4.44 1.61 0.00 0.00 4.77 -1.05 -4.95 117.00 112.94 1ggy n LEU 328 Ca -0.02 -0.52 0.00 0.00 -0.03 0.00 0.00 56.01 55.44 1ggy n LEU 328 Cb 0.15 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.20 1ggy n LEU 328 CO 0.35 0.28 0.00 0.61 -1.33 0.00 0.00 177.39 177.30 1ggy n GLY 329 N 1.29 0.92 3.64 -0.72 0.00 -0.33 -1.86 105.19 108.13 1ggy n GLY 329 Ca 0.14 -0.06 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 1ggy n GLY 329 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ggy s ILE 330 N -2.00 5.26 0.06 -0.61 1.01 0.47 -4.36 121.20 121.03 1ggy s ILE 330 Ca 0.00 0.43 -0.31 0.00 0.00 0.00 0.00 60.65 60.76 1ggy s ILE 330 Cb 0.00 -3.62 -0.10 0.00 0.01 0.00 0.00 42.46 38.74 1ggy s ILE 330 CO 0.00 0.25 1.88 -2.65 0.00 0.00 0.00 174.94 174.42 1ggy n PRO 331 N 4.76 2.69 -3.81 2.79 -0.02 -1.26 -3.01 135.00 137.14 1ggy n PRO 331 Ca -0.11 0.98 -0.12 0.00 -2.02 0.00 0.00 63.50 62.22 1ggy n PRO 331 Cb 0.51 -2.88 -0.09 0.00 -0.02 0.00 0.00 33.50 31.02 1ggy n PRO 331 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ggy s ALA 332 N 3.48 -0.59 -0.01 3.55 0.00 -0.89 -0.40 121.76 126.90 1ggy s ALA 332 Ca 0.86 0.15 -0.09 0.00 0.00 0.00 0.00 51.96 52.88 1ggy s ALA 332 Cb -0.51 0.07 0.01 0.00 0.00 0.00 0.00 23.12 22.69 1ggy s ALA 332 CO 0.41 -0.23 0.18 -0.98 0.00 0.00 0.00 175.76 175.14 1ggy s ARG 333 N -1.30 0.49 0.32 0.00 1.70 0.05 -4.77 118.95 115.45 1ggy s ARG 333 Ca -0.14 -0.28 -0.18 0.00 -0.47 0.00 0.00 55.73 54.67 1ggy s ARG 333 Cb -0.06 0.21 -0.09 0.00 -0.57 0.00 0.00 34.95 34.44 1ggy s ARG 333 CO 0.03 -0.12 0.78 0.42 -1.08 0.00 0.00 175.30 175.33 1ggy s ILE 334 N -1.20 4.58 0.00 4.99 1.01 -1.26 -0.67 121.20 128.65 1ggy s ILE 334 Ca -0.13 1.17 0.02 0.00 0.00 0.00 0.00 60.65 61.70 1ggy s ILE 334 Cb -0.06 -3.69 -0.01 0.00 0.01 0.00 0.00 42.46 38.71 1ggy s ILE 334 CO 0.02 -0.10 -0.06 -0.69 0.00 0.00 0.00 174.94 174.11 1ggy s VAL 335 N -1.89 0.43 -0.13 2.92 1.01 0.04 -4.56 120.40 118.21 1ggy s VAL 335 Ca 0.53 -0.36 0.01 0.00 0.00 0.00 0.00 61.98 62.15 1ggy s VAL 335 Cb -0.12 -0.39 -0.01 0.00 0.00 0.00 0.00 36.38 35.87 1ggy s VAL 335 CO 0.18 0.03 -0.17 -0.89 0.00 0.00 0.00 175.10 174.25 1ggy s THR 336 N -0.33 2.66 -0.15 3.92 2.01 0.64 -1.44 115.64 122.95 1ggy s THR 336 Ca -0.00 -0.79 -0.06 0.00 0.31 0.00 0.00 61.69 61.15 1ggy s THR 336 Cb -0.03 -2.10 -0.04 0.00 0.01 0.00 0.00 72.50 70.34 1ggy s THR 336 CO -0.00 0.53 0.05 0.21 -0.69 0.00 0.00 174.62 174.72 1ggy s ASN 337 N 0.53 5.58 -0.20 3.53 2.47 -0.52 -0.44 114.94 125.89 1ggy s ASN 337 Ca -0.11 0.13 -0.13 0.00 0.42 0.00 0.00 52.86 53.17 1ggy s ASN 337 Cb -0.16 -1.87 -0.05 0.00 -1.45 0.00 0.00 41.25 37.73 1ggy s ASN 337 CO 0.04 0.24 0.27 -0.31 -3.72 0.00 0.00 177.10 173.63 1ggy s TYR 338 N -0.05 3.38 -0.36 0.43 2.02 0.53 -1.60 117.35 121.70 1ggy s TYR 338 Ca 0.06 0.46 -0.11 0.00 -0.37 0.00 0.00 57.07 57.11 1ggy s TYR 338 Cb -0.12 -2.36 0.01 0.00 -0.40 0.00 0.00 41.96 39.09 1ggy s TYR 338 CO 0.01 0.11 0.48 1.19 -1.57 0.00 0.00 175.55 175.76 1ggy n PHE 339 N 4.09 -2.70 -3.82 2.71 3.72 -0.74 -2.01 117.46 118.70 1ggy n PHE 339 Ca -0.12 1.09 -0.35 0.00 -0.05 0.00 0.00 57.45 58.02 1ggy n PHE 339 Cb 0.52 -3.53 -0.09 0.00 -0.94 0.00 0.00 39.48 35.43 1ggy n PHE 339 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1ggy s SER 340 N -2.30 5.99 -1.24 4.37 0.15 -0.07 -1.71 113.70 118.89 1ggy s SER 340 Ca 0.18 0.16 -0.10 0.00 0.70 0.00 0.00 55.95 56.90 1ggy s SER 340 Cb -0.05 -2.05 0.19 0.00 -1.71 0.00 0.00 66.02 62.40 1ggy s SER 340 CO 0.60 0.16 1.72 0.00 1.20 0.00 0.00 173.24 176.93 1ggy n ALA 341 N 3.61 5.02 -1.75 5.45 0.00 -1.06 -0.82 120.51 130.96 1ggy n ALA 341 Ca -0.16 -4.37 -0.40 0.00 0.00 0.00 0.00 53.44 48.50 1ggy n ALA 341 Cb 0.52 -2.90 -0.05 0.00 0.00 0.00 0.00 19.45 17.02 1ggy n ALA 341 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1ggy s HIS 342 N 0.18 3.81 0.00 0.00 5.04 -1.26 -3.21 115.29 119.84 1ggy s HIS 342 Ca 0.39 1.82 0.00 0.00 -1.54 0.00 0.00 55.06 55.73 1ggy s HIS 342 Cb 0.06 -3.11 0.00 0.00 0.04 0.00 0.00 32.58 29.57 1ggy s HIS 342 CO 0.01 0.02 0.00 -0.25 -2.34 0.00 0.00 174.74 172.18 1ggy n ASP 343 N 1.35 -1.21 0.25 9.88 8.00 -1.26 -4.94 116.55 128.62 1ggy n ASP 343 Ca -0.02 0.00 0.07 0.00 0.71 0.00 0.00 54.79 55.56 1ggy n ASP 343 Cb 0.46 -0.48 0.60 0.00 -0.02 0.00 0.00 41.12 41.68 1ggy n ASP 343 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 1ggy h ASN 344 N 0.00 0.00 -4.52 -2.24 7.08 -1.86 -3.46 115.58 110.57 1ggy h ASN 344 Ca 0.00 0.00 -0.39 0.00 -3.08 0.00 0.00 56.30 52.83 1ggy h ASN 344 Cb 0.83 0.00 0.01 0.00 -2.08 0.00 0.00 38.32 37.08 1ggy h ASN 344 CO 0.00 0.08 -0.57 -0.67 -2.08 0.00 0.00 177.43 174.19 1ggy n ASP 345 N -4.39 -5.34 0.00 6.14 -0.08 -1.26 -0.55 116.55 111.07 1ggy n ASP 345 Ca -0.03 -0.25 0.00 0.00 -1.51 0.00 0.00 54.79 53.01 1ggy n ASP 345 Cb 0.16 -4.36 0.00 0.00 2.34 0.00 0.00 41.12 39.26 1ggy n ASP 345 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1ggy n ALA 346 N -3.29 0.00 -2.63 -1.67 0.00 -1.26 -4.86 120.51 106.79 1ggy n ALA 346 Ca -0.11 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 52.91 1ggy n ALA 346 Cb 0.61 -0.28 -0.04 0.00 0.00 0.00 0.00 19.45 19.73 1ggy n ALA 346 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1ggy s ASN 347 N -2.61 6.82 -0.03 0.00 0.01 0.28 0.48 114.94 119.88 1ggy s ASN 347 Ca 0.00 0.95 0.01 0.00 -0.71 0.00 0.00 52.86 53.11 1ggy s ASN 347 Cb 0.00 -2.45 0.06 0.00 0.41 0.00 0.00 41.25 39.27 1ggy s ASN 347 CO 0.00 -0.61 0.97 0.18 -1.51 0.00 0.00 177.10 176.13 1ggy n LEU 348 N 6.21 2.89 -3.84 0.60 4.77 0.11 -4.81 117.00 122.93 1ggy n LEU 348 Ca 0.06 -1.46 -0.12 0.00 -0.03 0.00 0.00 56.01 54.46 1ggy n LEU 348 Cb 0.47 -0.53 -0.11 0.00 -2.33 0.00 0.00 43.42 40.93 1ggy n LEU 348 CO 0.50 0.49 -0.15 -1.10 -1.33 0.00 0.00 177.39 175.80 1ggy s GLN 349 N -0.47 0.39 -0.12 3.23 -0.21 -1.26 -1.61 119.66 119.61 1ggy s GLN 349 Ca 0.05 -0.12 0.03 0.00 0.02 0.00 0.00 55.36 55.34 1ggy s GLN 349 Cb 0.04 0.17 0.01 0.00 1.00 0.00 0.00 33.01 34.23 1ggy s GLN 349 CO 0.01 -0.08 -0.21 1.41 -2.12 0.00 0.00 175.29 174.29 1ggy s MET 350 N -0.79 2.85 -0.21 2.91 1.75 0.17 -4.96 119.30 121.03 1ggy s MET 350 Ca -0.09 -0.80 -0.15 0.00 -1.25 0.00 0.00 55.69 53.40 1ggy s MET 350 Cb -0.05 -2.26 -0.04 0.00 2.84 0.00 0.00 34.83 35.32 1ggy s MET 350 CO 0.01 0.06 0.35 -0.51 -0.65 0.00 0.00 175.02 174.28 1ggy s ASP 351 N 0.65 6.37 -0.16 1.11 1.01 -1.26 -0.07 116.67 124.31 1ggy s ASP 351 Ca -0.12 0.43 0.00 0.00 0.71 0.00 0.00 52.55 53.57 1ggy s ASP 351 Cb -0.16 -2.21 0.00 0.00 1.01 0.00 0.00 42.92 41.56 1ggy s ASP 351 CO 0.03 -0.05 -0.16 -0.63 0.21 0.00 0.00 175.17 174.56 1ggy s ILE 352 N 1.28 2.51 -0.13 0.77 -1.09 -0.80 -4.71 121.20 119.04 1ggy s ILE 352 Ca 0.17 -0.81 -0.06 0.00 -2.23 0.00 0.00 60.65 57.71 1ggy s ILE 352 Cb -0.14 -2.06 -0.04 0.00 -1.58 0.00 0.00 42.46 38.64 1ggy s ILE 352 CO 0.07 0.52 0.09 -0.36 -1.23 0.00 0.00 174.94 174.02 1ggy s PHE 353 N 0.97 3.39 0.05 3.97 0.08 -1.26 -0.34 117.98 124.85 1ggy s PHE 353 Ca -0.03 0.32 0.06 0.00 0.12 0.00 0.00 56.93 57.40 1ggy s PHE 353 Cb -0.15 -1.95 -0.04 0.00 -0.57 0.00 0.00 43.02 40.32 1ggy s PHE 353 CO -0.03 0.50 -0.10 -0.51 -0.10 0.00 0.00 175.22 174.98 1ggy s LEU 354 N -0.57 3.01 0.77 -0.37 2.01 0.28 0.14 118.68 123.95 1ggy s LEU 354 Ca 0.11 -0.30 -0.12 0.00 0.01 0.00 0.00 54.13 53.84 1ggy s LEU 354 Cb -0.12 -1.77 0.06 0.00 0.01 0.00 0.00 46.19 44.37 1ggy s LEU 354 CO 0.02 0.23 1.11 -1.61 1.01 0.00 0.00 176.35 177.11 1ggy s GLU 355 N -1.75 2.29 0.34 1.70 0.41 0.16 -1.44 118.70 120.41 1ggy s GLU 355 Ca 0.18 0.49 0.06 0.00 -0.41 0.00 0.00 54.97 55.29 1ggy s GLU 355 Cb -0.11 -1.95 0.71 0.00 -1.78 0.00 0.00 34.13 31.00 1ggy s GLU 355 CO 0.10 -1.44 1.91 0.93 -0.49 0.00 0.00 175.26 176.27 1ggy h GLU 356 N -0.95 0.78 -1.54 1.61 5.08 -1.88 -1.97 114.58 115.70 1ggy h GLU 356 Ca -0.46 -0.05 -0.22 0.00 -1.00 0.00 0.00 59.36 57.63 1ggy h GLU 356 Cb 1.27 -0.18 -0.10 0.00 0.50 0.00 0.00 28.75 30.25 1ggy h GLU 356 CO 0.62 0.52 0.28 -0.40 -1.00 0.00 0.00 179.01 179.03 1ggy n ASP 357 N -4.51 5.61 0.00 1.42 5.68 -1.26 -4.88 116.55 118.60 1ggy n ASP 357 Ca 0.14 -2.81 0.00 0.00 -0.50 0.00 0.00 54.79 51.62 1ggy n ASP 357 Cb 0.31 -0.99 0.00 0.00 -1.14 0.00 0.00 41.12 39.29 1ggy n ASP 357 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ggy n GLY 358 N 0.56 2.23 3.42 6.12 0.00 -0.74 -5.01 105.19 111.78 1ggy n GLY 358 Ca 0.21 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.93 1ggy n GLY 358 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ggy n ASN 359 N 1.06 -1.77 -4.68 1.61 5.03 -1.26 -4.63 115.26 110.61 1ggy n ASN 359 Ca 0.00 -0.05 -0.38 0.00 0.87 0.00 0.00 54.58 55.02 1ggy n ASN 359 Cb 0.00 -1.18 -0.07 0.00 -1.02 0.00 0.00 39.78 37.50 1ggy n ASN 359 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 1ggy s VAL 360 N -2.37 5.23 -0.70 2.41 0.11 -1.26 0.37 120.40 124.19 1ggy s VAL 360 Ca 0.64 0.66 -0.26 0.00 -2.93 0.00 0.00 61.98 60.09 1ggy s VAL 360 Cb -0.21 -3.70 -0.03 0.00 -1.53 0.00 0.00 36.38 30.92 1ggy s VAL 360 CO 0.65 0.29 1.87 0.21 -3.33 0.00 0.00 175.10 174.79 1ggy s ASN 361 N 0.91 5.26 0.55 3.54 3.84 0.37 -4.74 114.94 124.67 1ggy s ASN 361 Ca 0.18 0.03 0.28 0.00 0.21 0.00 0.00 52.86 53.56 1ggy s ASN 361 Cb -0.14 -2.54 1.46 0.00 -0.55 0.00 0.00 41.25 39.48 1ggy s ASN 361 CO 0.07 -2.46 1.97 0.28 -2.79 0.00 0.00 177.10 174.17 1ggy h SER 362 N 13.82 0.00 0.34 -4.21 0.02 -1.93 -2.87 113.55 118.71 1ggy h SER 362 Ca -0.16 0.00 -0.32 0.00 -0.84 0.00 0.00 61.79 60.47 1ggy h SER 362 Cb 1.12 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.64 1ggy h SER 362 CO 1.22 0.00 -1.73 0.11 -1.14 0.00 0.00 176.83 175.28 1ggy h LYS 363 N 0.00 0.20 0.00 3.45 6.56 -1.96 -3.37 116.57 121.45 1ggy h LYS 363 Ca 0.25 -0.35 0.00 0.00 -1.06 0.00 0.00 60.65 59.49 1ggy h LYS 363 Cb 1.11 0.13 0.00 0.00 -0.57 0.00 0.00 32.23 32.90 1ggy h LYS 363 CO -0.00 1.02 0.00 -0.07 -2.06 0.00 0.00 179.45 178.33 1ggy h LEU 364 N 0.06 0.00 -8.05 2.94 3.38 -1.89 -3.41 115.31 108.34 1ggy h LEU 364 Ca -0.32 0.00 -0.71 0.00 0.09 0.00 0.00 57.88 56.94 1ggy h LEU 364 Cb 2.03 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 42.57 1ggy h LEU 364 CO 0.12 0.00 0.31 -0.89 0.09 0.00 0.00 178.44 178.07 1ggy s THR 365 N -3.13 4.94 -1.05 0.22 2.01 -1.14 -4.78 115.64 112.72 1ggy s THR 365 Ca 0.10 -1.42 0.08 0.00 0.31 0.00 0.00 61.69 60.76 1ggy s THR 365 Cb 0.11 -4.57 0.07 0.00 0.01 0.00 0.00 72.50 68.12 1ggy s THR 365 CO 0.61 -1.22 0.78 0.29 -0.69 0.00 0.00 174.62 174.39 1ggy n LYS 366 N 5.96 0.28 -3.65 4.92 4.76 -1.26 -4.97 118.16 124.20 1ggy n LYS 366 Ca 0.04 -1.04 -0.37 0.00 -2.87 0.00 0.00 58.31 54.07 1ggy n LYS 366 Cb 0.45 -1.16 -0.06 0.00 -1.84 0.00 0.00 35.03 32.41 1ggy n LYS 366 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1ggy s ASP 367 N -0.72 6.57 0.01 4.39 1.01 -1.26 -5.10 116.67 121.57 1ggy s ASP 367 Ca 0.10 0.68 0.01 0.00 0.71 0.00 0.00 52.55 54.05 1ggy s ASP 367 Cb 0.07 -2.17 -0.01 0.00 1.01 0.00 0.00 42.92 41.82 1ggy s ASP 367 CO 0.11 0.30 -0.03 -0.94 0.21 0.00 0.00 175.17 174.82 1ggy s SER 368 N -0.70 0.36 -0.03 0.27 1.04 -1.26 -4.96 113.70 108.42 1ggy s SER 368 Ca 0.19 -0.20 -0.19 0.00 0.48 0.00 0.00 55.95 56.22 1ggy s SER 368 Cb -0.14 0.00 -0.05 0.00 0.10 0.00 0.00 66.02 65.93 1ggy s SER 368 CO 0.08 -0.07 0.54 -0.69 0.98 0.00 0.00 173.24 174.08 1ggy s VAL 369 N -0.51 4.99 0.17 5.02 1.01 -1.26 -4.64 120.40 125.17 1ggy s VAL 369 Ca -0.04 1.12 -0.30 0.00 0.00 0.00 0.00 61.98 62.77 1ggy s VAL 369 Cb -0.04 -3.88 -0.07 0.00 0.00 0.00 0.00 36.38 32.39 1ggy s VAL 369 CO -0.00 0.42 1.00 0.26 0.00 0.00 0.00 175.10 176.78 1ggy s TRP 370 N -0.13 3.78 0.32 5.22 0.52 -0.00 -3.78 118.94 124.87 1ggy s TRP 370 Ca 0.29 1.77 0.04 0.00 0.02 0.00 0.00 56.10 58.22 1ggy s TRP 370 Cb -0.17 -3.11 0.66 0.00 -1.15 0.00 0.00 33.47 29.69 1ggy s TRP 370 CO 0.15 -0.00 1.86 -0.91 0.02 0.00 0.00 176.95 178.07 1ggy h ASN 371 N 5.02 0.81 -4.88 2.95 2.35 -0.65 -0.12 115.58 121.06 1ggy h ASN 371 Ca -0.44 0.04 -0.02 0.00 -0.55 0.00 0.00 56.30 55.33 1ggy h ASN 371 Cb 1.21 -0.13 -0.17 0.00 0.05 0.00 0.00 38.32 39.29 1ggy h ASN 371 CO 0.71 0.44 0.26 -0.72 -1.65 0.00 0.00 177.43 176.47 1ggy s TYR 372 N -5.83 -0.56 -0.19 1.19 1.13 -1.26 -1.80 117.35 110.03 1ggy s TYR 372 Ca -0.11 0.71 -0.07 0.00 -1.41 0.00 0.00 57.07 56.19 1ggy s TYR 372 Cb 0.22 0.48 0.08 0.00 -1.10 0.00 0.00 41.96 41.64 1ggy s TYR 372 CO 0.80 -0.66 0.41 -1.58 -2.51 0.00 0.00 175.55 172.01 1ggy s HIS 373 N -2.28 -0.74 0.34 -3.49 2.46 -0.63 -4.87 115.29 106.08 1ggy s HIS 373 Ca -0.04 1.45 0.02 0.00 0.47 0.00 0.00 55.06 56.95 1ggy s HIS 373 Cb -0.00 0.28 -0.03 0.00 -0.13 0.00 0.00 32.58 32.70 1ggy s HIS 373 CO -0.01 -0.44 0.52 0.00 -2.47 0.00 0.00 174.74 172.34 1ggy s TRP 375 N -2.27 0.12 0.32 0.00 -2.14 -0.52 -4.78 118.94 109.67 1ggy s TRP 375 Ca 0.40 -0.76 0.07 0.00 2.66 0.00 0.00 56.10 58.47 1ggy s TRP 375 Cb -0.09 0.79 -0.03 0.00 -3.10 0.00 0.00 33.47 31.03 1ggy s TRP 375 CO 0.35 -1.52 0.28 -0.80 -2.66 0.00 0.00 176.95 172.60 1ggy s ASN 376 N -3.06 5.39 -0.03 -2.66 -0.87 -0.58 -0.78 114.94 112.35 1ggy s ASN 376 Ca 0.16 -0.42 0.01 0.00 -1.57 0.00 0.00 52.86 51.03 1ggy s ASN 376 Cb -0.05 -1.09 0.03 0.00 -0.02 0.00 0.00 41.25 40.12 1ggy s ASN 376 CO 0.11 -0.29 -0.01 -1.61 -2.57 0.00 0.00 177.10 172.73 1ggy s GLU 377 N -3.97 0.45 -0.04 -0.60 2.02 0.16 -1.35 118.70 115.36 1ggy s GLU 377 Ca 0.39 0.03 0.05 0.00 0.02 0.00 0.00 54.97 55.46 1ggy s GLU 377 Cb -0.06 -0.58 -0.01 0.00 0.10 0.00 0.00 34.13 33.58 1ggy s GLU 377 CO 0.26 -0.12 -0.18 0.00 0.02 0.00 0.00 175.26 175.25 1ggy s ALA 378 N 1.00 1.56 -0.06 5.21 0.00 -0.24 -0.77 121.76 128.46 1ggy s ALA 378 Ca -0.10 -0.72 -0.21 0.00 0.00 0.00 0.00 51.96 50.92 1ggy s ALA 378 Cb -0.14 -0.50 -0.04 0.00 0.00 0.00 0.00 23.12 22.44 1ggy s ALA 378 CO -0.01 0.30 0.61 -0.46 0.00 0.00 0.00 175.76 176.20 1ggy s TRP 379 N -0.04 3.59 0.03 0.00 -0.11 0.46 -1.05 118.94 121.81 1ggy s TRP 379 Ca -0.02 1.14 -0.29 0.00 1.22 0.00 0.00 56.10 58.15 1ggy s TRP 379 Cb -0.11 -2.68 0.11 0.00 -1.50 0.00 0.00 33.47 29.28 1ggy s TRP 379 CO 0.02 0.18 1.21 0.00 -4.62 0.00 0.00 176.95 173.74 1ggy s MET 380 N 0.48 0.59 0.65 5.86 0.23 -0.85 -4.39 119.30 121.87 1ggy s MET 380 Ca 0.33 -0.33 -0.01 0.00 -1.03 0.00 0.00 55.69 54.65 1ggy s MET 380 Cb -0.17 0.20 0.08 0.00 -1.53 0.00 0.00 34.83 33.41 1ggy s MET 380 CO 0.16 -0.27 0.90 0.95 -2.03 0.00 0.00 175.02 174.73 1ggy s THR 381 N -2.63 2.38 -0.46 3.16 -4.23 -0.83 -1.43 115.64 111.60 1ggy s THR 381 Ca 0.14 -0.58 0.06 0.00 -1.18 0.00 0.00 61.69 60.13 1ggy s THR 381 Cb 0.03 -2.79 0.22 0.00 1.34 0.00 0.00 72.50 71.30 1ggy s THR 381 CO -0.02 0.00 0.51 0.54 -0.54 0.00 0.00 174.62 175.10 1ggy n ARG 382 N -2.64 0.94 0.26 3.99 5.12 -1.26 -4.88 116.66 118.19 1ggy n ARG 382 Ca 0.11 -3.53 0.15 0.00 -1.93 0.00 0.00 57.85 52.66 1ggy n ARG 382 Cb 0.60 -1.57 0.82 0.00 -1.16 0.00 0.00 32.46 31.15 1ggy n ARG 382 CO 0.00 0.00 0.00 -1.35 -1.93 0.00 0.00 177.63 174.35 1ggy h PRO 383 N 4.54 0.00 0.00 5.56 0.11 -1.97 -0.84 132.00 139.40 1ggy h PRO 383 Ca 0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.26 1ggy h PRO 383 Cb 0.84 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.95 1ggy h PRO 383 CO 0.51 0.00 -0.52 -0.40 -0.21 0.00 0.00 178.00 177.38 1ggy n ASP 384 N -2.63 0.65 -4.76 -2.05 5.75 -1.26 -4.92 116.55 107.34 1ggy n ASP 384 Ca -0.02 0.13 -0.23 0.00 -0.01 0.00 0.00 54.79 54.66 1ggy n ASP 384 Cb 0.16 0.06 -0.06 0.00 -1.03 0.00 0.00 41.12 40.24 1ggy n ASP 384 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1ggy s LEU 385 N -4.04 3.24 1.13 -2.12 1.43 -0.32 -5.07 118.68 112.93 1ggy s LEU 385 Ca 0.08 -0.85 -0.14 0.00 -1.03 0.00 0.00 54.13 52.18 1ggy s LEU 385 Cb 0.14 -1.71 0.26 0.00 0.03 0.00 0.00 46.19 44.91 1ggy s LEU 385 CO 0.70 -0.42 1.05 -2.84 0.23 0.00 0.00 176.35 175.07 1ggy s PRO 386 N -3.91 -0.64 0.46 1.29 0.02 -1.26 -4.94 135.00 126.02 1ggy s PRO 386 Ca 0.40 0.53 -0.25 0.00 0.02 0.00 0.00 61.00 61.70 1ggy s PRO 386 Cb -0.01 -1.61 -0.08 0.00 0.02 0.00 0.00 34.50 32.82 1ggy s PRO 386 CO 0.23 -3.46 1.42 0.54 -0.33 0.00 0.00 177.00 175.40 1ggy s VAL 387 N -2.71 2.10 0.00 3.83 0.11 -1.26 -3.54 120.40 118.93 1ggy s VAL 387 Ca 0.67 0.09 0.00 0.00 -2.93 0.00 0.00 61.98 59.81 1ggy s VAL 387 Cb -0.20 -3.05 0.00 0.00 -1.53 0.00 0.00 36.38 31.60 1ggy s VAL 387 CO 0.61 0.01 0.00 0.61 -3.33 0.00 0.00 175.10 173.00 1ggy n GLY 388 N 0.59 0.52 1.65 6.54 0.00 -1.26 -4.94 105.19 108.29 1ggy n GLY 388 Ca 0.05 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.15 1ggy n GLY 388 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1ggy n PHE 389 N -2.00 1.65 0.00 1.61 3.72 -1.23 -4.93 117.46 116.27 1ggy n PHE 389 Ca 0.00 -0.61 0.00 0.00 -0.05 0.00 0.00 57.45 56.79 1ggy n PHE 389 Cb 0.00 -0.34 0.00 0.00 -0.94 0.00 0.00 39.48 38.20 1ggy n PHE 389 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ggy n GLY 390 N 0.89 -0.41 4.72 1.37 0.00 -1.26 -4.60 105.19 105.89 1ggy n GLY 390 Ca 0.25 -1.59 0.00 0.00 0.00 0.00 0.00 46.02 44.68 1ggy n GLY 390 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ggy n GLY 391 N 4.94 0.17 3.77 -0.02 0.00 -0.51 -4.83 105.19 108.71 1ggy n GLY 391 Ca 0.00 -1.25 -0.38 0.00 0.00 0.00 0.00 46.02 44.38 1ggy n GLY 391 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1ggy s TRP 392 N 0.00 3.28 -0.06 1.61 0.52 -1.26 -2.00 118.94 121.02 1ggy s TRP 392 Ca 0.00 1.62 0.03 0.00 0.02 0.00 0.00 56.10 57.78 1ggy s TRP 392 Cb 0.00 -3.28 0.00 0.00 -1.15 0.00 0.00 33.47 29.04 1ggy s TRP 392 CO 0.00 -0.89 -0.17 -0.65 0.02 0.00 0.00 176.95 175.26 1ggy s GLN 393 N -2.11 2.01 -0.05 4.98 -1.52 -0.22 -2.65 119.66 120.11 1ggy s GLN 393 Ca 0.53 -0.58 -0.26 0.00 -1.95 0.00 0.00 55.36 53.10 1ggy s GLN 393 Cb -0.28 -1.65 -0.03 0.00 -0.22 0.00 0.00 33.01 30.83 1ggy s GLN 393 CO 0.36 0.14 0.81 0.00 -0.25 0.00 0.00 175.29 176.35 1ggy s ALA 394 N 0.36 3.29 -0.20 6.09 0.00 0.05 -1.08 121.76 130.28 1ggy s ALA 394 Ca -0.12 0.27 -0.03 0.00 0.00 0.00 0.00 51.96 52.09 1ggy s ALA 394 Cb -0.15 -3.12 0.06 0.00 0.00 0.00 0.00 23.12 19.91 1ggy s ALA 394 CO 0.04 -0.20 0.05 0.08 0.00 0.00 0.00 175.76 175.73 1ggy s VAL 395 N 1.01 0.45 -0.25 0.00 1.01 -0.46 -0.48 120.40 121.69 1ggy s VAL 395 Ca 0.43 -0.55 -0.09 0.00 0.00 0.00 0.00 61.98 61.77 1ggy s VAL 395 Cb -0.19 -1.00 -0.04 0.00 0.00 0.00 0.00 36.38 35.15 1ggy s VAL 395 CO 0.21 -0.25 0.11 -0.62 0.00 0.00 0.00 175.10 174.56 1ggy s ASP 396 N 1.89 5.57 0.00 3.32 -1.08 0.17 -1.52 116.67 125.01 1ggy s ASP 396 Ca -0.00 -0.08 0.23 0.00 -0.52 0.00 0.00 52.55 52.19 1ggy s ASP 396 Cb -0.17 -2.01 0.45 0.00 -1.46 0.00 0.00 42.92 39.74 1ggy s ASP 396 CO -0.09 -0.00 1.41 -1.54 0.52 0.00 0.00 175.17 175.47 1ggy n SER 397 N 4.72 2.99 -4.47 -0.34 3.41 -1.26 -0.93 113.62 117.74 1ggy n SER 397 Ca -0.15 -1.93 -0.43 0.00 -0.26 0.00 0.00 58.87 56.09 1ggy n SER 397 Cb 0.52 -0.16 -0.07 0.00 -0.26 0.00 0.00 64.21 64.24 1ggy n SER 397 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1ggy s THR 398 N -1.68 4.88 0.98 6.66 2.01 -1.26 -4.60 115.64 122.62 1ggy s THR 398 Ca 0.35 -0.32 -0.14 0.00 0.31 0.00 0.00 61.69 61.89 1ggy s THR 398 Cb 0.21 -4.25 0.04 0.00 0.01 0.00 0.00 72.50 68.51 1ggy s THR 398 CO 0.31 -0.72 0.33 -0.81 -0.69 0.00 0.00 174.62 173.04 1ggy n PRO 399 N 6.15 -0.48 -3.60 4.92 -0.04 -1.26 -4.73 135.00 135.96 1ggy n PRO 399 Ca -0.05 -0.10 -0.03 0.00 -0.04 0.00 0.00 63.50 63.27 1ggy n PRO 399 Cb 0.46 -1.82 -0.02 0.00 -0.04 0.00 0.00 33.50 32.08 1ggy n PRO 399 CO 0.00 0.00 0.00 1.14 -0.04 0.00 0.00 175.50 176.60 1ggy s GLN 400 N -3.59 0.29 -0.36 0.54 -2.07 -0.48 -4.86 119.66 109.14 1ggy s GLN 400 Ca 0.56 -0.12 -0.28 0.00 -1.82 0.00 0.00 55.36 53.70 1ggy s GLN 400 Cb -0.20 0.13 -0.01 0.00 -1.09 0.00 0.00 33.01 31.84 1ggy s GLN 400 CO 0.68 -0.13 1.67 -1.21 -1.32 0.00 0.00 175.29 174.98 1ggy s GLU 401 N -2.38 3.41 0.00 9.60 0.41 -1.26 -1.94 118.70 126.53 1ggy s GLU 401 Ca 0.10 1.26 0.00 0.00 -0.41 0.00 0.00 54.97 55.93 1ggy s GLU 401 Cb -0.00 -4.14 0.00 0.00 -1.78 0.00 0.00 34.13 28.21 1ggy s GLU 401 CO -0.04 -1.76 0.00 0.27 -0.49 0.00 0.00 175.26 173.23 1ggy n ASN 402 N 9.81 1.02 -0.16 -0.19 0.23 -1.26 -4.61 115.26 120.10 1ggy n ASN 402 Ca 0.21 0.00 -0.07 0.00 -0.53 0.00 0.00 54.58 54.18 1ggy n ASN 402 Cb 0.47 0.00 0.01 0.00 -2.08 0.00 0.00 39.78 38.19 1ggy n ASN 402 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1ggy h SER 403 N 0.00 0.55 1.01 0.53 0.02 -1.98 -1.33 113.55 112.35 1ggy h SER 403 Ca 0.00 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1ggy h SER 403 Cb 0.00 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 62.40 1ggy h SER 403 CO 0.00 0.41 0.00 0.44 -1.14 0.00 0.00 176.83 176.54 1ggy h ASP 404 N 0.64 0.00 -2.80 3.07 5.19 -1.97 -3.48 116.42 117.07 1ggy h ASP 404 Ca 0.17 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.58 1ggy h ASP 404 Cb -0.06 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.45 1ggy h ASP 404 CO -0.04 0.00 0.00 0.61 -3.12 0.00 0.00 179.24 176.69 1ggy n GLY 405 N 0.09 -2.23 1.24 2.75 0.00 -0.50 -4.94 105.19 101.59 1ggy n GLY 405 Ca 0.01 -0.25 0.00 0.00 0.00 0.00 0.00 46.02 45.78 1ggy n GLY 405 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1ggy n MET 406 N -0.10 0.00 -4.12 1.61 0.00 -1.07 -4.80 117.12 108.64 1ggy n MET 406 Ca 0.00 0.03 -0.16 0.00 -0.00 0.00 0.00 57.70 57.57 1ggy n MET 406 Cb 0.00 -1.24 -0.05 0.00 0.00 0.00 0.00 33.22 31.94 1ggy n MET 406 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 175.97 176.68 1ggy s TYR 407 N -2.83 1.22 1.36 1.12 2.02 -0.82 -4.63 117.35 114.81 1ggy s TYR 407 Ca 0.00 -1.39 -0.21 0.00 -0.37 0.00 0.00 57.07 55.10 1ggy s TYR 407 Cb 0.00 -0.20 0.35 0.00 -0.40 0.00 0.00 41.96 41.71 1ggy s TYR 407 CO 0.00 -1.11 0.97 -0.98 -1.57 0.00 0.00 175.55 172.86 1ggy s ARG 408 N -3.04 -2.48 0.03 -0.62 1.04 -1.26 -1.38 118.95 111.24 1ggy s ARG 408 Ca 0.33 0.17 0.02 0.00 -1.04 0.00 0.00 55.73 55.20 1ggy s ARG 408 Cb -0.00 -1.43 -0.02 0.00 -2.04 0.00 0.00 34.95 31.46 1ggy s ARG 408 CO 0.22 -4.59 -0.07 0.00 -0.04 0.00 0.00 175.30 170.83 1ggy n GLY 410 N 1.94 0.62 3.65 0.00 0.00 -0.95 -0.66 105.19 109.79 1ggy n GLY 410 Ca -0.20 -2.07 -0.43 0.00 0.00 0.00 0.00 46.02 43.32 1ggy n GLY 410 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1ggy n PRO 411 N 0.51 2.58 -4.09 1.61 -0.04 -1.26 -4.73 135.00 129.57 1ggy n PRO 411 Ca 0.00 0.91 -0.35 0.00 -0.04 0.00 0.00 63.50 64.02 1ggy n PRO 411 Cb 0.00 -2.99 -0.12 0.00 -0.04 0.00 0.00 33.50 30.35 1ggy n PRO 411 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ggy s ALA 412 N 5.16 3.10 -0.15 0.55 0.00 0.37 -0.26 121.76 130.53 1ggy s ALA 412 Ca 0.92 -0.94 -0.29 0.00 0.00 0.00 0.00 51.96 51.66 1ggy s ALA 412 Cb -0.46 -1.79 -0.05 0.00 0.00 0.00 0.00 23.12 20.82 1ggy s ALA 412 CO 0.42 -0.07 1.97 0.45 0.00 0.00 0.00 175.76 178.54 1ggy s SER 413 N 0.85 6.01 0.38 0.00 0.15 -1.26 -0.77 113.70 119.05 1ggy s SER 413 Ca 0.01 2.03 0.16 0.00 0.70 0.00 0.00 55.95 58.85 1ggy s SER 413 Cb -0.14 -2.52 1.03 0.00 -1.71 0.00 0.00 66.02 62.67 1ggy s SER 413 CO 0.02 -1.50 1.77 0.58 1.20 0.00 0.00 173.24 175.31 1ggy h VAL 414 N 6.42 0.56 -0.16 4.45 2.07 -1.83 0.21 116.25 127.97 1ggy h VAL 414 Ca -0.41 -0.16 -0.12 0.00 0.82 0.00 0.00 66.70 66.82 1ggy h VAL 414 Cb 1.21 0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 31.02 1ggy h VAL 414 CO 0.97 0.08 -0.43 1.56 0.02 0.00 0.00 177.57 179.77 1ggy h GLN 415 N 0.46 0.37 0.00 1.57 1.08 -1.83 -2.46 115.11 114.31 1ggy h GLN 415 Ca 0.59 -0.19 -0.08 0.00 -1.45 0.00 0.00 58.65 57.52 1ggy h GLN 415 Cb 1.37 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.80 1ggy h GLN 415 CO -0.33 0.74 -0.37 0.00 -0.95 0.00 0.00 178.83 177.92 1ggy h ALA 416 N 1.24 1.02 0.19 3.87 0.00 -0.91 -2.96 119.26 121.71 1ggy h ALA 416 Ca 0.02 -0.34 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 1ggy h ALA 416 Cb 0.89 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.62 1ggy h ALA 416 CO 0.07 0.47 -0.09 0.82 0.00 0.00 0.00 179.25 180.52 1ggy h ILE 417 N 0.00 0.90 -0.16 0.00 1.08 -0.98 -0.64 117.51 117.71 1ggy h ILE 417 Ca -0.00 -0.85 0.05 0.00 -0.39 0.00 0.00 64.86 63.66 1ggy h ILE 417 Cb 0.88 1.37 -0.01 0.00 -3.07 0.00 0.00 36.82 35.99 1ggy h ILE 417 CO 0.05 0.18 0.32 0.50 -0.69 0.00 0.00 178.15 178.51 1ggy h LYS 418 N -0.71 0.00 -0.27 2.37 3.64 -1.37 0.16 116.57 120.40 1ggy h LYS 418 Ca -0.03 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1ggy h LYS 418 Cb 0.49 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.31 1ggy h LYS 418 CO 0.04 0.00 0.00 0.72 -2.27 0.00 0.00 179.45 177.94 1ggy n HIS 419 N -3.31 0.65 -1.25 1.91 8.25 -1.13 -4.67 115.22 115.67 1ggy n HIS 419 Ca 0.01 -0.71 -0.09 0.00 -0.26 0.00 0.00 57.72 56.68 1ggy n HIS 419 Cb 0.43 -0.17 -0.04 0.00 1.12 0.00 0.00 29.99 31.32 1ggy n HIS 419 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1ggy n GLY 420 N -0.14 0.85 2.77 -1.41 0.00 0.04 -4.62 105.19 102.69 1ggy n GLY 420 Ca 0.16 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 1ggy n GLY 420 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1ggy n HIS 421 N -2.21 3.29 0.75 1.61 8.25 -0.27 -1.40 115.22 125.24 1ggy n HIS 421 Ca -0.09 -2.91 0.04 0.00 -0.26 0.00 0.00 57.72 54.51 1ggy n HIS 421 Cb 0.55 -2.32 0.14 0.00 1.12 0.00 0.00 29.99 29.48 1ggy n HIS 421 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 1ggy n VAL 422 N 4.40 0.67 1.01 1.59 0.24 -1.26 -3.88 118.33 121.10 1ggy n VAL 422 Ca 0.48 -0.45 0.13 0.00 -2.04 0.00 0.00 64.34 62.46 1ggy n VAL 422 Cb 0.38 -0.05 0.51 0.00 -1.47 0.00 0.00 33.84 33.21 1ggy n VAL 422 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ggy s PHE 424 N -2.99 3.63 0.65 0.00 0.08 -1.25 -5.09 117.98 113.00 1ggy s PHE 424 Ca 0.13 0.75 -0.15 0.00 0.12 0.00 0.00 56.93 57.78 1ggy s PHE 424 Cb 0.19 -2.18 -0.01 0.00 -0.57 0.00 0.00 43.02 40.45 1ggy s PHE 424 CO 0.58 0.59 1.11 1.14 -0.10 0.00 0.00 175.22 178.54 1ggy s GLN 425 N -0.73 2.86 -0.05 0.44 -2.07 -1.26 -4.22 119.66 114.63 1ggy s GLN 425 Ca 0.19 1.42 0.05 0.00 -1.82 0.00 0.00 55.36 55.20 1ggy s GLN 425 Cb -0.14 -1.96 -0.02 0.00 -1.09 0.00 0.00 33.01 29.80 1ggy s GLN 425 CO 0.08 -1.20 -0.20 -0.06 -1.32 0.00 0.00 175.29 172.59 1ggy s PHE 426 N -2.27 2.55 -1.46 9.60 0.40 0.64 -4.55 117.98 122.89 1ggy s PHE 426 Ca 0.68 -0.42 -0.09 0.00 -0.60 0.00 0.00 56.93 56.50 1ggy s PHE 426 Cb -0.21 -1.61 0.04 0.00 0.51 0.00 0.00 43.02 41.75 1ggy s PHE 426 CO 0.40 -0.01 0.88 -0.25 0.70 0.00 0.00 175.22 176.94 1ggy n ASP 427 N 2.62 -5.60 0.06 1.36 8.00 -1.26 -2.24 116.55 119.49 1ggy n ASP 427 Ca -0.17 -0.51 -0.12 0.00 0.71 0.00 0.00 54.79 54.69 1ggy n ASP 427 Cb 0.52 -4.48 -0.07 0.00 -0.02 0.00 0.00 41.12 37.07 1ggy n ASP 427 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ggy h ALA 428 N 1.00 -0.05 -0.78 2.24 0.00 -1.84 -3.05 119.26 116.78 1ggy h ALA 428 Ca -0.55 -0.02 0.19 0.00 0.00 0.00 0.00 54.91 54.53 1ggy h ALA 428 Cb 1.36 0.02 -0.05 0.00 0.00 0.00 0.00 17.79 19.13 1ggy h ALA 428 CO 0.59 -0.52 0.53 -1.35 0.00 0.00 0.00 179.25 178.50 1ggy h PRO 429 N -0.07 0.23 0.00 0.00 0.11 -1.92 -0.71 132.00 129.64 1ggy h PRO 429 Ca -0.01 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 66.06 1ggy h PRO 429 Cb 0.06 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 31.11 1ggy h PRO 429 CO 0.01 0.15 -0.15 0.74 -0.21 0.00 0.00 178.00 178.55 1ggy h PHE 430 N 0.24 0.00 0.08 0.65 -1.00 -1.93 -0.29 116.94 114.69 1ggy h PHE 430 Ca 0.38 0.00 -0.35 0.00 2.81 0.00 0.00 57.97 60.82 1ggy h PHE 430 Cb 1.15 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 40.68 1ggy h PHE 430 CO -0.00 0.15 -1.96 0.28 -1.61 0.00 0.00 178.31 175.16 1ggy n VAL 431 N -3.24 1.71 0.28 -0.55 0.31 -0.37 -3.30 118.33 113.16 1ggy n VAL 431 Ca 0.01 -0.70 -0.16 0.00 -0.01 0.00 0.00 64.34 63.48 1ggy n VAL 431 Cb 0.43 -1.48 -0.08 0.00 -0.91 0.00 0.00 33.84 31.80 1ggy n VAL 431 CO 0.00 0.00 0.00 0.15 -1.32 0.00 0.00 176.83 175.66 1ggy h PHE 432 N 0.05 -0.94 0.00 3.52 3.04 -1.19 -1.30 116.94 120.11 1ggy h PHE 432 Ca -0.40 -0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.55 1ggy h PHE 432 Cb 2.03 0.35 0.00 0.00 2.56 0.00 0.00 35.95 40.89 1ggy h PHE 432 CO 0.05 -0.52 0.00 0.00 -2.02 0.00 0.00 178.31 175.82 1ggy n ALA 433 N -2.61 1.35 0.02 2.41 0.00 -0.13 -0.10 120.51 121.46 1ggy n ALA 433 Ca -0.11 -0.02 -0.10 0.00 0.00 0.00 0.00 53.44 53.20 1ggy n ALA 433 Cb 0.37 -1.09 -0.13 0.00 0.00 0.00 0.00 19.45 18.60 1ggy n ALA 433 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1ggy h GLU 434 N 0.00 0.07 0.00 0.00 4.39 -1.24 -3.39 114.58 114.40 1ggy h GLU 434 Ca 0.00 -0.11 0.00 0.00 0.34 0.00 0.00 59.36 59.59 1ggy h GLU 434 Cb 0.07 0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.77 1ggy h GLU 434 CO 0.00 0.82 -1.07 1.55 -1.16 0.00 0.00 179.01 179.16 1ggy n VAL 435 N -3.25 0.00 -3.21 3.13 3.14 -0.37 -2.55 118.33 115.22 1ggy n VAL 435 Ca -0.12 -0.25 -0.23 0.00 -2.96 0.00 0.00 64.34 60.78 1ggy n VAL 435 Cb 1.01 0.56 -0.06 0.00 -1.06 0.00 0.00 33.84 34.30 1ggy n VAL 435 CO 0.00 0.00 0.00 -3.20 -6.46 0.00 0.00 176.83 167.17 1ggy n ASN 436 N -1.61 1.46 -3.93 6.55 2.85 0.86 -4.08 115.26 117.37 1ggy n ASN 436 Ca -0.00 -3.01 -0.11 0.00 -0.11 0.00 0.00 54.58 51.34 1ggy n ASN 436 Cb 0.22 -0.63 -0.13 0.00 1.24 0.00 0.00 39.78 40.48 1ggy n ASN 436 CO 0.00 0.00 0.00 -0.94 -2.11 0.00 0.00 177.26 174.21 1ggy s SER 437 N -1.97 0.20 0.44 1.20 1.04 -1.26 -4.71 113.70 108.64 1ggy s SER 437 Ca 0.39 -0.22 -0.06 0.00 0.48 0.00 0.00 55.95 56.54 1ggy s SER 437 Cb 0.22 0.03 -0.04 0.00 0.10 0.00 0.00 66.02 66.33 1ggy s SER 437 CO -0.09 -0.11 0.75 -1.81 0.98 0.00 0.00 173.24 172.96 1ggy s ASP 438 N -0.64 6.33 -0.14 7.02 1.01 -0.64 -4.39 116.67 125.22 1ggy s ASP 438 Ca -0.06 0.91 -0.11 0.00 0.71 0.00 0.00 52.55 54.01 1ggy s ASP 438 Cb -0.04 -2.24 -0.05 0.00 1.01 0.00 0.00 42.92 41.60 1ggy s ASP 438 CO -0.00 -0.50 0.20 -0.76 0.21 0.00 0.00 175.17 174.32 1ggy s LEU 439 N -4.46 4.30 -0.12 1.23 1.43 -1.18 -0.65 118.68 119.23 1ggy s LEU 439 Ca 0.47 0.45 0.03 0.00 -1.03 0.00 0.00 54.13 54.05 1ggy s LEU 439 Cb -0.10 -2.21 -0.00 0.00 0.03 0.00 0.00 46.19 43.91 1ggy s LEU 439 CO 0.41 0.24 -0.21 -0.63 0.23 0.00 0.00 176.35 176.40 1ggy s ILE 440 N -0.19 2.34 -0.29 -0.59 -1.09 0.90 -1.17 121.20 121.11 1ggy s ILE 440 Ca 0.14 -0.91 -0.11 0.00 -2.23 0.00 0.00 60.65 57.53 1ggy s ILE 440 Cb -0.12 -1.93 -0.04 0.00 -1.58 0.00 0.00 42.46 38.78 1ggy s ILE 440 CO 0.03 0.55 0.20 -0.31 -1.23 0.00 0.00 174.94 174.18 1ggy s TYR 441 N 0.43 3.22 0.04 3.97 2.02 0.11 -1.90 117.35 125.24 1ggy s TYR 441 Ca -0.15 0.07 0.08 0.00 -0.37 0.00 0.00 57.07 56.71 1ggy s TYR 441 Cb -0.17 -2.40 -0.03 0.00 -0.40 0.00 0.00 41.96 38.96 1ggy s TYR 441 CO 0.06 -0.20 -0.24 0.42 -1.57 0.00 0.00 175.55 174.03 1ggy s ILE 442 N 1.76 1.95 -0.21 2.71 1.01 0.54 0.11 121.20 129.07 1ggy s ILE 442 Ca 0.07 -1.29 -0.08 0.00 0.00 0.00 0.00 60.65 59.35 1ggy s ILE 442 Cb -0.16 -1.67 -0.04 0.00 0.01 0.00 0.00 42.46 40.59 1ggy s ILE 442 CO 0.11 0.33 0.10 -0.89 0.00 0.00 0.00 174.94 174.58 1ggy s THR 443 N -0.78 4.92 -0.59 2.92 2.01 0.67 0.99 115.64 125.78 1ggy s THR 443 Ca 0.10 0.02 -0.16 0.00 0.31 0.00 0.00 61.69 61.96 1ggy s THR 443 Cb -0.09 -3.26 0.14 0.00 0.01 0.00 0.00 72.50 69.30 1ggy s THR 443 CO 0.02 0.41 0.56 0.00 -0.69 0.00 0.00 174.62 174.91 1ggy s ALA 444 N 0.76 3.72 0.41 7.40 0.00 -0.52 -1.92 121.76 131.61 1ggy s ALA 444 Ca 0.05 -2.67 -0.25 0.00 0.00 0.00 0.00 51.96 49.09 1ggy s ALA 444 Cb -0.13 -3.32 -0.08 0.00 0.00 0.00 0.00 23.12 19.58 1ggy s ALA 444 CO 0.02 -2.08 1.24 0.15 0.00 0.00 0.00 175.76 175.09 1ggy s LYS 445 N 1.39 3.98 0.58 0.00 1.02 0.16 -4.44 119.74 122.43 1ggy s LYS 445 Ca 0.06 2.01 0.31 0.00 0.02 0.00 0.00 55.97 58.36 1ggy s LYS 445 Cb -0.26 -2.70 1.37 0.00 -0.52 0.00 0.00 37.83 35.72 1ggy s LYS 445 CO 0.01 -0.44 1.73 0.87 -0.92 0.00 0.00 175.35 176.60 1ggy h LYS 446 N 2.61 0.00 0.04 1.68 6.56 -1.97 0.67 116.57 126.17 1ggy h LYS 446 Ca -0.49 0.00 -0.26 0.00 -1.06 0.00 0.00 60.65 58.84 1ggy h LYS 446 Cb 1.24 0.00 -0.03 0.00 -0.57 0.00 0.00 32.23 32.88 1ggy h LYS 446 CO 0.62 0.00 -1.31 0.38 -2.06 0.00 0.00 179.45 177.08 1ggy h ASP 447 N 0.00 0.13 0.00 0.86 2.03 -2.04 -3.48 116.42 113.92 1ggy h ASP 447 Ca 0.37 -0.17 0.00 0.00 -0.73 0.00 0.00 57.03 56.51 1ggy h ASP 447 Cb 1.89 -0.04 0.00 0.00 -0.83 0.00 0.00 39.33 40.35 1ggy h ASP 447 CO -0.00 1.14 0.00 0.61 -1.03 0.00 0.00 179.24 179.95 1ggy n GLY 448 N 1.49 0.89 3.66 7.15 0.00 0.23 -5.15 105.19 113.46 1ggy n GLY 448 Ca -0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.64 1ggy n GLY 448 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ggy s THR 449 N -0.09 1.86 -0.04 2.61 -4.23 -1.25 -4.70 115.64 109.79 1ggy s THR 449 Ca 0.00 0.00 -0.03 0.00 -1.18 0.00 0.00 61.69 60.48 1ggy s THR 449 Cb 0.00 -2.53 0.02 0.00 1.34 0.00 0.00 72.50 71.34 1ggy s THR 449 CO 0.00 0.00 0.10 -1.00 -0.54 0.00 0.00 174.62 173.18 1ggy s HIS 450 N -3.03 -0.10 -0.01 3.99 3.76 -1.25 -0.66 115.29 117.98 1ggy s HIS 450 Ca 0.67 0.31 0.02 0.00 -0.15 0.00 0.00 55.06 55.91 1ggy s HIS 450 Cb -0.15 -0.05 0.00 0.00 1.11 0.00 0.00 32.58 33.49 1ggy s HIS 450 CO 0.57 -0.10 -0.05 0.54 -0.85 0.00 0.00 174.74 174.85 1ggy s VAL 451 N 0.60 0.42 -0.22 -0.90 0.11 -0.81 -4.93 120.40 114.68 1ggy s VAL 451 Ca -0.05 -0.20 -0.22 0.00 -2.93 0.00 0.00 61.98 58.59 1ggy s VAL 451 Cb -0.06 -0.38 -0.02 0.00 -1.53 0.00 0.00 36.38 34.39 1ggy s VAL 451 CO -0.03 0.13 0.71 0.68 -3.33 0.00 0.00 175.10 173.27 1ggy s VAL 452 N 0.08 4.95 0.00 2.04 -7.23 -1.26 -0.24 120.40 118.74 1ggy s VAL 452 Ca -0.00 1.33 0.00 0.00 -1.81 0.00 0.00 61.98 61.49 1ggy s VAL 452 Cb -0.04 -4.01 0.00 0.00 0.56 0.00 0.00 36.38 32.88 1ggy s VAL 452 CO -0.00 0.04 0.11 -0.62 -0.31 0.00 0.00 175.10 174.32 1ggy n GLU 453 N 5.45 0.00 -4.24 4.82 -0.58 0.30 -4.97 120.64 121.42 1ggy n GLU 453 Ca 0.01 0.27 -0.13 0.00 -0.42 0.00 0.00 57.16 56.89 1ggy n GLU 453 Cb 0.49 -0.84 -0.10 0.00 -0.57 0.00 0.00 31.44 30.41 1ggy n GLU 453 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1ggy s ASN 454 N -2.06 0.61 -0.08 1.62 4.22 -1.23 -4.96 114.94 113.06 1ggy s ASN 454 Ca 0.00 -1.35 0.02 0.00 -2.14 0.00 0.00 52.86 49.39 1ggy s ASN 454 Cb 0.00 0.27 0.01 0.00 1.28 0.00 0.00 41.25 42.82 1ggy s ASN 454 CO 0.00 -0.77 -0.12 0.68 -2.04 0.00 0.00 177.10 174.85 1ggy s VAL 455 N -3.97 1.19 -0.92 3.54 -7.23 -1.26 0.05 120.40 111.80 1ggy s VAL 455 Ca 0.36 -0.49 -0.15 0.00 -1.81 0.00 0.00 61.98 59.88 1ggy s VAL 455 Cb 0.07 -1.10 0.19 0.00 0.56 0.00 0.00 36.38 36.11 1ggy s VAL 455 CO 0.11 0.37 0.97 -0.62 -0.31 0.00 0.00 175.10 175.62 1ggy s ASP 456 N 0.79 6.80 -0.02 4.85 -1.08 -0.32 -4.92 116.67 122.77 1ggy s ASP 456 Ca -0.12 -2.60 0.01 0.00 -0.52 0.00 0.00 52.55 49.32 1ggy s ASP 456 Cb -0.15 -2.29 0.05 0.00 -1.46 0.00 0.00 42.92 39.07 1ggy s ASP 456 CO 0.02 -0.71 0.61 0.00 0.52 0.00 0.00 175.17 175.61 1ggy n ALA 457 N 4.80 2.60 -1.99 3.66 0.00 -1.26 -3.13 120.51 125.18 1ggy n ALA 457 Ca 0.20 -0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1ggy n ALA 457 Cb 0.47 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 18.91 1ggy n ALA 457 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1ggy n THR 458 N 0.06 0.04 -0.12 0.00 -2.24 -1.26 -4.87 114.28 105.89 1ggy n THR 458 Ca 0.02 -0.07 -0.19 0.00 -2.27 0.00 0.00 64.05 61.53 1ggy n THR 458 Cb 0.33 0.49 -0.12 0.00 -2.10 0.00 0.00 70.33 68.93 1ggy n THR 458 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 1ggy n HIS 459 N -0.02 0.06 -2.99 4.78 -0.00 -1.25 -4.68 115.22 111.13 1ggy n HIS 459 Ca 0.00 0.01 -0.41 0.00 -0.00 0.00 0.00 57.72 57.33 1ggy n HIS 459 Cb 0.71 -1.01 -0.05 0.00 -0.00 0.00 0.00 29.99 29.64 1ggy n HIS 459 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 1ggy s ILE 460 N -2.52 4.92 0.00 3.57 1.01 -1.26 -3.50 121.20 123.42 1ggy s ILE 460 Ca -0.35 1.41 0.00 0.00 0.00 0.00 0.00 60.65 61.71 1ggy s ILE 460 Cb 0.09 -4.05 0.00 0.00 0.01 0.00 0.00 42.46 38.52 1ggy s ILE 460 CO 0.60 0.01 0.00 0.61 0.00 0.00 0.00 174.94 176.16 1ggy n GLY 461 N 3.76 0.66 0.21 6.18 0.00 -0.69 -4.55 105.19 110.77 1ggy n GLY 461 Ca 0.02 -0.74 -0.01 0.00 0.00 0.00 0.00 46.02 45.29 1ggy n GLY 461 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ggy h LYS 462 N 0.00 0.19 -3.06 1.61 1.79 -1.57 -3.42 116.57 112.12 1ggy h LYS 462 Ca 0.00 -0.01 -0.24 0.00 -2.18 0.00 0.00 60.65 58.22 1ggy h LYS 462 Cb 0.65 -0.04 -0.33 0.00 -1.58 0.00 0.00 32.23 30.93 1ggy h LYS 462 CO 0.00 0.13 -0.57 -1.17 -1.08 0.00 0.00 179.45 176.76 1ggy s LEU 463 N -10.53 0.19 -0.17 2.94 0.20 -1.26 -5.02 118.68 105.03 1ggy s LEU 463 Ca -0.13 0.43 0.00 0.00 0.69 0.00 0.00 54.13 55.12 1ggy s LEU 463 Cb 0.17 0.51 0.00 0.00 -0.43 0.00 0.00 46.19 46.44 1ggy s LEU 463 CO 0.73 -0.20 -0.16 -0.63 -0.29 0.00 0.00 176.35 175.80 1ggy s ILE 464 N 1.79 2.54 0.10 6.68 1.01 -1.26 -0.35 121.20 131.72 1ggy s ILE 464 Ca -0.03 -0.80 -0.01 0.00 0.00 0.00 0.00 60.65 59.81 1ggy s ILE 464 Cb -0.12 -2.08 -0.04 0.00 0.01 0.00 0.00 42.46 40.24 1ggy s ILE 464 CO -0.07 0.51 0.01 0.54 0.00 0.00 0.00 174.94 175.93 1ggy s VAL 465 N 1.00 0.25 0.13 2.92 0.11 0.42 -0.77 120.40 124.46 1ggy s VAL 465 Ca -0.02 -1.88 -0.12 0.00 -2.93 0.00 0.00 61.98 57.03 1ggy s VAL 465 Cb -0.15 -1.83 0.01 0.00 -1.53 0.00 0.00 36.38 32.88 1ggy s VAL 465 CO -0.03 -0.69 0.31 0.28 -3.33 0.00 0.00 175.10 171.63 1ggy s THR 466 N -3.93 0.09 0.49 5.04 -1.32 -0.44 -0.26 115.64 115.31 1ggy s THR 466 Ca 0.17 -1.04 -0.22 0.00 -1.21 0.00 0.00 61.69 59.39 1ggy s THR 466 Cb 0.07 -1.46 -0.06 0.00 -1.51 0.00 0.00 72.50 69.54 1ggy s THR 466 CO -0.03 -0.41 1.24 -0.75 -2.21 0.00 0.00 174.62 172.47 1ggy s LYS 467 N -3.88 3.51 0.52 7.08 2.20 -1.26 0.80 119.74 128.72 1ggy s LYS 467 Ca 0.08 1.95 -0.05 0.00 -0.36 0.00 0.00 55.97 57.60 1ggy s LYS 467 Cb 0.03 -2.34 -0.01 0.00 -1.51 0.00 0.00 37.83 33.99 1ggy s LYS 467 CO -0.07 -0.80 0.82 1.14 -0.36 0.00 0.00 175.35 176.07 1ggy s GLN 468 N -2.79 3.24 0.27 4.03 -2.07 0.25 -4.72 119.66 117.88 1ggy s GLN 468 Ca 0.67 0.04 -0.03 0.00 -1.82 0.00 0.00 55.36 54.21 1ggy s GLN 468 Cb -0.33 -2.36 0.35 0.00 -1.09 0.00 0.00 33.01 29.58 1ggy s GLN 468 CO 0.40 -0.41 1.87 0.82 -1.32 0.00 0.00 175.29 176.65 1ggy h ILE 469 N 0.09 1.23 0.00 3.63 2.04 -1.95 -3.33 117.51 119.22 1ggy h ILE 469 Ca -0.46 -0.65 0.00 0.00 1.00 0.00 0.00 64.86 64.74 1ggy h ILE 469 Cb 1.23 0.31 0.00 0.00 -0.74 0.00 0.00 36.82 37.62 1ggy h ILE 469 CO 0.61 0.28 0.00 0.61 0.00 0.00 0.00 178.15 179.64 1ggy n GLY 470 N -1.08 -2.58 0.00 5.37 0.00 -1.26 -4.94 105.19 100.70 1ggy n GLY 470 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1ggy n GLY 470 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ggy n GLY 471 N -0.15 4.95 0.04 -0.02 0.00 -1.25 -5.03 105.19 103.74 1ggy n GLY 471 Ca 0.00 -0.86 0.04 0.00 0.00 0.00 0.00 46.02 45.21 1ggy n GLY 471 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1ggy n ASP 472 N 0.00 0.11 -4.85 1.61 8.00 -1.26 -3.85 116.55 116.31 1ggy n ASP 472 Ca 0.00 -1.76 -0.31 0.00 0.71 0.00 0.00 54.79 53.43 1ggy n ASP 472 Cb 0.00 -0.01 0.03 0.00 -0.02 0.00 0.00 41.12 41.12 1ggy n ASP 472 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 1ggy s GLY 473 N -1.25 1.66 0.40 0.44 0.00 -1.26 -4.85 107.32 102.46 1ggy s GLY 473 Ca 0.13 -0.07 -0.05 0.00 0.00 0.00 0.00 44.72 44.73 1ggy s GLY 473 CO 0.10 0.23 0.69 -3.16 0.00 0.00 0.00 173.10 170.96 1ggy s MET 474 N -5.16 3.60 -0.09 2.90 0.23 -1.26 -0.59 119.30 118.93 1ggy s MET 474 Ca 0.56 0.13 -0.01 0.00 -1.03 0.00 0.00 55.69 55.34 1ggy s MET 474 Cb -0.12 -2.48 0.03 0.00 -1.53 0.00 0.00 34.83 30.72 1ggy s MET 474 CO 0.54 -0.02 -0.04 1.41 -2.03 0.00 0.00 175.02 174.88 1ggy s MET 475 N -4.23 1.08 -0.35 3.16 0.00 0.24 -4.71 119.30 114.50 1ggy s MET 475 Ca 0.46 -0.08 -0.29 0.00 0.00 0.00 0.00 55.69 55.78 1ggy s MET 475 Cb -0.10 -1.30 0.00 0.00 0.00 0.00 0.00 34.83 33.43 1ggy s MET 475 CO 0.37 -0.29 1.39 0.34 0.00 0.00 0.00 175.02 176.84 1ggy s ASP 476 N 1.84 6.47 -0.20 1.11 -1.08 -1.26 -1.33 116.67 122.21 1ggy s ASP 476 Ca 0.05 1.06 0.15 0.00 -0.52 0.00 0.00 52.55 53.29 1ggy s ASP 476 Cb -0.12 -2.54 0.50 0.00 -1.46 0.00 0.00 42.92 39.29 1ggy s ASP 476 CO -0.07 -1.28 1.40 2.30 0.52 0.00 0.00 175.17 178.04 1ggy n ILE 477 N 6.67 2.30 0.02 4.11 -5.35 0.05 -4.69 119.36 122.46 1ggy n ILE 477 Ca 0.16 -2.10 0.00 0.00 -0.27 0.00 0.00 62.75 60.54 1ggy n ILE 477 Cb 0.47 -0.27 0.32 0.00 -1.74 0.00 0.00 39.64 38.42 1ggy n ILE 477 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1ggy h THR 478 N 1.41 1.19 0.00 7.28 2.02 -1.85 -2.18 112.91 120.78 1ggy h THR 478 Ca 0.05 -0.75 0.00 0.00 0.77 0.00 0.00 66.41 66.48 1ggy h THR 478 Cb 1.44 0.96 0.00 0.00 -1.74 0.00 0.00 68.15 68.81 1ggy h THR 478 CO 0.23 0.25 0.00 -2.24 0.37 0.00 0.00 175.52 174.14 1ggy h ASP 479 N 0.46 0.00 0.77 4.18 2.03 -1.84 -1.24 116.42 120.78 1ggy h ASP 479 Ca 0.10 0.00 -0.25 0.00 -0.73 0.00 0.00 57.03 56.15 1ggy h ASP 479 Cb 0.31 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.80 1ggy h ASP 479 CO 0.01 0.00 -1.17 0.71 -1.03 0.00 0.00 179.24 177.76 1ggy h THR 480 N 0.00 1.56 0.02 1.15 1.35 -1.76 -3.34 112.91 111.90 1ggy h THR 480 Ca 0.00 -3.20 -0.29 0.00 -0.55 0.00 0.00 66.41 62.37 1ggy h THR 480 Cb 0.37 2.89 -0.04 0.00 -1.73 0.00 0.00 68.15 69.63 1ggy h THR 480 CO 0.00 0.92 -1.63 1.88 -0.25 0.00 0.00 175.52 176.43 1ggy h TYR 481 N 0.04 0.08 -3.31 4.73 -1.99 -1.56 -3.41 116.97 111.55 1ggy h TYR 481 Ca -0.09 -0.06 -0.06 0.00 2.00 0.00 0.00 58.73 60.52 1ggy h TYR 481 Cb 1.89 -0.00 -0.14 0.00 2.00 0.00 0.00 36.73 40.48 1ggy h TYR 481 CO 0.04 1.10 -0.11 -1.59 -0.00 0.00 0.00 178.16 177.60 1ggy s LYS 482 N -2.61 1.00 0.02 4.88 -2.85 -0.49 -3.38 119.74 116.31 1ggy s LYS 482 Ca -0.06 -0.62 -0.00 0.00 -1.00 0.00 0.00 55.97 54.29 1ggy s LYS 482 Cb 0.08 0.44 0.00 0.00 -2.06 0.00 0.00 37.83 36.29 1ggy s LYS 482 CO 0.82 -0.37 0.03 1.19 0.10 0.00 0.00 175.35 177.12 1ggy n PHE 483 N 0.03 -3.97 -2.97 1.78 3.72 -1.26 -3.84 117.46 110.95 1ggy n PHE 483 Ca -0.17 -0.03 -0.41 0.00 -0.05 0.00 0.00 57.45 56.80 1ggy n PHE 483 Cb 0.62 -0.02 -0.05 0.00 -0.94 0.00 0.00 39.48 39.10 1ggy n PHE 483 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1ggy s GLN 484 N -3.03 4.27 -0.05 -1.08 1.11 -1.26 -4.88 119.66 114.74 1ggy s GLN 484 Ca 0.02 0.88 -0.35 0.00 0.01 0.00 0.00 55.36 55.92 1ggy s GLN 484 Cb -0.00 -3.57 -0.13 0.00 -1.01 0.00 0.00 33.01 28.30 1ggy s GLN 484 CO 0.01 -0.29 1.78 0.39 0.01 0.00 0.00 175.29 177.19 1ggy n GLU 485 N 5.13 2.02 -0.69 2.91 -0.58 -1.26 -2.96 120.64 125.21 1ggy n GLU 485 Ca 0.02 0.74 0.00 0.00 -0.42 0.00 0.00 57.16 57.50 1ggy n GLU 485 Cb 0.49 -2.54 0.00 0.00 -0.57 0.00 0.00 31.44 28.82 1ggy n GLU 485 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1ggy n GLY 486 N 4.09 0.50 3.33 0.62 0.00 -1.26 -5.08 105.19 107.38 1ggy n GLY 486 Ca 0.22 -0.19 -0.15 0.00 0.00 0.00 0.00 46.02 45.90 1ggy n GLY 486 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ggy s GLN 487 N -0.82 0.78 0.37 1.61 -0.21 -1.15 -5.03 119.66 115.20 1ggy s GLN 487 Ca 0.00 -0.01 0.17 0.00 0.02 0.00 0.00 55.36 55.54 1ggy s GLN 487 Cb 0.00 0.36 1.10 0.00 1.00 0.00 0.00 33.01 35.47 1ggy s GLN 487 CO 0.00 -0.22 1.70 0.93 -2.12 0.00 0.00 175.29 175.58 1ggy h GLU 488 N 3.69 0.35 0.01 2.91 4.39 -1.98 -0.16 114.58 123.79 1ggy h GLU 488 Ca -0.29 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.39 1ggy h GLU 488 Cb 1.17 -0.08 -0.00 0.00 -0.10 0.00 0.00 28.75 29.74 1ggy h GLU 488 CO 0.39 0.23 -0.01 0.93 -1.16 0.00 0.00 179.01 179.39 1ggy h GLU 489 N 0.36 -0.02 -0.52 2.33 4.39 -1.96 0.43 114.58 119.61 1ggy h GLU 489 Ca 0.69 0.00 0.15 0.00 0.34 0.00 0.00 59.36 60.54 1ggy h GLU 489 Cb 1.67 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 30.30 1ggy h GLU 489 CO -0.46 -0.01 0.38 1.49 -1.16 0.00 0.00 179.01 179.25 1ggy h GLU 490 N -0.02 0.00 -0.12 2.33 4.57 -1.62 -0.91 114.58 118.82 1ggy h GLU 490 Ca -0.00 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 58.08 1ggy h GLU 490 Cb 0.01 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.61 1ggy h GLU 490 CO 0.00 0.00 -0.32 -0.09 -1.18 0.00 0.00 179.01 177.42 1ggy h ARG 491 N 0.00 0.42 -0.28 1.92 2.43 -0.68 -2.88 114.38 115.32 1ggy h ARG 491 Ca 0.25 -0.30 -0.11 0.00 -0.81 0.00 0.00 59.98 59.01 1ggy h ARG 491 Cb 1.00 0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 30.59 1ggy h ARG 491 CO -0.00 0.91 -0.24 1.25 -1.51 0.00 0.00 179.97 180.38 1ggy h LEU 492 N 0.01 0.69 -1.00 3.80 6.46 0.11 -1.94 115.31 123.44 1ggy h LEU 492 Ca -0.01 -0.46 0.08 0.00 -0.12 0.00 0.00 57.88 57.38 1ggy h LEU 492 Cb 0.93 -0.19 -0.07 0.00 -0.73 0.00 0.00 40.66 40.60 1ggy h LEU 492 CO 0.07 1.01 0.64 0.00 -0.62 0.00 0.00 178.44 179.54 1ggy h ALA 493 N 0.70 1.43 -0.57 1.25 0.00 -1.37 0.30 119.26 121.00 1ggy h ALA 493 Ca 0.05 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 1ggy h ALA 493 Cb 0.80 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 1ggy h ALA 493 CO 0.06 0.38 0.21 1.25 0.00 0.00 0.00 179.25 181.15 1ggy h LEU 494 N 1.12 0.77 -0.25 0.00 5.85 -1.26 -1.61 115.31 119.92 1ggy h LEU 494 Ca 0.45 -0.10 -0.21 0.00 0.84 0.00 0.00 57.88 58.86 1ggy h LEU 494 Cb 0.27 -0.20 0.01 0.00 0.37 0.00 0.00 40.66 41.11 1ggy h LEU 494 CO -0.20 0.70 -0.71 -0.33 -0.34 0.00 0.00 178.44 177.56 1ggy h GLU 495 N 0.82 0.74 -0.24 1.25 5.08 0.22 -2.93 114.58 119.53 1ggy h GLU 495 Ca 0.19 -0.57 -0.00 0.00 -1.00 0.00 0.00 59.36 57.98 1ggy h GLU 495 Cb 0.19 0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.53 1ggy h GLU 495 CO -0.02 1.19 0.15 1.15 -1.00 0.00 0.00 179.01 180.48 1ggy h THR 496 N 0.53 1.08 0.00 1.13 2.02 -0.33 -1.66 112.91 115.68 1ggy h THR 496 Ca -0.03 -0.19 -0.00 0.00 0.77 0.00 0.00 66.41 66.95 1ggy h THR 496 Cb 1.32 0.78 -0.00 0.00 -1.74 0.00 0.00 68.15 68.51 1ggy h THR 496 CO 0.14 0.08 -0.01 0.00 0.37 0.00 0.00 175.52 176.10 1ggy h ALA 497 N 1.06 1.87 -0.10 6.16 0.00 -0.24 -1.80 119.26 126.20 1ggy h ALA 497 Ca 0.09 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 1ggy h ALA 497 Cb 0.00 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1ggy h ALA 497 CO -0.02 0.02 -0.44 -0.07 0.00 0.00 0.00 179.25 178.74 1ggy h LEU 498 N 0.00 0.24 0.00 0.00 4.07 -1.10 -0.96 115.31 117.56 1ggy h LEU 498 Ca -0.00 -0.11 0.00 0.00 0.08 0.00 0.00 57.88 57.85 1ggy h LEU 498 Cb 0.03 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 41.70 1ggy h LEU 498 CO 0.00 0.66 -0.37 0.00 -1.08 0.00 0.00 178.44 177.65 1ggy h MET 499 N 0.19 0.00 -1.01 1.13 -0.00 -1.14 -3.22 114.93 110.88 1ggy h MET 499 Ca 0.01 0.00 -0.53 0.00 -0.00 0.00 0.00 59.70 59.18 1ggy h MET 499 Cb 0.86 0.00 -0.29 0.00 -0.00 0.00 0.00 31.60 32.17 1ggy h MET 499 CO 0.07 0.00 0.68 0.66 -0.00 0.00 0.00 176.91 178.31 1ggy n TYR 500 N -2.77 2.96 -2.25 -0.10 4.01 -1.01 -4.90 117.16 113.09 1ggy n TYR 500 Ca 0.03 -2.06 0.00 0.00 -0.16 0.00 0.00 57.90 55.71 1ggy n TYR 500 Cb 0.51 -1.03 0.00 0.00 -0.31 0.00 0.00 39.34 38.51 1ggy n TYR 500 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ggy n GLY 501 N -1.00 0.69 3.62 2.72 0.00 -1.17 -4.57 105.19 105.49 1ggy n GLY 501 Ca 0.58 -0.77 -0.36 0.00 0.00 0.00 0.00 46.02 45.47 1ggy n GLY 501 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ggy s ALA 502 N -2.54 3.47 0.01 4.61 0.00 -0.40 -4.96 121.76 121.96 1ggy s ALA 502 Ca 0.00 -0.88 -0.26 0.00 0.00 0.00 0.00 51.96 50.82 1ggy s ALA 502 Cb 0.00 -2.15 -0.04 0.00 0.00 0.00 0.00 23.12 20.93 1ggy s ALA 502 CO 0.00 -0.11 0.82 0.15 0.00 0.00 0.00 175.76 176.62 1ggy s LYS 503 N 0.91 4.52 -0.49 0.00 1.02 0.18 -4.50 119.74 121.37 1ggy s LYS 503 Ca 0.06 1.15 0.06 0.00 0.02 0.00 0.00 55.97 57.26 1ggy s LYS 503 Cb -0.13 -3.41 0.21 0.00 -0.52 0.00 0.00 37.83 33.98 1ggy s LYS 503 CO 0.03 0.13 0.50 1.17 -0.92 0.00 0.00 175.35 176.26 1ggy n LYS 504 N 3.36 1.04 0.02 1.68 4.81 -1.26 0.05 118.16 127.87 1ggy n LYS 504 Ca 0.01 -3.66 -0.14 0.00 -0.87 0.00 0.00 58.31 53.65 1ggy n LYS 504 Cb 0.51 -1.70 -0.07 0.00 0.02 0.00 0.00 35.03 33.78 1ggy n LYS 504 CO 0.00 0.00 0.00 -1.00 1.17 0.00 0.00 177.40 177.57 1ggy h PRO 505 N 4.74 -0.54 -5.76 1.64 0.13 -1.97 -3.42 132.00 126.81 1ggy h PRO 505 Ca 0.17 0.04 -0.59 0.00 -0.87 0.00 0.00 66.00 64.75 1ggy h PRO 505 Cb 0.83 0.12 -0.08 0.00 0.13 0.00 0.00 31.00 32.01 1ggy h PRO 505 CO 0.54 -0.36 -0.19 -0.51 -0.23 0.00 0.00 178.00 177.25 1ggy s LEU 506 N -10.33 4.33 -0.48 1.56 1.02 -1.26 -5.02 118.68 108.49 1ggy s LEU 506 Ca -0.16 0.80 -0.28 0.00 0.02 0.00 0.00 54.13 54.51 1ggy s LEU 506 Cb 0.08 -2.60 0.03 0.00 0.02 0.00 0.00 46.19 43.72 1ggy s LEU 506 CO 0.63 0.11 1.09 0.21 0.02 0.00 0.00 176.35 178.42 1ggy s ASN 507 N 0.11 6.60 0.60 2.29 2.47 -1.26 -5.13 114.94 120.62 1ggy s ASN 507 Ca 0.23 0.39 -0.15 0.00 0.42 0.00 0.00 52.86 53.75 1ggy s ASN 507 Cb -0.15 -2.53 -0.04 0.00 -1.45 0.00 0.00 41.25 37.08 1ggy s ASN 507 CO 0.10 -1.21 1.05 0.28 -3.72 0.00 0.00 177.10 173.59 1ggy s THR 508 N 4.32 3.90 0.00 -5.21 -1.32 -1.26 -5.10 115.64 110.97 1ggy s THR 508 Ca 0.46 0.87 0.00 0.00 -1.21 0.00 0.00 61.69 61.81 1ggy s THR 508 Cb -0.08 -3.42 0.00 0.00 -1.51 0.00 0.00 72.50 67.50 1ggy s THR 508 CO 0.31 -0.56 0.42 -1.54 -2.21 0.00 0.00 174.62 171.04 1ggy n SER 516 N -2.11 -0.25 -3.97 8.08 3.41 -1.26 -5.13 113.62 112.39 1ggy n SER 516 Ca 0.08 -0.84 -0.32 0.00 -0.26 0.00 0.00 58.87 57.53 1ggy n SER 516 Cb 0.53 0.08 -0.01 0.00 -0.26 0.00 0.00 64.21 64.54 1ggy n SER 516 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1ggy n ASN 517 N 0.00 -1.93 -3.53 4.04 2.85 -1.26 -4.84 115.26 110.59 1ggy n ASN 517 Ca -0.07 -0.99 -0.29 0.00 -0.11 0.00 0.00 54.58 53.12 1ggy n ASN 517 Cb 0.39 -1.20 -0.13 0.00 1.24 0.00 0.00 39.78 40.08 1ggy n ASN 517 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 1ggy s VAL 518 N -3.94 0.33 0.57 3.44 1.01 -1.26 -2.60 120.40 117.96 1ggy s VAL 518 Ca 0.26 -1.61 -0.10 0.00 0.00 0.00 0.00 61.98 60.53 1ggy s VAL 518 Cb -0.15 -1.26 -0.04 0.00 0.00 0.00 0.00 36.38 34.94 1ggy s VAL 518 CO 0.74 -0.90 0.96 -0.62 0.00 0.00 0.00 175.10 175.29 1ggy s ASP 519 N 1.22 6.27 -0.24 3.32 -1.08 -1.24 -4.90 116.67 120.01 1ggy s ASP 519 Ca 0.16 1.31 -0.26 0.00 -0.52 0.00 0.00 52.55 53.24 1ggy s ASP 519 Cb -0.21 -2.42 0.08 0.00 -1.46 0.00 0.00 42.92 38.91 1ggy s ASP 519 CO -0.09 -0.77 0.78 0.00 0.52 0.00 0.00 175.17 175.61 1ggy s MET 520 N -4.96 0.80 0.12 4.34 0.23 -1.26 -1.18 119.30 117.38 1ggy s MET 520 Ca 0.53 0.82 -0.09 0.00 -1.03 0.00 0.00 55.69 55.93 1ggy s MET 520 Cb -0.11 0.39 -0.00 0.00 -1.53 0.00 0.00 34.83 33.58 1ggy s MET 520 CO 0.50 -0.12 0.23 0.34 -2.03 0.00 0.00 175.02 173.94 1ggy s ASP 521 N 0.14 0.08 0.01 -1.18 2.15 -0.84 -4.98 116.67 112.04 1ggy s ASP 521 Ca -0.01 -0.71 0.02 0.00 0.43 0.00 0.00 52.55 52.28 1ggy s ASP 521 Cb -0.04 0.38 -0.01 0.00 -0.30 0.00 0.00 42.92 42.95 1ggy s ASP 521 CO 0.01 -0.79 -0.08 0.72 -0.17 0.00 0.00 175.17 174.86 1ggy s PHE 522 N -3.90 0.67 -0.20 -5.34 -0.71 -1.26 -0.22 117.98 107.02 1ggy s PHE 522 Ca 0.09 -0.20 0.01 0.00 -1.04 0.00 0.00 56.93 55.79 1ggy s PHE 522 Cb 0.04 -0.42 0.03 0.00 -1.21 0.00 0.00 43.02 41.45 1ggy s PHE 522 CO -0.07 -0.02 -0.16 -2.00 -1.34 0.00 0.00 175.22 171.63 1ggy s GLU 523 N -0.47 2.85 0.22 1.99 2.56 -0.78 -4.96 118.70 120.11 1ggy s GLU 523 Ca 0.01 -0.93 -0.17 0.00 0.00 0.00 0.00 54.97 53.87 1ggy s GLU 523 Cb -0.04 -2.69 -0.08 0.00 2.00 0.00 0.00 34.13 33.32 1ggy s GLU 523 CO -0.00 -0.30 0.68 0.08 -0.56 0.00 0.00 175.26 175.16 1ggy s VAL 524 N 1.26 4.67 -0.40 3.70 1.01 -1.26 -1.43 120.40 127.96 1ggy s VAL 524 Ca 0.02 1.08 -0.12 0.00 0.00 0.00 0.00 61.98 62.96 1ggy s VAL 524 Cb -0.15 -3.78 0.03 0.00 0.00 0.00 0.00 36.38 32.49 1ggy s VAL 524 CO -0.10 0.14 0.26 -1.83 0.00 0.00 0.00 175.10 173.56 1ggy s GLU 525 N -2.17 2.85 -0.35 2.72 -1.05 -0.59 -4.97 118.70 115.14 1ggy s GLU 525 Ca 0.44 -1.13 -0.41 0.00 -0.15 0.00 0.00 54.97 53.72 1ggy s GLU 525 Cb -0.15 -3.84 -0.16 0.00 -0.44 0.00 0.00 34.13 29.53 1ggy s GLU 525 CO 0.20 -0.77 1.82 0.27 0.95 0.00 0.00 175.26 177.72 1ggy n ASN 526 N 5.05 2.00 -4.87 0.83 6.94 -1.26 -4.45 115.26 119.51 1ggy n ASN 526 Ca -0.11 0.97 -0.23 0.00 -0.02 0.00 0.00 54.58 55.19 1ggy n ASN 526 Cb 0.46 -1.09 -0.02 0.00 -2.36 0.00 0.00 39.78 36.77 1ggy n ASN 526 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1ggy s ALA 527 N 4.18 4.14 0.24 -2.53 0.00 -1.26 -5.00 121.76 121.54 1ggy s ALA 527 Ca 1.03 -1.73 -0.02 0.00 0.00 0.00 0.00 51.96 51.24 1ggy s ALA 527 Cb -1.16 -0.85 -0.04 0.00 0.00 0.00 0.00 23.12 21.07 1ggy s ALA 527 CO 0.67 -0.32 0.46 0.08 0.00 0.00 0.00 175.76 176.65 1ggy s VAL 528 N -2.60 5.14 -0.21 0.00 1.01 -1.26 -1.49 120.40 120.99 1ggy s VAL 528 Ca 0.43 -0.25 -0.29 0.00 0.00 0.00 0.00 61.98 61.88 1ggy s VAL 528 Cb -0.02 -3.75 -0.04 0.00 0.00 0.00 0.00 36.38 32.57 1ggy s VAL 528 CO 0.25 -0.26 1.99 -0.22 0.00 0.00 0.00 175.10 176.87 1ggy s LEU 529 N -3.50 3.67 0.00 3.92 1.98 0.13 -1.58 118.68 123.30 1ggy s LEU 529 Ca 0.40 1.83 0.00 0.00 -2.89 0.00 0.00 54.13 53.47 1ggy s LEU 529 Cb -0.11 -3.52 0.00 0.00 0.66 0.00 0.00 46.19 43.22 1ggy s LEU 529 CO 0.30 -1.66 0.00 0.61 -1.89 0.00 0.00 176.35 173.71 1ggy n GLY 530 N 5.34 0.69 3.96 7.98 0.00 -1.26 -4.95 105.19 116.94 1ggy n GLY 530 Ca 0.25 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.04 1ggy n GLY 530 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ggy s LYS 531 N -0.57 3.44 0.37 1.61 -0.14 -0.62 -4.72 119.74 119.12 1ggy s LYS 531 Ca 0.00 -0.67 -0.12 0.00 -1.36 0.00 0.00 55.97 53.82 1ggy s LYS 531 Cb 0.00 -2.92 -0.07 0.00 -1.68 0.00 0.00 37.83 33.16 1ggy s LYS 531 CO 0.00 0.47 0.75 -0.51 -0.76 0.00 0.00 175.35 175.30 1ggy s ASP 532 N -3.62 6.61 0.35 2.83 1.11 -1.26 -4.01 116.67 118.67 1ggy s ASP 532 Ca 0.34 1.17 -0.03 0.00 0.18 0.00 0.00 52.55 54.22 1ggy s ASP 532 Cb -0.10 -2.33 0.01 0.00 1.07 0.00 0.00 42.92 41.57 1ggy s ASP 532 CO 0.29 -0.32 0.51 2.22 1.18 0.00 0.00 175.17 179.04 1ggy n PHE 533 N -0.96 -1.51 -4.39 4.23 -1.74 0.31 -4.92 117.46 108.49 1ggy n PHE 533 Ca 0.03 -2.32 -0.22 0.00 -0.56 0.00 0.00 57.45 54.37 1ggy n PHE 533 Cb 0.54 0.57 -0.11 0.00 1.52 0.00 0.00 39.48 42.00 1ggy n PHE 533 CO 0.00 0.00 0.00 0.15 -0.56 0.00 0.00 176.76 176.35 1ggy s LYS 534 N -2.76 1.44 -0.15 3.97 1.02 -1.26 0.15 119.74 122.15 1ggy s LYS 534 Ca 0.28 -1.58 0.01 0.00 0.02 0.00 0.00 55.97 54.71 1ggy s LYS 534 Cb -0.01 -1.47 0.02 0.00 -0.52 0.00 0.00 37.83 35.85 1ggy s LYS 534 CO 0.20 0.28 -0.16 -1.17 -0.92 0.00 0.00 175.35 173.58 1ggy s LEU 535 N -3.08 1.82 -0.47 3.17 0.20 -0.36 -1.54 118.68 118.42 1ggy s LEU 535 Ca 0.22 -0.52 -0.00 0.00 0.69 0.00 0.00 54.13 54.52 1ggy s LEU 535 Cb -0.04 -1.25 0.12 0.00 -0.43 0.00 0.00 46.19 44.59 1ggy s LEU 535 CO 0.09 -0.02 0.24 -0.44 -0.29 0.00 0.00 176.35 175.94 1ggy s SER 536 N 1.29 4.99 0.35 3.68 0.01 -0.51 -0.41 113.70 123.10 1ggy s SER 536 Ca 0.02 -2.43 -0.25 0.00 1.31 0.00 0.00 55.95 54.60 1ggy s SER 536 Cb -0.13 -1.76 -0.10 0.00 0.21 0.00 0.00 66.02 64.23 1ggy s SER 536 CO -0.09 -0.41 0.97 -0.63 0.41 0.00 0.00 173.24 173.49 1ggy s ILE 537 N 0.55 4.13 -0.18 1.44 1.01 0.57 -1.86 121.20 126.86 1ggy s ILE 537 Ca 0.12 1.69 -0.04 0.00 0.00 0.00 0.00 60.65 62.42 1ggy s ILE 537 Cb -0.22 -3.90 0.08 0.00 0.01 0.00 0.00 42.46 38.43 1ggy s ILE 537 CO -0.04 0.07 0.17 0.42 0.00 0.00 0.00 174.94 175.55 1ggy s THR 538 N -1.68 -0.23 0.24 2.92 -4.23 0.69 -0.06 115.64 113.29 1ggy s THR 538 Ca 0.53 -0.07 -0.03 0.00 -1.18 0.00 0.00 61.69 60.93 1ggy s THR 538 Cb -0.18 -0.59 -0.05 0.00 1.34 0.00 0.00 72.50 73.02 1ggy s THR 538 CO 0.23 -0.19 0.47 -0.36 -0.54 0.00 0.00 174.62 174.24 1ggy s PHE 539 N 2.26 3.48 -0.37 3.99 0.40 0.15 -1.98 117.98 125.90 1ggy s PHE 539 Ca 0.05 0.53 0.02 0.00 -0.60 0.00 0.00 56.93 56.92 1ggy s PHE 539 Cb -0.15 -2.00 0.15 0.00 0.51 0.00 0.00 43.02 41.52 1ggy s PHE 539 CO -0.10 0.28 0.27 1.03 0.70 0.00 0.00 175.22 177.40 1ggy s ARG 540 N -3.35 0.68 -0.44 0.44 3.00 -0.33 -0.80 118.95 118.16 1ggy s ARG 540 Ca 0.42 -1.58 -0.27 0.00 0.00 0.00 0.00 55.73 54.29 1ggy s ARG 540 Cb -0.11 -1.29 -0.08 0.00 0.00 0.00 0.00 34.95 33.47 1ggy s ARG 540 CO 0.29 -1.28 2.37 -1.71 0.00 0.00 0.00 175.30 174.97 1ggy n ASN 541 N 3.61 2.45 0.05 0.23 2.85 -1.25 -3.73 115.26 119.47 1ggy n ASN 541 Ca 0.19 -0.22 -0.10 0.00 -0.11 0.00 0.00 54.58 54.34 1ggy n ASN 541 Cb 0.42 -1.52 -0.13 0.00 1.24 0.00 0.00 39.78 39.79 1ggy n ASN 541 CO 0.00 0.00 0.00 -1.13 -2.11 0.00 0.00 177.26 174.02 1ggy h ASN 542 N 17.49 0.12 -0.27 1.20 -0.73 -1.78 0.18 115.58 131.79 1ggy h ASN 542 Ca -0.28 -0.14 0.00 0.00 1.87 0.00 0.00 56.30 57.75 1ggy h ASN 542 Cb 1.27 -0.04 0.00 0.00 0.27 0.00 0.00 38.32 39.82 1ggy h ASN 542 CO 1.11 1.12 0.00 -1.54 -0.37 0.00 0.00 177.43 177.74 1ggy n SER 543 N -3.34 0.00 -2.97 1.15 3.41 -1.22 -4.15 113.62 106.50 1ggy n SER 543 Ca -0.06 0.00 -0.30 0.00 -0.26 0.00 0.00 58.87 58.25 1ggy n SER 543 Cb 0.99 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.91 1ggy n SER 543 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1ggy n HIS 544 N 0.00 3.73 -3.96 7.33 -0.00 -1.26 -0.02 115.22 121.04 1ggy n HIS 544 Ca 0.00 -3.57 -0.09 0.00 -0.00 0.00 0.00 57.72 54.05 1ggy n HIS 544 Cb 0.00 -0.56 -0.10 0.00 -0.00 0.00 0.00 29.99 29.33 1ggy n HIS 544 CO 0.00 0.00 0.00 -0.80 -0.00 0.00 0.00 176.34 175.54 1ggy s ASN 545 N -3.07 0.22 -0.29 0.41 0.01 -1.26 -4.93 114.94 106.03 1ggy s ASN 545 Ca 0.47 -0.57 -0.16 0.00 -0.71 0.00 0.00 52.86 51.90 1ggy s ASN 545 Cb 0.29 0.20 -0.03 0.00 0.41 0.00 0.00 41.25 42.12 1ggy s ASN 545 CO -0.16 -0.47 0.41 -0.60 -1.51 0.00 0.00 177.10 174.77 1ggy s ARG 546 N -2.47 3.89 0.10 -0.60 3.52 -1.26 -3.19 118.95 118.94 1ggy s ARG 546 Ca -0.06 -0.03 0.03 0.00 -0.13 0.00 0.00 55.73 55.53 1ggy s ARG 546 Cb -0.02 -3.70 -0.04 0.00 -1.56 0.00 0.00 34.95 29.63 1ggy s ARG 546 CO -0.04 -0.38 0.12 0.71 -0.81 0.00 0.00 175.30 174.89 1ggy s TYR 547 N 2.14 3.23 -0.23 5.12 2.02 -1.03 -4.96 117.35 123.63 1ggy s TYR 547 Ca 0.16 0.07 0.01 0.00 -0.37 0.00 0.00 57.07 56.94 1ggy s TYR 547 Cb -0.16 -1.61 0.04 0.00 -0.40 0.00 0.00 41.96 39.83 1ggy s TYR 547 CO 0.11 0.53 -0.12 0.99 -1.57 0.00 0.00 175.55 175.48 1ggy s THR 548 N -1.51 2.37 0.25 -0.71 2.01 -1.26 -1.75 115.64 115.04 1ggy s THR 548 Ca 0.31 -1.20 0.11 0.00 0.31 0.00 0.00 61.69 61.22 1ggy s THR 548 Cb -0.12 -2.20 -0.05 0.00 0.01 0.00 0.00 72.50 70.15 1ggy s THR 548 CO 0.23 0.24 -0.20 -0.63 -0.69 0.00 0.00 174.62 173.57 1ggy s ILE 549 N 1.24 2.36 -0.29 1.82 1.01 -0.65 -2.48 121.20 124.20 1ggy s ILE 549 Ca -0.01 -2.31 0.00 0.00 0.00 0.00 0.00 60.65 58.33 1ggy s ILE 549 Cb -0.17 -2.23 0.09 0.00 0.01 0.00 0.00 42.46 40.17 1ggy s ILE 549 CO -0.08 -0.37 0.06 -0.89 0.00 0.00 0.00 174.94 173.66 1ggy s THR 550 N -2.41 1.20 0.31 2.92 2.01 -0.22 -2.47 115.64 116.97 1ggy s THR 550 Ca 0.27 -1.47 -0.08 0.00 0.31 0.00 0.00 61.69 60.71 1ggy s THR 550 Cb -0.05 -1.82 -0.06 0.00 0.01 0.00 0.00 72.50 70.58 1ggy s THR 550 CO 0.13 -0.54 0.63 0.00 -0.69 0.00 0.00 174.62 174.15 1ggy s ALA 551 N 1.47 3.51 -0.04 7.40 0.00 -0.27 -0.98 121.76 132.85 1ggy s ALA 551 Ca 0.07 -0.34 0.00 0.00 0.00 0.00 0.00 51.96 51.70 1ggy s ALA 551 Cb -0.18 -2.48 0.02 0.00 0.00 0.00 0.00 23.12 20.48 1ggy s ALA 551 CO -0.18 0.25 -0.02 0.71 0.00 0.00 0.00 175.76 176.53 1ggy s TYR 552 N -2.08 0.55 -0.15 0.00 2.02 0.30 -1.03 117.35 116.95 1ggy s TYR 552 Ca 0.48 -0.11 -0.01 0.00 -0.37 0.00 0.00 57.07 57.06 1ggy s TYR 552 Cb -0.11 -0.57 -0.01 0.00 -0.40 0.00 0.00 41.96 40.87 1ggy s TYR 552 CO 0.27 -0.18 -0.11 -1.17 -1.57 0.00 0.00 175.55 172.79 1ggy s LEU 553 N 1.09 2.74 -0.17 -1.29 1.98 0.12 -1.63 118.68 121.52 1ggy s LEU 553 Ca -0.09 -0.35 0.01 0.00 -2.89 0.00 0.00 54.13 50.81 1ggy s LEU 553 Cb -0.14 -1.64 0.03 0.00 0.66 0.00 0.00 46.19 45.10 1ggy s LEU 553 CO -0.01 0.12 -0.15 -0.55 -1.89 0.00 0.00 176.35 173.87 1ggy s SER 554 N 0.65 2.95 -0.28 3.68 0.15 0.36 -1.66 113.70 119.55 1ggy s SER 554 Ca -0.06 -0.62 -0.03 0.00 0.70 0.00 0.00 55.95 55.94 1ggy s SER 554 Cb -0.15 -1.26 0.03 0.00 -1.71 0.00 0.00 66.02 62.93 1ggy s SER 554 CO 0.02 -0.06 -0.00 0.00 1.20 0.00 0.00 173.24 174.40 1ggy s ALA 555 N 1.42 2.83 0.02 5.45 0.00 0.09 -0.32 121.76 131.25 1ggy s ALA 555 Ca 0.04 -1.61 0.06 0.00 0.00 0.00 0.00 51.96 50.45 1ggy s ALA 555 Cb -0.14 -1.91 -0.03 0.00 0.00 0.00 0.00 23.12 21.04 1ggy s ALA 555 CO -0.11 -1.06 -0.17 -0.80 0.00 0.00 0.00 175.76 173.62 1ggy s ASN 556 N 1.33 3.83 -0.03 0.00 0.01 -0.23 0.08 114.94 119.93 1ggy s ASN 556 Ca -0.02 -0.38 -0.22 0.00 -0.71 0.00 0.00 52.86 51.53 1ggy s ASN 556 Cb -0.18 -0.65 -0.05 0.00 0.41 0.00 0.00 41.25 40.78 1ggy s ASN 556 CO -0.01 0.27 0.66 -0.63 -1.51 0.00 0.00 177.10 175.88 1ggy s ILE 557 N -0.89 4.96 0.16 0.60 1.01 0.65 -0.41 121.20 127.28 1ggy s ILE 557 Ca 0.14 1.37 -0.06 0.00 0.00 0.00 0.00 60.65 62.11 1ggy s ILE 557 Cb -0.11 -4.00 -0.02 0.00 0.01 0.00 0.00 42.46 38.34 1ggy s ILE 557 CO 0.04 0.33 0.21 0.42 0.00 0.00 0.00 174.94 175.94 1ggy s THR 558 N 0.31 0.06 0.74 2.92 -4.23 -0.88 -0.77 115.64 113.78 1ggy s THR 558 Ca 0.35 -1.63 -0.10 0.00 -1.18 0.00 0.00 61.69 59.13 1ggy s THR 558 Cb -0.18 -2.01 0.05 0.00 1.34 0.00 0.00 72.50 71.70 1ggy s THR 558 CO 0.18 -0.29 1.10 -0.36 -0.54 0.00 0.00 174.62 174.70 1ggy s PHE 559 N -4.02 3.07 0.17 3.99 0.08 -0.38 -4.15 117.98 116.73 1ggy s PHE 559 Ca 0.22 0.75 0.30 0.00 0.12 0.00 0.00 56.93 58.32 1ggy s PHE 559 Cb 0.05 -3.25 1.28 0.00 -0.57 0.00 0.00 43.02 40.53 1ggy s PHE 559 CO 0.03 -1.45 1.96 0.10 -0.10 0.00 0.00 175.22 175.75 1ggy h TYR 560 N -0.77 0.00 0.00 0.36 -0.00 -1.93 -2.51 116.97 112.12 1ggy h TYR 560 Ca -0.45 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.28 1ggy h TYR 560 Cb 1.30 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 38.03 1ggy h TYR 560 CO 0.38 0.08 0.00 0.25 -0.00 0.00 0.00 178.16 178.88 1ggy n THR 561 N -3.24 0.70 0.00 -0.90 -2.24 -1.26 0.04 114.28 107.38 1ggy n THR 561 Ca 0.00 0.18 0.00 0.00 -2.27 0.00 0.00 64.05 61.96 1ggy n THR 561 Cb 0.33 -0.91 0.00 0.00 -2.10 0.00 0.00 70.33 67.65 1ggy n THR 561 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ggy n GLY 562 N 0.07 0.24 3.68 3.38 0.00 -0.95 -3.50 105.19 108.12 1ggy n GLY 562 Ca 0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.66 1ggy n GLY 562 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ggy s VAL 563 N -2.08 3.84 0.62 1.61 1.01 -1.26 -4.80 120.40 119.34 1ggy s VAL 563 Ca 0.00 1.15 -0.13 0.00 0.00 0.00 0.00 61.98 63.01 1ggy s VAL 563 Cb 0.00 -3.74 -0.03 0.00 0.00 0.00 0.00 36.38 32.61 1ggy s VAL 563 CO 0.00 -0.03 1.04 -2.16 0.00 0.00 0.00 175.10 173.94 1ggy s PRO 564 N 2.82 3.41 0.00 2.72 0.04 -1.26 -1.25 135.00 141.48 1ggy s PRO 564 Ca 0.63 0.92 0.00 0.00 0.04 0.00 0.00 61.00 62.59 1ggy s PRO 564 Cb -0.29 -2.05 0.00 0.00 0.04 0.00 0.00 34.50 32.19 1ggy s PRO 564 CO 0.24 -0.72 0.00 1.17 0.04 0.00 0.00 177.00 177.73 1ggy n LYS 565 N -2.55 2.09 -3.59 4.56 0.00 0.05 -4.90 118.16 113.83 1ggy n LYS 565 Ca 0.07 0.00 -0.08 0.00 0.00 0.00 0.00 58.31 58.30 1ggy n LYS 565 Cb 0.54 -1.00 -0.04 0.00 0.00 0.00 0.00 35.03 34.53 1ggy n LYS 565 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1ggy s ALA 566 N -1.99 -1.97 -0.40 3.14 0.00 -1.20 -4.99 121.76 114.34 1ggy s ALA 566 Ca 0.00 1.60 -0.18 0.00 0.00 0.00 0.00 51.96 53.38 1ggy s ALA 566 Cb 0.00 -0.73 0.01 0.00 0.00 0.00 0.00 23.12 22.40 1ggy s ALA 566 CO 0.00 -0.35 0.50 -2.00 0.00 0.00 0.00 175.76 173.91 1ggy s GLU 567 N -1.36 3.34 0.01 0.00 2.12 -1.26 -0.25 118.70 121.28 1ggy s GLU 567 Ca 0.02 -0.46 0.22 0.00 0.36 0.00 0.00 54.97 55.11 1ggy s GLU 567 Cb -0.01 -3.90 0.01 0.00 0.26 0.00 0.00 34.13 30.49 1ggy s GLU 567 CO -0.02 -0.80 1.04 1.97 -0.54 0.00 0.00 175.26 176.91 1ggy n PHE 568 N 5.78 0.04 -3.65 5.30 -1.74 0.11 -4.89 117.46 118.42 1ggy n PHE 568 Ca -0.05 0.01 -0.09 0.00 -0.56 0.00 0.00 57.45 56.76 1ggy n PHE 568 Cb 0.48 -0.16 -0.10 0.00 1.52 0.00 0.00 39.48 41.22 1ggy n PHE 568 CO 0.00 0.00 0.00 0.21 -0.56 0.00 0.00 176.76 176.41 1ggy s LYS 569 N -3.06 0.30 -0.01 3.97 2.20 -1.13 -4.91 119.74 117.11 1ggy s LYS 569 Ca 0.07 0.98 0.08 0.00 -0.36 0.00 0.00 55.97 56.75 1ggy s LYS 569 Cb 0.16 0.26 -0.02 0.00 -1.51 0.00 0.00 37.83 36.72 1ggy s LYS 569 CO 0.82 -0.27 -0.25 0.21 -0.36 0.00 0.00 175.35 175.49 1ggy s LYS 570 N 2.59 1.97 -0.27 4.03 2.47 -1.26 -0.73 119.74 128.53 1ggy s LYS 570 Ca -0.01 -0.93 -0.21 0.00 -1.56 0.00 0.00 55.97 53.26 1ggy s LYS 570 Cb -0.12 -1.95 0.07 0.00 -1.46 0.00 0.00 37.83 34.37 1ggy s LYS 570 CO -0.12 0.53 0.70 -2.00 0.16 0.00 0.00 175.35 174.62 1ggy s GLU 571 N -0.71 0.78 0.01 4.03 2.56 -0.67 -5.01 118.70 119.69 1ggy s GLU 571 Ca 0.10 1.09 0.04 0.00 0.00 0.00 0.00 54.97 56.20 1ggy s GLU 571 Cb -0.10 0.29 -0.01 0.00 2.00 0.00 0.00 34.13 36.31 1ggy s GLU 571 CO -0.00 -0.12 -0.13 -0.08 -0.56 0.00 0.00 175.26 174.37 1ggy s THR 572 N 0.91 1.01 -0.07 -1.70 -1.32 -1.26 0.16 115.64 113.37 1ggy s THR 572 Ca -0.04 -0.73 -0.22 0.00 -1.21 0.00 0.00 61.69 59.48 1ggy s THR 572 Cb -0.05 -0.88 0.05 0.00 -1.51 0.00 0.00 72.50 70.11 1ggy s THR 572 CO -0.08 0.14 0.51 0.72 -2.21 0.00 0.00 174.62 173.70 1ggy s PHE 573 N -0.55 -0.47 0.12 9.09 -0.12 -0.20 -5.00 117.98 120.85 1ggy s PHE 573 Ca 0.03 0.89 -0.13 0.00 -0.05 0.00 0.00 56.93 57.67 1ggy s PHE 573 Cb -0.06 0.25 -0.07 0.00 -0.63 0.00 0.00 43.02 42.51 1ggy s PHE 573 CO 0.00 -0.45 0.50 -0.51 -0.05 0.00 0.00 175.22 174.71 1ggy s ASP 574 N -0.89 6.76 -0.01 1.98 1.01 -1.26 -1.12 116.67 123.14 1ggy s ASP 574 Ca -0.09 0.98 0.01 0.00 0.71 0.00 0.00 52.55 54.16 1ggy s ASP 574 Cb -0.03 -2.25 0.01 0.00 1.01 0.00 0.00 42.92 41.66 1ggy s ASP 574 CO 0.06 0.13 -0.03 -0.69 0.21 0.00 0.00 175.17 174.84 1ggy s VAL 575 N -1.44 0.32 -0.56 -1.27 1.01 -1.03 -5.00 120.40 112.43 1ggy s VAL 575 Ca 0.36 -0.12 -0.02 0.00 0.00 0.00 0.00 61.98 62.20 1ggy s VAL 575 Cb -0.15 -0.31 0.15 0.00 0.00 0.00 0.00 36.38 36.07 1ggy s VAL 575 CO 0.19 0.12 0.36 -0.89 0.00 0.00 0.00 175.10 174.88 1ggy s THR 576 N 0.23 3.46 0.32 3.92 2.01 -1.26 -1.63 115.64 122.69 1ggy s THR 576 Ca -0.02 -2.81 -0.27 0.00 0.31 0.00 0.00 61.69 58.90 1ggy s THR 576 Cb -0.05 -3.30 -0.10 0.00 0.01 0.00 0.00 72.50 69.06 1ggy s THR 576 CO -0.00 -0.82 0.98 -0.76 -0.69 0.00 0.00 174.62 173.32 1ggy s LEU 577 N 0.17 4.38 0.05 4.42 1.02 -0.72 -4.91 118.68 123.08 1ggy s LEU 577 Ca 0.15 1.94 -0.12 0.00 0.02 0.00 0.00 54.13 56.12 1ggy s LEU 577 Cb -0.21 -3.93 -0.06 0.00 0.02 0.00 0.00 46.19 42.01 1ggy s LEU 577 CO -0.03 -0.12 0.41 -0.70 0.02 0.00 0.00 176.35 175.93 1ggy s GLU 578 N -1.92 3.84 0.23 1.70 2.56 -1.26 -2.48 118.70 121.38 1ggy s GLU 578 Ca 0.49 0.30 -0.31 0.00 0.00 0.00 0.00 54.97 55.45 1ggy s GLU 578 Cb -0.22 -3.09 -0.13 0.00 2.00 0.00 0.00 34.13 32.68 1ggy s GLU 578 CO 0.28 0.61 1.43 -2.30 -0.56 0.00 0.00 175.26 174.72 1ggy n PRO 579 N 1.31 2.06 0.00 4.30 -0.02 -1.19 -2.28 135.00 139.18 1ggy n PRO 579 Ca -0.11 0.73 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 1ggy n PRO 579 Cb 0.52 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.60 1ggy n PRO 579 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1ggy n LEU 580 N 2.26 0.00 0.00 2.45 4.77 0.97 -4.88 117.00 122.57 1ggy n LEU 580 Ca 0.12 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 1ggy n LEU 580 Cb 0.31 -0.32 0.00 0.00 -2.33 0.00 0.00 43.42 41.08 1ggy n LEU 580 CO 0.63 0.00 0.00 -1.54 -1.33 0.00 0.00 177.39 175.15 1ggy n SER 581 N 0.00 0.00 -1.67 -1.43 3.41 -0.96 -4.78 113.62 108.18 1ggy n SER 581 Ca 0.00 0.00 -0.02 0.00 -0.26 0.00 0.00 58.87 58.59 1ggy n SER 581 Cb 0.00 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 63.96 1ggy n SER 581 CO 0.00 0.00 0.00 2.22 -0.16 0.00 0.00 175.04 177.10 1ggy n PHE 582 N 0.00 -1.06 -3.41 7.33 1.16 -1.26 -3.80 117.46 116.41 1ggy n PHE 582 Ca 0.00 -0.48 0.03 0.00 -1.87 0.00 0.00 57.45 55.13 1ggy n PHE 582 Cb 0.00 0.24 -0.05 0.00 -1.61 0.00 0.00 39.48 38.06 1ggy n PHE 582 CO 0.00 0.00 0.00 0.21 -1.87 0.00 0.00 176.76 175.10 1ggy s LYS 583 N -2.02 0.07 -0.07 3.97 2.20 0.02 -4.54 119.74 119.36 1ggy s LYS 583 Ca 0.06 0.14 0.03 0.00 -0.36 0.00 0.00 55.97 55.84 1ggy s LYS 583 Cb -0.01 0.05 -0.02 0.00 -1.51 0.00 0.00 37.83 36.34 1ggy s LYS 583 CO 0.03 -0.02 -0.15 0.21 -0.36 0.00 0.00 175.35 175.06 1ggy s LYS 584 N 1.61 2.75 -0.14 4.03 2.20 -1.26 0.34 119.74 129.27 1ggy s LYS 584 Ca -0.04 -0.71 0.01 0.00 -0.36 0.00 0.00 55.97 54.87 1ggy s LYS 584 Cb -0.02 -2.43 0.02 0.00 -1.51 0.00 0.00 37.83 33.89 1ggy s LYS 584 CO -0.13 0.50 -0.15 -1.21 -0.36 0.00 0.00 175.35 174.00 1ggy s GLU 585 N -0.40 2.28 -0.24 4.03 0.41 0.92 -4.99 118.70 120.72 1ggy s GLU 585 Ca 0.04 -0.56 -0.06 0.00 -0.41 0.00 0.00 54.97 53.98 1ggy s GLU 585 Cb -0.12 -2.04 -0.02 0.00 -1.78 0.00 0.00 34.13 30.16 1ggy s GLU 585 CO 0.02 -0.18 0.04 0.00 -0.49 0.00 0.00 175.26 174.65 1ggy s ALA 586 N 1.33 3.08 0.01 5.21 0.00 -1.26 -0.32 121.76 129.81 1ggy s ALA 586 Ca 0.01 -1.12 -0.01 0.00 0.00 0.00 0.00 51.96 50.85 1ggy s ALA 586 Cb -0.13 -1.97 -0.04 0.00 0.00 0.00 0.00 23.12 20.98 1ggy s ALA 586 CO -0.08 -0.44 0.12 0.08 0.00 0.00 0.00 175.76 175.45 1ggy s VAL 587 N 1.52 4.97 -0.17 0.00 1.01 0.45 -4.97 120.40 123.21 1ggy s VAL 587 Ca 0.06 -0.38 0.01 0.00 0.00 0.00 0.00 61.98 61.67 1ggy s VAL 587 Cb -0.15 -3.32 0.02 0.00 0.00 0.00 0.00 36.38 32.93 1ggy s VAL 587 CO 0.02 0.29 -0.20 -0.22 0.00 0.00 0.00 175.10 175.00 1ggy s LEU 588 N -1.95 2.17 -0.33 3.92 1.98 -1.26 -1.22 118.68 121.99 1ggy s LEU 588 Ca 0.26 -0.62 -0.15 0.00 -2.89 0.00 0.00 54.13 50.73 1ggy s LEU 588 Cb -0.12 -1.49 -0.02 0.00 0.66 0.00 0.00 46.19 45.23 1ggy s LEU 588 CO 0.18 0.02 0.37 -0.63 -1.89 0.00 0.00 176.35 174.40 1ggy s ILE 589 N 1.16 5.16 0.11 6.68 -1.09 0.12 -4.97 121.20 128.38 1ggy s ILE 589 Ca 0.02 0.14 -0.21 0.00 -2.23 0.00 0.00 60.65 58.36 1ggy s ILE 589 Cb -0.14 -3.81 -0.07 0.00 -1.58 0.00 0.00 42.46 36.87 1ggy s ILE 589 CO -0.09 -0.06 0.64 -1.10 -1.23 0.00 0.00 174.94 173.10 1ggy s GLN 590 N 2.04 4.32 0.38 2.79 -0.21 -1.26 -0.53 119.66 127.19 1ggy s GLN 590 Ca 0.12 0.88 0.20 0.00 0.02 0.00 0.00 55.36 56.58 1ggy s GLN 590 Cb -0.16 -3.24 1.20 0.00 1.00 0.00 0.00 33.01 31.80 1ggy s GLN 590 CO 0.12 0.62 1.67 0.00 -2.12 0.00 0.00 175.29 175.57 1ggy h ALA 591 N 4.45 2.24 0.00 6.09 0.00 -1.85 0.77 119.26 130.95 1ggy h ALA 591 Ca -0.49 0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.57 1ggy h ALA 591 Cb 1.21 0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.15 1ggy h ALA 591 CO 0.64 -0.82 0.00 0.78 0.00 0.00 0.00 179.25 179.85 1ggy h GLY 592 N 0.26 0.00 2.00 0.00 0.00 -1.92 -1.30 103.07 102.11 1ggy h GLY 592 Ca 0.74 0.00 0.00 0.00 0.00 0.00 0.00 47.33 48.07 1ggy h GLY 592 CO -0.50 0.00 0.00 0.83 0.00 0.00 0.00 176.54 176.87 1ggy h GLU 593 N 0.00 0.00 0.00 4.80 5.08 -1.21 -3.40 114.58 119.85 1ggy h GLU 593 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1ggy h GLU 593 Cb 0.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1ggy h GLU 593 CO 0.00 0.00 -0.83 2.48 -1.00 0.00 0.00 179.01 179.66 1ggy n TYR 594 N -2.74 0.00 -0.19 4.33 0.18 -0.96 -4.82 117.16 112.95 1ggy n TYR 594 Ca 0.04 0.00 0.01 0.00 1.88 0.00 0.00 57.90 59.84 1ggy n TYR 594 Cb 0.47 0.00 0.05 0.00 -0.38 0.00 0.00 39.34 39.48 1ggy n TYR 594 CO 0.00 0.00 0.00 -1.33 -2.08 0.00 0.00 176.86 173.45 1ggy n MET 595 N -2.33 -0.08 0.00 -3.48 2.81 -0.53 -1.31 117.12 112.20 1ggy n MET 595 Ca 0.00 0.80 0.04 0.00 -1.81 0.00 0.00 57.70 56.73 1ggy n MET 595 Cb 0.42 -1.19 0.20 0.00 -0.71 0.00 0.00 33.22 31.94 1ggy n MET 595 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ggy n GLY 596 N -1.29 -0.51 2.76 3.03 0.00 -1.26 -3.67 105.19 104.25 1ggy n GLY 596 Ca 0.07 -0.04 -0.01 0.00 0.00 0.00 0.00 46.02 46.04 1ggy n GLY 596 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ggy n GLN 597 N -1.25 1.56 -1.57 1.61 10.64 -0.43 -5.12 117.38 122.82 1ggy n GLN 597 Ca 0.04 -2.47 -0.30 0.00 -1.83 0.00 0.00 57.00 52.44 1ggy n GLN 597 Cb 0.06 -0.69 0.10 0.00 -0.86 0.00 0.00 30.24 28.85 1ggy n GLN 597 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1ggy s LEU 598 N -3.94 2.52 -0.06 2.61 1.43 -1.24 -4.93 118.68 115.07 1ggy s LEU 598 Ca 0.19 1.25 0.04 0.00 -1.03 0.00 0.00 54.13 54.58 1ggy s LEU 598 Cb 0.38 -3.82 0.00 0.00 0.03 0.00 0.00 46.19 42.78 1ggy s LEU 598 CO -0.08 -2.03 -0.19 -0.76 0.23 0.00 0.00 176.35 173.52 1ggy s LEU 599 N -5.80 1.91 0.00 1.79 1.43 -1.26 -5.00 118.68 111.76 1ggy s LEU 599 Ca 0.61 -0.41 0.00 0.00 -1.03 0.00 0.00 54.13 53.31 1ggy s LEU 599 Cb -0.14 -1.08 0.00 0.00 0.03 0.00 0.00 46.19 44.99 1ggy s LEU 599 CO 0.54 0.14 0.00 -0.62 0.23 0.00 0.00 176.35 176.64 1ggy n GLU 600 N 3.35 0.00 -0.30 1.70 1.02 -1.26 0.11 120.64 125.26 1ggy n GLU 600 Ca -0.19 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 56.94 1ggy n GLU 600 Cb 0.53 0.00 0.10 0.00 -0.02 0.00 0.00 31.44 32.05 1ggy n GLU 600 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1ggy n GLN 601 N 0.00 1.92 -4.00 3.49 6.02 -1.26 -4.60 117.38 118.95 1ggy n GLN 601 Ca 0.00 -0.93 -0.36 0.00 -0.01 0.00 0.00 57.00 55.70 1ggy n GLN 601 Cb 0.00 -1.61 0.01 0.00 1.02 0.00 0.00 30.24 29.66 1ggy n GLN 601 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ggy n ALA 602 N 0.13 -2.20 -2.55 -1.58 0.00 0.31 -4.55 120.51 110.06 1ggy n ALA 602 Ca 0.11 -0.45 -0.30 0.00 0.00 0.00 0.00 53.44 52.80 1ggy n ALA 602 Cb 0.63 -1.87 -0.10 0.00 0.00 0.00 0.00 19.45 18.11 1ggy n ALA 602 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1ggy s SER 603 N -3.90 4.26 0.08 0.00 1.04 -1.25 -0.97 113.70 112.96 1ggy s SER 603 Ca 0.36 -0.40 0.05 0.00 0.48 0.00 0.00 55.95 56.44 1ggy s SER 603 Cb -0.20 -0.78 -0.03 0.00 0.10 0.00 0.00 66.02 65.10 1ggy s SER 603 CO 0.74 0.19 -0.15 -0.76 0.98 0.00 0.00 173.24 174.25 1ggy s LEU 604 N -2.05 2.30 0.04 2.42 2.01 -0.57 -2.08 118.68 120.75 1ggy s LEU 604 Ca 0.20 -0.66 0.07 0.00 0.01 0.00 0.00 54.13 53.75 1ggy s LEU 604 Cb -0.11 -0.54 -0.02 0.00 0.01 0.00 0.00 46.19 45.52 1ggy s LEU 604 CO 0.12 -0.08 -0.20 -2.28 1.01 0.00 0.00 176.35 174.92 1ggy s HIS 605 N -1.44 1.72 -0.06 0.29 2.46 0.45 -1.78 115.29 116.93 1ggy s HIS 605 Ca 0.01 -0.37 0.04 0.00 0.47 0.00 0.00 55.06 55.21 1ggy s HIS 605 Cb -0.09 -1.03 -0.00 0.00 -0.13 0.00 0.00 32.58 31.33 1ggy s HIS 605 CO 0.02 0.08 -0.20 -0.06 -2.47 0.00 0.00 174.74 172.11 1ggy s PHE 606 N -0.80 2.06 -0.22 3.88 0.08 -0.38 -1.07 117.98 121.53 1ggy s PHE 606 Ca 0.07 -0.68 -0.01 0.00 0.12 0.00 0.00 56.93 56.42 1ggy s PHE 606 Cb -0.09 -1.38 0.01 0.00 -0.57 0.00 0.00 43.02 40.99 1ggy s PHE 606 CO 0.02 -0.25 -0.10 -0.06 -0.10 0.00 0.00 175.22 174.73 1ggy s PHE 607 N 0.14 2.94 -0.25 0.36 0.08 0.57 -2.33 117.98 119.49 1ggy s PHE 607 Ca -0.09 -1.39 0.02 0.00 0.12 0.00 0.00 56.93 55.60 1ggy s PHE 607 Cb -0.14 -2.03 0.06 0.00 -0.57 0.00 0.00 43.02 40.34 1ggy s PHE 607 CO 0.04 -0.70 -0.08 0.08 -0.10 0.00 0.00 175.22 174.46 1ggy s VAL 608 N 1.36 1.92 -0.00 -0.44 1.01 0.53 -0.48 120.40 124.29 1ggy s VAL 608 Ca 0.03 -1.49 0.07 0.00 0.00 0.00 0.00 61.98 60.59 1ggy s VAL 608 Cb -0.15 -2.10 -0.02 0.00 0.00 0.00 0.00 36.38 34.12 1ggy s VAL 608 CO -0.07 -0.07 -0.22 0.42 0.00 0.00 0.00 175.10 175.16 1ggy s THR 609 N 1.21 1.71 0.09 3.92 -4.23 -0.65 0.85 115.64 118.55 1ggy s THR 609 Ca -0.07 -1.00 0.04 0.00 -1.18 0.00 0.00 61.69 59.48 1ggy s THR 609 Cb -0.20 -1.44 -0.03 0.00 1.34 0.00 0.00 72.50 72.17 1ggy s THR 609 CO -0.06 0.42 -0.11 0.00 -0.54 0.00 0.00 174.62 174.33 1ggy s ALA 610 N -0.58 1.10 -0.12 3.99 0.00 0.21 0.11 121.76 126.46 1ggy s ALA 610 Ca 0.08 -1.10 -0.01 0.00 0.00 0.00 0.00 51.96 50.94 1ggy s ALA 610 Cb -0.08 -0.01 0.03 0.00 0.00 0.00 0.00 23.12 23.05 1ggy s ALA 610 CO -0.00 0.03 -0.07 0.50 0.00 0.00 0.00 175.76 176.22 1ggy s ARG 611 N -2.39 1.45 -0.95 0.00 3.52 -0.16 -0.96 118.95 119.46 1ggy s ARG 611 Ca 0.02 -0.26 -0.17 0.00 -0.13 0.00 0.00 55.73 55.19 1ggy s ARG 611 Cb -0.06 -1.60 0.15 0.00 -1.56 0.00 0.00 34.95 31.88 1ggy s ARG 611 CO 0.01 -0.29 1.11 0.42 -0.81 0.00 0.00 175.30 175.74 1ggy s ILE 612 N 1.72 4.92 -0.22 4.11 1.01 -0.84 -1.06 121.20 130.84 1ggy s ILE 612 Ca 0.04 -1.88 0.03 0.00 0.00 0.00 0.00 60.65 58.85 1ggy s ILE 612 Cb -0.13 -4.75 0.03 0.00 0.01 0.00 0.00 42.46 37.62 1ggy s ILE 612 CO -0.08 -1.45 0.84 -0.46 0.00 0.00 0.00 174.94 173.79 1ggy n ASN 613 N 5.98 0.08 0.01 3.58 2.04 -1.04 -0.01 115.26 125.90 1ggy n ASN 613 Ca 0.24 0.28 -0.00 0.00 -0.44 0.00 0.00 54.58 54.66 1ggy n ASN 613 Cb 0.48 -0.24 -0.00 0.00 -2.53 0.00 0.00 39.78 37.48 1ggy n ASN 613 CO 0.00 0.00 0.00 -0.33 -0.44 0.00 0.00 177.26 176.49 1ggy h GLU 614 N 0.00 -0.03 -0.00 -3.83 3.07 -1.91 -3.39 114.58 108.49 1ggy h GLU 614 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 1ggy h GLU 614 Cb 0.71 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.62 1ggy h GLU 614 CO 0.00 -0.02 -0.29 0.25 -1.40 0.00 0.00 179.01 177.55 1ggy n THR 615 N -2.30 0.00 -0.77 1.13 -2.24 -0.70 -4.94 114.28 104.46 1ggy n THR 615 Ca -0.00 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.74 1ggy n THR 615 Cb 0.01 0.09 0.00 0.00 -2.10 0.00 0.00 70.33 68.33 1ggy n THR 615 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1ggy n ARG 616 N -1.22 -0.00 -1.95 -0.78 5.12 0.98 -4.96 116.66 113.85 1ggy n ARG 616 Ca 0.09 0.00 -0.39 0.00 -1.93 0.00 0.00 57.85 55.62 1ggy n ARG 616 Cb 0.33 -3.43 0.01 0.00 -1.16 0.00 0.00 32.46 28.21 1ggy n ARG 616 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1ggy s ASP 617 N -2.54 5.93 0.03 0.55 1.11 -1.25 -4.78 116.67 115.72 1ggy s ASP 617 Ca 0.00 2.70 0.05 0.00 0.18 0.00 0.00 52.55 55.48 1ggy s ASP 617 Cb 0.00 -2.64 -0.03 0.00 1.07 0.00 0.00 42.92 41.32 1ggy s ASP 617 CO 0.00 -1.12 -0.12 -0.69 1.18 0.00 0.00 175.17 174.42 1ggy s VAL 618 N -1.30 3.21 -0.08 -1.27 1.01 -1.26 -1.99 120.40 118.72 1ggy s VAL 618 Ca 0.62 -1.02 0.02 0.00 0.00 0.00 0.00 61.98 61.61 1ggy s VAL 618 Cb -0.39 -2.39 0.01 0.00 0.00 0.00 0.00 36.38 33.62 1ggy s VAL 618 CO 0.48 0.34 -0.13 -0.76 0.00 0.00 0.00 175.10 175.03 1ggy s LEU 619 N -1.50 1.65 0.02 3.92 1.43 -0.14 -4.82 118.68 119.24 1ggy s LEU 619 Ca 0.16 -0.35 0.02 0.00 -1.03 0.00 0.00 54.13 52.93 1ggy s LEU 619 Cb -0.11 -0.94 -0.01 0.00 0.03 0.00 0.00 46.19 45.16 1ggy s LEU 619 CO 0.07 0.02 -0.07 0.00 0.23 0.00 0.00 176.35 176.60 1ggy s ALA 620 N 0.82 0.59 -0.00 4.21 0.00 -1.26 0.64 121.76 126.76 1ggy s ALA 620 Ca -0.11 -0.49 -0.10 0.00 0.00 0.00 0.00 51.96 51.26 1ggy s ALA 620 Cb -0.15 -0.07 0.01 0.00 0.00 0.00 0.00 23.12 22.90 1ggy s ALA 620 CO 0.02 0.08 0.20 0.15 0.00 0.00 0.00 175.76 176.20 1ggy s LYS 621 N -0.75 0.54 -0.06 0.00 -0.14 0.25 -4.97 119.74 114.61 1ggy s LYS 621 Ca -0.02 -0.32 -0.08 0.00 -1.36 0.00 0.00 55.97 54.20 1ggy s LYS 621 Cb -0.06 0.23 0.02 0.00 -1.68 0.00 0.00 37.83 36.34 1ggy s LYS 621 CO 0.00 -0.14 0.20 1.14 -0.76 0.00 0.00 175.35 175.80 1ggy s GLN 622 N -1.34 0.30 0.13 1.68 -2.07 -1.26 -0.35 119.66 116.75 1ggy s GLN 622 Ca -0.14 0.16 -0.02 0.00 -1.82 0.00 0.00 55.36 53.53 1ggy s GLN 622 Cb -0.07 0.14 -0.03 0.00 -1.09 0.00 0.00 33.01 31.96 1ggy s GLN 622 CO 0.02 -0.05 0.09 0.15 -1.32 0.00 0.00 175.29 174.18 1ggy s LYS 623 N -0.19 0.94 0.06 9.60 1.02 -0.98 -5.00 119.74 125.18 1ggy s LYS 623 Ca -0.03 -1.37 0.05 0.00 0.02 0.00 0.00 55.97 54.64 1ggy s LYS 623 Cb -0.03 0.26 -0.03 0.00 -0.52 0.00 0.00 37.83 37.52 1ggy s LYS 623 CO 0.01 -0.27 -0.14 -1.12 -0.92 0.00 0.00 175.35 172.91 1ggy s SER 624 N -3.02 1.61 -0.03 2.83 0.01 -1.26 -1.25 113.70 112.58 1ggy s SER 624 Ca 0.21 -0.54 -0.03 0.00 1.31 0.00 0.00 55.95 56.91 1ggy s SER 624 Cb 0.07 -0.07 0.01 0.00 0.21 0.00 0.00 66.02 66.24 1ggy s SER 624 CO 0.00 -0.04 0.08 0.42 0.41 0.00 0.00 173.24 174.12 1ggy s THR 625 N -1.09 -0.00 -0.18 1.44 -4.23 -0.73 -4.94 115.64 105.90 1ggy s THR 625 Ca -0.01 0.01 -0.02 0.00 -1.18 0.00 0.00 61.69 60.49 1ggy s THR 625 Cb -0.09 -0.12 -0.01 0.00 1.34 0.00 0.00 72.50 73.62 1ggy s THR 625 CO 0.02 0.00 -0.08 0.68 -0.54 0.00 0.00 174.62 174.70 1ggy s VAL 626 N 0.09 3.26 0.45 2.29 -7.23 -1.26 -1.52 120.40 116.48 1ggy s VAL 626 Ca -0.00 -0.56 -0.24 0.00 -1.81 0.00 0.00 61.98 59.37 1ggy s VAL 626 Cb -0.01 -2.43 -0.08 0.00 0.56 0.00 0.00 36.38 34.42 1ggy s VAL 626 CO -0.00 0.47 1.27 -0.76 -0.31 0.00 0.00 175.10 175.78 1ggy s LEU 627 N 0.94 4.09 0.08 1.32 1.43 -0.14 -4.77 118.68 121.63 1ggy s LEU 627 Ca -0.01 2.58 -0.15 0.00 -1.03 0.00 0.00 54.13 55.51 1ggy s LEU 627 Cb -0.15 -4.07 -0.06 0.00 0.03 0.00 0.00 46.19 41.94 1ggy s LEU 627 CO 0.00 -1.01 0.50 -0.89 0.23 0.00 0.00 176.35 175.18 1ggy s THR 628 N -1.35 4.90 -0.01 5.49 2.01 -0.56 -4.80 115.64 121.31 1ggy s THR 628 Ca 0.61 0.90 0.04 0.00 0.31 0.00 0.00 61.69 63.55 1ggy s THR 628 Cb -0.36 -3.76 -0.01 0.00 0.01 0.00 0.00 72.50 68.38 1ggy s THR 628 CO 0.45 0.43 -0.13 -0.63 -0.69 0.00 0.00 174.62 174.05 1ggy s ILE 629 N -1.25 1.00 0.37 1.82 1.01 -1.26 -0.69 121.20 122.20 1ggy s ILE 629 Ca 0.31 -0.53 -0.27 0.00 0.00 0.00 0.00 60.65 60.15 1ggy s ILE 629 Cb -0.17 -0.85 -0.10 0.00 0.01 0.00 0.00 42.46 41.36 1ggy s ILE 629 CO 0.17 0.29 1.30 -2.16 0.00 0.00 0.00 174.94 174.55 1ggy s PRO 630 N -0.20 4.18 1.05 2.79 0.04 -1.26 -5.01 135.00 136.59 1ggy s PRO 630 Ca 0.03 2.19 -0.16 0.00 0.04 0.00 0.00 61.00 63.10 1ggy s PRO 630 Cb -0.06 -2.93 0.22 0.00 0.04 0.00 0.00 34.50 31.77 1ggy s PRO 630 CO -0.00 -0.32 1.15 -1.21 0.04 0.00 0.00 177.00 176.65 1ggy s GLU 631 N -2.00 0.01 0.19 4.56 0.41 -1.26 -4.89 118.70 115.71 1ggy s GLU 631 Ca 0.52 0.07 -0.15 0.00 -0.41 0.00 0.00 54.97 55.01 1ggy s GLU 631 Cb -0.39 -1.73 -0.07 0.00 -1.78 0.00 0.00 34.13 30.16 1ggy s GLU 631 CO 0.51 -2.92 0.60 0.42 -0.49 0.00 0.00 175.26 173.38 1ggy s ILE 632 N -3.22 4.79 -0.18 -1.63 1.01 -0.56 -4.84 121.20 116.57 1ggy s ILE 632 Ca 0.68 0.90 -0.10 0.00 0.00 0.00 0.00 60.65 62.13 1ggy s ILE 632 Cb -0.12 -3.74 -0.05 0.00 0.01 0.00 0.00 42.46 38.57 1ggy s ILE 632 CO 0.55 0.16 0.17 -0.63 0.00 0.00 0.00 174.94 175.19 1ggy s ILE 633 N -1.56 5.40 -0.11 2.92 -1.09 0.51 -4.45 121.20 122.82 1ggy s ILE 633 Ca 0.41 0.27 0.01 0.00 -2.23 0.00 0.00 60.65 59.12 1ggy s ILE 633 Cb -0.15 -3.50 0.02 0.00 -1.58 0.00 0.00 42.46 37.26 1ggy s ILE 633 CO 0.20 0.46 -0.14 -0.63 -1.23 0.00 0.00 174.94 173.60 1ggy s ILE 634 N 0.17 1.41 -0.02 2.92 1.01 -1.26 -0.07 121.20 125.36 1ggy s ILE 634 Ca 0.11 -0.57 0.03 0.00 0.00 0.00 0.00 60.65 60.21 1ggy s ILE 634 Cb -0.12 -1.31 -0.00 0.00 0.01 0.00 0.00 42.46 41.04 1ggy s ILE 634 CO 0.00 0.42 -0.10 -1.59 0.00 0.00 0.00 174.94 173.68 1ggy s LYS 635 N 1.13 0.89 -0.04 2.79 -2.85 0.10 -4.79 119.74 116.97 1ggy s LYS 635 Ca -0.04 -0.33 -0.09 0.00 -1.00 0.00 0.00 55.97 54.51 1ggy s LYS 635 Cb -0.14 -0.84 -0.05 0.00 -2.06 0.00 0.00 37.83 34.74 1ggy s LYS 635 CO -0.03 0.16 0.26 0.14 0.10 0.00 0.00 175.35 175.98 1ggy s VAL 636 N -0.02 5.31 -0.35 1.79 -7.23 -1.26 -0.36 120.40 118.27 1ggy s VAL 636 Ca 0.00 0.35 0.00 0.00 -1.81 0.00 0.00 61.98 60.53 1ggy s VAL 636 Cb -0.06 -3.54 0.14 0.00 0.56 0.00 0.00 36.38 33.48 1ggy s VAL 636 CO 0.00 0.51 0.22 -0.60 -0.31 0.00 0.00 175.10 174.91 1ggy s ARG 637 N -1.34 0.56 0.00 4.82 3.52 0.50 -4.97 118.95 122.05 1ggy s ARG 637 Ca 0.22 -1.36 0.00 0.00 -0.13 0.00 0.00 55.73 54.46 1ggy s ARG 637 Cb -0.14 -1.31 0.00 0.00 -1.56 0.00 0.00 34.95 31.95 1ggy s ARG 637 CO 0.11 -1.22 0.00 0.41 -0.81 0.00 0.00 175.30 173.80 1ggy n GLY 638 N 4.00 -0.59 3.62 8.12 0.00 -1.26 0.28 105.19 119.35 1ggy n GLY 638 Ca 0.13 -0.63 -0.38 0.00 0.00 0.00 0.00 46.02 45.13 1ggy n GLY 638 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ggy s THR 639 N -3.90 5.24 -0.12 2.61 2.01 0.14 -4.92 115.64 116.69 1ggy s THR 639 Ca 0.00 0.44 -0.02 0.00 0.31 0.00 0.00 61.69 62.42 1ggy s THR 639 Cb 0.00 -3.63 -0.03 0.00 0.01 0.00 0.00 72.50 68.85 1ggy s THR 639 CO 0.00 0.22 2.56 0.00 -0.69 0.00 0.00 174.62 176.72 1ggy n GLN 640 N 4.96 1.62 -5.15 4.92 3.00 -1.26 -4.21 117.38 121.26 1ggy n GLN 640 Ca -0.11 -0.90 -0.32 0.00 -0.01 0.00 0.00 57.00 55.67 1ggy n GLN 640 Cb 0.51 -1.55 -0.15 0.00 0.00 0.00 0.00 30.24 29.05 1ggy n GLN 640 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 1ggy s VAL 641 N -0.47 2.37 0.22 5.09 1.01 -1.26 -0.73 120.40 126.63 1ggy s VAL 641 Ca 0.33 -0.97 -0.32 0.00 0.00 0.00 0.00 61.98 61.02 1ggy s VAL 641 Cb 0.19 -1.88 -0.14 0.00 0.00 0.00 0.00 36.38 34.55 1ggy s VAL 641 CO -0.03 0.58 1.43 0.52 0.00 0.00 0.00 175.10 177.60 1ggy n VAL 642 N 2.67 0.78 0.00 2.92 0.31 -0.48 -1.34 118.33 123.19 1ggy n VAL 642 Ca -0.17 -0.20 0.00 0.00 -0.01 0.00 0.00 64.34 63.97 1ggy n VAL 642 Cb 0.52 -1.46 0.00 0.00 -0.91 0.00 0.00 33.84 31.98 1ggy n VAL 642 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1ggy n GLY 643 N 2.36 2.89 3.90 2.92 0.00 0.06 -4.96 105.19 112.35 1ggy n GLY 643 Ca 0.13 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.86 1ggy n GLY 643 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ggy s SER 644 N -0.38 6.40 0.37 1.61 0.01 -0.45 -4.92 113.70 116.33 1ggy s SER 644 Ca 0.00 0.91 -0.13 0.00 1.31 0.00 0.00 55.95 58.04 1ggy s SER 644 Cb 0.00 -2.23 -0.08 0.00 0.21 0.00 0.00 66.02 63.92 1ggy s SER 644 CO 0.00 -0.41 0.77 -1.81 0.41 0.00 0.00 173.24 172.20 1ggy s ASP 645 N -3.56 6.67 -0.08 2.44 1.01 -1.26 -4.05 116.67 117.83 1ggy s ASP 645 Ca 0.47 1.25 -0.10 0.00 0.71 0.00 0.00 52.55 54.88 1ggy s ASP 645 Cb -0.10 -2.36 0.02 0.00 1.01 0.00 0.00 42.92 41.49 1ggy s ASP 645 CO 0.36 -0.31 0.27 0.00 0.21 0.00 0.00 175.17 175.69 1ggy s MET 646 N -3.41 0.38 -0.44 8.23 0.23 -0.93 -0.69 119.30 122.67 1ggy s MET 646 Ca 0.53 0.23 -0.13 0.00 -1.03 0.00 0.00 55.69 55.30 1ggy s MET 646 Cb -0.10 0.18 0.07 0.00 -1.53 0.00 0.00 34.83 33.45 1ggy s MET 646 CO 0.24 -0.06 0.33 0.99 -2.03 0.00 0.00 175.02 174.48 1ggy s THR 647 N -0.19 4.77 0.09 3.16 2.01 0.14 -0.58 115.64 125.04 1ggy s THR 647 Ca -0.03 -1.20 -0.30 0.00 0.31 0.00 0.00 61.69 60.47 1ggy s THR 647 Cb -0.03 -3.87 -0.05 0.00 0.01 0.00 0.00 72.50 68.56 1ggy s THR 647 CO 0.01 -0.53 1.00 -0.69 -0.69 0.00 0.00 174.62 173.72 1ggy s VAL 648 N 1.54 4.48 -0.14 3.82 1.01 0.39 -0.37 120.40 131.13 1ggy s VAL 648 Ca 0.03 1.96 0.02 0.00 0.00 0.00 0.00 61.98 64.00 1ggy s VAL 648 Cb -0.23 -4.26 0.01 0.00 0.00 0.00 0.00 36.38 31.90 1ggy s VAL 648 CO 0.05 0.26 -0.20 -0.89 0.00 0.00 0.00 175.10 174.31 1ggy s THR 649 N 0.30 1.93 -0.23 3.92 2.01 0.51 0.50 115.64 124.58 1ggy s THR 649 Ca 0.49 -0.89 0.01 0.00 0.31 0.00 0.00 61.69 61.62 1ggy s THR 649 Cb -0.24 -1.72 0.04 0.00 0.01 0.00 0.00 72.50 70.58 1ggy s THR 649 CO 0.30 0.52 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.93 1ggy s VAL 650 N 0.98 2.28 -0.04 3.82 1.01 -0.68 -0.72 120.40 127.06 1ggy s VAL 650 Ca -0.04 -1.25 0.06 0.00 0.00 0.00 0.00 61.98 60.74 1ggy s VAL 650 Cb -0.15 -2.17 -0.02 0.00 0.00 0.00 0.00 36.38 34.04 1ggy s VAL 650 CO -0.05 0.23 -0.20 -1.83 0.00 0.00 0.00 175.10 173.25 1ggy s GLU 651 N 1.22 2.37 0.02 2.72 -1.05 0.89 -1.87 118.70 123.00 1ggy s GLU 651 Ca -0.02 -0.82 0.04 0.00 -0.15 0.00 0.00 54.97 54.03 1ggy s GLU 651 Cb -0.17 -2.22 -0.02 0.00 -0.44 0.00 0.00 34.13 31.28 1ggy s GLU 651 CO -0.08 0.56 -0.13 0.12 0.95 0.00 0.00 175.26 176.68 1ggy s PHE 652 N -0.58 1.10 -0.18 4.83 5.36 -0.95 -0.36 117.98 127.20 1ggy s PHE 652 Ca 0.08 -0.28 0.01 0.00 -0.96 0.00 0.00 56.93 55.78 1ggy s PHE 652 Cb -0.11 -0.68 0.04 0.00 -0.34 0.00 0.00 43.02 41.93 1ggy s PHE 652 CO 0.00 0.00 -0.12 0.99 -1.46 0.00 0.00 175.22 174.64 1ggy s THR 653 N -0.60 1.64 -0.33 0.12 2.01 -1.26 -0.93 115.64 116.30 1ggy s THR 653 Ca 0.02 -0.89 -0.30 0.00 0.31 0.00 0.00 61.69 60.84 1ggy s THR 653 Cb -0.06 -1.65 -0.07 0.00 0.01 0.00 0.00 72.50 70.72 1ggy s THR 653 CO 0.00 0.27 2.27 -3.20 -0.69 0.00 0.00 174.62 173.28 1ggy n ASN 654 N 4.71 2.71 0.09 3.53 2.85 0.10 -4.82 115.26 124.44 1ggy n ASN 654 Ca -0.16 0.11 -0.05 0.00 -0.11 0.00 0.00 54.58 54.38 1ggy n ASN 654 Cb 0.48 -1.47 0.01 0.00 1.24 0.00 0.00 39.78 40.03 1ggy n ASN 654 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1ggy h PRO 655 N 15.23 0.02 -7.29 1.20 0.13 -1.94 0.37 132.00 139.72 1ggy h PRO 655 Ca -0.33 -0.03 -0.47 0.00 -0.87 0.00 0.00 66.00 64.30 1ggy h PRO 655 Cb 1.27 0.01 0.17 0.00 0.13 0.00 0.00 31.00 32.57 1ggy h PRO 655 CO 1.03 0.84 0.18 -0.51 -0.23 0.00 0.00 178.00 179.31 1ggy s LEU 656 N -7.15 1.83 -0.19 1.56 1.43 -1.26 -4.69 118.68 110.21 1ggy s LEU 656 Ca -0.00 1.49 0.14 0.00 -1.03 0.00 0.00 54.13 54.73 1ggy s LEU 656 Cb 0.11 -3.73 0.74 0.00 0.03 0.00 0.00 46.19 43.34 1ggy s LEU 656 CO 0.80 -3.16 1.63 0.29 0.23 0.00 0.00 176.35 176.15 1ggy n LYS 657 N -4.22 4.32 -4.32 1.70 4.01 -1.26 -3.03 118.16 115.36 1ggy n LYS 657 Ca 0.06 -2.85 -0.17 0.00 -0.51 0.00 0.00 58.31 54.84 1ggy n LYS 657 Cb 0.55 -2.11 -0.10 0.00 -0.51 0.00 0.00 35.03 32.86 1ggy n LYS 657 CO 0.00 0.00 0.00 -1.83 -1.11 0.00 0.00 177.40 174.46 1ggy s GLU 658 N -2.40 1.27 0.03 1.97 -1.05 -1.26 -4.78 118.70 112.48 1ggy s GLU 658 Ca 0.50 -1.60 -0.30 0.00 -0.15 0.00 0.00 54.97 53.42 1ggy s GLU 658 Cb 0.36 -0.81 -0.05 0.00 -0.44 0.00 0.00 34.13 33.19 1ggy s GLU 658 CO 0.17 0.05 1.15 0.95 0.95 0.00 0.00 175.26 178.53 1ggy s THR 659 N -3.23 4.25 0.01 1.83 -4.23 -1.26 -3.82 115.64 109.20 1ggy s THR 659 Ca 0.23 1.61 -0.19 0.00 -1.18 0.00 0.00 61.69 62.17 1ggy s THR 659 Cb 0.03 -4.03 -0.06 0.00 1.34 0.00 0.00 72.50 69.78 1ggy s THR 659 CO 0.06 0.10 0.53 -0.76 -0.54 0.00 0.00 174.62 174.01 1ggy s LEU 660 N 1.25 4.46 0.10 4.79 1.43 0.19 -4.89 118.68 126.01 1ggy s LEU 660 Ca 0.57 1.12 0.09 0.00 -1.03 0.00 0.00 54.13 54.88 1ggy s LEU 660 Cb -0.27 -2.81 -0.04 0.00 0.03 0.00 0.00 46.19 43.10 1ggy s LEU 660 CO 0.28 0.21 -0.23 -0.13 0.23 0.00 0.00 176.35 176.70 1ggy s ARG 661 N -0.64 1.29 -1.35 1.70 0.52 -1.26 0.46 118.95 119.66 1ggy s ARG 661 Ca 0.28 -1.21 -0.00 0.00 -0.52 0.00 0.00 55.73 54.28 1ggy s ARG 661 Cb -0.18 -1.62 -0.00 0.00 0.52 0.00 0.00 34.95 33.67 1ggy s ARG 661 CO 0.16 0.39 0.57 0.09 0.02 0.00 0.00 175.30 176.53 1ggy n ASN 662 N 1.14 -0.75 -4.63 0.23 3.02 -0.92 -2.78 115.26 110.57 1ggy n ASN 662 Ca -0.19 -0.90 -0.43 0.00 -0.03 0.00 0.00 54.58 53.03 1ggy n ASN 662 Cb 0.53 -3.61 -0.02 0.00 -0.61 0.00 0.00 39.78 36.07 1ggy n ASN 662 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1ggy s VAL 663 N -3.80 4.38 -0.61 2.41 1.01 -0.80 -4.26 120.40 118.72 1ggy s VAL 663 Ca 0.00 1.56 -0.18 0.00 0.00 0.00 0.00 61.98 63.36 1ggy s VAL 663 Cb -0.00 -4.38 0.12 0.00 0.00 0.00 0.00 36.38 32.11 1ggy s VAL 663 CO 0.85 -0.56 0.68 0.26 0.00 0.00 0.00 175.10 176.32 1ggy s TRP 664 N 3.94 3.11 0.31 5.22 0.52 0.16 -1.21 118.94 131.00 1ggy s TRP 664 Ca 0.48 -1.13 -0.22 0.00 0.02 0.00 0.00 56.10 55.25 1ggy s TRP 664 Cb -0.12 -3.96 -0.10 0.00 -1.15 0.00 0.00 33.47 28.14 1ggy s TRP 664 CO 0.20 -1.22 0.87 0.08 0.02 0.00 0.00 176.95 176.89 1ggy s VAL 665 N 2.26 4.38 0.12 4.03 1.01 -0.20 -3.27 120.40 128.73 1ggy s VAL 665 Ca 0.11 1.54 0.08 0.00 0.00 0.00 0.00 61.98 63.71 1ggy s VAL 665 Cb -0.24 -3.86 -0.04 0.00 0.00 0.00 0.00 36.38 32.24 1ggy s VAL 665 CO 0.04 0.05 -0.19 -1.00 0.00 0.00 0.00 175.10 174.00 1ggy s HIS 666 N -1.72 1.72 -0.03 5.22 3.76 -0.09 -1.49 115.29 122.66 1ggy s HIS 666 Ca 0.51 -0.45 -0.03 0.00 -0.15 0.00 0.00 55.06 54.93 1ggy s HIS 666 Cb -0.16 -0.91 0.01 0.00 1.11 0.00 0.00 32.58 32.63 1ggy s HIS 666 CO 0.21 0.23 0.09 -1.17 -0.85 0.00 0.00 174.74 173.24 1ggy s LEU 667 N -2.18 1.69 0.34 0.89 2.96 -0.08 -2.28 118.68 120.02 1ggy s LEU 667 Ca 0.09 0.09 -0.18 0.00 -0.22 0.00 0.00 54.13 53.91 1ggy s LEU 667 Cb -0.08 0.33 0.04 0.00 0.50 0.00 0.00 46.19 46.98 1ggy s LEU 667 CO 0.05 -0.09 0.77 -0.62 -1.32 0.00 0.00 176.35 175.14 1ggy s ASP 668 N -0.22 -0.10 0.00 3.68 2.15 -0.09 -0.97 116.67 121.12 1ggy s ASP 668 Ca -0.03 -0.91 0.00 0.00 0.43 0.00 0.00 52.55 52.04 1ggy s ASP 668 Cb -0.02 0.79 0.00 0.00 -0.30 0.00 0.00 42.92 43.39 1ggy s ASP 668 CO 0.00 -1.53 0.00 0.61 -0.17 0.00 0.00 175.17 174.08 1ggy n GLY 669 N -0.51 0.65 3.70 2.66 0.00 -1.26 -0.74 105.19 109.69 1ggy n GLY 669 Ca -0.07 0.36 -0.42 0.00 0.00 0.00 0.00 46.02 45.89 1ggy n GLY 669 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ggy s PRO 670 N 0.00 4.14 0.00 1.61 0.04 -1.26 -1.66 135.00 137.87 1ggy s PRO 670 Ca 0.00 2.58 0.00 0.00 0.04 0.00 0.00 61.00 63.62 1ggy s PRO 670 Cb 0.00 -3.37 0.00 0.00 0.04 0.00 0.00 34.50 31.17 1ggy s PRO 670 CO 0.00 -0.79 0.00 0.41 0.04 0.00 0.00 177.00 176.66 1ggy n GLY 671 N 4.11 0.21 0.14 0.56 0.00 -1.26 -4.81 105.19 104.13 1ggy n GLY 671 Ca 0.17 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.18 1ggy n GLY 671 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1ggy n VAL 672 N -2.00 0.07 -3.81 1.61 0.31 -0.78 -0.51 118.33 113.22 1ggy n VAL 672 Ca 0.00 -0.03 -0.08 0.00 -0.01 0.00 0.00 64.34 64.22 1ggy n VAL 672 Cb 0.00 -0.68 -0.03 0.00 -0.91 0.00 0.00 33.84 32.22 1ggy n VAL 672 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1ggy s THR 673 N -2.03 0.00 0.09 2.52 -1.32 -0.66 -3.75 115.64 110.50 1ggy s THR 673 Ca -0.02 -0.92 -0.03 0.00 -1.21 0.00 0.00 61.69 59.52 1ggy s THR 673 Cb 0.00 -1.85 -0.05 0.00 -1.51 0.00 0.00 72.50 69.09 1ggy s THR 673 CO 0.03 -0.02 0.29 -0.60 -2.21 0.00 0.00 174.62 172.11 1ggy s ARG 674 N -3.91 3.54 -0.06 7.08 6.06 -1.26 -4.25 118.95 126.15 1ggy s ARG 674 Ca 0.11 -0.24 -0.35 0.00 -2.50 0.00 0.00 55.73 52.76 1ggy s ARG 674 Cb -0.04 -2.95 -0.13 0.00 0.06 0.00 0.00 34.95 31.89 1ggy s ARG 674 CO 0.04 0.55 1.80 -0.35 -2.50 0.00 0.00 175.30 174.84 1ggy n PRO 675 N 0.28 2.07 -4.39 5.12 -0.04 -1.26 -4.75 135.00 132.02 1ggy n PRO 675 Ca -0.04 0.75 -0.21 0.00 -0.04 0.00 0.00 63.50 63.96 1ggy n PRO 675 Cb 0.52 -2.57 -0.10 0.00 -0.04 0.00 0.00 33.50 31.31 1ggy n PRO 675 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 1ggy s MET 676 N 3.39 1.46 -0.10 0.54 -1.94 -0.15 -4.99 119.30 117.52 1ggy s MET 676 Ca 0.91 -1.65 -0.05 0.00 -1.71 0.00 0.00 55.69 53.18 1ggy s MET 676 Cb -0.73 -1.38 0.04 0.00 2.01 0.00 0.00 34.83 34.78 1ggy s MET 676 CO 0.50 0.24 0.23 -1.59 -0.01 0.00 0.00 175.02 174.40 1ggy s LYS 677 N -3.55 0.20 0.23 2.03 -2.85 -1.26 -0.90 119.74 113.63 1ggy s LYS 677 Ca 0.25 0.48 0.10 0.00 -1.00 0.00 0.00 55.97 55.79 1ggy s LYS 677 Cb -0.03 -0.09 -0.04 0.00 -2.06 0.00 0.00 37.83 35.61 1ggy s LYS 677 CO 0.10 -0.14 -0.09 0.21 0.10 0.00 0.00 175.35 175.53 1ggy s LYS 678 N 1.07 2.06 -0.02 1.78 2.36 -0.55 -4.98 119.74 121.44 1ggy s LYS 678 Ca -0.08 -1.42 0.03 0.00 -2.55 0.00 0.00 55.97 51.95 1ggy s LYS 678 Cb -0.09 -2.08 -0.00 0.00 -1.05 0.00 0.00 37.83 34.61 1ggy s LYS 678 CO -0.07 0.39 -0.11 1.41 1.55 0.00 0.00 175.35 178.52 1ggy s MET 679 N -3.24 1.08 -0.15 4.03 -2.45 -1.26 -1.03 119.30 116.28 1ggy s MET 679 Ca 0.28 -0.39 -0.02 0.00 -1.25 0.00 0.00 55.69 54.32 1ggy s MET 679 Cb -0.07 -1.00 -0.02 0.00 1.25 0.00 0.00 34.83 34.99 1ggy s MET 679 CO 0.17 0.18 -0.09 -0.06 1.05 0.00 0.00 175.02 176.26 1ggy s PHE 680 N 0.02 2.89 0.50 4.11 0.40 -0.35 -4.98 117.98 120.57 1ggy s PHE 680 Ca -0.01 -0.65 0.26 0.00 -0.60 0.00 0.00 56.93 55.94 1ggy s PHE 680 Cb -0.08 -1.92 1.35 0.00 0.51 0.00 0.00 43.02 42.88 1ggy s PHE 680 CO 0.00 -0.25 1.91 0.00 0.70 0.00 0.00 175.22 177.58 1ggy h ARG 681 N 7.01 0.11 -1.12 0.44 2.47 -1.95 -2.10 114.38 119.23 1ggy h ARG 681 Ca -0.30 -0.01 0.37 0.00 -1.26 0.00 0.00 59.98 58.78 1ggy h ARG 681 Cb 1.20 -0.02 -0.15 0.00 -1.65 0.00 0.00 29.97 29.34 1ggy h ARG 681 CO 0.58 0.07 0.95 -1.83 0.56 0.00 0.00 179.97 180.31 1ggy s GLU 682 N -5.11 0.10 -0.07 0.04 -1.05 -1.26 -2.17 118.70 109.19 1ggy s GLU 682 Ca -0.06 -0.05 -0.03 0.00 -0.15 0.00 0.00 54.97 54.68 1ggy s GLU 682 Cb 0.21 0.04 0.04 0.00 -0.44 0.00 0.00 34.13 33.98 1ggy s GLU 682 CO 0.76 -0.05 0.14 0.42 0.95 0.00 0.00 175.26 177.49 1ggy s ILE 683 N -2.12 -0.10 0.91 1.83 1.01 0.17 -4.95 121.20 117.96 1ggy s ILE 683 Ca 0.14 0.23 -0.12 0.00 0.00 0.00 0.00 60.65 60.89 1ggy s ILE 683 Cb 0.05 -0.24 0.13 0.00 0.01 0.00 0.00 42.46 42.42 1ggy s ILE 683 CO -0.05 0.09 1.11 -0.13 0.00 0.00 0.00 174.94 175.96 1ggy s ARG 684 N 1.43 1.18 0.51 2.79 1.81 -1.26 -0.63 118.95 124.78 1ggy s ARG 684 Ca -0.06 0.46 -0.21 0.00 -1.72 0.00 0.00 55.73 54.19 1ggy s ARG 684 Cb -0.12 -1.83 -0.06 0.00 -0.45 0.00 0.00 34.95 32.49 1ggy s ARG 684 CO -0.06 -2.20 1.20 -1.25 -0.68 0.00 0.00 175.30 172.31 1ggy s PRO 685 N -5.15 3.46 -2.03 3.54 0.04 -1.25 -2.79 135.00 130.82 1ggy s PRO 685 Ca 0.63 1.83 0.00 0.00 0.04 0.00 0.00 61.00 63.50 1ggy s PRO 685 Cb -0.16 -2.23 0.00 0.00 0.04 0.00 0.00 34.50 32.15 1ggy s PRO 685 CO 0.55 -0.81 0.00 0.09 0.04 0.00 0.00 177.00 176.87 1ggy n ASN 686 N -0.89 -5.04 -4.97 6.66 5.03 0.12 -4.95 115.26 111.22 1ggy n ASN 686 Ca 0.10 0.47 -0.21 0.00 0.87 0.00 0.00 54.58 55.81 1ggy n ASN 686 Cb 0.48 -4.49 0.03 0.00 -1.02 0.00 0.00 39.78 34.79 1ggy n ASN 686 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.26 174.99 1ggy s SER 687 N -2.62 5.43 0.04 6.41 0.01 -1.12 -4.80 113.70 117.05 1ggy s SER 687 Ca 0.00 0.03 0.02 0.00 1.31 0.00 0.00 55.95 57.32 1ggy s SER 687 Cb 0.00 -1.02 -0.02 0.00 0.21 0.00 0.00 66.02 65.19 1ggy s SER 687 CO 0.00 -1.02 -0.08 -0.89 0.41 0.00 0.00 173.24 171.67 1ggy s THR 688 N -2.69 0.55 0.04 1.44 2.01 -1.26 0.01 115.64 115.74 1ggy s THR 688 Ca 0.55 -1.12 0.03 0.00 0.31 0.00 0.00 61.69 61.46 1ggy s THR 688 Cb -0.10 -0.66 -0.02 0.00 0.01 0.00 0.00 72.50 71.72 1ggy s THR 688 CO 0.38 -0.40 -0.10 0.68 -0.69 0.00 0.00 174.62 174.48 1ggy s VAL 689 N -1.49 0.75 0.09 3.82 -7.23 -0.10 -5.00 120.40 111.25 1ggy s VAL 689 Ca -0.09 -1.00 0.09 0.00 -1.81 0.00 0.00 61.98 59.17 1ggy s VAL 689 Cb -0.09 -0.75 -0.03 0.00 0.56 0.00 0.00 36.38 36.07 1ggy s VAL 689 CO 0.00 -0.21 -0.24 -1.10 -0.31 0.00 0.00 175.10 173.24 1ggy s GLN 690 N -1.34 1.41 -0.29 4.82 -0.21 -1.26 -2.24 119.66 120.55 1ggy s GLN 690 Ca -0.05 -1.20 -0.03 0.00 0.02 0.00 0.00 55.36 54.10 1ggy s GLN 690 Cb -0.09 -1.73 0.10 0.00 1.00 0.00 0.00 33.01 32.30 1ggy s GLN 690 CO 0.01 0.42 0.13 -0.46 -2.12 0.00 0.00 175.29 173.27 1ggy s TRP 691 N -1.00 0.54 0.21 0.91 -0.00 -0.78 -4.97 118.94 113.85 1ggy s TRP 691 Ca 0.11 -1.02 -0.29 0.00 -0.00 0.00 0.00 56.10 54.90 1ggy s TRP 691 Cb -0.10 -1.03 -0.08 0.00 -0.00 0.00 0.00 33.47 32.26 1ggy s TRP 691 CO 0.04 -0.84 0.90 -1.21 -0.00 0.00 0.00 176.95 175.84 1ggy s GLU 692 N 2.01 4.77 -0.17 5.86 0.41 -1.26 -1.69 118.70 128.64 1ggy s GLU 692 Ca 0.09 1.40 -0.08 0.00 -0.41 0.00 0.00 54.97 55.97 1ggy s GLU 692 Cb -0.16 -3.29 0.07 0.00 -1.78 0.00 0.00 34.13 28.97 1ggy s GLU 692 CO -0.35 0.50 0.39 -1.21 -0.49 0.00 0.00 175.26 174.10 1ggy s GLU 693 N -1.04 0.34 -0.32 1.61 0.41 0.18 -4.98 118.70 114.90 1ggy s GLU 693 Ca 0.40 0.83 -0.20 0.00 -0.41 0.00 0.00 54.97 55.59 1ggy s GLU 693 Cb -0.25 0.06 -0.01 0.00 -1.78 0.00 0.00 34.13 32.15 1ggy s GLU 693 CO 0.30 -0.19 0.61 0.08 -0.49 0.00 0.00 175.26 175.57 1ggy s VAL 694 N 1.78 4.94 0.25 2.63 1.01 -1.26 0.15 120.40 129.91 1ggy s VAL 694 Ca -0.07 0.71 0.07 0.00 0.00 0.00 0.00 61.98 62.70 1ggy s VAL 694 Cb -0.10 -4.00 -0.04 0.00 0.00 0.00 0.00 36.38 32.24 1ggy s VAL 694 CO -0.12 -0.18 0.16 0.00 0.00 0.00 0.00 175.10 174.95 1ggy n ARG 696 N -1.10 1.37 -1.41 0.00 0.63 -1.25 -2.18 116.66 112.72 1ggy n ARG 696 Ca -0.08 -4.02 -0.62 0.00 -0.92 0.00 0.00 57.85 52.21 1ggy n ARG 696 Cb 0.58 -2.00 -0.11 0.00 0.45 0.00 0.00 32.46 31.38 1ggy n ARG 696 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 1ggy n PRO 697 N 1.96 0.05 0.00 -0.14 -0.04 -1.25 -4.56 135.00 131.02 1ggy n PRO 697 Ca 0.25 0.01 0.11 0.00 -0.04 0.00 0.00 63.50 63.83 1ggy n PRO 697 Cb 0.42 -1.53 0.09 0.00 -0.04 0.00 0.00 33.50 32.43 1ggy n PRO 697 CO 0.00 0.00 0.00 -2.67 -0.04 0.00 0.00 175.50 172.79 1ggy n TRP 698 N 6.46 0.00 -4.65 0.54 2.14 0.34 -0.76 117.44 121.50 1ggy n TRP 698 Ca 0.47 0.00 -0.28 0.00 2.07 0.00 0.00 57.50 59.76 1ggy n TRP 698 Cb -0.04 0.00 -0.14 0.00 -0.81 0.00 0.00 31.31 30.32 1ggy n TRP 698 CO 0.00 0.00 0.00 0.08 2.07 0.00 0.00 177.69 179.84 1ggy s VAL 699 N -1.94 1.97 -0.12 -1.67 1.01 -0.50 -4.92 120.40 114.23 1ggy s VAL 699 Ca 0.26 -1.43 -0.01 0.00 0.00 0.00 0.00 61.98 60.80 1ggy s VAL 699 Cb 0.19 -1.72 -0.02 0.00 0.00 0.00 0.00 36.38 34.83 1ggy s VAL 699 CO 0.31 0.21 -0.09 -0.94 0.00 0.00 0.00 175.10 174.59 1ggy s SER 700 N -1.47 4.39 0.00 3.32 1.04 -1.26 -4.79 113.70 114.93 1ggy s SER 700 Ca 0.10 -0.20 0.00 0.00 0.48 0.00 0.00 55.95 56.33 1ggy s SER 700 Cb -0.10 -1.55 0.00 0.00 0.10 0.00 0.00 66.02 64.48 1ggy s SER 700 CO 0.03 0.21 0.00 0.61 0.98 0.00 0.00 173.24 175.07 1ggy n GLY 701 N 3.23 0.52 3.58 7.32 0.00 0.59 -4.95 105.19 115.48 1ggy n GLY 701 Ca -0.18 -1.78 -0.42 0.00 0.00 0.00 0.00 46.02 43.64 1ggy n GLY 701 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1ggy s HIS 702 N -2.28 2.54 0.08 1.61 5.65 -1.26 -0.94 115.29 120.69 1ggy s HIS 702 Ca 0.00 0.48 0.01 0.00 0.25 0.00 0.00 55.06 55.80 1ggy s HIS 702 Cb 0.00 -4.47 0.01 0.00 -1.18 0.00 0.00 32.58 26.94 1ggy s HIS 702 CO 0.00 -1.67 0.06 0.54 -0.65 0.00 0.00 174.74 173.02 1ggy n ARG 703 N 8.40 1.36 -3.64 2.88 5.12 0.14 -5.00 116.66 125.92 1ggy n ARG 703 Ca 0.10 -0.49 -0.10 0.00 -1.93 0.00 0.00 57.85 55.44 1ggy n ARG 703 Cb 0.49 0.05 -0.07 0.00 -1.16 0.00 0.00 32.46 31.77 1ggy n ARG 703 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 1ggy s LYS 704 N -2.32 0.59 0.30 5.56 2.20 -1.26 -2.66 119.74 122.15 1ggy s LYS 704 Ca 0.05 0.73 0.03 0.00 -0.36 0.00 0.00 55.97 56.42 1ggy s LYS 704 Cb -0.00 0.27 -0.03 0.00 -1.51 0.00 0.00 37.83 36.56 1ggy s LYS 704 CO 0.03 -0.08 0.47 -0.51 -0.36 0.00 0.00 175.35 174.90 1ggy s LEU 705 N 0.40 4.14 -0.08 5.43 1.43 -0.44 -4.38 118.68 125.17 1ggy s LEU 705 Ca 0.01 0.26 -0.05 0.00 -1.03 0.00 0.00 54.13 53.32 1ggy s LEU 705 Cb -0.05 -3.09 0.04 0.00 0.03 0.00 0.00 46.19 43.12 1ggy s LEU 705 CO -0.05 -0.21 0.20 -0.63 0.23 0.00 0.00 176.35 175.88 1ggy s ILE 706 N -2.17 -0.03 0.19 -0.59 1.01 0.08 -3.05 121.20 116.64 1ggy s ILE 706 Ca 0.38 0.11 0.06 0.00 0.00 0.00 0.00 60.65 61.20 1ggy s ILE 706 Cb -0.09 -0.31 -0.05 0.00 0.01 0.00 0.00 42.46 42.02 1ggy s ILE 706 CO 0.33 0.05 -0.10 0.00 0.00 0.00 0.00 174.94 175.21 1ggy s ALA 707 N 0.88 1.82 0.06 9.38 0.00 -0.62 -0.91 121.76 132.38 1ggy s ALA 707 Ca -0.06 -1.64 -0.19 0.00 0.00 0.00 0.00 51.96 50.07 1ggy s ALA 707 Cb -0.08 0.06 0.04 0.00 0.00 0.00 0.00 23.12 23.14 1ggy s ALA 707 CO -0.05 -0.04 0.44 -1.54 0.00 0.00 0.00 175.76 174.56 1ggy s SER 708 N -3.27 -0.31 0.03 0.00 1.04 -0.97 -2.57 113.70 107.64 1ggy s SER 708 Ca 0.22 -0.02 0.02 0.00 0.48 0.00 0.00 55.95 56.64 1ggy s SER 708 Cb 0.02 0.45 -0.02 0.00 0.10 0.00 0.00 66.02 66.57 1ggy s SER 708 CO 0.05 -0.72 -0.06 -0.32 0.98 0.00 0.00 173.24 173.17 1ggy s MET 709 N -2.75 0.46 -0.28 4.02 1.75 0.66 -0.92 119.30 122.24 1ggy s MET 709 Ca -0.04 -0.66 -0.15 0.00 -1.25 0.00 0.00 55.69 53.60 1ggy s MET 709 Cb -0.00 -0.22 0.09 0.00 2.84 0.00 0.00 34.83 37.54 1ggy s MET 709 CO -0.04 0.04 0.71 0.45 -0.65 0.00 0.00 175.02 175.52 1ggy s SER 710 N -1.38 -0.94 0.19 1.11 0.15 -1.20 -3.19 113.70 108.44 1ggy s SER 710 Ca -0.10 1.47 0.02 0.00 0.70 0.00 0.00 55.95 58.04 1ggy s SER 710 Cb -0.09 1.50 -0.01 0.00 -1.71 0.00 0.00 66.02 65.72 1ggy s SER 710 CO 0.00 -0.23 0.08 -1.54 1.20 0.00 0.00 173.24 172.76 1ggy n SER 711 N 4.43 0.80 0.25 5.45 3.41 0.77 -0.66 113.62 128.08 1ggy n SER 711 Ca -0.19 -2.05 0.14 0.00 -0.26 0.00 0.00 58.87 56.51 1ggy n SER 711 Cb 0.57 0.56 0.58 0.00 -0.26 0.00 0.00 64.21 65.66 1ggy n SER 711 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1ggy h ASP 712 N 0.82 0.00 0.00 4.04 5.19 -1.70 -3.40 116.42 121.37 1ggy h ASP 712 Ca -0.15 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.26 1ggy h ASP 712 Cb 0.59 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.10 1ggy h ASP 712 CO 0.23 0.11 0.00 -1.54 -3.12 0.00 0.00 179.24 174.91 1ggy n SER 713 N -3.25 0.00 -4.77 6.45 3.41 -1.26 -5.04 113.62 109.16 1ggy n SER 713 Ca 0.00 0.00 -0.38 0.00 -0.26 0.00 0.00 58.87 58.23 1ggy n SER 713 Cb 0.36 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.29 1ggy n SER 713 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1ggy s LEU 714 N -0.51 4.24 0.25 1.04 2.96 -1.26 -4.96 118.68 120.45 1ggy s LEU 714 Ca 0.00 2.29 -0.21 0.00 -0.22 0.00 0.00 54.13 55.98 1ggy s LEU 714 Cb 0.00 -3.99 0.03 0.00 0.50 0.00 0.00 46.19 42.73 1ggy s LEU 714 CO 0.00 -0.57 0.70 -0.60 -1.32 0.00 0.00 176.35 174.56 1ggy s ARG 715 N -2.21 1.68 -0.63 1.98 3.52 -1.26 -0.16 118.95 121.87 1ggy s ARG 715 Ca 0.55 -0.88 -0.03 0.00 -0.13 0.00 0.00 55.73 55.24 1ggy s ARG 715 Cb -0.29 0.60 0.00 0.00 -1.56 0.00 0.00 34.95 33.70 1ggy s ARG 715 CO 0.37 -0.76 0.55 1.58 -0.81 0.00 0.00 175.30 176.23 1ggy n HIS 716 N -0.44 -1.31 -4.02 5.12 -0.00 -1.19 -4.77 115.22 108.60 1ggy n HIS 716 Ca -0.07 0.48 -0.34 0.00 0.46 0.00 0.00 57.72 58.25 1ggy n HIS 716 Cb 0.60 -3.07 -0.15 0.00 -0.12 0.00 0.00 29.99 27.25 1ggy n HIS 716 CO 0.00 0.00 0.00 0.08 0.46 0.00 0.00 176.34 176.88 1ggy s VAL 717 N -3.16 2.62 0.41 3.57 1.01 -1.21 -5.00 120.40 118.63 1ggy s VAL 717 Ca 0.22 -0.85 0.01 0.00 0.00 0.00 0.00 61.98 61.35 1ggy s VAL 717 Cb -0.09 -2.20 0.01 0.00 0.00 0.00 0.00 36.38 34.10 1ggy s VAL 717 CO 0.35 0.42 0.06 -1.22 0.00 0.00 0.00 175.10 174.71 1ggy n TYR 718 N 4.67 0.60 -3.57 5.22 4.01 -1.26 -0.24 117.16 126.59 1ggy n TYR 718 Ca -0.19 -1.94 -0.05 0.00 -0.16 0.00 0.00 57.90 55.56 1ggy n TYR 718 Cb 0.49 -0.28 -0.02 0.00 -0.31 0.00 0.00 39.34 39.22 1ggy n TYR 718 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1ggy s GLY 719 N -3.28 -0.33 0.10 2.72 0.00 -1.06 -1.49 107.32 103.98 1ggy s GLY 719 Ca 0.05 1.50 -0.25 0.00 0.00 0.00 0.00 44.72 46.01 1ggy s GLY 719 CO 0.03 0.51 0.71 -1.83 0.00 0.00 0.00 173.10 172.51 1ggy s GLU 720 N -2.53 1.11 -0.05 2.90 -1.05 -1.26 -1.59 118.70 116.23 1ggy s GLU 720 Ca 0.08 -0.41 -0.07 0.00 -0.15 0.00 0.00 54.97 54.42 1ggy s GLU 720 Cb -0.01 0.51 0.01 0.00 -0.44 0.00 0.00 34.13 34.21 1ggy s GLU 720 CO -0.06 -0.49 0.18 -1.17 0.95 0.00 0.00 175.26 174.68 1ggy s LEU 721 N -2.65 1.32 -0.27 1.83 0.20 -1.17 -4.74 118.68 113.19 1ggy s LEU 721 Ca 0.02 0.22 -0.09 0.00 0.69 0.00 0.00 54.13 54.98 1ggy s LEU 721 Cb -0.01 0.69 -0.03 0.00 -0.43 0.00 0.00 46.19 46.42 1ggy s LEU 721 CO -0.12 -0.16 0.13 -1.81 -0.29 0.00 0.00 176.35 174.10 1ggy s ASP 722 N -0.35 5.51 0.10 3.68 1.01 -1.26 -1.33 116.67 124.03 1ggy s ASP 722 Ca -0.04 -0.22 0.05 0.00 0.71 0.00 0.00 52.55 53.05 1ggy s ASP 722 Cb -0.03 -2.00 -0.04 0.00 1.01 0.00 0.00 42.92 41.85 1ggy s ASP 722 CO 0.01 -0.08 -0.02 0.68 0.21 0.00 0.00 175.17 175.97 1ggy s VAL 723 N 1.66 3.88 -0.31 -1.27 -7.23 -1.09 -4.99 120.40 111.05 1ggy s VAL 723 Ca 0.06 -1.08 -0.00 0.00 -1.81 0.00 0.00 61.98 59.15 1ggy s VAL 723 Cb -0.16 -2.85 0.07 0.00 0.56 0.00 0.00 36.38 34.00 1ggy s VAL 723 CO 0.07 0.09 0.01 -1.58 -0.31 0.00 0.00 175.10 173.38 1ggy s GLN 724 N -2.36 2.18 -0.11 4.82 2.00 -1.26 -0.69 119.66 124.24 1ggy s GLN 724 Ca 0.25 -1.46 -0.01 0.00 -2.00 0.00 0.00 55.36 52.14 1ggy s GLN 724 Cb -0.11 -3.18 -0.03 0.00 0.80 0.00 0.00 33.01 30.49 1ggy s GLN 724 CO 0.18 -0.73 -0.08 0.42 -0.50 0.00 0.00 175.29 174.58 1ggy s ILE 725 N 1.15 3.57 0.39 -2.34 1.01 -0.12 -4.79 121.20 120.08 1ggy s ILE 725 Ca -0.02 -0.50 0.04 0.00 0.00 0.00 0.00 60.65 60.18 1ggy s ILE 725 Cb -0.20 -2.51 -0.03 0.00 0.01 0.00 0.00 42.46 39.74 1ggy s ILE 725 CO -0.03 0.54 0.16 0.00 0.00 0.00 0.00 174.94 175.61 1ggy s GLN 726 N -0.12 1.88 0.00 2.79 0.00 0.09 0.22 119.66 124.52 1ggy s GLN 726 Ca 0.01 -2.13 0.21 0.00 -0.00 0.00 0.00 55.36 53.45 1ggy s GLN 726 Cb -0.13 -0.42 1.26 0.00 0.00 0.00 0.00 33.01 33.72 1ggy s GLN 726 CO 0.03 -0.51 1.64 0.54 0.00 0.00 0.00 175.29 176.99