#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vuy n THR 7 N 0.00 0.00 -2.83 5.15 5.66 -1.26 -4.82 114.28 116.18 2vuy n THR 7 Ca 0.00 0.00 -0.43 0.00 -3.05 0.00 0.00 64.05 60.57 2vuy n THR 7 Cb 0.00 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 68.76 2vuy n THR 7 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 2vuy s ARG 8 N 0.00 3.73 0.00 1.09 3.00 -1.26 -4.81 118.95 120.70 2vuy s ARG 8 Ca 0.00 -1.83 0.00 0.00 0.00 0.00 0.00 55.73 53.90 2vuy s ARG 8 Cb 0.00 -5.08 0.00 0.00 0.00 0.00 0.00 34.95 29.87 2vuy s ARG 8 CO 0.00 -1.89 0.48 -0.25 0.00 0.00 0.00 175.30 173.64 2vuy n ASP 9 N 6.96 1.36 -4.07 0.23 8.00 -1.26 -4.50 116.55 123.26 2vuy n ASP 9 Ca 0.30 -1.00 -0.11 0.00 0.71 0.00 0.00 54.79 54.69 2vuy n ASP 9 Cb 0.48 -0.26 -0.11 0.00 -0.02 0.00 0.00 41.12 41.21 2vuy n ASP 9 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2vuy s ARG 10 N 0.91 0.56 0.23 -1.24 1.04 -1.26 -5.15 118.95 114.04 2vuy s ARG 10 Ca 0.00 -0.88 -0.30 0.00 -1.04 0.00 0.00 55.73 53.52 2vuy s ARG 10 Cb 0.00 -0.18 -0.09 0.00 -2.04 0.00 0.00 34.95 32.65 2vuy s ARG 10 CO 0.00 0.01 1.18 -2.14 -0.04 0.00 0.00 175.30 174.31 2vuy s PRO 11 N -2.15 4.52 0.21 3.89 0.02 -1.26 -5.03 135.00 135.20 2vuy s PRO 11 Ca -0.06 1.89 -0.08 0.00 0.02 0.00 0.00 61.00 62.77 2vuy s PRO 11 Cb -0.06 -3.21 -0.02 0.00 0.02 0.00 0.00 34.50 31.24 2vuy s PRO 11 CO -0.02 -0.00 0.32 -0.51 -0.33 0.00 0.00 177.00 176.47 2vuy s LEU 12 N -0.78 0.73 0.03 -5.54 1.43 -1.26 -4.33 118.68 108.95 2vuy s LEU 12 Ca 0.50 -1.06 0.01 0.00 -1.03 0.00 0.00 54.13 52.55 2vuy s LEU 12 Cb -0.33 1.20 -0.02 0.00 0.03 0.00 0.00 46.19 47.07 2vuy s LEU 12 CO 0.40 -0.99 -0.05 -0.13 0.23 0.00 0.00 176.35 175.81 2vuy s ARG 13 N -4.05 0.42 0.42 1.70 0.52 -0.16 -4.98 118.95 112.82 2vuy s ARG 13 Ca 0.26 -0.70 0.14 0.00 -0.52 0.00 0.00 55.73 54.92 2vuy s ARG 13 Cb 0.03 -0.06 1.02 0.00 0.52 0.00 0.00 34.95 36.46 2vuy s ARG 13 CO 0.08 -0.01 1.94 -1.00 0.02 0.00 0.00 175.30 176.33 2vuy h PRO 14 N 4.53 0.43 -1.93 3.54 0.13 -1.90 0.27 132.00 137.07 2vuy h PRO 14 Ca -0.34 -0.03 0.22 0.00 -0.87 0.00 0.00 66.00 64.99 2vuy h PRO 14 Cb 1.20 -0.10 -0.07 0.00 0.13 0.00 0.00 31.00 32.17 2vuy h PRO 14 CO 0.42 0.28 -0.42 0.41 -0.23 0.00 0.00 178.00 178.46 2vuy n GLY 15 N -1.51 -1.99 3.71 1.56 0.00 -1.26 -3.56 105.19 102.14 2vuy n GLY 15 Ca 0.13 -1.29 -0.31 0.00 0.00 0.00 0.00 46.02 44.55 2vuy n GLY 15 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2vuy s ASP 16 N -5.65 5.17 0.42 1.61 1.01 -1.26 -4.86 116.67 113.11 2vuy s ASP 16 Ca 0.00 -0.11 0.28 0.00 0.71 0.00 0.00 52.55 53.43 2vuy s ASP 16 Cb 0.00 -1.29 0.96 0.00 1.01 0.00 0.00 42.92 43.60 2vuy s ASP 16 CO 0.00 0.19 1.81 1.55 0.21 0.00 0.00 175.17 178.93 2vuy h PRO 17 N 3.56 0.00 -6.26 8.23 0.13 -1.92 -3.44 132.00 132.30 2vuy h PRO 17 Ca -0.48 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.03 2vuy h PRO 17 Cb 1.17 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 32.03 2vuy h PRO 17 CO 0.61 0.00 -0.86 0.71 -0.23 0.00 0.00 178.00 178.23 2vuy s TYR 18 N -3.41 1.97 0.65 1.56 2.02 -1.26 -4.08 117.35 114.80 2vuy s TYR 18 Ca 0.04 -0.38 -0.09 0.00 -0.37 0.00 0.00 57.07 56.27 2vuy s TYR 18 Cb 0.08 -1.20 0.00 0.00 -0.40 0.00 0.00 41.96 40.44 2vuy s TYR 18 CO 0.55 0.06 1.01 -1.25 -1.57 0.00 0.00 175.55 174.36 2vuy s PRO 19 N -1.00 3.00 0.46 -1.71 0.04 -1.26 -5.11 135.00 129.43 2vuy s PRO 19 Ca 0.09 0.34 -0.23 0.00 0.04 0.00 0.00 61.00 61.24 2vuy s PRO 19 Cb -0.09 -2.12 -0.07 0.00 0.04 0.00 0.00 34.50 32.26 2vuy s PRO 19 CO 0.01 -0.83 1.19 -0.51 0.04 0.00 0.00 177.00 176.90 2vuy s LEU 20 N -5.20 4.01 0.00 -3.56 1.43 -1.26 -4.58 118.68 109.53 2vuy s LEU 20 Ca 0.56 2.37 0.00 0.00 -1.03 0.00 0.00 54.13 56.03 2vuy s LEU 20 Cb -0.11 -4.22 0.00 0.00 0.03 0.00 0.00 46.19 41.90 2vuy s LEU 20 CO 0.50 -0.97 0.00 0.61 0.23 0.00 0.00 176.35 176.72 2vuy n GLY 21 N 0.50 -1.74 3.85 -3.19 0.00 0.40 -4.90 105.19 100.11 2vuy n GLY 21 Ca 0.07 -2.03 -0.37 0.00 0.00 0.00 0.00 46.02 43.69 2vuy n GLY 21 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2vuy s SER 22 N -4.00 6.32 -0.05 1.61 1.04 -1.26 -1.02 113.70 116.34 2vuy s SER 22 Ca 0.00 0.43 -0.01 0.00 0.48 0.00 0.00 55.95 56.85 2vuy s SER 22 Cb 0.00 -2.05 0.03 0.00 0.10 0.00 0.00 66.02 64.10 2vuy s SER 22 CO 0.00 0.38 0.01 0.20 0.98 0.00 0.00 173.24 174.82 2vuy s ASN 23 N -0.87 1.11 -0.22 7.02 -0.87 0.33 -4.83 114.94 116.61 2vuy s ASN 23 Ca 0.14 -0.03 -0.29 0.00 -1.57 0.00 0.00 52.86 51.11 2vuy s ASN 23 Cb -0.12 -0.30 -0.02 0.00 -0.02 0.00 0.00 41.25 40.79 2vuy s ASN 23 CO 0.03 -0.17 1.49 0.86 -2.57 0.00 0.00 177.10 176.74 2vuy s TRP 24 N 1.70 2.33 -0.96 2.20 -0.00 -1.26 -1.16 118.94 121.80 2vuy s TRP 24 Ca -0.00 0.65 -0.03 0.00 -0.00 0.00 0.00 56.10 56.72 2vuy s TRP 24 Cb -0.13 -3.90 0.25 0.00 -0.00 0.00 0.00 33.47 29.70 2vuy s TRP 24 CO -0.03 -2.56 0.95 -0.89 -0.00 0.00 0.00 176.95 174.42 2vuy n ILE 25 N 6.13 3.63 -0.31 5.86 5.41 -0.52 -4.96 119.36 134.61 2vuy n ILE 25 Ca 0.17 -5.29 0.06 0.00 1.00 0.00 0.00 62.75 58.69 2vuy n ILE 25 Cb 0.45 -2.38 0.14 0.00 -0.71 0.00 0.00 39.64 37.14 2vuy n ILE 25 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 176.55 177.76 2vuy n GLU 26 N 2.17 -0.08 0.08 0.38 2.13 -1.26 -0.20 120.64 123.86 2vuy n GLU 26 Ca 0.23 1.34 0.08 0.00 0.66 0.00 0.00 57.16 59.47 2vuy n GLU 26 Cb 0.37 -2.02 0.35 0.00 0.27 0.00 0.00 31.44 30.42 2vuy n GLU 26 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 2vuy n ASP 27 N -5.39 0.32 -0.16 4.31 10.43 -1.26 -2.27 116.55 122.52 2vuy n ASP 27 Ca 0.15 0.61 0.02 0.00 2.57 0.00 0.00 54.79 58.13 2vuy n ASP 27 Cb 0.46 -0.67 0.03 0.00 1.84 0.00 0.00 41.12 42.78 2vuy n ASP 27 CO 0.00 0.00 0.00 0.47 -1.07 0.00 0.00 177.20 176.60 2vuy n ASP 28 N -1.89 1.58 -3.62 -2.24 10.43 0.72 -5.03 116.55 116.50 2vuy n ASP 28 Ca 0.01 -1.39 -0.26 0.00 2.57 0.00 0.00 54.79 55.73 2vuy n ASP 28 Cb 0.11 -0.02 0.03 0.00 1.84 0.00 0.00 41.12 43.07 2vuy n ASP 28 CO 0.00 0.00 0.00 -0.67 -1.07 0.00 0.00 177.20 175.46 2vuy n ASP 29 N 0.10 -5.60 0.00 -2.24 2.03 -0.96 -4.79 116.55 105.09 2vuy n ASP 29 Ca 0.03 -0.87 0.00 0.00 0.52 0.00 0.00 54.79 54.47 2vuy n ASP 29 Cb 0.15 -3.27 0.00 0.00 -0.72 0.00 0.00 41.12 37.28 2vuy n ASP 29 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2vuy n GLY 30 N -1.71 -1.09 3.26 0.27 0.00 -1.25 -0.09 105.19 104.58 2vuy n GLY 30 Ca -0.12 -1.00 -0.28 0.00 0.00 0.00 0.00 46.02 44.61 2vuy n GLY 30 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vuy s VAL 31 N -2.04 1.81 -0.21 1.61 1.01 -0.84 -1.44 120.40 120.30 2vuy s VAL 31 Ca 0.00 -1.04 -0.08 0.00 0.00 0.00 0.00 61.98 60.86 2vuy s VAL 31 Cb 0.00 -1.52 -0.04 0.00 0.00 0.00 0.00 36.38 34.82 2vuy s VAL 31 CO 0.00 0.46 0.10 0.21 0.00 0.00 0.00 175.10 175.87 2vuy s ASN 32 N -0.67 5.74 -0.20 3.32 3.84 -0.30 -1.09 114.94 125.57 2vuy s ASN 32 Ca 0.09 0.06 -0.03 0.00 0.21 0.00 0.00 52.86 53.19 2vuy s ASN 32 Cb -0.09 -2.01 -0.01 0.00 -0.55 0.00 0.00 41.25 38.59 2vuy s ASN 32 CO -0.00 0.12 -0.06 -0.36 -2.79 0.00 0.00 177.10 174.01 2vuy s PHE 33 N 0.73 2.94 -0.06 0.43 0.40 0.43 -0.51 117.98 122.34 2vuy s PHE 33 Ca 0.05 -0.88 0.03 0.00 -0.60 0.00 0.00 56.93 55.53 2vuy s PHE 33 Cb -0.13 -2.06 0.01 0.00 0.51 0.00 0.00 43.02 41.35 2vuy s PHE 33 CO 0.02 -0.48 -0.13 0.45 0.70 0.00 0.00 175.22 175.78 2vuy s SER 34 N 1.27 1.77 -0.07 1.36 0.15 -0.19 -1.42 113.70 116.56 2vuy s SER 34 Ca 0.03 -0.29 -0.04 0.00 0.70 0.00 0.00 55.95 56.35 2vuy s SER 34 Cb -0.14 -0.74 0.04 0.00 -1.71 0.00 0.00 66.02 63.46 2vuy s SER 34 CO -0.02 0.05 0.17 -0.22 1.20 0.00 0.00 173.24 174.42 2vuy s LEU 35 N 0.53 0.78 -0.05 3.45 2.96 -0.06 -0.46 118.68 125.83 2vuy s LEU 35 Ca -0.12 0.35 -0.22 0.00 -0.22 0.00 0.00 54.13 53.92 2vuy s LEU 35 Cb -0.14 0.48 -0.04 0.00 0.50 0.00 0.00 46.19 46.98 2vuy s LEU 35 CO 0.03 -0.13 0.65 0.12 -1.32 0.00 0.00 176.35 175.70 2vuy s PHE 36 N 0.99 3.60 -0.30 5.38 5.36 -1.26 -0.53 117.98 131.22 2vuy s PHE 36 Ca -0.07 1.21 -0.10 0.00 -0.96 0.00 0.00 56.93 57.00 2vuy s PHE 36 Cb -0.09 -2.73 0.17 0.00 -0.34 0.00 0.00 43.02 40.03 2vuy s PHE 36 CO -0.05 0.17 0.88 0.45 -1.46 0.00 0.00 175.22 175.21 2vuy s SER 37 N 0.49 -0.80 0.00 6.13 0.15 -0.90 -4.81 113.70 113.96 2vuy s SER 37 Ca 0.35 0.68 0.26 0.00 0.70 0.00 0.00 55.95 57.93 2vuy s SER 37 Cb -0.18 1.74 0.71 0.00 -1.71 0.00 0.00 66.02 66.59 2vuy s SER 37 CO 0.17 -0.15 1.54 -1.84 1.20 0.00 0.00 173.24 174.16 2vuy n GLU 38 N 5.33 0.79 -0.00 5.44 0.28 -1.26 -3.77 120.64 127.45 2vuy n GLU 38 Ca -0.06 -0.47 0.03 0.00 -0.16 0.00 0.00 57.16 56.50 2vuy n GLU 38 Cb 0.52 -1.49 -0.04 0.00 1.43 0.00 0.00 31.44 31.86 2vuy n GLU 38 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2vuy n ASN 39 N -0.69 0.96 -4.76 -1.84 3.02 -1.26 -5.04 115.26 105.66 2vuy n ASN 39 Ca 0.12 -0.52 -0.38 0.00 -0.03 0.00 0.00 54.58 53.77 2vuy n ASN 39 Cb 0.35 1.06 0.03 0.00 -0.61 0.00 0.00 39.78 40.61 2vuy n ASN 39 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2vuy s ALA 40 N -1.79 2.89 -0.14 5.41 0.00 -1.25 -4.75 121.76 122.14 2vuy s ALA 40 Ca 0.01 1.23 0.18 0.00 0.00 0.00 0.00 51.96 53.39 2vuy s ALA 40 Cb 0.05 -3.52 -0.25 0.00 0.00 0.00 0.00 23.12 19.40 2vuy s ALA 40 CO 0.27 -1.17 0.31 0.39 0.00 0.00 0.00 175.76 175.56 2vuy n GLU 41 N -0.82 0.67 -3.58 0.00 1.02 0.58 -4.99 120.64 113.51 2vuy n GLU 41 Ca 0.09 0.01 -0.16 0.00 -0.02 0.00 0.00 57.16 57.08 2vuy n GLU 41 Cb 0.46 -1.58 -0.06 0.00 -0.02 0.00 0.00 31.44 30.23 2vuy n GLU 41 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2vuy s LYS 42 N -2.78 0.97 0.01 3.49 2.20 -1.17 -5.02 119.74 117.43 2vuy s LYS 42 Ca -0.08 0.06 0.02 0.00 -0.36 0.00 0.00 55.97 55.62 2vuy s LYS 42 Cb 0.08 0.45 -0.01 0.00 -1.51 0.00 0.00 37.83 36.84 2vuy s LYS 42 CO 0.84 -0.31 -0.07 0.08 -0.36 0.00 0.00 175.35 175.53 2vuy s VAL 43 N -1.46 0.57 -0.07 4.02 1.01 -1.26 -0.83 120.40 122.37 2vuy s VAL 43 Ca -0.11 -0.48 0.02 0.00 0.00 0.00 0.00 61.98 61.41 2vuy s VAL 43 Cb -0.01 -0.51 0.01 0.00 0.00 0.00 0.00 36.38 35.87 2vuy s VAL 43 CO 0.06 0.04 -0.12 -1.61 0.00 0.00 0.00 175.10 173.48 2vuy s GLU 44 N -0.48 1.69 -0.00 2.72 2.02 -0.48 -1.31 118.70 122.85 2vuy s GLU 44 Ca 0.00 -0.40 -0.19 0.00 0.02 0.00 0.00 54.97 54.41 2vuy s GLU 44 Cb -0.04 -1.44 -0.06 0.00 0.10 0.00 0.00 34.13 32.70 2vuy s GLU 44 CO -0.00 -0.01 0.55 -1.17 0.02 0.00 0.00 175.26 174.65 2vuy s LEU 45 N 0.80 4.43 -0.12 1.80 2.96 0.22 -1.61 118.68 127.16 2vuy s LEU 45 Ca -0.12 1.11 0.03 0.00 -0.22 0.00 0.00 54.13 54.93 2vuy s LEU 45 Cb -0.15 -2.84 -0.00 0.00 0.50 0.00 0.00 46.19 43.69 2vuy s LEU 45 CO 0.02 0.16 -0.21 -0.76 -1.32 0.00 0.00 176.35 174.24 2vuy s LEU 46 N -0.41 2.25 -0.12 -0.68 1.43 0.11 -1.40 118.68 119.86 2vuy s LEU 46 Ca 0.29 -0.52 -0.01 0.00 -1.03 0.00 0.00 54.13 52.87 2vuy s LEU 46 Cb -0.18 -1.47 -0.02 0.00 0.03 0.00 0.00 46.19 44.55 2vuy s LEU 46 CO 0.16 0.14 -0.10 -0.76 0.23 0.00 0.00 176.35 176.02 2vuy s LEU 47 N 0.49 2.94 0.49 1.79 1.43 -1.00 -1.22 118.68 123.61 2vuy s LEU 47 Ca -0.14 -0.21 0.03 0.00 -1.03 0.00 0.00 54.13 52.79 2vuy s LEU 47 Cb -0.17 -1.67 -0.02 0.00 0.03 0.00 0.00 46.19 44.37 2vuy s LEU 47 CO 0.05 0.22 0.07 -0.31 0.23 0.00 0.00 176.35 176.61 2vuy s TYR 48 N 0.05 1.98 0.26 0.29 1.51 -0.47 -0.54 117.35 120.43 2vuy s TYR 48 Ca -0.03 -0.87 0.08 0.00 -1.01 0.00 0.00 57.07 55.24 2vuy s TYR 48 Cb -0.14 -1.70 -0.05 0.00 -0.11 0.00 0.00 41.96 39.96 2vuy s TYR 48 CO 0.04 0.17 -0.12 -1.54 -1.11 0.00 0.00 175.55 172.99 2vuy s SER 49 N -3.91 2.96 0.11 2.29 1.04 -1.15 -4.28 113.70 110.76 2vuy s SER 49 Ca 0.16 -1.10 -0.31 0.00 0.48 0.00 0.00 55.95 55.18 2vuy s SER 49 Cb 0.02 -0.20 -0.10 0.00 0.10 0.00 0.00 66.02 65.85 2vuy s SER 49 CO 0.09 -0.20 1.59 -0.07 0.98 0.00 0.00 173.24 175.63 2vuy h LEU 50 N 2.34 -1.25 -0.69 2.42 -0.00 -1.98 -3.00 115.31 113.15 2vuy h LEU 50 Ca -0.40 0.14 0.10 0.00 -0.00 0.00 0.00 57.88 57.72 2vuy h LEU 50 Cb 1.24 0.47 -0.07 0.00 -0.00 0.00 0.00 40.66 42.30 2vuy h LEU 50 CO 0.64 -0.48 0.33 0.71 -0.00 0.00 0.00 178.44 179.64 2vuy h THR 51 N -0.64 0.82 -3.86 0.22 1.35 -2.04 -3.39 112.91 105.38 2vuy h THR 51 Ca 0.03 -0.19 -0.67 0.00 -0.55 0.00 0.00 66.41 65.03 2vuy h THR 51 Cb 0.68 0.22 -0.37 0.00 -1.73 0.00 0.00 68.15 66.94 2vuy h THR 51 CO -0.26 0.10 -0.80 0.21 -0.25 0.00 0.00 175.52 174.52 2vuy s ASN 52 N -5.47 4.43 -0.07 5.36 2.47 -1.13 -4.94 114.94 115.59 2vuy s ASN 52 Ca -0.13 -1.40 0.10 0.00 0.42 0.00 0.00 52.86 51.86 2vuy s ASN 52 Cb 0.18 -1.53 0.22 0.00 -1.45 0.00 0.00 41.25 38.66 2vuy s ASN 52 CO 0.76 -0.19 1.15 0.00 -3.72 0.00 0.00 177.10 175.09 2vuy n GLN 53 N 4.44 2.44 -0.10 0.43 6.02 -1.26 -2.95 117.38 126.40 2vuy n GLN 53 Ca -0.14 -2.12 -0.20 0.00 -0.01 0.00 0.00 57.00 54.54 2vuy n GLN 53 Cb 0.42 -1.32 -0.10 0.00 1.02 0.00 0.00 30.24 30.27 2vuy n GLN 53 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 2vuy n LYS 54 N -0.62 0.55 -4.71 -1.09 4.01 -1.26 -4.67 118.16 110.36 2vuy n LYS 54 Ca 0.10 0.53 -0.31 0.00 -0.51 0.00 0.00 58.31 58.12 2vuy n LYS 54 Cb 0.49 -1.71 -0.13 0.00 -0.51 0.00 0.00 35.03 33.18 2vuy n LYS 54 CO 0.00 0.00 0.00 0.71 -1.11 0.00 0.00 177.40 177.00 2vuy s TYR 55 N -2.37 2.58 0.57 2.13 4.12 -1.26 -3.77 117.35 119.35 2vuy s TYR 55 Ca -0.28 -0.24 -0.21 0.00 0.02 0.00 0.00 57.07 56.37 2vuy s TYR 55 Cb 0.06 -1.49 -0.04 0.00 -1.52 0.00 0.00 41.96 38.97 2vuy s TYR 55 CO 0.52 0.23 1.31 -2.14 0.02 0.00 0.00 175.55 175.49 2vuy s PRO 56 N -1.30 3.02 0.03 -1.71 0.02 -1.26 -4.85 135.00 128.95 2vuy s PRO 56 Ca 0.14 2.10 0.24 0.00 0.02 0.00 0.00 61.00 63.50 2vuy s PRO 56 Cb -0.11 -2.12 0.27 0.00 0.02 0.00 0.00 34.50 32.56 2vuy s PRO 56 CO 0.04 -1.24 1.23 0.36 -0.33 0.00 0.00 177.00 177.06 2vuy n LYS 57 N -1.28 0.13 -3.58 5.54 2.85 0.30 -4.92 118.16 117.20 2vuy n LYS 57 Ca 0.12 0.01 -0.12 0.00 -1.05 0.00 0.00 58.31 57.27 2vuy n LYS 57 Cb 0.47 -1.56 -0.06 0.00 -0.65 0.00 0.00 35.03 33.23 2vuy n LYS 57 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 177.40 175.35 2vuy s GLU 58 N -3.09 0.68 -0.13 -1.58 2.12 -1.18 -5.03 118.70 110.48 2vuy s GLU 58 Ca 0.08 0.30 0.01 0.00 0.36 0.00 0.00 54.97 55.71 2vuy s GLU 58 Cb 0.16 0.32 0.02 0.00 0.26 0.00 0.00 34.13 34.89 2vuy s GLU 58 CO 0.75 -0.18 -0.15 0.42 -0.54 0.00 0.00 175.26 175.55 2vuy s ILE 59 N -0.79 1.60 -0.17 -3.70 1.01 -1.26 -2.37 121.20 115.52 2vuy s ILE 59 Ca -0.02 -0.68 -0.00 0.00 0.00 0.00 0.00 60.65 59.95 2vuy s ILE 59 Cb -0.01 -1.47 0.00 0.00 0.01 0.00 0.00 42.46 40.98 2vuy s ILE 59 CO 0.02 0.46 -0.15 -0.63 0.00 0.00 0.00 174.94 174.64 2vuy s ILE 60 N 1.22 2.62 -0.34 2.92 1.01 -0.50 -4.97 121.20 123.17 2vuy s ILE 60 Ca -0.01 -0.77 -0.24 0.00 0.00 0.00 0.00 60.65 59.63 2vuy s ILE 60 Cb -0.14 -2.12 0.01 0.00 0.01 0.00 0.00 42.46 40.22 2vuy s ILE 60 CO -0.06 0.51 0.85 -0.70 0.00 0.00 0.00 174.94 175.53 2vuy s GLU 61 N 1.01 3.89 -0.51 2.79 2.12 -1.26 0.69 118.70 127.44 2vuy s GLU 61 Ca -0.02 0.57 -0.28 0.00 0.36 0.00 0.00 54.97 55.61 2vuy s GLU 61 Cb -0.15 -3.77 -0.01 0.00 0.26 0.00 0.00 34.13 30.47 2vuy s GLU 61 CO -0.03 -0.80 1.68 0.08 -0.54 0.00 0.00 175.26 175.65 2vuy s VAL 62 N 3.17 3.55 -0.11 3.70 1.01 -0.43 -4.84 120.40 126.45 2vuy s VAL 62 Ca 0.35 0.46 0.17 0.00 0.00 0.00 0.00 61.98 62.95 2vuy s VAL 62 Cb -0.13 -4.03 -0.19 0.00 0.00 0.00 0.00 36.38 32.02 2vuy s VAL 62 CO 0.15 -0.86 0.63 0.29 0.00 0.00 0.00 175.10 175.31 2vuy n LYS 63 N 8.77 0.64 -2.91 2.72 5.02 -1.26 -4.43 118.16 126.71 2vuy n LYS 63 Ca 0.18 0.16 -0.40 0.00 -2.02 0.00 0.00 58.31 56.23 2vuy n LYS 63 Cb 0.50 -1.73 -0.05 0.00 -0.02 0.00 0.00 35.03 33.73 2vuy n LYS 63 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 2vuy s ASN 64 N -5.67 7.30 -0.08 4.39 -0.87 -1.25 -5.01 114.94 113.75 2vuy s ASN 64 Ca -0.05 1.56 -0.03 0.00 -1.57 0.00 0.00 52.86 52.77 2vuy s ASN 64 Cb 0.09 -2.50 0.04 0.00 -0.02 0.00 0.00 41.25 38.85 2vuy s ASN 64 CO 0.83 0.00 0.08 -0.75 -2.57 0.00 0.00 177.10 174.69 2vuy s LYS 65 N -0.11 -0.03 -0.47 -0.60 2.20 -1.26 -1.37 119.74 118.10 2vuy s LYS 65 Ca 0.41 0.29 -0.10 0.00 -0.36 0.00 0.00 55.97 56.21 2vuy s LYS 65 Cb -0.21 -0.80 0.11 0.00 -1.51 0.00 0.00 37.83 35.42 2vuy s LYS 65 CO 0.25 -0.41 0.35 0.99 -0.36 0.00 0.00 175.35 176.17 2vuy s THR 66 N 2.18 4.35 0.00 3.43 2.01 0.41 -4.92 115.64 123.11 2vuy s THR 66 Ca 0.04 -1.67 0.00 0.00 0.31 0.00 0.00 61.69 60.37 2vuy s THR 66 Cb -0.13 -3.82 0.00 0.00 0.01 0.00 0.00 72.50 68.56 2vuy s THR 66 CO -0.05 -0.74 0.00 0.61 -0.69 0.00 0.00 174.62 173.75 2vuy n GLY 67 N 4.95 1.47 1.43 4.40 0.00 -1.26 -2.81 105.19 113.38 2vuy n GLY 67 Ca -0.09 -0.55 -0.00 0.00 0.00 0.00 0.00 46.02 45.38 2vuy n GLY 67 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2vuy n ASP 68 N 8.10 4.05 -4.09 1.61 3.85 -1.26 -4.93 116.55 123.87 2vuy n ASP 68 Ca 0.00 -3.26 -0.29 0.00 -0.71 0.00 0.00 54.79 50.54 2vuy n ASP 68 Cb 0.00 -0.65 -0.17 0.00 -1.35 0.00 0.00 41.12 38.95 2vuy n ASP 68 CO 0.00 0.00 0.00 -0.63 -1.01 0.00 0.00 177.20 175.56 2vuy s ILE 69 N -2.99 1.57 0.09 2.12 1.01 -1.12 -2.13 121.20 119.74 2vuy s ILE 69 Ca 0.48 -0.70 -0.12 0.00 0.00 0.00 0.00 60.65 60.32 2vuy s ILE 69 Cb 0.40 -1.41 -0.06 0.00 0.01 0.00 0.00 42.46 41.40 2vuy s ILE 69 CO 0.09 0.45 0.44 0.26 0.00 0.00 0.00 174.94 176.19 2vuy s TRP 70 N 0.80 3.61 0.05 3.97 0.52 0.31 -0.44 118.94 127.76 2vuy s TRP 70 Ca -0.10 0.89 -0.27 0.00 0.02 0.00 0.00 56.10 56.64 2vuy s TRP 70 Cb -0.16 -2.24 0.07 0.00 -1.15 0.00 0.00 33.47 30.00 2vuy s TRP 70 CO 0.01 0.51 0.63 -3.38 0.02 0.00 0.00 176.95 174.74 2vuy s HIS 71 N -1.37 -0.58 -0.06 -1.98 -3.43 -0.47 -0.89 115.29 106.50 2vuy s HIS 71 Ca 0.33 0.73 -0.31 0.00 -0.80 0.00 0.00 55.06 55.01 2vuy s HIS 71 Cb -0.15 0.46 0.08 0.00 -1.43 0.00 0.00 32.58 31.54 2vuy s HIS 71 CO 0.18 -0.71 0.72 0.54 -2.00 0.00 0.00 174.74 173.47 2vuy s VAL 72 N -2.37 0.00 -0.18 -5.38 0.11 -0.51 -3.86 120.40 108.21 2vuy s VAL 72 Ca -0.05 0.00 -0.02 0.00 -2.93 0.00 0.00 61.98 58.98 2vuy s VAL 72 Cb -0.00 -1.00 -0.01 0.00 -1.53 0.00 0.00 36.38 33.84 2vuy s VAL 72 CO -0.01 0.00 -0.10 0.12 -3.33 0.00 0.00 175.10 171.78 2vuy s PHE 73 N -1.20 2.88 -0.33 1.54 5.36 0.96 -0.43 117.98 126.76 2vuy s PHE 73 Ca -0.10 -0.92 -0.09 0.00 -0.96 0.00 0.00 56.93 54.87 2vuy s PHE 73 Cb -0.00 -1.98 0.02 0.00 -0.34 0.00 0.00 43.02 40.72 2vuy s PHE 73 CO 0.09 -0.45 0.14 0.08 -1.46 0.00 0.00 175.22 173.62 2vuy s VAL 74 N 1.00 4.27 0.40 3.12 1.01 -0.25 -0.99 120.40 128.96 2vuy s VAL 74 Ca -0.01 -0.76 -0.26 0.00 0.00 0.00 0.00 61.98 60.95 2vuy s VAL 74 Cb -0.15 -3.29 -0.09 0.00 0.00 0.00 0.00 36.38 32.85 2vuy s VAL 74 CO -0.01 -0.07 1.29 -2.84 0.00 0.00 0.00 175.10 173.48 2vuy s PRO 75 N 1.53 4.02 0.00 2.72 0.02 -1.26 -1.99 135.00 140.04 2vuy s PRO 75 Ca 0.02 2.14 0.00 0.00 0.02 0.00 0.00 61.00 63.18 2vuy s PRO 75 Cb -0.18 -2.79 0.00 0.00 0.02 0.00 0.00 34.50 31.55 2vuy s PRO 75 CO 0.05 -0.44 0.00 0.41 -0.33 0.00 0.00 177.00 176.68 2vuy n GLY 76 N 0.68 3.04 3.80 0.52 0.00 0.87 -4.93 105.19 109.18 2vuy n GLY 76 Ca 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.71 2vuy n GLY 76 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vuy s LEU 77 N 0.00 3.79 0.37 0.99 1.43 -1.24 -4.88 118.68 119.15 2vuy s LEU 77 Ca 0.00 1.90 0.05 0.00 -1.03 0.00 0.00 54.13 55.05 2vuy s LEU 77 Cb 0.00 -4.55 -0.03 0.00 0.03 0.00 0.00 46.19 41.64 2vuy s LEU 77 CO 0.00 -0.83 0.19 -0.13 0.23 0.00 0.00 176.35 175.81 2vuy s ARG 78 N -3.38 1.84 0.33 1.70 0.52 -1.26 -3.82 118.95 114.88 2vuy s ARG 78 Ca 0.66 -2.10 -0.29 0.00 -0.52 0.00 0.00 55.73 53.48 2vuy s ARG 78 Cb -0.16 -0.21 -0.11 0.00 0.52 0.00 0.00 34.95 35.00 2vuy s ARG 78 CO 0.23 -0.55 1.43 -2.14 0.02 0.00 0.00 175.30 174.28 2vuy s PRO 79 N -3.62 4.22 0.00 3.54 0.02 -1.26 -2.63 135.00 135.27 2vuy s PRO 79 Ca 0.31 2.40 0.00 0.00 0.02 0.00 0.00 61.00 63.73 2vuy s PRO 79 Cb 0.02 -3.03 0.00 0.00 0.02 0.00 0.00 34.50 31.51 2vuy s PRO 79 CO 0.20 -0.41 0.00 0.41 -0.33 0.00 0.00 177.00 176.87 2vuy n GLY 80 N 1.06 1.76 3.68 0.52 0.00 0.23 -4.98 105.19 107.45 2vuy n GLY 80 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 2vuy n GLY 80 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2vuy s GLN 81 N -0.40 4.15 0.03 1.61 2.00 -1.08 -4.70 119.66 121.27 2vuy s GLN 81 Ca 0.00 2.56 -0.25 0.00 -2.00 0.00 0.00 55.36 55.67 2vuy s GLN 81 Cb 0.00 -3.87 -0.05 0.00 0.80 0.00 0.00 33.01 29.89 2vuy s GLN 81 CO 0.00 -0.89 0.78 -0.51 -0.50 0.00 0.00 175.29 174.17 2vuy s LEU 82 N 3.59 4.43 0.21 3.68 1.43 -1.26 -1.65 118.68 129.11 2vuy s LEU 82 Ca 0.83 1.44 -0.14 0.00 -1.03 0.00 0.00 54.13 55.24 2vuy s LEU 82 Cb -0.43 -3.25 0.01 0.00 0.03 0.00 0.00 46.19 42.55 2vuy s LEU 82 CO 0.38 -0.02 0.46 -0.72 0.23 0.00 0.00 176.35 176.68 2vuy s TYR 83 N 0.12 0.20 0.29 0.29 -0.85 0.53 -1.37 117.35 116.56 2vuy s TYR 83 Ca 0.40 -0.56 -0.20 0.00 -0.52 0.00 0.00 57.07 56.18 2vuy s TYR 83 Cb -0.20 0.22 0.04 0.00 0.38 0.00 0.00 41.96 42.39 2vuy s TYR 83 CO 0.23 -0.92 0.78 0.00 -1.52 0.00 0.00 175.55 174.12 2vuy s ALA 84 N -3.96 -1.15 0.23 9.51 0.00 -0.36 -0.60 121.76 125.43 2vuy s ALA 84 Ca 0.17 -0.39 0.09 0.00 0.00 0.00 0.00 51.96 51.83 2vuy s ALA 84 Cb -0.00 0.77 -0.05 0.00 0.00 0.00 0.00 23.12 23.84 2vuy s ALA 84 CO 0.03 -1.03 -0.16 0.71 0.00 0.00 0.00 175.76 175.31 2vuy s TYR 85 N -3.30 1.90 -0.08 0.00 1.51 -0.87 0.10 117.35 116.62 2vuy s TYR 85 Ca 0.13 -0.49 0.01 0.00 -1.01 0.00 0.00 57.07 55.71 2vuy s TYR 85 Cb -0.05 -0.87 0.02 0.00 -0.11 0.00 0.00 41.96 40.95 2vuy s TYR 85 CO 0.08 0.47 -0.08 1.03 -1.11 0.00 0.00 175.55 175.94 2vuy s ARG 86 N -3.54 1.36 -0.18 -0.62 0.52 -0.64 -0.12 118.95 115.74 2vuy s ARG 86 Ca 0.24 -0.25 0.00 0.00 -0.52 0.00 0.00 55.73 55.21 2vuy s ARG 86 Cb -0.02 -1.32 0.01 0.00 0.52 0.00 0.00 34.95 34.14 2vuy s ARG 86 CO 0.09 -0.13 -0.17 0.08 0.02 0.00 0.00 175.30 175.19 2vuy s VAL 87 N 1.22 2.34 0.08 3.52 1.01 -1.26 -1.39 120.40 125.92 2vuy s VAL 87 Ca -0.05 -0.85 -0.19 0.00 0.00 0.00 0.00 61.98 60.89 2vuy s VAL 87 Cb -0.14 -2.00 -0.07 0.00 0.00 0.00 0.00 36.38 34.18 2vuy s VAL 87 CO -0.02 0.52 0.56 -0.31 0.00 0.00 0.00 175.10 175.85 2vuy s TYR 88 N 1.24 3.79 -0.15 5.22 2.02 -0.01 -3.43 117.35 126.03 2vuy s TYR 88 Ca 0.03 1.25 0.00 0.00 -0.37 0.00 0.00 57.07 57.98 2vuy s TYR 88 Cb -0.14 -2.48 0.00 0.00 -0.40 0.00 0.00 41.96 38.95 2vuy s TYR 88 CO -0.09 0.58 0.00 0.41 -1.57 0.00 0.00 175.55 174.88 2vuy n GLY 89 N 1.65 -1.17 3.77 0.71 0.00 -1.26 -0.31 105.19 108.58 2vuy n GLY 89 Ca -0.10 -0.95 -0.41 0.00 0.00 0.00 0.00 46.02 44.56 2vuy n GLY 89 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2vuy s PRO 90 N -1.37 4.36 -0.48 1.61 0.02 -1.26 -4.67 135.00 133.22 2vuy s PRO 90 Ca 0.00 2.20 0.00 0.00 0.02 0.00 0.00 61.00 63.22 2vuy s PRO 90 Cb 0.00 -3.08 0.13 0.00 0.02 0.00 0.00 34.50 31.57 2vuy s PRO 90 CO 0.00 -0.18 0.25 -0.47 -0.33 0.00 0.00 177.00 176.27 2vuy s TYR 91 N -1.10 3.48 -0.40 6.54 5.04 -1.26 -2.87 117.35 126.79 2vuy s TYR 91 Ca 0.49 -2.81 0.07 0.00 -2.44 0.00 0.00 57.07 52.38 2vuy s TYR 91 Cb -0.39 -3.06 0.23 0.00 0.35 0.00 0.00 41.96 39.09 2vuy s TYR 91 CO 0.52 -0.88 0.48 1.63 -1.34 0.00 0.00 175.55 175.96 2vuy n LYS 92 N 3.86 0.59 -0.34 4.97 5.02 0.19 -4.99 118.16 127.45 2vuy n LYS 92 Ca 0.04 -3.21 0.32 0.00 -2.02 0.00 0.00 58.31 53.43 2vuy n LYS 92 Cb 0.38 -1.32 0.58 0.00 -0.02 0.00 0.00 35.03 34.65 2vuy n LYS 92 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 2vuy h PRO 93 N 4.39 0.04 0.00 1.97 0.11 -1.87 1.07 132.00 137.71 2vuy h PRO 93 Ca 0.12 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.23 2vuy h PRO 93 Cb 0.89 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.99 2vuy h PRO 93 CO 0.44 0.03 0.00 0.39 -0.21 0.00 0.00 178.00 178.65 2vuy n GLU 94 N -5.18 0.14 -0.01 1.05 4.71 -1.26 -1.83 120.64 118.27 2vuy n GLU 94 Ca 0.37 0.53 0.03 0.00 -0.01 0.00 0.00 57.16 58.09 2vuy n GLU 94 Cb 1.28 -1.88 0.03 0.00 -1.01 0.00 0.00 31.44 29.86 2vuy n GLU 94 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 2vuy n LEU 95 N -2.17 1.57 0.00 -4.62 4.77 0.37 -4.24 117.00 112.68 2vuy n LEU 95 Ca 0.00 -1.05 0.00 0.00 -0.03 0.00 0.00 56.01 54.93 2vuy n LEU 95 Cb 0.11 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.19 2vuy n LEU 95 CO 0.13 0.33 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 2vuy n GLY 96 N 0.33 1.01 3.52 -0.72 0.00 -0.76 -4.81 105.19 103.77 2vuy n GLY 96 Ca 0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 2vuy n GLY 96 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2vuy s LEU 97 N 0.00 3.96 -0.35 0.99 1.43 -1.17 -4.02 118.68 119.51 2vuy s LEU 97 Ca 0.00 -0.39 0.06 0.00 -1.03 0.00 0.00 54.13 52.76 2vuy s LEU 97 Cb 0.00 -2.79 0.45 0.00 0.03 0.00 0.00 46.19 43.88 2vuy s LEU 97 CO 0.00 -1.36 1.29 0.54 0.23 0.00 0.00 176.35 177.05 2vuy n ARG 98 N 7.83 3.49 -2.23 1.70 1.74 -1.26 0.52 116.66 128.46 2vuy n ARG 98 Ca 0.02 -4.09 -0.40 0.00 -0.77 0.00 0.00 57.85 52.61 2vuy n ARG 98 Cb 0.48 -2.28 -0.02 0.00 -1.02 0.00 0.00 32.46 29.61 2vuy n ARG 98 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2vuy s PHE 99 N -3.63 3.12 -0.41 -1.55 0.40 -1.14 -4.62 117.98 110.16 2vuy s PHE 99 Ca 0.52 1.51 0.06 0.00 -0.60 0.00 0.00 56.93 58.42 2vuy s PHE 99 Cb 0.42 -3.52 0.17 0.00 0.51 0.00 0.00 43.02 40.60 2vuy s PHE 99 CO 0.01 -1.48 0.54 1.21 0.70 0.00 0.00 175.22 176.19 2vuy s ASN 100 N -0.79 -0.41 0.00 1.36 3.84 -1.25 -4.57 114.94 113.12 2vuy s ASN 100 Ca 0.52 -1.29 0.00 0.00 0.21 0.00 0.00 52.86 52.30 2vuy s ASN 100 Cb -0.35 1.34 0.00 0.00 -0.55 0.00 0.00 41.25 41.69 2vuy s ASN 100 CO 0.46 -0.19 0.78 -0.81 -2.79 0.00 0.00 177.10 174.55 2vuy n PRO 101 N 4.11 0.00 0.13 0.43 -0.04 -1.22 -0.53 135.00 137.88 2vuy n PRO 101 Ca 0.13 0.29 0.00 0.00 -0.04 0.00 0.00 63.50 63.89 2vuy n PRO 101 Cb 0.52 -1.52 0.07 0.00 -0.04 0.00 0.00 33.50 32.53 2vuy n PRO 101 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 2vuy h ASN 102 N 0.00 0.00 -3.37 3.54 4.21 -1.91 -3.44 115.58 114.62 2vuy h ASN 102 Ca 0.00 0.00 -0.59 0.00 1.21 0.00 0.00 56.30 56.92 2vuy h ASN 102 Cb 0.04 0.00 -0.09 0.00 -1.12 0.00 0.00 38.32 37.15 2vuy h ASN 102 CO 0.00 0.61 0.27 -0.54 -1.29 0.00 0.00 177.43 176.48 2vuy s LYS 103 N -3.10 4.22 0.09 0.81 -0.14 0.31 -2.95 119.74 118.98 2vuy s LYS 103 Ca 0.02 0.79 -0.30 0.00 -1.36 0.00 0.00 55.97 55.11 2vuy s LYS 103 Cb 0.09 -3.60 -0.06 0.00 -1.68 0.00 0.00 37.83 32.59 2vuy s LYS 103 CO 0.75 -0.34 1.05 0.08 -0.76 0.00 0.00 175.35 176.13 2vuy s VAL 104 N 2.23 4.34 0.20 3.17 1.01 -1.26 -4.62 120.40 125.47 2vuy s VAL 104 Ca 0.32 1.83 0.07 0.00 0.00 0.00 0.00 61.98 64.21 2vuy s VAL 104 Cb -0.16 -4.17 -0.04 0.00 0.00 0.00 0.00 36.38 32.01 2vuy s VAL 104 CO 0.10 0.23 0.04 -0.76 0.00 0.00 0.00 175.10 174.71 2vuy s LEU 105 N 0.36 3.41 -0.12 3.92 2.01 0.83 -4.77 118.68 124.32 2vuy s LEU 105 Ca 0.51 -0.40 -0.13 0.00 0.01 0.00 0.00 54.13 54.12 2vuy s LEU 105 Cb -0.25 -2.02 -0.05 0.00 0.01 0.00 0.00 46.19 43.88 2vuy s LEU 105 CO 0.31 0.05 0.31 -0.63 1.01 0.00 0.00 176.35 177.40 2vuy s ILE 106 N -1.90 5.26 -0.00 -0.59 1.01 -0.81 -2.04 121.20 122.13 2vuy s ILE 106 Ca 0.29 0.59 -0.30 0.00 0.00 0.00 0.00 60.65 61.23 2vuy s ILE 106 Cb -0.09 -3.63 -0.08 0.00 0.01 0.00 0.00 42.46 38.68 2vuy s ILE 106 CO 0.20 0.46 1.97 -0.62 0.00 0.00 0.00 174.94 176.95 2vuy s ASP 107 N -0.10 6.35 0.58 3.58 -1.08 -1.26 -4.72 116.67 120.03 2vuy s ASP 107 Ca 0.18 2.54 0.28 0.00 -0.52 0.00 0.00 52.55 55.03 2vuy s ASP 107 Cb -0.14 -2.53 1.54 0.00 -1.46 0.00 0.00 42.92 40.34 2vuy s ASP 107 CO 0.06 -1.15 2.00 -0.65 0.52 0.00 0.00 175.17 175.96 2vuy h PRO 108 N 11.01 0.00 -0.64 4.34 0.11 -1.95 0.21 132.00 145.08 2vuy h PRO 108 Ca -0.48 0.00 -0.25 0.00 0.11 0.00 0.00 66.00 65.38 2vuy h PRO 108 Cb 1.23 0.00 -0.15 0.00 0.11 0.00 0.00 31.00 32.19 2vuy h PRO 108 CO 0.94 0.00 0.24 0.66 -0.21 0.00 0.00 178.00 179.64 2vuy n TYR 109 N -3.86 2.08 -2.20 0.65 4.02 -1.26 -4.35 117.16 112.23 2vuy n TYR 109 Ca 0.05 -1.40 -0.41 0.00 -0.01 0.00 0.00 57.90 56.13 2vuy n TYR 109 Cb 0.50 -0.65 -0.03 0.00 -0.02 0.00 0.00 39.34 39.14 2vuy n TYR 109 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2vuy s ALA 110 N -3.10 3.50 -1.91 -0.72 0.00 0.06 -4.51 121.76 115.07 2vuy s ALA 110 Ca 0.51 1.16 0.23 0.00 0.00 0.00 0.00 51.96 53.86 2vuy s ALA 110 Cb 0.43 -3.46 0.09 0.00 0.00 0.00 0.00 23.12 20.18 2vuy s ALA 110 CO 0.09 -0.53 1.15 1.63 0.00 0.00 0.00 175.76 178.09 2vuy n LYS 111 N 1.51 1.05 -3.64 0.00 4.76 -1.26 -3.35 118.16 117.23 2vuy n LYS 111 Ca 0.02 -0.84 -0.07 0.00 -2.87 0.00 0.00 58.31 54.55 2vuy n LYS 111 Cb 0.42 -1.48 -0.07 0.00 -1.84 0.00 0.00 35.03 32.06 2vuy n LYS 111 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2vuy s ALA 112 N -2.53 -1.94 -0.17 7.82 0.00 -1.26 -4.30 121.76 119.38 2vuy s ALA 112 Ca 0.18 2.32 0.01 0.00 0.00 0.00 0.00 51.96 54.47 2vuy s ALA 112 Cb 0.18 -1.45 0.01 0.00 0.00 0.00 0.00 23.12 21.86 2vuy s ALA 112 CO 0.59 -0.36 -0.18 0.42 0.00 0.00 0.00 175.76 176.23 2vuy s ILE 113 N 1.38 2.34 -1.05 0.00 1.01 -1.26 -0.02 121.20 123.59 2vuy s ILE 113 Ca -0.08 -0.87 -0.22 0.00 0.00 0.00 0.00 60.65 59.48 2vuy s ILE 113 Cb -0.05 -1.98 0.06 0.00 0.01 0.00 0.00 42.46 40.50 2vuy s ILE 113 CO -0.16 0.52 1.48 0.21 0.00 0.00 0.00 174.94 176.99 2vuy s ASN 114 N 1.07 6.55 0.00 3.58 2.47 0.30 -4.73 114.94 124.18 2vuy s ASN 114 Ca -0.01 -1.60 0.00 0.00 0.42 0.00 0.00 52.86 51.68 2vuy s ASN 114 Cb -0.14 -2.56 0.00 0.00 -1.45 0.00 0.00 41.25 37.09 2vuy s ASN 114 CO -0.06 -1.45 0.00 0.61 -3.72 0.00 0.00 177.10 172.48 2vuy n GLY 115 N 6.65 -2.02 0.00 1.21 0.00 -1.26 -3.63 105.19 106.14 2vuy n GLY 115 Ca 0.35 -1.92 0.00 0.00 0.00 0.00 0.00 46.02 44.45 2vuy n GLY 115 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2vuy n SER 116 N 0.18 1.92 -4.80 1.61 2.88 -1.26 -4.79 113.62 109.37 2vuy n SER 116 Ca 0.00 -0.94 -0.38 0.00 -1.33 0.00 0.00 58.87 56.23 2vuy n SER 116 Cb 0.00 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.40 2vuy n SER 116 CO 0.00 0.00 0.00 -0.69 -1.23 0.00 0.00 175.04 173.12 2vuy s VAL 117 N -0.91 4.47 -0.45 2.46 1.01 -1.26 -3.70 120.40 122.02 2vuy s VAL 117 Ca 0.00 1.49 -0.10 0.00 0.00 0.00 0.00 61.98 63.37 2vuy s VAL 117 Cb 0.00 -3.99 0.10 0.00 0.00 0.00 0.00 36.38 32.48 2vuy s VAL 117 CO 0.00 0.37 0.31 -0.63 0.00 0.00 0.00 175.10 175.15 2vuy s ILE 118 N -1.34 4.33 0.23 2.22 1.01 0.25 -5.00 121.20 122.90 2vuy s ILE 118 Ca 0.39 -1.53 -0.31 0.00 0.00 0.00 0.00 60.65 59.20 2vuy s ILE 118 Cb -0.20 -3.73 -0.14 0.00 0.01 0.00 0.00 42.46 38.40 2vuy s ILE 118 CO 0.23 -0.63 1.32 0.79 0.00 0.00 0.00 174.94 176.65 2vuy n TRP 119 N 4.95 1.88 -3.63 3.97 7.02 -1.26 -4.77 117.44 125.59 2vuy n TRP 119 Ca -0.10 0.52 -0.08 0.00 -1.02 0.00 0.00 57.50 56.82 2vuy n TRP 119 Cb 0.42 -2.40 -0.07 0.00 -2.42 0.00 0.00 31.31 26.84 2vuy n TRP 119 CO 0.00 0.00 0.00 1.21 -2.02 0.00 0.00 177.69 176.88 2vuy s ASN 120 N 0.15 -0.36 0.11 -0.99 3.84 -1.26 -5.02 114.94 111.41 2vuy s ASN 120 Ca 0.69 0.65 0.05 0.00 0.21 0.00 0.00 52.86 54.46 2vuy s ASN 120 Cb -0.71 0.65 0.28 0.00 -0.55 0.00 0.00 41.25 40.93 2vuy s ASN 120 CO 0.51 -0.15 1.04 0.47 -2.79 0.00 0.00 177.10 176.18 2vuy n ASP 121 N 1.87 0.14 -0.16 -4.21 8.00 -1.26 -1.62 116.55 119.31 2vuy n ASP 121 Ca -0.11 0.45 0.15 0.00 0.71 0.00 0.00 54.79 55.98 2vuy n ASP 121 Cb 0.56 -0.44 0.67 0.00 -0.02 0.00 0.00 41.12 41.90 2vuy n ASP 121 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2vuy n ALA 122 N -1.45 2.71 -1.29 2.24 0.00 -1.26 -3.70 120.51 117.75 2vuy n ALA 122 Ca -0.00 -0.28 -0.19 0.00 0.00 0.00 0.00 53.44 52.96 2vuy n ALA 122 Cb 0.17 -1.35 0.18 0.00 0.00 0.00 0.00 19.45 18.46 2vuy n ALA 122 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2vuy n VAL 123 N -0.76 3.05 -0.01 0.00 0.24 -0.64 -4.01 118.33 116.20 2vuy n VAL 123 Ca 0.17 -2.16 0.02 0.00 -2.04 0.00 0.00 64.34 60.34 2vuy n VAL 123 Cb 0.25 -0.44 -0.06 0.00 -1.47 0.00 0.00 33.84 32.11 2vuy n VAL 123 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 2vuy n PHE 124 N -1.14 0.00 0.00 6.34 3.01 -1.24 -1.76 117.46 122.67 2vuy n PHE 124 Ca 0.53 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.99 2vuy n PHE 124 Cb 1.50 -0.25 0.00 0.00 -0.01 0.00 0.00 39.48 40.72 2vuy n PHE 124 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2vuy n GLY 125 N 2.17 3.11 3.14 1.37 0.00 -1.26 -4.07 105.19 109.64 2vuy n GLY 125 Ca -0.05 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.84 2vuy n GLY 125 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2vuy s TYR 126 N -1.48 0.91 -0.43 1.61 -0.85 -1.26 -2.35 117.35 113.51 2vuy s TYR 126 Ca 0.00 -0.64 -0.28 0.00 -0.52 0.00 0.00 57.07 55.63 2vuy s TYR 126 Cb 0.00 -0.52 -0.01 0.00 0.38 0.00 0.00 41.96 41.82 2vuy s TYR 126 CO 0.00 -0.05 1.65 0.15 -1.52 0.00 0.00 175.55 175.78 2vuy s LYS 127 N -2.52 3.28 0.18 -3.49 1.02 -1.26 -4.50 119.74 112.45 2vuy s LYS 127 Ca 0.01 1.03 -0.23 0.00 0.02 0.00 0.00 55.97 56.81 2vuy s LYS 127 Cb -0.04 -4.17 0.10 0.00 -0.52 0.00 0.00 37.83 33.19 2vuy s LYS 127 CO -0.01 -1.93 1.57 0.82 -0.92 0.00 0.00 175.35 174.89 2vuy h ILE 128 N 6.67 0.09 0.00 2.17 1.08 -1.95 -2.34 117.51 123.23 2vuy h ILE 128 Ca -0.30 0.00 -0.09 0.00 -0.39 0.00 0.00 64.86 64.08 2vuy h ILE 128 Cb 1.14 0.09 -0.01 0.00 -3.07 0.00 0.00 36.82 34.97 2vuy h ILE 128 CO 1.10 0.00 -0.44 1.23 -0.69 0.00 0.00 178.15 179.34 2vuy h GLY 129 N -0.16 0.00 -4.07 5.37 0.00 -1.98 -3.47 103.07 98.76 2vuy h GLY 129 Ca 0.22 0.00 -0.61 0.00 0.00 0.00 0.00 47.33 46.94 2vuy h GLY 129 CO -0.75 0.00 -0.48 1.34 0.00 0.00 0.00 176.54 176.65 2vuy n ASP 130 N -3.30 -1.15 -0.28 0.19 -0.08 -0.88 -4.91 116.55 106.14 2vuy n ASP 130 Ca 0.01 0.91 -0.05 0.00 -1.51 0.00 0.00 54.79 54.16 2vuy n ASP 130 Cb 0.65 -1.07 0.09 0.00 2.34 0.00 0.00 41.12 43.13 2vuy n ASP 130 CO 0.00 0.00 0.00 -0.61 0.12 0.00 0.00 177.20 176.71 2vuy h GLN 131 N 0.76 1.16 -0.57 -0.67 4.15 -1.91 -2.97 115.11 115.06 2vuy h GLN 131 Ca -0.39 -0.20 0.00 0.00 0.77 0.00 0.00 58.65 58.83 2vuy h GLN 131 Cb 1.41 -0.19 0.00 0.00 0.21 0.00 0.00 27.48 28.90 2vuy h GLN 131 CO 0.51 0.92 0.00 0.09 -1.93 0.00 0.00 178.83 178.43 2vuy n ASN 132 N -4.29 2.01 0.00 -0.69 4.13 -1.26 -4.98 115.26 110.18 2vuy n ASN 132 Ca 0.07 -2.17 0.00 0.00 1.68 0.00 0.00 54.58 54.17 2vuy n ASN 132 Cb 0.17 -0.38 0.00 0.00 -1.54 0.00 0.00 39.78 38.04 2vuy n ASN 132 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2vuy n GLN 133 N 0.23 0.00 0.07 3.52 6.02 -1.12 -1.67 117.38 124.42 2vuy n GLN 133 Ca 0.09 0.00 0.04 0.00 -0.01 0.00 0.00 57.00 57.12 2vuy n GLN 133 Cb 0.40 0.00 0.22 0.00 1.02 0.00 0.00 30.24 31.88 2vuy n GLN 133 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 2vuy n ASP 134 N -0.28 0.21 0.17 1.08 5.75 -1.26 0.22 116.55 122.44 2vuy n ASP 134 Ca 0.00 0.54 0.13 0.00 -0.01 0.00 0.00 54.79 55.45 2vuy n ASP 134 Cb 0.00 -0.55 0.31 0.00 -1.03 0.00 0.00 41.12 39.85 2vuy n ASP 134 CO 0.00 0.00 0.00 -0.07 -0.11 0.00 0.00 177.20 177.02 2vuy h LEU 135 N 0.00 0.00-10.64 -2.12 3.38 -1.75 -3.46 115.31 100.72 2vuy h LEU 135 Ca 0.00 0.00 -0.47 0.00 0.09 0.00 0.00 57.88 57.50 2vuy h LEU 135 Cb 0.18 0.00 0.11 0.00 0.09 0.00 0.00 40.66 41.04 2vuy h LEU 135 CO 0.00 0.00 0.40 0.42 0.09 0.00 0.00 178.44 179.35 2vuy s THR 136 N -3.18 2.02 -0.30 0.22 -4.23 0.13 -4.86 115.64 105.44 2vuy s THR 136 Ca 0.08 -0.02 -0.00 0.00 -1.18 0.00 0.00 61.69 60.57 2vuy s THR 136 Cb 0.09 -3.00 0.09 0.00 1.34 0.00 0.00 72.50 71.02 2vuy s THR 136 CO 0.62 0.00 0.08 -0.47 -0.54 0.00 0.00 174.62 174.31 2vuy s TYR 137 N -3.60 1.85 -0.09 3.99 6.14 -1.26 -4.35 117.35 120.03 2vuy s TYR 137 Ca 0.63 -1.77 -0.30 0.00 0.64 0.00 0.00 57.07 56.28 2vuy s TYR 137 Cb -0.10 -1.75 -0.02 0.00 0.42 0.00 0.00 41.96 40.51 2vuy s TYR 137 CO 0.49 -0.86 1.03 0.34 0.64 0.00 0.00 175.55 177.20 2vuy s ASP 138 N 1.57 7.23 -0.25 4.32 -1.08 -0.99 -4.76 116.67 122.71 2vuy s ASP 138 Ca 0.08 1.58 0.13 0.00 -0.52 0.00 0.00 52.55 53.82 2vuy s ASP 138 Cb -0.17 -2.56 0.81 0.00 -1.46 0.00 0.00 42.92 39.54 2vuy s ASP 138 CO -0.22 -0.45 1.75 -0.62 0.52 0.00 0.00 175.17 176.16 2vuy n GLU 139 N 4.93 4.72 -2.88 4.34 1.02 -1.26 -4.63 120.64 126.88 2vuy n GLU 139 Ca 0.09 -3.12 -0.34 0.00 -0.02 0.00 0.00 57.16 53.76 2vuy n GLU 139 Cb 0.49 -2.26 -0.07 0.00 -0.02 0.00 0.00 31.44 29.58 2vuy n GLU 139 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2vuy s ARG 140 N -2.79 4.31 0.02 3.49 0.52 -1.26 -4.96 118.95 118.28 2vuy s ARG 140 Ca 0.54 1.10 -0.30 0.00 -0.52 0.00 0.00 55.73 56.55 2vuy s ARG 140 Cb 0.42 -2.47 -0.05 0.00 0.52 0.00 0.00 34.95 33.37 2vuy s ARG 140 CO 0.15 0.13 1.15 0.34 0.02 0.00 0.00 175.30 177.09 2vuy s ASP 141 N -1.97 7.14 0.00 0.23 -1.08 -1.26 -4.52 116.67 115.22 2vuy s ASP 141 Ca 0.55 1.89 0.23 0.00 -0.52 0.00 0.00 52.55 54.70 2vuy s ASP 141 Cb -0.13 -2.57 0.09 0.00 -1.46 0.00 0.00 42.92 38.85 2vuy s ASP 141 CO 0.18 -0.44 1.13 -1.54 0.52 0.00 0.00 175.17 175.01 2vuy n SER 142 N 4.16 0.91 -0.35 -0.34 3.41 -1.15 -4.67 113.62 115.59 2vuy n SER 142 Ca 0.09 -0.78 0.03 0.00 -0.26 0.00 0.00 58.87 57.94 2vuy n SER 142 Cb 0.47 0.65 0.09 0.00 -0.26 0.00 0.00 64.21 65.17 2vuy n SER 142 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2vuy n GLY 143 N 1.48 -1.77 0.00 5.00 0.00 -1.26 -1.15 105.19 107.49 2vuy n GLY 143 Ca 0.05 1.04 0.11 0.00 0.00 0.00 0.00 46.02 47.23 2vuy n GLY 143 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2vuy n GLU 144 N -5.48 0.69 0.00 1.61 0.28 -1.25 -2.96 120.64 113.53 2vuy n GLU 144 Ca 0.13 0.00 0.01 0.00 -0.16 0.00 0.00 57.16 57.14 2vuy n GLU 144 Cb 0.43 -1.50 0.00 0.00 1.43 0.00 0.00 31.44 31.80 2vuy n GLU 144 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 2vuy n TYR 145 N -1.01 0.00 -4.23 -1.84 4.02 -0.30 -4.94 117.16 108.85 2vuy n TYR 145 Ca 0.17 0.00 -0.34 0.00 -0.01 0.00 0.00 57.90 57.71 2vuy n TYR 145 Cb 0.08 0.00 -0.12 0.00 -0.02 0.00 0.00 39.34 39.28 2vuy n TYR 145 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 2vuy s VAL 146 N -0.64 4.04 0.90 -0.72 1.01 -1.12 -0.58 120.40 123.29 2vuy s VAL 146 Ca 0.02 -0.30 -0.11 0.00 0.00 0.00 0.00 61.98 61.60 2vuy s VAL 146 Cb 0.02 -2.80 0.12 0.00 0.00 0.00 0.00 36.38 33.73 2vuy s VAL 146 CO 0.06 0.47 1.05 -0.81 0.00 0.00 0.00 175.10 175.87 2vuy n PRO 147 N 3.78 -0.34 -3.98 2.72 -0.04 -1.24 -4.95 135.00 130.94 2vuy n PRO 147 Ca -0.17 -0.03 -0.29 0.00 -0.04 0.00 0.00 63.50 62.96 2vuy n PRO 147 Cb 0.52 -2.31 -0.05 0.00 -0.04 0.00 0.00 33.50 31.62 2vuy n PRO 147 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2vuy s LYS 148 N -4.40 3.20 0.29 0.54 3.01 -1.24 -4.87 119.74 116.28 2vuy s LYS 148 Ca 0.67 -0.60 -0.25 0.00 -1.01 0.00 0.00 55.97 54.78 2vuy s LYS 148 Cb -0.24 -2.88 -0.09 0.00 -1.01 0.00 0.00 37.83 33.61 2vuy s LYS 148 CO 0.58 0.56 0.89 -1.12 0.51 0.00 0.00 175.35 176.77 2vuy s SER 149 N -2.68 7.28 -0.12 2.83 0.01 0.23 -0.54 113.70 120.70 2vuy s SER 149 Ca 0.33 1.73 0.03 0.00 1.31 0.00 0.00 55.95 59.35 2vuy s SER 149 Cb -0.12 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.57 2vuy s SER 149 CO 0.26 -0.03 -0.22 -0.69 0.41 0.00 0.00 173.24 172.97 2vuy s VAL 150 N -1.57 2.14 -0.09 3.43 1.01 0.98 -0.35 120.40 125.94 2vuy s VAL 150 Ca 0.48 -0.98 -0.30 0.00 0.00 0.00 0.00 61.98 61.19 2vuy s VAL 150 Cb -0.18 -1.84 -0.03 0.00 0.00 0.00 0.00 36.38 34.33 2vuy s VAL 150 CO 0.23 0.55 1.36 -0.69 0.00 0.00 0.00 175.10 176.55 2vuy s VAL 151 N 0.55 4.03 0.27 2.92 1.01 -0.66 -4.00 120.40 124.53 2vuy s VAL 151 Ca -0.13 1.30 0.07 0.00 0.00 0.00 0.00 61.98 63.21 2vuy s VAL 151 Cb -0.17 -3.84 -0.03 0.00 0.00 0.00 0.00 36.38 32.35 2vuy s VAL 151 CO 0.04 -0.08 0.26 0.27 0.00 0.00 0.00 175.10 175.59 2vuy s ILE 152 N 3.19 4.37 -0.31 2.22 -4.36 -1.26 0.76 121.20 125.82 2vuy s ILE 152 Ca 0.60 -1.31 -0.08 0.00 -0.26 0.00 0.00 60.65 59.60 2vuy s ILE 152 Cb -0.26 -3.43 0.00 0.00 1.25 0.00 0.00 42.46 40.02 2vuy s ILE 152 CO 0.21 -0.30 0.12 0.21 0.24 0.00 0.00 174.94 175.41 2vuy s ASN 153 N -3.91 5.33 0.11 4.36 3.04 -1.26 -4.60 114.94 118.01 2vuy s ASN 153 Ca 0.35 -0.67 0.26 0.00 0.04 0.00 0.00 52.86 52.84 2vuy s ASN 153 Cb -0.08 -1.93 0.98 0.00 -1.54 0.00 0.00 41.25 38.68 2vuy s ASN 153 CO 0.26 -0.21 1.80 -0.81 -3.04 0.00 0.00 177.10 175.10 2vuy n PRO 154 N 4.92 0.13 -2.13 0.43 -0.04 -1.26 -4.80 135.00 132.25 2vuy n PRO 154 Ca -0.14 0.16 -0.42 0.00 -0.04 0.00 0.00 63.50 63.06 2vuy n PRO 154 Cb 0.48 -1.66 -0.03 0.00 -0.04 0.00 0.00 33.50 32.25 2vuy n PRO 154 CO 0.00 0.00 0.00 -0.47 -0.04 0.00 0.00 175.50 174.99 2vuy s TYR 155 N -3.07 2.96 -0.29 0.54 5.04 -1.26 -4.99 117.35 116.27 2vuy s TYR 155 Ca 0.11 0.78 -0.04 0.00 -2.44 0.00 0.00 57.07 55.47 2vuy s TYR 155 Cb 0.14 -3.74 0.16 0.00 0.35 0.00 0.00 41.96 38.88 2vuy s TYR 155 CO 0.52 -2.73 0.59 0.12 -1.34 0.00 0.00 175.55 172.71 2vuy s PHE 156 N 1.80 -1.45 -0.79 4.97 5.36 -1.26 -5.11 117.98 121.51 2vuy s PHE 156 Ca 0.66 1.84 -0.26 0.00 -0.96 0.00 0.00 56.93 58.22 2vuy s PHE 156 Cb -0.36 0.60 0.02 0.00 -0.34 0.00 0.00 43.02 42.94 2vuy s PHE 156 CO 0.29 -0.79 1.45 -1.83 -1.46 0.00 0.00 175.22 172.89 2vuy s GLU 157 N 2.84 3.15 -0.78 10.12 -1.05 -1.26 -4.92 118.70 126.80 2vuy s GLU 157 Ca 0.11 -0.30 -0.25 0.00 -0.15 0.00 0.00 54.97 54.38 2vuy s GLU 157 Cb -0.14 -4.53 -0.07 0.00 -0.44 0.00 0.00 34.13 28.95 2vuy s GLU 157 CO -0.20 -2.34 2.10 -1.58 0.95 0.00 0.00 175.26 174.20 2vuy s TRP 158 N 6.39 1.53 0.20 4.83 0.52 -1.26 -4.93 118.94 126.22 2vuy s TRP 158 Ca 0.45 1.12 -0.30 0.00 0.02 0.00 0.00 56.10 57.38 2vuy s TRP 158 Cb -0.07 -3.84 -0.09 0.00 -1.15 0.00 0.00 33.47 28.32 2vuy s TRP 158 CO 0.09 -1.88 1.36 0.16 0.02 0.00 0.00 176.95 176.70 2vuy s ASP 159 N 9.23 6.81 0.52 2.95 3.84 -1.26 -4.28 116.67 134.48 2vuy s ASP 159 Ca 0.78 2.47 0.00 0.00 -0.00 0.00 0.00 52.55 55.80 2vuy s ASP 159 Cb -0.10 -2.61 0.00 0.00 -1.38 0.00 0.00 42.92 38.83 2vuy s ASP 159 CO 0.08 -0.60 0.00 0.47 -0.00 0.00 0.00 175.17 175.12 2vuy n ASP 160 N 2.75 0.00 0.00 2.11 10.43 -1.26 -4.79 116.55 125.79 2vuy n ASP 160 Ca 0.07 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.43 2vuy n ASP 160 Cb 0.42 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.38 2vuy n ASP 160 CO 0.00 0.00 0.00 1.21 -1.07 0.00 0.00 177.20 177.34 2vuy n GLU 161 N 14.00 0.00 0.06 -1.24 0.00 -1.26 -4.41 120.64 127.79 2vuy n GLU 161 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 57.16 57.33 2vuy n GLU 161 Cb 0.00 -0.32 0.42 0.00 0.00 0.00 0.00 31.44 31.55 2vuy n GLU 161 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.13 176.69 2vuy h ASP 162 N 0.00 0.00 0.00 4.31 3.32 -1.87 -3.18 116.42 119.00 2vuy h ASP 162 Ca 0.00 0.00 -0.23 0.00 0.02 0.00 0.00 57.03 56.82 2vuy h ASP 162 Cb 0.00 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.52 2vuy h ASP 162 CO 0.00 0.00 -1.49 0.49 -1.72 0.00 0.00 179.24 176.52 2vuy n PHE 163 N -3.08 0.52 0.24 4.55 0.99 -1.26 -3.62 117.46 115.80 2vuy n PHE 163 Ca 0.11 0.23 0.02 0.00 -0.00 0.00 0.00 57.45 57.80 2vuy n PHE 163 Cb 1.08 -0.91 0.09 0.00 -1.00 0.00 0.00 39.48 38.74 2vuy n PHE 163 CO 0.00 0.00 0.00 1.51 -0.00 0.00 0.00 176.76 178.27 2vuy n ILE 164 N -4.41 0.00 1.04 4.37 3.06 -1.21 -0.58 119.36 121.64 2vuy n ILE 164 Ca -0.32 0.00 0.13 0.00 -2.50 0.00 0.00 62.75 60.07 2vuy n ILE 164 Cb 0.65 -0.85 0.52 0.00 0.54 0.00 0.00 39.64 40.49 2vuy n ILE 164 CO 0.00 0.00 0.00 0.29 -2.50 0.00 0.00 176.55 174.34 2vuy n LYS 165 N -0.91 0.06 0.00 9.51 4.76 -1.21 -4.62 118.16 125.76 2vuy n LYS 165 Ca 0.02 -0.02 0.00 0.00 -2.87 0.00 0.00 58.31 55.45 2vuy n LYS 165 Cb 0.01 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.70 2vuy n LYS 165 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2vuy n GLY 166 N 1.48 0.90 3.69 0.72 0.00 0.26 -4.87 105.19 107.35 2vuy n GLY 166 Ca 0.07 -0.66 -0.42 0.00 0.00 0.00 0.00 46.02 45.02 2vuy n GLY 166 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vuy s LYS 167 N 0.23 4.16 0.47 1.61 1.02 -1.26 -4.98 119.74 120.99 2vuy s LYS 167 Ca 0.00 2.47 0.07 0.00 0.02 0.00 0.00 55.97 58.53 2vuy s LYS 167 Cb 0.00 -3.65 -0.00 0.00 -0.52 0.00 0.00 37.83 33.66 2vuy s LYS 167 CO 0.00 -0.80 0.35 0.21 -0.92 0.00 0.00 175.35 174.19 2vuy s LYS 168 N 2.86 2.36 -0.63 1.68 2.20 -1.26 -4.92 119.74 122.03 2vuy s LYS 168 Ca 0.78 -1.78 -0.33 0.00 -0.36 0.00 0.00 55.97 54.28 2vuy s LYS 168 Cb -0.43 -2.20 -0.15 0.00 -1.51 0.00 0.00 37.83 33.55 2vuy s LYS 168 CO 0.35 -0.35 2.41 0.28 -0.36 0.00 0.00 175.35 177.68 2vuy n VAL 169 N -1.58 0.04 -0.86 4.02 0.31 -1.26 -4.88 118.33 114.12 2vuy n VAL 169 Ca 0.01 -0.26 -0.34 0.00 -0.01 0.00 0.00 64.34 63.74 2vuy n VAL 169 Cb 0.63 -1.37 0.10 0.00 -0.91 0.00 0.00 33.84 32.29 2vuy n VAL 169 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 2vuy n PRO 170 N 8.40 -0.28 0.04 5.55 -0.02 -1.26 -4.90 135.00 142.54 2vuy n PRO 170 Ca 0.51 -0.06 -0.09 0.00 -2.02 0.00 0.00 63.50 61.84 2vuy n PRO 170 Cb 0.20 -1.54 0.04 0.00 -0.02 0.00 0.00 33.50 32.18 2vuy n PRO 170 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2vuy h LEU 171 N -1.40 0.50 -0.68 2.45 3.38 -2.00 -3.29 115.31 114.27 2vuy h LEU 171 Ca -0.44 -0.31 -0.14 0.00 0.09 0.00 0.00 57.88 57.08 2vuy h LEU 171 Cb 1.30 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.89 2vuy h LEU 171 CO 0.30 1.04 -0.63 0.07 0.09 0.00 0.00 178.44 179.31 2vuy h LYS 172 N 0.30 0.12 -0.48 1.13 2.10 -1.91 -3.19 116.57 114.64 2vuy h LYS 172 Ca -0.02 -0.09 0.00 0.00 -2.00 0.00 0.00 60.65 58.54 2vuy h LYS 172 Cb 1.25 0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.59 2vuy h LYS 172 CO 0.12 0.71 0.00 -0.25 -2.00 0.00 0.00 179.45 178.03 2vuy n ASP 173 N -3.83 2.54 -4.81 7.07 8.00 -1.24 -4.65 116.55 119.64 2vuy n ASP 173 Ca -0.02 -2.05 -0.32 0.00 0.71 0.00 0.00 54.79 53.11 2vuy n ASP 173 Cb 0.63 -0.33 0.01 0.00 -0.02 0.00 0.00 41.12 41.41 2vuy n ASP 173 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2vuy s THR 174 N -1.46 3.99 -0.27 -3.53 2.01 -1.21 -4.89 115.64 110.28 2vuy s THR 174 Ca 0.30 0.88 0.00 0.00 0.31 0.00 0.00 61.69 63.19 2vuy s THR 174 Cb 0.17 -3.46 0.16 0.00 0.01 0.00 0.00 72.50 69.38 2vuy s THR 174 CO 0.19 -0.62 0.42 -0.69 -0.69 0.00 0.00 174.62 173.24 2vuy s VAL 175 N -2.61 -0.68 0.08 3.82 1.01 -1.26 -4.52 120.40 116.23 2vuy s VAL 175 Ca 0.62 -0.17 -0.27 0.00 0.00 0.00 0.00 61.98 62.16 2vuy s VAL 175 Cb -0.14 -0.93 -0.06 0.00 0.00 0.00 0.00 36.38 35.25 2vuy s VAL 175 CO 0.40 -0.18 0.83 -0.63 0.00 0.00 0.00 175.10 175.51 2vuy s ILE 176 N 2.59 4.62 -0.29 2.22 1.01 -0.85 -2.73 121.20 127.77 2vuy s ILE 176 Ca 0.12 1.78 0.02 0.00 0.00 0.00 0.00 60.65 62.57 2vuy s ILE 176 Cb -0.14 -4.19 0.07 0.00 0.01 0.00 0.00 42.46 38.22 2vuy s ILE 176 CO -0.24 0.37 -0.05 -0.47 0.00 0.00 0.00 174.94 174.55 2vuy s TYR 177 N -0.15 3.38 -0.37 3.97 5.04 -0.42 0.38 117.35 129.18 2vuy s TYR 177 Ca 0.41 -2.38 -0.24 0.00 -2.44 0.00 0.00 57.07 52.41 2vuy s TYR 177 Cb -0.22 -2.21 0.01 0.00 0.35 0.00 0.00 41.96 39.89 2vuy s TYR 177 CO 0.25 -0.88 0.83 -2.00 -1.34 0.00 0.00 175.55 172.42 2vuy s GLU 178 N 1.09 3.77 0.24 4.97 2.12 -0.30 0.06 118.70 130.65 2vuy s GLU 178 Ca -0.04 0.39 0.06 0.00 0.36 0.00 0.00 54.97 55.75 2vuy s GLU 178 Cb -0.20 -3.81 -0.05 0.00 0.26 0.00 0.00 34.13 30.33 2vuy s GLU 178 CO -0.05 -0.90 -0.08 0.14 -0.54 0.00 0.00 175.26 173.83 2vuy s VAL 179 N 3.24 1.57 -0.20 3.70 -7.23 -0.87 0.10 120.40 120.72 2vuy s VAL 179 Ca 0.34 -2.14 -0.03 0.00 -1.81 0.00 0.00 61.98 58.33 2vuy s VAL 179 Cb -0.13 -2.26 -0.01 0.00 0.56 0.00 0.00 36.38 34.54 2vuy s VAL 179 CO 0.18 -0.43 -0.06 -2.28 -0.31 0.00 0.00 175.10 172.20 2vuy s HIS 180 N -3.07 2.94 0.34 2.82 2.46 -1.26 -1.78 115.29 117.74 2vuy s HIS 180 Ca 0.26 -0.80 0.12 0.00 0.47 0.00 0.00 55.06 55.11 2vuy s HIS 180 Cb 0.02 -2.04 0.94 0.00 -0.13 0.00 0.00 32.58 31.37 2vuy s HIS 180 CO 0.09 -0.42 1.75 0.28 -2.47 0.00 0.00 174.74 173.97 2vuy h VAL 181 N 5.58 0.55 0.01 0.89 2.07 -1.93 -0.55 116.25 122.87 2vuy h VAL 181 Ca -0.37 -0.19 -0.00 0.00 0.82 0.00 0.00 66.70 66.96 2vuy h VAL 181 Cb 1.17 -0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 2vuy h VAL 181 CO 0.60 0.10 -0.00 0.50 0.02 0.00 0.00 177.57 178.78 2vuy h LYS 182 N 0.54 -0.01 -0.95 1.57 1.63 -1.90 -3.31 116.57 114.14 2vuy h LYS 182 Ca 0.62 0.00 0.28 0.00 -0.85 0.00 0.00 60.65 60.70 2vuy h LYS 182 Cb 1.28 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 32.87 2vuy h LYS 182 CO -0.41 -0.01 0.69 0.78 -3.45 0.00 0.00 179.45 177.05 2vuy h GLY 183 N -0.04 0.04 0.92 5.01 0.00 -1.87 -1.77 103.07 105.37 2vuy h GLY 183 Ca -0.00 -0.01 0.08 0.00 0.00 0.00 0.00 47.33 47.41 2vuy h GLY 183 CO 0.00 -0.00 0.50 -2.75 0.00 0.00 0.00 176.54 174.29 2vuy h PHE 184 N 0.01 0.75 0.00 5.60 3.57 -1.24 -0.18 116.94 125.46 2vuy h PHE 184 Ca 0.46 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.98 2vuy h PHE 184 Cb 1.81 -0.25 0.00 0.00 2.79 0.00 0.00 35.95 40.30 2vuy h PHE 184 CO -0.00 0.37 0.00 0.25 -2.23 0.00 0.00 178.31 176.70 2vuy n THR 185 N -4.49 0.10 -0.07 4.41 -2.24 -0.90 -4.81 114.28 106.28 2vuy n THR 185 Ca 0.12 -0.25 -0.07 0.00 -2.27 0.00 0.00 64.05 61.57 2vuy n THR 185 Cb 0.29 1.39 -0.01 0.00 -2.10 0.00 0.00 70.33 69.91 2vuy n THR 185 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 2vuy h LYS 186 N 0.00 0.07 -1.28 -0.78 1.63 -1.44 -2.26 116.57 112.51 2vuy h LYS 186 Ca 0.00 -0.00 -0.37 0.00 -0.85 0.00 0.00 60.65 59.43 2vuy h LYS 186 Cb 0.42 -0.01 -0.17 0.00 -0.60 0.00 0.00 32.23 31.87 2vuy h LYS 186 CO 0.00 0.04 0.47 1.28 -3.45 0.00 0.00 179.45 177.79 2vuy n LEU 187 N -5.17 6.23 -4.12 5.20 4.32 -1.26 -4.72 117.00 117.47 2vuy n LEU 187 Ca -0.01 -3.25 -0.37 0.00 -0.02 0.00 0.00 56.01 52.36 2vuy n LEU 187 Cb 0.14 -0.93 -0.07 0.00 -1.62 0.00 0.00 43.42 40.94 2vuy n LEU 187 CO 0.24 1.13 0.22 -0.60 -1.22 0.00 0.00 177.39 177.16 2vuy s ARG 188 N -2.13 3.00 0.00 3.23 6.06 -0.85 -4.43 118.95 123.82 2vuy s ARG 188 Ca 0.36 -2.89 0.06 0.00 -2.50 0.00 0.00 55.73 50.77 2vuy s ARG 188 Cb 0.29 -3.90 0.39 0.00 0.06 0.00 0.00 34.95 31.79 2vuy s ARG 188 CO 0.02 -1.23 0.79 1.28 -2.50 0.00 0.00 175.30 173.66 2vuy n LEU 189 N 2.97 0.00 -0.01 -0.88 7.99 -1.26 -1.92 117.00 123.88 2vuy n LEU 189 Ca 0.15 0.00 -0.17 0.00 -0.01 0.00 0.00 56.01 55.98 2vuy n LEU 189 Cb 0.38 0.00 -0.10 0.00 -0.11 0.00 0.00 43.42 43.60 2vuy n LEU 189 CO 0.35 0.00 0.30 -0.78 -1.51 0.00 0.00 177.39 175.74 2vuy h ASP 190 N 0.00 0.62 -3.47 -1.43 1.82 -1.95 -3.45 116.42 108.56 2vuy h ASP 190 Ca 0.00 -0.69 -0.51 0.00 -0.39 0.00 0.00 57.03 55.44 2vuy h ASP 190 Cb 0.00 -0.19 -0.01 0.00 0.68 0.00 0.00 39.33 39.81 2vuy h ASP 190 CO 0.00 1.22 -0.02 -0.76 -1.61 0.00 0.00 179.24 178.08 2vuy s LEU 191 N -8.45 3.99 0.50 2.28 1.43 -0.81 -5.05 118.68 112.57 2vuy s LEU 191 Ca -0.13 0.95 -0.20 0.00 -1.03 0.00 0.00 54.13 53.73 2vuy s LEU 191 Cb 0.05 -3.79 -0.11 0.00 0.03 0.00 0.00 46.19 42.37 2vuy s LEU 191 CO 0.84 -0.26 0.45 -0.81 0.23 0.00 0.00 176.35 176.80 2vuy n PRO 192 N -0.92 0.48 -0.10 1.29 -0.04 -1.26 -4.79 135.00 129.66 2vuy n PRO 192 Ca 0.01 0.18 0.01 0.00 -0.04 0.00 0.00 63.50 63.66 2vuy n PRO 192 Cb 0.54 -1.54 0.05 0.00 -0.04 0.00 0.00 33.50 32.51 2vuy n PRO 192 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2vuy n GLU 193 N 0.41 1.43 0.00 0.54 2.13 -1.26 -2.82 120.64 121.07 2vuy n GLU 193 Ca 0.11 -0.40 0.00 0.00 0.66 0.00 0.00 57.16 57.53 2vuy n GLU 193 Cb 0.44 -1.43 0.00 0.00 0.27 0.00 0.00 31.44 30.72 2vuy n GLU 193 CO 0.00 0.00 0.00 0.27 -0.41 0.00 0.00 177.13 176.99 2vuy n ASN 194 N -0.01 0.78 0.00 4.31 6.94 -1.26 -4.61 115.26 121.41 2vuy n ASN 194 Ca 0.04 -1.17 0.00 0.00 -0.02 0.00 0.00 54.58 53.42 2vuy n ASN 194 Cb 0.28 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.70 2vuy n ASN 194 CO 0.00 0.00 0.00 2.30 -1.03 0.00 0.00 177.26 178.53 2vuy n ILE 195 N -0.09 0.56 -2.44 1.53 -5.35 -1.13 -4.80 119.36 107.65 2vuy n ILE 195 Ca 0.00 -0.71 -0.42 0.00 -0.27 0.00 0.00 62.75 61.35 2vuy n ILE 195 Cb 0.17 0.77 -0.03 0.00 -1.74 0.00 0.00 39.64 38.81 2vuy n ILE 195 CO 0.00 0.00 0.00 -0.13 -1.76 0.00 0.00 176.55 174.66 2vuy s ARG 196 N -0.56 4.38 -0.18 6.28 0.52 -1.25 -2.87 118.95 125.26 2vuy s ARG 196 Ca 0.00 1.72 0.00 0.00 -0.52 0.00 0.00 55.73 56.93 2vuy s ARG 196 Cb 0.00 -3.49 0.00 0.00 0.52 0.00 0.00 34.95 31.98 2vuy s ARG 196 CO 0.00 -0.39 0.00 0.41 0.02 0.00 0.00 175.30 175.34 2vuy n GLY 197 N 3.33 0.40 3.49 -3.53 0.00 -1.24 -4.59 105.19 103.05 2vuy n GLY 197 Ca 0.10 -0.89 -0.23 0.00 0.00 0.00 0.00 46.02 45.00 2vuy n GLY 197 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2vuy s THR 198 N -2.08 1.22 0.08 2.61 -4.23 -1.14 -4.05 115.64 108.04 2vuy s THR 198 Ca 0.00 -2.00 -0.26 0.00 -1.18 0.00 0.00 61.69 58.25 2vuy s THR 198 Cb 0.00 -2.75 -0.16 0.00 1.34 0.00 0.00 72.50 70.93 2vuy s THR 198 CO 0.00 0.00 1.68 1.88 -0.54 0.00 0.00 174.62 177.64 2vuy h TYR 199 N 2.01 -0.28 -0.97 3.99 0.99 -1.35 -1.78 116.97 119.59 2vuy h TYR 199 Ca -0.41 -0.01 0.17 0.00 2.00 0.00 0.00 58.73 60.49 2vuy h TYR 199 Cb 1.25 0.09 -0.09 0.00 1.00 0.00 0.00 36.73 38.98 2vuy h TYR 199 CO 0.73 -0.16 0.61 1.49 -0.00 0.00 0.00 178.16 180.83 2vuy h GLU 200 N -0.32 0.70 -0.29 4.88 4.81 -1.82 -1.25 114.58 121.30 2vuy h GLU 200 Ca -0.03 -0.04 -0.09 0.00 -0.13 0.00 0.00 59.36 59.07 2vuy h GLU 200 Cb 0.25 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.46 2vuy h GLU 200 CO 0.05 0.47 -0.16 0.78 -0.73 0.00 0.00 179.01 179.42 2vuy h GLY 201 N 0.72 0.66 1.41 1.92 0.00 -1.40 -2.83 103.07 103.56 2vuy h GLY 201 Ca 0.52 -0.61 0.08 0.00 0.00 0.00 0.00 47.33 47.32 2vuy h GLY 201 CO -0.28 0.55 0.22 -2.00 0.00 0.00 0.00 176.54 175.03 2vuy h LEU 202 N 0.35 0.00 -3.42 3.11 6.46 -0.37 -0.81 115.31 120.64 2vuy h LEU 202 Ca 0.06 0.00 -0.07 0.00 -0.12 0.00 0.00 57.88 57.76 2vuy h LEU 202 Cb 0.68 0.00 -0.04 0.00 -0.73 0.00 0.00 40.66 40.57 2vuy h LEU 202 CO 0.05 0.00 0.05 0.00 -0.62 0.00 0.00 178.44 177.91 2vuy n ALA 203 N -2.48 3.63 -1.29 1.25 0.00 -1.06 -4.53 120.51 116.02 2vuy n ALA 203 Ca 0.03 -2.35 -0.32 0.00 0.00 0.00 0.00 53.44 50.80 2vuy n ALA 203 Cb 0.37 -0.90 0.08 0.00 0.00 0.00 0.00 19.45 19.01 2vuy n ALA 203 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2vuy s SER 204 N -1.63 4.52 0.27 0.00 1.04 -0.31 -4.77 113.70 112.82 2vuy s SER 204 Ca 0.47 1.96 -0.02 0.00 0.48 0.00 0.00 55.95 58.84 2vuy s SER 204 Cb 0.38 -2.54 0.43 0.00 0.10 0.00 0.00 66.02 64.39 2vuy s SER 204 CO 0.10 -2.03 1.87 -0.33 0.98 0.00 0.00 173.24 173.83 2vuy h GLU 205 N -0.76 1.11 -0.63 4.02 3.07 -1.92 -0.62 114.58 118.86 2vuy h GLU 205 Ca -0.45 -0.07 -0.01 0.00 -0.50 0.00 0.00 59.36 58.33 2vuy h GLU 205 Cb 1.24 -0.25 -0.03 0.00 -0.84 0.00 0.00 28.75 28.87 2vuy h GLU 205 CO 0.51 0.73 0.34 1.96 -1.40 0.00 0.00 179.01 181.16 2vuy h GLN 206 N 1.14 0.88 -0.09 2.33 7.50 -1.93 -1.56 115.11 123.38 2vuy h GLN 206 Ca 0.44 -0.10 -0.19 0.00 0.50 0.00 0.00 58.65 59.30 2vuy h GLN 206 Cb 0.22 -0.17 -0.00 0.00 0.05 0.00 0.00 27.48 27.57 2vuy h GLN 206 CO -0.19 0.67 -0.73 0.52 -1.50 0.00 0.00 178.83 177.60 2vuy h MET 207 N 0.86 0.47 -0.44 1.46 2.86 -1.69 -2.46 114.93 115.99 2vuy h MET 207 Ca 0.22 -0.38 -0.11 0.00 -2.06 0.00 0.00 59.70 57.37 2vuy h MET 207 Cb 0.05 0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.77 2vuy h MET 207 CO -0.04 1.01 -0.19 0.82 1.06 0.00 0.00 176.91 179.58 2vuy h ILE 208 N 0.32 1.27 -0.85 -1.22 2.04 -1.00 -0.93 117.51 117.13 2vuy h ILE 208 Ca -0.03 -1.31 -0.03 0.00 1.00 0.00 0.00 64.86 64.48 2vuy h ILE 208 Cb 1.32 1.13 -0.04 0.00 -0.74 0.00 0.00 36.82 38.49 2vuy h ILE 208 CO 0.13 0.45 0.41 0.28 0.00 0.00 0.00 178.15 179.41 2vuy h SER 209 N 0.75 1.11 0.04 1.72 0.02 -1.24 -0.24 113.55 115.71 2vuy h SER 209 Ca 0.11 -0.13 -0.00 0.00 -0.84 0.00 0.00 61.79 60.92 2vuy h SER 209 Cb 0.72 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.97 2vuy h SER 209 CO 0.05 0.93 -0.02 0.22 -1.14 0.00 0.00 176.83 176.88 2vuy h TYR 210 N 1.21 -0.05 -0.71 3.45 3.20 -0.92 0.33 116.97 123.48 2vuy h TYR 210 Ca 0.29 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.16 2vuy h TYR 210 Cb 0.12 0.02 -0.03 0.00 1.54 0.00 0.00 36.73 38.37 2vuy h TYR 210 CO 0.02 -0.02 0.44 -0.07 -1.64 0.00 0.00 178.16 176.89 2vuy h LEU 211 N -0.07 0.84 -0.42 2.82 3.38 -0.86 -0.49 115.31 120.51 2vuy h LEU 211 Ca -0.01 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 2vuy h LEU 211 Cb 0.06 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 2vuy h LEU 211 CO 0.01 0.64 0.18 0.11 0.09 0.00 0.00 178.44 179.47 2vuy h LYS 212 N 0.96 0.61 -0.60 1.13 1.79 -0.81 -1.47 116.57 118.19 2vuy h LYS 212 Ca 0.26 -0.10 -0.06 0.00 -2.18 0.00 0.00 60.65 58.57 2vuy h LYS 212 Cb -0.05 -0.10 -0.03 0.00 -1.58 0.00 0.00 32.23 30.47 2vuy h LYS 212 CO -0.05 0.55 0.15 -0.44 -1.08 0.00 0.00 179.45 178.58 2vuy h ASP 213 N 0.53 0.86 0.51 0.86 3.32 -0.61 -1.95 116.42 119.94 2vuy h ASP 213 Ca 0.14 -0.16 -0.06 0.00 0.02 0.00 0.00 57.03 56.97 2vuy h ASP 213 Cb 0.15 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.47 2vuy h ASP 213 CO -0.01 0.84 -0.27 0.25 -1.72 0.00 0.00 179.24 178.33 2vuy h LEU 214 N 0.89 0.00 0.00 1.55 5.85 -0.84 -3.47 115.31 119.28 2vuy h LEU 214 Ca 0.19 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.91 2vuy h LEU 214 Cb 0.31 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.34 2vuy h LEU 214 CO -0.00 0.27 0.00 0.61 -0.34 0.00 0.00 178.44 178.98 2vuy n GLY 215 N -0.35 0.62 3.78 3.75 0.00 -0.58 -4.71 105.19 107.69 2vuy n GLY 215 Ca -0.01 -0.37 -0.37 0.00 0.00 0.00 0.00 46.02 45.26 2vuy n GLY 215 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2vuy s ILE 216 N -2.00 4.16 -0.10 -0.61 -5.25 -1.20 -4.97 121.20 111.24 2vuy s ILE 216 Ca 0.00 1.85 -0.16 0.00 -0.99 0.00 0.00 60.65 61.35 2vuy s ILE 216 Cb 0.00 -4.05 -0.27 0.00 2.95 0.00 0.00 42.46 41.08 2vuy s ILE 216 CO 0.00 0.20 0.58 0.71 -1.79 0.00 0.00 174.94 174.64 2vuy h THR 217 N 2.70 1.06 -3.88 8.37 1.35 -1.86 -3.45 112.91 117.20 2vuy h THR 217 Ca -0.46 -2.41 -0.48 0.00 -0.55 0.00 0.00 66.41 62.51 2vuy h THR 217 Cb 1.19 2.74 -0.21 0.00 -1.73 0.00 0.00 68.15 70.15 2vuy h THR 217 CO 0.65 0.70 -0.80 0.42 -0.25 0.00 0.00 175.52 176.25 2vuy s THR 218 N -2.47 1.41 -0.07 6.82 -4.23 -1.11 -2.00 115.64 113.99 2vuy s THR 218 Ca -0.19 -1.46 0.02 0.00 -1.18 0.00 0.00 61.69 58.87 2vuy s THR 218 Cb 0.04 -1.34 -0.03 0.00 1.34 0.00 0.00 72.50 72.51 2vuy s THR 218 CO 0.77 -0.18 -0.11 0.68 -0.54 0.00 0.00 174.62 175.25 2vuy s VAL 219 N -1.33 3.35 -0.44 2.29 -7.23 -0.71 -1.30 120.40 115.03 2vuy s VAL 219 Ca 0.03 -0.60 -0.01 0.00 -1.81 0.00 0.00 61.98 59.59 2vuy s VAL 219 Cb -0.09 -2.36 0.12 0.00 0.56 0.00 0.00 36.38 34.61 2vuy s VAL 219 CO 0.03 0.58 0.22 -0.70 -0.31 0.00 0.00 175.10 174.92 2vuy s GLU 220 N -0.56 2.00 0.26 4.82 2.12 0.11 -0.89 118.70 126.56 2vuy s GLU 220 Ca 0.08 -2.01 -0.29 0.00 0.36 0.00 0.00 54.97 53.11 2vuy s GLU 220 Cb -0.12 -3.52 -0.09 0.00 0.26 0.00 0.00 34.13 30.66 2vuy s GLU 220 CO 0.02 -1.07 1.19 -0.51 -0.54 0.00 0.00 175.26 174.35 2vuy s LEU 221 N 0.79 4.49 0.81 2.70 1.02 -0.40 -2.05 118.68 126.04 2vuy s LEU 221 Ca 0.11 2.36 -0.11 0.00 0.02 0.00 0.00 54.13 56.51 2vuy s LEU 221 Cb -0.22 -3.63 0.08 0.00 0.02 0.00 0.00 46.19 42.45 2vuy s LEU 221 CO -0.04 -0.32 1.09 -0.04 0.02 0.00 0.00 176.35 177.05 2vuy s MET 222 N -1.09 1.94 0.06 1.70 -1.94 -0.73 -1.03 119.30 118.20 2vuy s MET 222 Ca 0.49 0.98 -0.25 0.00 -1.71 0.00 0.00 55.69 55.20 2vuy s MET 222 Cb -0.34 -1.87 -0.13 0.00 2.01 0.00 0.00 34.83 34.49 2vuy s MET 222 CO 0.42 -1.81 0.60 -2.30 -0.01 0.00 0.00 175.02 171.92 2vuy n PRO 223 N -3.61 0.00 0.00 2.03 -0.02 -1.26 -4.68 135.00 127.46 2vuy n PRO 223 Ca 0.08 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.56 2vuy n PRO 223 Cb 0.54 -0.92 0.00 0.00 -0.02 0.00 0.00 33.50 33.10 2vuy n PRO 223 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 2vuy n VAL 224 N 0.64 0.00 -1.68 -1.45 0.24 -1.26 -4.83 118.33 110.00 2vuy n VAL 224 Ca 0.14 -0.33 -0.46 0.00 -2.04 0.00 0.00 64.34 61.65 2vuy n VAL 224 Cb 0.10 1.06 -0.04 0.00 -1.47 0.00 0.00 33.84 33.49 2vuy n VAL 224 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 2vuy n PHE 225 N -0.54 2.36 -1.68 6.34 3.72 -1.26 0.05 117.46 126.45 2vuy n PHE 225 Ca 0.00 0.09 -0.64 0.00 -0.05 0.00 0.00 57.45 56.85 2vuy n PHE 225 Cb 0.02 -2.62 -0.09 0.00 -0.94 0.00 0.00 39.48 35.84 2vuy n PHE 225 CO 0.00 0.00 0.00 1.58 -0.05 0.00 0.00 176.76 178.29 2vuy n HIS 226 N 5.01 1.51 -4.56 1.38 -0.00 0.09 -4.65 115.22 114.00 2vuy n HIS 226 Ca 0.19 1.05 -0.26 0.00 0.46 0.00 0.00 57.72 59.16 2vuy n HIS 226 Cb 0.31 -2.22 -0.09 0.00 -0.12 0.00 0.00 29.99 27.86 2vuy n HIS 226 CO 0.00 0.00 0.00 -0.59 0.46 0.00 0.00 176.34 176.21 2vuy s PHE 227 N 2.25 1.90 0.02 1.57 -0.12 -1.26 -2.55 117.98 119.79 2vuy s PHE 227 Ca 1.00 -1.09 0.06 0.00 -0.05 0.00 0.00 56.93 56.86 2vuy s PHE 227 Cb -1.38 -1.33 -0.02 0.00 -0.63 0.00 0.00 43.02 39.65 2vuy s PHE 227 CO 0.73 -0.05 -0.19 0.42 -0.05 0.00 0.00 175.22 176.08 2vuy s ILE 228 N -3.12 1.54 -0.25 -4.49 1.01 -1.07 -4.93 121.20 109.88 2vuy s ILE 228 Ca 0.24 -1.04 -0.29 0.00 0.00 0.00 0.00 60.65 59.56 2vuy s ILE 228 Cb 0.04 -1.32 0.01 0.00 0.01 0.00 0.00 42.46 41.20 2vuy s ILE 228 CO 0.12 0.26 1.13 -1.81 0.00 0.00 0.00 174.94 174.64 2vuy s ASP 229 N -0.92 6.96 0.34 3.58 1.01 -1.26 -4.88 116.67 121.49 2vuy s ASP 229 Ca 0.07 1.32 -0.27 0.00 0.71 0.00 0.00 52.55 54.38 2vuy s ASP 229 Cb -0.08 -2.54 -0.13 0.00 1.01 0.00 0.00 42.92 41.18 2vuy s ASP 229 CO 0.01 -0.81 1.10 0.00 0.21 0.00 0.00 175.17 175.68 2vuy n GLN 230 N 6.69 1.61 -0.29 8.23 3.00 -1.26 -4.78 117.38 130.58 2vuy n GLN 230 Ca 0.13 0.57 0.07 0.00 -0.01 0.00 0.00 57.00 57.76 2vuy n GLN 230 Cb 0.46 -2.06 0.29 0.00 0.00 0.00 0.00 30.24 28.93 2vuy n GLN 230 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.06 176.97 2vuy h ARG 231 N 2.06 0.88 0.00 -1.09 2.43 -1.97 -0.61 114.38 116.07 2vuy h ARG 231 Ca -0.43 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.69 2vuy h ARG 231 Cb 1.32 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 30.67 2vuy h ARG 231 CO 0.60 0.58 0.00 1.97 -1.51 0.00 0.00 179.97 181.61 2vuy n PHE 232 N -4.53 0.78 -0.00 2.20 1.16 -1.26 -0.05 117.46 115.76 2vuy n PHE 232 Ca 0.15 0.35 -0.22 0.00 -1.87 0.00 0.00 57.45 55.87 2vuy n PHE 232 Cb 0.30 -1.07 -0.14 0.00 -1.61 0.00 0.00 39.48 36.97 2vuy n PHE 232 CO 0.00 0.00 0.00 -0.07 -1.87 0.00 0.00 176.76 174.82 2vuy h LEU 233 N 0.00 0.38 -0.32 5.98 -0.00 -1.45 -3.33 115.31 116.58 2vuy h LEU 233 Ca 0.00 -0.88 -0.01 0.00 -0.00 0.00 0.00 57.88 56.99 2vuy h LEU 233 Cb 0.19 -0.12 -0.01 0.00 -0.00 0.00 0.00 40.66 40.71 2vuy h LEU 233 CO 0.00 1.78 0.15 0.74 -0.00 0.00 0.00 178.44 181.12 2vuy h THR 234 N -0.11 1.15 0.00 0.22 2.02 -0.89 0.30 112.91 115.61 2vuy h THR 234 Ca -0.39 -0.44 0.00 0.00 0.77 0.00 0.00 66.41 66.35 2vuy h THR 234 Cb 1.92 0.86 0.00 0.00 -1.74 0.00 0.00 68.15 69.19 2vuy h THR 234 CO 0.05 0.16 0.00 0.47 0.37 0.00 0.00 175.52 176.57 2vuy n ASP 235 N -4.77 0.00 -1.19 4.18 8.00 0.93 -2.10 116.55 121.61 2vuy n ASP 235 Ca -0.01 -0.55 0.04 0.00 0.71 0.00 0.00 54.79 54.98 2vuy n ASP 235 Cb 0.10 0.00 0.06 0.00 -0.02 0.00 0.00 41.12 41.26 2vuy n ASP 235 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 2vuy n LYS 236 N -0.86 0.37 -0.83 -1.24 2.85 -0.74 -5.00 118.16 112.72 2vuy n LYS 236 Ca 0.07 -2.21 0.00 0.00 -1.05 0.00 0.00 58.31 55.12 2vuy n LYS 236 Cb 0.03 -0.43 0.00 0.00 -0.65 0.00 0.00 35.03 33.99 2vuy n LYS 236 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2vuy n GLY 237 N 0.06 0.54 0.93 2.58 0.00 -0.89 -4.99 105.19 103.41 2vuy n GLY 237 Ca 0.09 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.06 2vuy n GLY 237 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2vuy n LEU 238 N 0.00 0.00 -3.94 0.99 4.77 0.98 -4.98 117.00 114.82 2vuy n LEU 238 Ca 0.00 -0.58 -0.09 0.00 -0.03 0.00 0.00 56.01 55.31 2vuy n LEU 238 Cb 0.03 -0.11 -0.05 0.00 -2.33 0.00 0.00 43.42 40.96 2vuy n LEU 238 CO 0.00 -0.56 0.19 0.28 -1.33 0.00 0.00 177.39 175.97 2vuy s THR 239 N 0.03 0.01 -0.52 -5.08 -1.32 -1.25 -3.70 115.64 103.81 2vuy s THR 239 Ca 0.15 -1.28 -0.19 0.00 -1.21 0.00 0.00 61.69 59.16 2vuy s THR 239 Cb -0.01 -2.05 0.07 0.00 -1.51 0.00 0.00 72.50 68.99 2vuy s THR 239 CO 0.09 -0.05 0.62 0.21 -2.21 0.00 0.00 174.62 173.28 2vuy s ASN 240 N -2.98 6.21 -0.14 8.08 3.84 -1.26 -4.19 114.94 124.50 2vuy s ASN 240 Ca 0.19 -1.07 -0.27 0.00 0.21 0.00 0.00 52.86 51.92 2vuy s ASN 240 Cb -0.01 -2.28 -0.26 0.00 -0.55 0.00 0.00 41.25 38.16 2vuy s ASN 240 CO 0.06 -0.91 0.72 0.22 -2.79 0.00 0.00 177.10 174.40 2vuy h TYR 241 N 9.01 0.05 0.27 0.43 3.20 -1.19 -3.39 116.97 125.35 2vuy h TYR 241 Ca -0.28 -0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.54 2vuy h TYR 241 Cb 1.10 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.37 2vuy h TYR 241 CO 0.76 1.08 -0.13 -1.49 -1.64 0.00 0.00 178.16 176.74 2vuy h TRP 242 N -0.94 -0.34 0.00 -3.82 6.55 -1.78 -3.48 115.95 112.14 2vuy h TRP 242 Ca -0.05 -0.01 0.00 0.00 0.95 0.00 0.00 58.89 59.78 2vuy h TRP 242 Cb 1.09 0.11 0.00 0.00 -0.86 0.00 0.00 29.16 29.51 2vuy h TRP 242 CO 0.25 -0.11 0.00 0.41 -1.05 0.00 0.00 178.44 177.94 2vuy n GLY 243 N -0.84 1.11 2.68 1.49 0.00 -1.26 -4.06 105.19 104.31 2vuy n GLY 243 Ca -0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 2vuy n GLY 243 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2vuy n TYR 244 N -1.74 3.21 0.00 1.61 4.02 -1.26 -4.40 117.16 118.60 2vuy n TYR 244 Ca 0.00 -2.95 0.00 0.00 -0.01 0.00 0.00 57.90 54.94 2vuy n TYR 244 Cb 0.00 -2.39 0.00 0.00 -0.02 0.00 0.00 39.34 36.93 2vuy n TYR 244 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 2vuy n ASP 245 N 5.09 0.00 -4.96 7.72 4.64 -1.26 -5.03 116.55 122.74 2vuy n ASP 245 Ca 0.54 0.00 -0.21 0.00 -1.38 0.00 0.00 54.79 53.74 2vuy n ASP 245 Cb 0.36 0.00 0.04 0.00 -1.04 0.00 0.00 41.12 40.47 2vuy n ASP 245 CO 0.00 0.00 0.00 -2.16 -0.82 0.00 0.00 177.20 174.22 2vuy s PRO 246 N 0.00 2.52 0.00 -0.67 0.04 -1.26 -2.61 135.00 133.01 2vuy s PRO 246 Ca 0.00 -0.82 0.00 0.00 0.04 0.00 0.00 61.00 60.22 2vuy s PRO 246 Cb 0.00 -2.50 0.00 0.00 0.04 0.00 0.00 34.50 32.04 2vuy s PRO 246 CO 0.00 -0.72 0.12 0.44 0.04 0.00 0.00 177.00 176.88 2vuy n ILE 247 N -2.34 0.00 -3.77 0.56 -6.64 -1.06 0.30 119.36 106.41 2vuy n ILE 247 Ca 0.08 -0.27 -0.13 0.00 -1.77 0.00 0.00 62.75 60.67 2vuy n ILE 247 Cb 0.60 1.20 -0.11 0.00 -1.44 0.00 0.00 39.64 39.89 2vuy n ILE 247 CO 0.00 0.00 0.00 0.21 -1.77 0.00 0.00 176.55 174.99 2vuy s ASN 248 N -0.30 -0.29 -0.14 7.28 3.84 -1.25 -4.90 114.94 119.17 2vuy s ASN 248 Ca 0.00 0.54 0.16 0.00 0.21 0.00 0.00 52.86 53.76 2vuy s ASN 248 Cb 0.00 0.58 0.58 0.00 -0.55 0.00 0.00 41.25 41.86 2vuy s ASN 248 CO 0.00 -0.14 1.50 0.49 -2.79 0.00 0.00 177.10 176.15 2vuy n PHE 249 N 2.73 1.17 0.00 0.43 3.72 -1.26 -4.01 117.46 120.24 2vuy n PHE 249 Ca -0.14 -0.72 0.00 0.00 -0.05 0.00 0.00 57.45 56.54 2vuy n PHE 249 Cb 0.58 -0.28 0.00 0.00 -0.94 0.00 0.00 39.48 38.84 2vuy n PHE 249 CO 0.00 0.00 0.00 1.19 -0.05 0.00 0.00 176.76 177.90 2vuy n PHE 250 N 0.26 0.00 -3.84 1.38 3.01 -1.26 -4.82 117.46 112.19 2vuy n PHE 250 Ca 0.22 0.00 -0.36 0.00 1.01 0.00 0.00 57.45 58.32 2vuy n PHE 250 Cb 0.86 0.00 -0.07 0.00 -0.01 0.00 0.00 39.48 40.26 2vuy n PHE 250 CO 0.00 0.00 0.00 -1.12 1.01 0.00 0.00 176.76 176.65 2vuy s SER 251 N -0.89 6.26 0.54 4.37 0.01 -1.21 -4.65 113.70 118.12 2vuy s SER 251 Ca 0.00 0.36 -0.19 0.00 1.31 0.00 0.00 55.95 57.42 2vuy s SER 251 Cb 0.00 -2.06 -0.06 0.00 0.21 0.00 0.00 66.02 64.11 2vuy s SER 251 CO 0.00 0.31 1.11 -2.84 0.41 0.00 0.00 173.24 172.23 2vuy s PRO 252 N -0.45 3.43 0.21 12.44 0.02 -1.26 -0.73 135.00 148.66 2vuy s PRO 252 Ca 0.12 1.55 -0.32 0.00 0.02 0.00 0.00 61.00 62.37 2vuy s PRO 252 Cb -0.12 -2.02 -0.12 0.00 0.02 0.00 0.00 34.50 32.26 2vuy s PRO 252 CO 0.02 -0.77 1.69 -1.91 -0.33 0.00 0.00 177.00 175.69 2vuy n GLU 253 N -1.27 2.69 -0.01 5.54 0.00 0.11 -4.43 120.64 123.27 2vuy n GLU 253 Ca 0.11 0.97 0.01 0.00 0.00 0.00 0.00 57.16 58.25 2vuy n GLU 253 Cb 0.51 -2.80 0.32 0.00 0.00 0.00 0.00 31.44 29.47 2vuy n GLU 253 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2vuy n ARG 255 N -4.32 0.25 -0.16 0.00 1.85 -1.26 -2.67 116.66 110.35 2vuy n ARG 255 Ca 0.02 0.07 0.10 0.00 -1.00 0.00 0.00 57.85 57.04 2vuy n ARG 255 Cb 0.20 -1.50 0.18 0.00 -1.05 0.00 0.00 32.46 30.29 2vuy n ARG 255 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 2vuy n TYR 256 N -1.35 0.41 -3.09 2.89 4.01 -1.16 -4.93 117.16 113.95 2vuy n TYR 256 Ca 0.10 -0.25 -0.39 0.00 -0.16 0.00 0.00 57.90 57.19 2vuy n TYR 256 Cb 0.22 -0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.19 2vuy n TYR 256 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2vuy s SER 257 N -1.32 7.12 0.00 7.72 0.15 -1.09 -0.96 113.70 125.32 2vuy s SER 257 Ca 0.32 1.33 0.23 0.00 0.70 0.00 0.00 55.95 58.53 2vuy s SER 257 Cb 0.19 -2.42 0.13 0.00 -1.71 0.00 0.00 66.02 62.21 2vuy s SER 257 CO 0.26 0.08 1.15 -1.54 1.20 0.00 0.00 173.24 174.39 2vuy n SER 258 N 2.64 0.91 -2.19 5.45 3.41 -1.26 -4.43 113.62 118.15 2vuy n SER 258 Ca -0.05 -0.76 -0.23 0.00 -0.26 0.00 0.00 58.87 57.57 2vuy n SER 258 Cb 0.50 0.62 0.02 0.00 -0.26 0.00 0.00 64.21 65.09 2vuy n SER 258 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2vuy n THR 259 N -1.31 2.38 -1.01 6.66 -2.24 -1.26 -4.99 114.28 112.50 2vuy n THR 259 Ca 0.06 -4.26 0.00 0.00 -2.27 0.00 0.00 64.05 57.58 2vuy n THR 259 Cb 0.34 -0.96 0.00 0.00 -2.10 0.00 0.00 70.33 67.62 2vuy n THR 259 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2vuy n GLY 260 N -0.64 -2.41 0.30 3.38 0.00 -1.26 -4.10 105.19 100.46 2vuy n GLY 260 Ca 0.40 -1.59 0.06 0.00 0.00 0.00 0.00 46.02 44.89 2vuy n GLY 260 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vuy n LEU 262 N -0.89 5.43 0.00 0.00 7.99 -1.26 -3.84 117.00 124.42 2vuy n LEU 262 Ca 0.11 -2.79 0.00 0.00 -0.01 0.00 0.00 56.01 53.32 2vuy n LEU 262 Cb 0.68 -0.70 0.00 0.00 -0.11 0.00 0.00 43.42 43.30 2vuy n LEU 262 CO 0.00 0.68 0.00 0.61 -1.51 0.00 0.00 177.39 177.17 2vuy n GLY 263 N 0.17 1.32 0.26 -0.72 0.00 -1.26 -4.73 105.19 100.23 2vuy n GLY 263 Ca 0.31 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.42 2vuy n GLY 263 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2vuy h GLY 264 N 0.00 0.00 1.01 -0.02 0.00 -1.71 -2.19 103.07 100.15 2vuy h GLY 264 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.23 2vuy h GLY 264 CO 0.00 0.00 -0.12 0.06 0.00 0.00 0.00 176.54 176.48 2vuy h GLN 265 N 0.00 0.83 -0.23 4.80 -0.00 -1.80 0.74 115.11 119.45 2vuy h GLN 265 Ca -0.00 -0.32 -0.13 0.00 -0.00 0.00 0.00 58.65 58.20 2vuy h GLN 265 Cb 0.03 -0.04 -0.01 0.00 -0.00 0.00 0.00 27.48 27.45 2vuy h GLN 265 CO 0.00 0.95 -0.40 -0.24 -0.00 0.00 0.00 178.83 179.14 2vuy h VAL 266 N 0.65 1.30 -0.14 1.86 3.04 -1.74 -1.94 116.25 119.28 2vuy h VAL 266 Ca 0.11 -1.56 -0.08 0.00 -1.01 0.00 0.00 66.70 64.16 2vuy h VAL 266 Cb 0.65 1.56 -0.00 0.00 -2.01 0.00 0.00 31.29 31.49 2vuy h VAL 266 CO 0.04 0.49 -0.21 0.25 -1.01 0.00 0.00 177.57 177.13 2vuy h LEU 267 N 0.44 0.43 -0.47 3.16 5.85 -1.25 -2.52 115.31 120.95 2vuy h LEU 267 Ca 0.04 -0.52 0.05 0.00 0.84 0.00 0.00 57.88 58.28 2vuy h LEU 267 Cb 0.89 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 41.75 2vuy h LEU 267 CO 0.08 0.87 0.22 0.28 -0.34 0.00 0.00 178.44 179.54 2vuy h SER 268 N 0.01 0.30 -0.35 1.25 0.02 -0.82 -2.37 113.55 111.59 2vuy h SER 268 Ca 0.01 0.03 0.02 0.00 -0.84 0.00 0.00 61.79 61.02 2vuy h SER 268 Cb 0.77 -0.02 -0.02 0.00 0.14 0.00 0.00 62.40 63.27 2vuy h SER 268 CO 0.05 0.21 0.20 0.15 -1.14 0.00 0.00 176.83 176.30 2vuy h PHE 269 N 0.44 0.37 -0.58 3.45 3.57 -1.33 -1.69 116.94 121.17 2vuy h PHE 269 Ca 0.21 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.72 2vuy h PHE 269 Cb 0.14 -0.11 -0.03 0.00 2.79 0.00 0.00 35.95 38.74 2vuy h PHE 269 CO -0.12 0.21 0.36 0.87 -2.23 0.00 0.00 178.31 177.41 2vuy h LYS 270 N 0.40 0.78 -0.79 1.11 1.57 -1.14 -1.52 116.57 116.98 2vuy h LYS 270 Ca 0.14 -0.06 -0.03 0.00 -1.87 0.00 0.00 60.65 58.83 2vuy h LYS 270 Cb 0.02 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 32.12 2vuy h LYS 270 CO -0.07 0.54 0.37 0.87 -0.57 0.00 0.00 179.45 180.59 2vuy h LYS 271 N 0.78 1.15 -0.08 3.15 1.57 -1.23 0.11 116.57 122.01 2vuy h LYS 271 Ca 0.21 -0.17 0.01 0.00 -1.87 0.00 0.00 60.65 58.83 2vuy h LYS 271 Cb -0.04 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.05 2vuy h LYS 271 CO -0.04 0.89 0.01 1.98 -0.57 0.00 0.00 179.45 181.72 2vuy h MET 272 N 1.13 0.04 -0.64 3.15 4.05 -0.69 0.36 114.93 122.33 2vuy h MET 272 Ca 0.27 -0.00 -0.06 0.00 -0.28 0.00 0.00 59.70 59.63 2vuy h MET 272 Cb 0.14 -0.01 -0.03 0.00 -0.80 0.00 0.00 31.60 30.90 2vuy h MET 272 CO -0.03 0.03 0.16 0.28 0.23 0.00 0.00 176.91 177.58 2vuy h VAL 273 N 0.05 1.26 -0.52 -5.77 2.07 -0.93 -1.55 116.25 110.85 2vuy h VAL 273 Ca 0.04 -0.93 0.01 0.00 0.82 0.00 0.00 66.70 66.64 2vuy h VAL 273 Cb 0.03 0.63 -0.03 0.00 -1.52 0.00 0.00 31.29 30.41 2vuy h VAL 273 CO -0.05 0.35 0.33 -1.13 0.02 0.00 0.00 177.57 177.09 2vuy h ASN 274 N 0.95 0.56 -0.36 0.57 -0.73 -0.27 -1.26 115.58 115.03 2vuy h ASN 274 Ca 0.20 -0.01 0.00 0.00 1.87 0.00 0.00 56.30 58.36 2vuy h ASN 274 Cb 0.36 -0.13 -0.02 0.00 0.27 0.00 0.00 38.32 38.80 2vuy h ASN 274 CO 0.00 0.40 0.23 -0.33 -0.37 0.00 0.00 177.43 177.36 2vuy h GLU 275 N 0.67 0.48 -0.75 6.67 4.39 0.08 -2.46 114.58 123.66 2vuy h GLU 275 Ca 0.20 -0.04 0.01 0.00 0.34 0.00 0.00 59.36 59.87 2vuy h GLU 275 Cb -0.04 -0.10 -0.04 0.00 -0.10 0.00 0.00 28.75 28.47 2vuy h GLU 275 CO -0.06 0.35 0.50 -0.07 -1.16 0.00 0.00 179.01 178.56 2vuy h LEU 276 N 0.48 0.86 -1.47 1.33 3.38 -0.91 -2.36 115.31 116.62 2vuy h LEU 276 Ca 0.13 -0.02 -0.06 0.00 0.09 0.00 0.00 57.88 58.02 2vuy h LEU 276 Cb -0.02 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.51 2vuy h LEU 276 CO -0.03 0.62 -0.27 0.45 0.09 0.00 0.00 178.44 179.31 2vuy h HIS 277 N 1.02 0.00 0.00 1.13 3.86 -1.02 -0.92 115.15 119.22 2vuy h HIS 277 Ca 0.28 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.49 2vuy h HIS 277 Cb -0.11 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.36 2vuy h HIS 277 CO -0.02 0.27 0.00 0.09 0.86 0.00 0.00 177.93 179.12 2vuy n ASN 278 N -3.91 0.00 -0.50 2.45 5.03 -0.90 -1.66 115.26 115.76 2vuy n ASN 278 Ca -0.02 0.03 0.05 0.00 0.87 0.00 0.00 54.58 55.52 2vuy n ASN 278 Cb 0.34 -0.32 0.09 0.00 -1.02 0.00 0.00 39.78 38.87 2vuy n ASN 278 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2vuy n ALA 279 N -1.32 2.34 -2.62 5.41 0.00 -0.54 -4.98 120.51 118.79 2vuy n ALA 279 Ca 0.11 -0.83 -0.10 0.00 0.00 0.00 0.00 53.44 52.61 2vuy n ALA 279 Cb 0.21 -0.38 0.02 0.00 0.00 0.00 0.00 19.45 19.29 2vuy n ALA 279 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2vuy n GLY 280 N 0.53 0.14 3.40 0.00 0.00 -0.67 -5.03 105.19 103.56 2vuy n GLY 280 Ca 0.08 -0.36 -0.33 0.00 0.00 0.00 0.00 46.02 45.41 2vuy n GLY 280 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2vuy s ILE 281 N -2.83 3.29 0.55 -0.61 1.01 -0.46 -4.96 121.20 117.18 2vuy s ILE 281 Ca 0.14 -0.57 -0.16 0.00 0.00 0.00 0.00 60.65 60.06 2vuy s ILE 281 Cb -0.06 -2.41 -0.06 0.00 0.01 0.00 0.00 42.46 39.94 2vuy s ILE 281 CO 0.18 0.51 1.01 -1.61 0.00 0.00 0.00 174.94 175.03 2vuy s GLU 282 N 0.41 3.70 -0.17 2.79 2.02 -0.85 -3.91 118.70 122.68 2vuy s GLU 282 Ca -0.08 1.03 0.00 0.00 0.02 0.00 0.00 54.97 55.94 2vuy s GLU 282 Cb -0.15 -2.09 0.04 0.00 0.10 0.00 0.00 34.13 32.02 2vuy s GLU 282 CO 0.04 -0.49 -0.09 0.08 0.02 0.00 0.00 175.26 174.83 2vuy s VAL 283 N -2.60 1.39 -0.13 2.63 1.01 -1.26 -1.73 120.40 119.71 2vuy s VAL 283 Ca 0.60 -0.76 -0.01 0.00 0.00 0.00 0.00 61.98 61.82 2vuy s VAL 283 Cb -0.12 -1.47 -0.02 0.00 0.00 0.00 0.00 36.38 34.77 2vuy s VAL 283 CO 0.35 0.21 -0.12 -0.63 0.00 0.00 0.00 175.10 174.91 2vuy s ILE 284 N 1.52 3.19 -0.06 2.22 1.01 -0.07 -0.71 121.20 128.31 2vuy s ILE 284 Ca 0.01 -0.61 0.00 0.00 0.00 0.00 0.00 60.65 60.05 2vuy s ILE 284 Cb -0.15 -2.35 -0.03 0.00 0.01 0.00 0.00 42.46 39.94 2vuy s ILE 284 CO -0.08 0.52 -0.03 0.27 0.00 0.00 0.00 174.94 175.62 2vuy s ILE 285 N 0.28 3.99 -0.06 2.92 -4.36 -0.75 -1.27 121.20 121.96 2vuy s ILE 285 Ca -0.09 -0.43 -0.30 0.00 -0.26 0.00 0.00 60.65 59.57 2vuy s ILE 285 Cb -0.15 -2.68 -0.02 0.00 1.25 0.00 0.00 42.46 40.86 2vuy s ILE 285 CO 0.05 0.55 1.01 -0.62 0.24 0.00 0.00 174.94 176.17 2vuy s ASP 286 N -1.00 7.29 -0.00 4.36 -1.08 -0.19 -1.69 116.67 124.36 2vuy s ASP 286 Ca 0.14 1.60 0.06 0.00 -0.52 0.00 0.00 52.55 53.83 2vuy s ASP 286 Cb -0.11 -2.56 -0.02 0.00 -1.46 0.00 0.00 42.92 38.77 2vuy s ASP 286 CO 0.04 -0.38 -0.18 0.68 0.52 0.00 0.00 175.17 175.85 2vuy s VAL 287 N 1.60 1.39 -0.32 1.11 -7.23 -0.24 -4.05 120.40 112.67 2vuy s VAL 287 Ca 0.50 -0.81 -0.03 0.00 -1.81 0.00 0.00 61.98 59.83 2vuy s VAL 287 Cb -0.20 -1.17 0.05 0.00 0.56 0.00 0.00 36.38 35.62 2vuy s VAL 287 CO 0.22 0.34 0.04 -0.69 -0.31 0.00 0.00 175.10 174.71 2vuy s VAL 288 N -0.48 3.27 -0.07 1.32 1.01 -1.26 -1.45 120.40 122.75 2vuy s VAL 288 Ca 0.06 -1.32 0.01 0.00 0.00 0.00 0.00 61.98 60.73 2vuy s VAL 288 Cb -0.07 -2.88 -0.00 0.00 0.00 0.00 0.00 36.38 33.43 2vuy s VAL 288 CO -0.00 -0.15 0.29 -1.22 0.00 0.00 0.00 175.10 174.02 2vuy n TYR 289 N 4.69 0.00 0.13 5.22 4.02 -1.26 -4.75 117.16 125.21 2vuy n TYR 289 Ca -0.13 0.00 -0.23 0.00 -0.01 0.00 0.00 57.90 57.54 2vuy n TYR 289 Cb 0.44 0.00 -0.15 0.00 -0.02 0.00 0.00 39.34 39.60 2vuy n TYR 289 CO 0.00 0.00 0.00 -2.95 -1.01 0.00 0.00 176.86 172.90 2vuy h ASN 290 N 0.08 0.74 -3.47 7.72 7.08 -1.91 -3.42 115.58 122.41 2vuy h ASN 290 Ca 0.00 -0.81 -0.49 0.00 -3.08 0.00 0.00 56.30 51.92 2vuy h ASN 290 Cb 0.02 -0.24 -0.14 0.00 -2.08 0.00 0.00 38.32 35.89 2vuy h ASN 290 CO 0.00 1.64 -0.56 -1.38 -2.08 0.00 0.00 177.43 175.05 2vuy s HIS 291 N -2.61 1.80 0.17 4.14 -3.43 -1.26 0.12 115.29 114.22 2vuy s HIS 291 Ca -0.08 -1.17 0.07 0.00 -0.80 0.00 0.00 55.06 53.08 2vuy s HIS 291 Cb 0.05 -1.14 -0.04 0.00 -1.43 0.00 0.00 32.58 30.01 2vuy s HIS 291 CO 0.93 -0.22 -0.14 0.99 -2.00 0.00 0.00 174.74 174.30 2vuy s THR 292 N -3.34 1.58 -2.00 -5.38 2.01 -1.26 -4.67 115.64 102.58 2vuy s THR 292 Ca 0.31 -2.03 0.17 0.00 0.31 0.00 0.00 61.69 60.45 2vuy s THR 292 Cb 0.05 -1.87 0.50 0.00 0.01 0.00 0.00 72.50 71.19 2vuy s THR 292 CO 0.15 -0.53 1.45 0.00 -0.69 0.00 0.00 174.62 175.00 2vuy n ALA 293 N -0.04 2.21 0.94 7.40 0.00 0.15 -2.60 120.51 128.57 2vuy n ALA 293 Ca -0.11 -0.11 0.13 0.00 0.00 0.00 0.00 53.44 53.36 2vuy n ALA 293 Cb 0.59 -1.28 0.50 0.00 0.00 0.00 0.00 19.45 19.25 2vuy n ALA 293 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2vuy n GLU 294 N -0.95 0.04 0.00 0.00 1.02 -1.26 -4.82 120.64 114.67 2vuy n GLU 294 Ca 0.13 0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.30 2vuy n GLU 294 Cb 0.06 -1.54 0.00 0.00 -0.02 0.00 0.00 31.44 29.94 2vuy n GLU 294 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2vuy n GLY 295 N 1.47 0.02 0.00 0.62 0.00 -1.07 -3.63 105.19 102.60 2vuy n GLY 295 Ca 0.06 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.25 2vuy n GLY 295 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2vuy n ASN 296 N -3.17 -0.00 -4.61 1.61 6.94 -1.17 -4.40 115.26 110.46 2vuy n ASN 296 Ca 0.00 -0.00 -0.29 0.00 -0.02 0.00 0.00 54.58 54.27 2vuy n ASN 296 Cb 0.00 0.00 0.20 0.00 -2.36 0.00 0.00 39.78 37.62 2vuy n ASN 296 CO 0.00 0.00 0.00 -1.38 -1.03 0.00 0.00 177.26 174.85 2vuy s HIS 297 N -0.01 1.82 0.00 -2.53 -3.43 -1.26 -2.12 115.29 107.76 2vuy s HIS 297 Ca 0.00 1.08 0.00 0.00 -0.80 0.00 0.00 55.06 55.34 2vuy s HIS 297 Cb 0.00 -3.20 0.00 0.00 -1.43 0.00 0.00 32.58 27.95 2vuy s HIS 297 CO 0.00 -3.26 0.00 1.28 -2.00 0.00 0.00 174.74 170.76 2vuy n LEU 298 N -4.46 0.00 -4.92 5.38 4.77 -1.26 -4.97 117.00 111.54 2vuy n LEU 298 Ca 0.04 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.74 2vuy n LEU 298 Cb 0.56 -0.02 0.11 0.00 -2.33 0.00 0.00 43.42 41.73 2vuy n LEU 298 CO 0.57 0.00 0.75 -0.83 -1.33 0.00 0.00 177.39 176.55 2vuy s GLY 299 N -1.44 1.67 0.89 -0.72 0.00 -0.90 -5.07 107.32 101.75 2vuy s GLY 299 Ca 0.00 -0.91 -0.12 0.00 0.00 0.00 0.00 44.72 43.69 2vuy s GLY 299 CO 0.00 -0.38 1.09 2.56 0.00 0.00 0.00 173.10 176.38 2vuy s PRO 300 N -5.53 1.33 -0.70 2.90 0.04 -1.24 -4.82 135.00 126.98 2vuy s PRO 300 Ca 0.64 0.75 0.05 0.00 0.04 0.00 0.00 61.00 62.49 2vuy s PRO 300 Cb -0.09 -1.82 0.19 0.00 0.04 0.00 0.00 34.50 32.82 2vuy s PRO 300 CO 0.48 -2.17 0.57 2.41 0.04 0.00 0.00 177.00 178.34 2vuy n THR 301 N -3.82 1.89 -0.11 1.26 -1.04 -0.72 -4.81 114.28 106.92 2vuy n THR 301 Ca 0.07 -4.98 -0.24 0.00 -2.04 0.00 0.00 64.05 56.86 2vuy n THR 301 Cb 0.56 -2.17 -0.11 0.00 -1.82 0.00 0.00 70.33 66.78 2vuy n THR 301 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2vuy n LEU 302 N 1.65 2.24 0.00 -4.42 4.77 -1.26 -4.75 117.00 115.23 2vuy n LEU 302 Ca 0.23 0.24 0.00 0.00 -0.03 0.00 0.00 56.01 56.45 2vuy n LEU 302 Cb 0.37 -0.92 0.00 0.00 -2.33 0.00 0.00 43.42 40.54 2vuy n LEU 302 CO 0.31 0.62 0.00 -0.24 -1.33 0.00 0.00 177.39 176.75 2vuy n SER 303 N -3.98 0.00 -0.02 -1.43 2.88 -1.26 -1.93 113.62 107.87 2vuy n SER 303 Ca -0.44 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 56.97 2vuy n SER 303 Cb 0.88 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 64.24 2vuy n SER 303 CO 0.00 0.00 0.00 -0.26 -1.23 0.00 0.00 175.04 173.55 2vuy h PHE 304 N 0.00 0.04 -1.04 0.66 -1.00 -1.90 -2.47 116.94 111.22 2vuy h PHE 304 Ca 0.00 -0.01 0.27 0.00 2.81 0.00 0.00 57.97 61.04 2vuy h PHE 304 Cb 0.00 -0.01 -0.11 0.00 3.61 0.00 0.00 35.95 39.44 2vuy h PHE 304 CO 0.00 0.57 0.65 -0.09 -1.61 0.00 0.00 178.31 177.83 2vuy h ARG 305 N -0.51 0.44 0.00 1.51 2.43 -1.92 -0.15 114.38 116.17 2vuy h ARG 305 Ca 0.00 -0.03 -0.05 0.00 -0.81 0.00 0.00 59.98 59.10 2vuy h ARG 305 Cb 0.57 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 30.02 2vuy h ARG 305 CO 0.00 0.29 -0.94 0.78 -1.51 0.00 0.00 179.97 178.59 2vuy h GLY 306 N 0.45 0.00 0.13 2.80 0.00 -1.79 -3.12 103.07 101.54 2vuy h GLY 306 Ca 0.63 0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.78 2vuy h GLY 306 CO -0.38 0.00 -0.98 -2.22 0.00 0.00 0.00 176.54 172.96 2vuy h ILE 307 N 0.00 1.16 -0.63 2.60 2.04 -0.60 -3.43 117.51 118.65 2vuy h ILE 307 Ca -0.04 -2.27 -0.10 0.00 1.00 0.00 0.00 64.86 63.45 2vuy h ILE 307 Cb 1.17 2.64 -0.16 0.00 -0.74 0.00 0.00 36.82 39.73 2vuy h ILE 307 CO 0.02 0.48 -0.35 -0.67 0.00 0.00 0.00 178.15 177.63 2vuy n ASP 308 N -4.35 -2.68 -0.18 1.72 4.64 -0.47 -4.58 116.55 110.65 2vuy n ASP 308 Ca -0.25 -2.24 -0.01 0.00 -1.38 0.00 0.00 54.79 50.92 2vuy n ASP 308 Cb 0.68 1.38 0.09 0.00 -1.04 0.00 0.00 41.12 42.23 2vuy n ASP 308 CO 0.00 0.00 0.00 -1.13 -0.82 0.00 0.00 177.20 175.25 2vuy h ASN 309 N 4.60 -0.05 0.57 1.67 -1.24 -1.56 -1.86 115.58 117.71 2vuy h ASN 309 Ca 0.01 0.11 0.00 0.00 0.71 0.00 0.00 56.30 57.13 2vuy h ASN 309 Cb 1.13 0.16 0.00 0.00 0.73 0.00 0.00 38.32 40.34 2vuy h ASN 309 CO -0.02 -0.01 0.00 0.35 -1.29 0.00 0.00 177.43 176.46 2vuy n THR 310 N -5.15 0.95 -0.09 -3.57 -2.24 -1.26 -2.54 114.28 100.37 2vuy n THR 310 Ca 0.07 0.29 -0.23 0.00 -2.27 0.00 0.00 64.05 61.91 2vuy n THR 310 Cb 0.29 -1.17 -0.12 0.00 -2.10 0.00 0.00 70.33 67.23 2vuy n THR 310 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2vuy n ALA 311 N -1.68 1.11 0.08 6.98 0.00 -0.76 -4.62 120.51 121.63 2vuy n ALA 311 Ca 0.02 -0.86 -0.09 0.00 0.00 0.00 0.00 53.44 52.51 2vuy n ALA 311 Cb 0.19 -0.27 -0.03 0.00 0.00 0.00 0.00 19.45 19.34 2vuy n ALA 311 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 2vuy h TYR 312 N -0.45 0.31 -3.51 0.00 -1.99 -1.38 -3.43 116.97 106.52 2vuy h TYR 312 Ca -0.53 -0.18 -0.66 0.00 2.00 0.00 0.00 58.73 59.36 2vuy h TYR 312 Cb 1.74 -0.03 -0.15 0.00 2.00 0.00 0.00 36.73 40.29 2vuy h TYR 312 CO 0.02 1.01 -0.72 0.71 -0.00 0.00 0.00 178.16 179.19 2vuy s TYR 313 N -3.15 2.81 -0.42 4.88 1.51 -1.05 -0.74 117.35 121.20 2vuy s TYR 313 Ca -0.03 -0.12 -0.29 0.00 -1.01 0.00 0.00 57.07 55.63 2vuy s TYR 313 Cb 0.10 -1.47 0.01 0.00 -0.11 0.00 0.00 41.96 40.49 2vuy s TYR 313 CO 0.83 0.44 1.32 -1.64 -1.11 0.00 0.00 175.55 175.40 2vuy s MET 314 N -2.19 3.65 -0.06 -0.62 -1.94 -0.48 -4.66 119.30 113.01 2vuy s MET 314 Ca 0.22 0.87 -0.03 0.00 -1.71 0.00 0.00 55.69 55.04 2vuy s MET 314 Cb -0.11 -3.98 -0.04 0.00 2.01 0.00 0.00 34.83 32.71 2vuy s MET 314 CO 0.15 -1.47 0.11 -0.51 -0.01 0.00 0.00 175.02 173.29 2vuy s LEU 315 N 5.05 4.11 -0.14 -0.03 1.43 -1.26 -1.36 118.68 126.48 2vuy s LEU 315 Ca 0.57 0.30 -0.33 0.00 -1.03 0.00 0.00 54.13 53.64 2vuy s LEU 315 Cb -0.12 -2.20 -0.10 0.00 0.03 0.00 0.00 46.19 43.79 2vuy s LEU 315 CO 0.31 0.33 2.00 1.67 0.23 0.00 0.00 176.35 180.89 2vuy n GLN 316 N 1.56 2.04 -0.35 1.70 7.27 -1.00 -4.76 117.38 123.83 2vuy n GLN 316 Ca -0.16 0.70 -0.02 0.00 0.07 0.00 0.00 57.00 57.59 2vuy n GLN 316 Cb 0.54 -2.75 0.03 0.00 2.41 0.00 0.00 30.24 30.46 2vuy n GLN 316 CO 0.00 0.00 0.00 -1.35 0.07 0.00 0.00 177.06 175.78 2vuy h PRO 317 N 10.82 -0.03 0.00 3.69 0.11 -1.96 0.79 132.00 145.42 2vuy h PRO 317 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2vuy h PRO 317 Cb 1.27 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.39 2vuy h PRO 317 CO 0.96 -0.02 0.00 -0.40 -0.21 0.00 0.00 178.00 178.33 2vuy n ASP 318 N -5.46 0.00 0.04 -2.05 5.68 -1.26 -4.46 116.55 109.05 2vuy n ASP 318 Ca 0.09 0.29 0.00 0.00 -0.50 0.00 0.00 54.79 54.66 2vuy n ASP 318 Cb 0.39 -0.42 0.00 0.00 -1.14 0.00 0.00 41.12 39.94 2vuy n ASP 318 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 2vuy n ASN 319 N -1.42 0.27 0.00 -1.12 4.05 -0.50 -5.01 115.26 111.53 2vuy n ASN 319 Ca 0.08 0.14 0.00 0.00 0.45 0.00 0.00 54.58 55.25 2vuy n ASN 319 Cb 0.26 -0.01 0.00 0.00 1.23 0.00 0.00 39.78 41.26 2vuy n ASN 319 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 177.26 174.50 2vuy n LYS 320 N -3.12 0.00 0.06 1.20 5.02 0.26 -4.38 118.16 117.20 2vuy n LYS 320 Ca 0.00 0.00 -0.11 0.00 -2.02 0.00 0.00 58.31 56.18 2vuy n LYS 320 Cb 0.16 -2.44 -0.13 0.00 -0.02 0.00 0.00 35.03 32.60 2vuy n LYS 320 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 2vuy h ARG 321 N 1.27 0.10 -6.42 1.97 2.43 -1.74 -3.15 114.38 108.84 2vuy h ARG 321 Ca 0.00 -0.17 -0.46 0.00 -0.81 0.00 0.00 59.98 58.54 2vuy h ARG 321 Cb 0.00 0.06 0.01 0.00 -0.42 0.00 0.00 29.97 29.62 2vuy h ARG 321 CO 0.00 0.99 -0.27 0.71 -1.51 0.00 0.00 179.97 179.89 2vuy s TYR 322 N -2.67 3.33 -0.10 2.20 1.51 -1.26 -4.80 117.35 115.56 2vuy s TYR 322 Ca -0.03 0.08 -0.01 0.00 -1.01 0.00 0.00 57.07 56.11 2vuy s TYR 322 Cb 0.09 -1.93 -0.03 0.00 -0.11 0.00 0.00 41.96 39.98 2vuy s TYR 322 CO 0.84 0.06 -0.07 0.71 -1.11 0.00 0.00 175.55 175.98 2vuy s TYR 323 N -2.25 2.94 0.04 2.71 2.02 -1.26 -2.39 117.35 119.17 2vuy s TYR 323 Ca 0.42 -0.18 -0.30 0.00 -0.37 0.00 0.00 57.07 56.63 2vuy s TYR 323 Cb -0.09 -1.80 -0.05 0.00 -0.40 0.00 0.00 41.96 39.61 2vuy s TYR 323 CO 0.33 0.14 1.15 -0.51 -1.57 0.00 0.00 175.55 175.10 2vuy s LEU 324 N -0.29 4.37 -0.28 -1.29 1.43 -0.46 -4.82 118.68 117.34 2vuy s LEU 324 Ca 0.04 1.94 0.02 0.00 -1.03 0.00 0.00 54.13 55.10 2vuy s LEU 324 Cb -0.13 -3.58 0.08 0.00 0.03 0.00 0.00 46.19 42.59 2vuy s LEU 324 CO 0.02 -0.43 -0.02 -0.62 0.23 0.00 0.00 176.35 175.53 2vuy s ASP 325 N 1.06 4.31 0.00 2.29 -1.08 -1.26 -2.59 116.67 119.40 2vuy s ASP 325 Ca 0.57 -1.58 0.12 0.00 -0.52 0.00 0.00 52.55 51.14 2vuy s ASP 325 Cb -0.28 -1.38 0.14 0.00 -1.46 0.00 0.00 42.92 39.94 2vuy s ASP 325 CO 0.29 -0.29 0.95 0.49 0.52 0.00 0.00 175.17 177.13 2vuy n PHE 326 N 4.50 0.10 0.01 -5.34 3.01 -1.26 -4.46 117.46 114.01 2vuy n PHE 326 Ca -0.07 -0.10 0.09 0.00 1.01 0.00 0.00 57.45 58.39 2vuy n PHE 326 Cb 0.43 -0.01 -0.14 0.00 -0.01 0.00 0.00 39.48 39.75 2vuy n PHE 326 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 2vuy n THR 327 N 0.64 0.00 -1.01 4.37 -2.24 -1.26 -2.06 114.28 112.72 2vuy n THR 327 Ca 0.08 -0.41 -0.00 0.00 -2.27 0.00 0.00 64.05 61.45 2vuy n THR 327 Cb 0.32 0.10 -0.00 0.00 -2.10 0.00 0.00 70.33 68.65 2vuy n THR 327 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2vuy n GLY 328 N 1.47 0.43 0.05 3.38 0.00 -1.26 -4.83 105.19 104.43 2vuy n GLY 328 Ca -0.03 -0.72 0.01 0.00 0.00 0.00 0.00 46.02 45.27 2vuy n GLY 328 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2vuy n THR 329 N -2.99 0.75 0.00 2.61 -2.24 -1.26 -5.01 114.28 106.14 2vuy n THR 329 Ca -0.00 -0.88 0.00 0.00 -2.27 0.00 0.00 64.05 60.90 2vuy n THR 329 Cb 0.01 0.63 0.00 0.00 -2.10 0.00 0.00 70.33 68.87 2vuy n THR 329 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2vuy n GLY 330 N -0.29 2.80 3.45 3.38 0.00 -1.26 -4.43 105.19 108.84 2vuy n GLY 330 Ca 0.01 -0.91 -0.10 0.00 0.00 0.00 0.00 46.02 45.02 2vuy n GLY 330 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vuy s ASN 331 N -0.06 -0.04 -0.02 1.61 2.20 -1.26 -3.02 114.94 114.35 2vuy s ASN 331 Ca 0.00 -0.89 0.01 0.00 -0.94 0.00 0.00 52.86 51.04 2vuy s ASN 331 Cb 0.00 0.51 0.01 0.00 -2.00 0.00 0.00 41.25 39.77 2vuy s ASN 331 CO 0.00 -1.01 -0.05 -0.89 -2.94 0.00 0.00 177.10 172.21 2vuy s THR 332 N -3.99 0.50 0.21 0.54 2.01 -1.07 -4.51 115.64 109.33 2vuy s THR 332 Ca 0.20 -0.18 -0.30 0.00 0.31 0.00 0.00 61.69 61.72 2vuy s THR 332 Cb 0.01 -0.48 -0.09 0.00 0.01 0.00 0.00 72.50 71.95 2vuy s THR 332 CO 0.04 0.18 1.28 -0.22 -0.69 0.00 0.00 174.62 175.21 2vuy s LEU 333 N 0.42 4.43 -1.24 4.42 2.96 0.32 -1.38 118.68 128.62 2vuy s LEU 333 Ca -0.05 2.39 -0.18 0.00 -0.22 0.00 0.00 54.13 56.07 2vuy s LEU 333 Cb -0.09 -3.61 -0.01 0.00 0.50 0.00 0.00 46.19 42.97 2vuy s LEU 333 CO -0.00 -0.48 1.99 -3.20 -1.32 0.00 0.00 176.35 173.35 2vuy n ASN 334 N 2.33 3.77 -0.14 3.68 4.05 0.08 -4.68 115.26 124.36 2vuy n ASN 334 Ca 0.05 -2.81 0.00 0.00 0.45 0.00 0.00 54.58 52.27 2vuy n ASN 334 Cb 0.43 -1.58 0.00 0.00 1.23 0.00 0.00 39.78 39.86 2vuy n ASN 334 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 2vuy n LEU 335 N 8.10 0.11 -0.55 1.20 7.99 -1.26 -2.12 117.00 130.48 2vuy n LEU 335 Ca 0.50 -0.06 0.06 0.00 -0.01 0.00 0.00 56.01 56.51 2vuy n LEU 335 Cb 0.42 -0.06 0.07 0.00 -0.11 0.00 0.00 43.42 43.75 2vuy n LEU 335 CO 0.87 0.03 0.48 -1.54 -1.51 0.00 0.00 177.39 175.72 2vuy n SER 336 N -0.28 2.22 -4.71 -1.43 3.41 -1.26 -4.47 113.62 107.09 2vuy n SER 336 Ca 0.00 -1.60 -0.37 0.00 -0.26 0.00 0.00 58.87 56.63 2vuy n SER 336 Cb 0.03 -0.04 -0.07 0.00 -0.26 0.00 0.00 64.21 63.87 2vuy n SER 336 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 2vuy s HIS 337 N -1.06 3.45 0.23 7.33 5.65 -0.90 -4.99 115.29 125.00 2vuy s HIS 337 Ca 0.17 0.66 -0.15 0.00 0.25 0.00 0.00 55.06 55.99 2vuy s HIS 337 Cb 0.11 -2.43 0.27 0.00 -1.18 0.00 0.00 32.58 29.36 2vuy s HIS 337 CO 0.16 0.17 1.57 -1.35 -0.65 0.00 0.00 174.74 174.65 2vuy h PRO 338 N 6.85 -0.04 -0.23 2.88 0.11 -1.92 0.27 132.00 139.92 2vuy h PRO 338 Ca -0.40 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 65.59 2vuy h PRO 338 Cb 1.17 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 2vuy h PRO 338 CO 0.75 -0.03 -0.39 0.00 -0.21 0.00 0.00 178.00 178.12 2vuy h ARG 339 N -0.04 0.52 -0.50 1.05 2.47 -1.96 -0.04 114.38 115.88 2vuy h ARG 339 Ca 0.35 -0.26 -0.11 0.00 -1.26 0.00 0.00 59.98 58.71 2vuy h ARG 339 Cb 0.60 -0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.91 2vuy h ARG 339 CO -0.87 0.83 -0.10 0.28 0.56 0.00 0.00 179.97 180.66 2vuy h VAL 340 N 0.43 1.27 -0.49 2.04 2.07 -1.47 0.62 116.25 120.73 2vuy h VAL 340 Ca 0.04 -1.24 -0.02 0.00 0.82 0.00 0.00 66.70 66.30 2vuy h VAL 340 Cb 0.87 1.04 -0.02 0.00 -1.52 0.00 0.00 31.29 31.66 2vuy h VAL 340 CO 0.07 0.43 0.22 0.40 0.02 0.00 0.00 177.57 178.71 2vuy h ILE 341 N 0.81 1.20 -0.13 4.57 2.04 -0.34 -2.20 117.51 123.45 2vuy h ILE 341 Ca 0.13 -0.60 0.01 0.00 1.00 0.00 0.00 64.86 65.39 2vuy h ILE 341 Cb 0.66 0.68 -0.01 0.00 -0.74 0.00 0.00 36.82 37.41 2vuy h ILE 341 CO 0.05 0.23 0.07 -0.61 0.00 0.00 0.00 178.15 177.88 2vuy h GLN 342 N 0.65 0.14 -0.31 2.37 4.15 -0.68 -1.68 115.11 119.76 2vuy h GLN 342 Ca 0.17 -0.01 0.07 0.00 0.77 0.00 0.00 58.65 59.65 2vuy h GLN 342 Cb 0.16 -0.03 -0.08 0.00 0.21 0.00 0.00 27.48 27.74 2vuy h GLN 342 CO -0.02 0.09 -0.21 1.98 -1.93 0.00 0.00 178.83 178.75 2vuy h MET 343 N 0.15 -0.17 -0.25 1.69 4.05 -0.58 0.94 114.93 120.75 2vuy h MET 343 Ca 0.05 0.01 -0.00 0.00 -0.28 0.00 0.00 59.70 59.48 2vuy h MET 343 Cb 0.01 0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 30.83 2vuy h MET 343 CO -0.03 -0.12 0.15 0.28 0.23 0.00 0.00 176.91 177.42 2vuy h VAL 344 N -0.18 1.09 -0.71 -5.77 2.07 -1.25 0.21 116.25 111.72 2vuy h VAL 344 Ca 0.16 -0.22 -0.05 0.00 0.82 0.00 0.00 66.70 67.42 2vuy h VAL 344 Cb 0.43 0.78 -0.03 0.00 -1.52 0.00 0.00 31.29 30.95 2vuy h VAL 344 CO -0.42 0.09 0.26 -0.07 0.02 0.00 0.00 177.57 177.45 2vuy h LEU 345 N 0.32 0.98 -1.11 2.57 3.38 -0.64 -0.37 115.31 120.42 2vuy h LEU 345 Ca 0.09 -0.15 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 2vuy h LEU 345 Cb 0.01 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 2vuy h LEU 345 CO -0.02 0.89 0.07 0.44 0.09 0.00 0.00 178.44 179.91 2vuy h ASP 346 N 1.03 0.65 0.34 -0.43 3.45 0.13 -1.63 116.42 119.96 2vuy h ASP 346 Ca 0.23 -0.12 -0.02 0.00 0.43 0.00 0.00 57.03 57.56 2vuy h ASP 346 Cb 0.23 -0.17 0.00 0.00 -0.56 0.00 0.00 39.33 38.83 2vuy h ASP 346 CO -0.02 0.67 -0.17 -1.28 -1.57 0.00 0.00 179.24 176.88 2vuy h SER 347 N 0.67 -0.39 -0.16 6.45 0.87 0.48 -1.32 113.55 120.15 2vuy h SER 347 Ca 0.14 -0.13 0.05 0.00 -1.23 0.00 0.00 61.79 60.62 2vuy h SER 347 Cb 0.31 0.10 -0.05 0.00 -0.44 0.00 0.00 62.40 62.33 2vuy h SER 347 CO 0.00 -0.08 -0.14 -0.07 -0.53 0.00 0.00 176.83 176.01 2vuy h LEU 348 N -0.72 -0.45 -1.13 2.23 3.38 -0.98 -0.40 115.31 117.24 2vuy h LEU 348 Ca -0.05 0.09 0.06 0.00 0.09 0.00 0.00 57.88 58.07 2vuy h LEU 348 Cb 0.49 0.22 -0.06 0.00 0.09 0.00 0.00 40.66 41.41 2vuy h LEU 348 CO 0.08 -0.18 0.59 0.03 0.09 0.00 0.00 178.44 179.05 2vuy h ARG 349 N -0.16 1.03 0.83 1.13 3.08 -1.32 -1.06 114.38 117.91 2vuy h ARG 349 Ca 0.10 -0.06 -0.04 0.00 0.07 0.00 0.00 59.98 60.05 2vuy h ARG 349 Cb 0.31 -0.23 0.01 0.00 0.08 0.00 0.00 29.97 30.14 2vuy h ARG 349 CO -0.26 0.68 -0.40 -0.92 -1.07 0.00 0.00 179.97 178.01 2vuy h TYR 350 N 1.07 -1.03 -0.10 3.04 3.20 -0.21 0.15 116.97 123.08 2vuy h TYR 350 Ca 0.38 -0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.26 2vuy h TYR 350 Cb 0.15 0.34 -0.00 0.00 1.54 0.00 0.00 36.73 38.75 2vuy h TYR 350 CO -0.00 -0.64 0.15 -1.49 -1.64 0.00 0.00 178.16 174.55 2vuy h TRP 351 N -1.14 0.00 0.00 -3.82 4.06 -0.71 0.41 115.95 114.75 2vuy h TRP 351 Ca -0.11 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.84 2vuy h TRP 351 Cb 0.86 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.02 2vuy h TRP 351 CO -0.01 0.00 -0.09 0.28 -3.56 0.00 0.00 178.44 175.06 2vuy h VAL 352 N 0.00 0.00 0.00 1.49 2.07 -0.75 -0.31 116.25 118.75 2vuy h VAL 352 Ca 0.05 -0.32 -0.08 0.00 0.82 0.00 0.00 66.70 67.16 2vuy h VAL 352 Cb 0.36 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.11 2vuy h VAL 352 CO -0.00 0.00 -0.39 0.71 0.02 0.00 0.00 177.57 177.91 2vuy h THR 353 N -0.32 1.20 0.04 2.57 1.35 -0.68 -1.24 112.91 115.82 2vuy h THR 353 Ca 0.00 -1.38 -0.36 0.00 -0.55 0.00 0.00 66.41 64.11 2vuy h THR 353 Cb 0.09 1.76 -0.04 0.00 -1.73 0.00 0.00 68.15 68.23 2vuy h THR 353 CO 0.00 0.39 -2.08 1.21 -0.25 0.00 0.00 175.52 174.79 2vuy n GLU 354 N -3.95 0.66 -0.01 4.72 4.07 0.14 -4.46 120.64 121.80 2vuy n GLU 354 Ca -0.02 0.30 0.12 0.00 -0.06 0.00 0.00 57.16 57.51 2vuy n GLU 354 Cb 0.44 -1.63 0.16 0.00 -0.06 0.00 0.00 31.44 30.36 2vuy n GLU 354 CO 0.00 0.00 0.00 -1.33 -0.06 0.00 0.00 177.13 175.74 2vuy n MET 355 N -3.77 2.25 -3.86 5.31 2.81 -1.06 -4.99 117.12 113.81 2vuy n MET 355 Ca -0.40 -1.82 -0.28 0.00 -1.81 0.00 0.00 57.70 53.38 2vuy n MET 355 Cb 0.92 -1.47 0.03 0.00 -0.71 0.00 0.00 33.22 32.00 2vuy n MET 355 CO 0.00 0.00 0.00 0.72 1.51 0.00 0.00 175.97 178.20 2vuy n HIS 356 N 1.20 -2.26 -2.54 2.03 8.25 -0.47 -4.88 115.22 116.54 2vuy n HIS 356 Ca 0.15 0.90 -0.33 0.00 -0.26 0.00 0.00 57.72 58.18 2vuy n HIS 356 Cb 0.57 -4.12 -0.04 0.00 1.12 0.00 0.00 29.99 27.51 2vuy n HIS 356 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2vuy s VAL 357 N -3.38 4.35 -0.53 1.59 1.01 -0.15 -4.92 120.40 118.37 2vuy s VAL 357 Ca 0.53 1.28 0.20 0.00 0.00 0.00 0.00 61.98 64.00 2vuy s VAL 357 Cb -0.26 -3.62 -0.26 0.00 0.00 0.00 0.00 36.38 32.23 2vuy s VAL 357 CO 0.82 -0.49 0.67 0.47 0.00 0.00 0.00 175.10 176.57 2vuy n ASP 358 N -1.20 0.65 -3.72 3.32 8.00 0.11 -4.60 116.55 119.11 2vuy n ASP 358 Ca 0.07 -0.53 0.02 0.00 0.71 0.00 0.00 54.79 55.06 2vuy n ASP 358 Cb 0.54 1.42 0.01 0.00 -0.02 0.00 0.00 41.12 43.07 2vuy n ASP 358 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2vuy s GLY 359 N -3.56 -0.27 0.01 0.44 0.00 -1.16 -2.38 107.32 100.41 2vuy s GLY 359 Ca 0.01 0.37 0.01 0.00 0.00 0.00 0.00 44.72 45.11 2vuy s GLY 359 CO 0.84 3.01 -0.04 -1.36 0.00 0.00 0.00 173.10 175.55 2vuy s PHE 360 N -2.17 0.33 -0.30 1.90 0.40 -0.59 -1.81 117.98 115.74 2vuy s PHE 360 Ca 0.22 -0.25 -0.00 0.00 -0.60 0.00 0.00 56.93 56.30 2vuy s PHE 360 Cb 0.02 -0.21 0.06 0.00 0.51 0.00 0.00 43.02 43.40 2vuy s PHE 360 CO -0.02 -0.06 -0.01 0.50 0.70 0.00 0.00 175.22 176.32 2vuy s ARG 361 N -0.69 2.31 -0.18 0.44 3.00 -0.68 -0.20 118.95 122.94 2vuy s ARG 361 Ca -0.05 -1.35 -0.29 0.00 -1.00 0.00 0.00 55.73 53.04 2vuy s ARG 361 Cb -0.05 -3.13 -0.00 0.00 0.00 0.00 0.00 34.95 31.77 2vuy s ARG 361 CO -0.00 -0.65 1.00 -0.06 0.00 0.00 0.00 175.30 175.59 2vuy s PHE 362 N 1.19 3.40 0.21 5.12 0.40 0.25 -1.08 117.98 127.47 2vuy s PHE 362 Ca -0.05 1.47 -0.30 0.00 -0.60 0.00 0.00 56.93 57.45 2vuy s PHE 362 Cb -0.20 -3.21 -0.08 0.00 0.51 0.00 0.00 43.02 40.04 2vuy s PHE 362 CO -0.03 -0.37 1.10 0.34 0.70 0.00 0.00 175.22 176.96 2vuy s ASP 363 N 1.17 7.28 -1.56 1.36 -1.08 -0.53 -1.92 116.67 121.39 2vuy s ASP 363 Ca 0.44 2.14 -0.02 0.00 -0.52 0.00 0.00 52.55 54.59 2vuy s ASP 363 Cb -0.16 -2.61 0.02 0.00 -1.46 0.00 0.00 42.92 38.71 2vuy s ASP 363 CO 0.11 -0.19 0.10 0.18 0.52 0.00 0.00 175.17 175.89 2vuy n LEU 364 N 2.01 -1.11 -0.31 -1.34 4.77 -1.26 -4.71 117.00 115.05 2vuy n LEU 364 Ca 0.01 -1.24 0.16 0.00 -0.03 0.00 0.00 56.01 54.91 2vuy n LEU 364 Cb 0.46 -1.67 0.34 0.00 -2.33 0.00 0.00 43.42 40.21 2vuy n LEU 364 CO 0.54 0.44 0.95 0.00 -1.33 0.00 0.00 177.39 177.99 2vuy h ALA 365 N 0.80 1.42 -0.96 -1.18 0.00 -1.22 -1.68 119.26 116.45 2vuy h ALA 365 Ca -0.65 0.24 0.20 0.00 0.00 0.00 0.00 54.91 54.70 2vuy h ALA 365 Cb 1.40 0.34 -0.11 0.00 0.00 0.00 0.00 17.79 19.41 2vuy h ALA 365 CO 0.72 -0.54 0.54 0.00 0.00 0.00 0.00 179.25 179.97 2vuy h ALA 366 N 1.84 1.59 0.00 0.00 0.00 -1.66 0.84 119.26 121.87 2vuy h ALA 366 Ca 0.61 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.62 2vuy h ALA 366 Cb 1.30 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.08 2vuy h ALA 366 CO -0.70 -0.16 0.08 0.00 0.00 0.00 0.00 179.25 178.47 2vuy n ALA 367 N -2.37 0.91 0.90 0.00 0.00 -0.63 -0.12 120.51 119.19 2vuy n ALA 367 Ca 0.23 0.11 0.13 0.00 0.00 0.00 0.00 53.44 53.91 2vuy n ALA 367 Cb 0.61 -1.06 0.40 0.00 0.00 0.00 0.00 19.45 19.39 2vuy n ALA 367 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2vuy n LEU 368 N -1.93 0.37 -1.17 0.00 4.77 0.29 -3.38 117.00 115.96 2vuy n LEU 368 Ca -0.01 0.29 0.09 0.00 -0.03 0.00 0.00 56.01 56.35 2vuy n LEU 368 Cb 0.10 -0.34 0.28 0.00 -2.33 0.00 0.00 43.42 41.12 2vuy n LEU 368 CO 0.05 0.02 0.74 0.00 -1.33 0.00 0.00 177.39 176.87 2vuy n ALA 369 N -1.58 2.67 -2.64 -1.18 0.00 0.82 -4.87 120.51 113.73 2vuy n ALA 369 Ca 0.06 -1.51 -0.43 0.00 0.00 0.00 0.00 53.44 51.56 2vuy n ALA 369 Cb 0.36 -0.78 -0.02 0.00 0.00 0.00 0.00 19.45 19.01 2vuy n ALA 369 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2vuy s ARG 370 N -1.57 4.13 -0.45 0.00 1.81 -1.22 -1.17 118.95 120.48 2vuy s ARG 370 Ca 0.41 1.12 0.00 0.00 -1.72 0.00 0.00 55.73 55.54 2vuy s ARG 370 Cb 0.26 -3.70 0.12 0.00 -0.45 0.00 0.00 34.95 31.18 2vuy s ARG 370 CO 0.21 -0.78 0.22 -1.21 -0.68 0.00 0.00 175.30 173.07 2vuy s GLU 371 N 3.41 1.97 4.18 3.54 2.02 -0.72 -4.73 118.70 128.37 2vuy s GLU 371 Ca 0.43 -2.11 0.00 0.00 0.02 0.00 0.00 54.97 53.31 2vuy s GLU 371 Cb -0.13 -3.47 0.00 0.00 0.10 0.00 0.00 34.13 30.62 2vuy s GLU 371 CO 0.12 -1.06 0.00 -0.11 0.02 0.00 0.00 175.26 174.22 2vuy n LEU 372 N 4.04 0.00 0.28 1.80 7.94 -1.26 -3.08 117.00 126.72 2vuy n LEU 372 Ca 0.03 0.00 0.19 0.00 -1.11 0.00 0.00 56.01 55.12 2vuy n LEU 372 Cb 0.39 0.00 0.95 0.00 0.53 0.00 0.00 43.42 45.30 2vuy n LEU 372 CO 0.30 0.00 1.06 1.88 -1.11 0.00 0.00 177.39 179.53 2vuy h TYR 373 N 0.00 0.00 -1.42 1.96 -1.99 -2.01 -3.45 116.97 110.06 2vuy h TYR 373 Ca 0.00 0.00 -0.45 0.00 2.00 0.00 0.00 58.73 60.28 2vuy h TYR 373 Cb 0.00 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.73 2vuy h TYR 373 CO 0.00 0.00 -0.29 -1.54 -0.00 0.00 0.00 178.16 176.33 2vuy s SER 374 N -4.99 5.41 -0.22 3.88 1.04 -1.18 -4.96 113.70 112.68 2vuy s SER 374 Ca -0.03 -0.56 -0.03 0.00 0.48 0.00 0.00 55.95 55.81 2vuy s SER 374 Cb 0.11 -0.57 -0.00 0.00 0.10 0.00 0.00 66.02 65.65 2vuy s SER 374 CO 0.40 -0.76 -0.06 -0.69 0.98 0.00 0.00 173.24 173.11 2vuy s VAL 375 N -2.41 3.22 -0.22 5.02 1.01 -1.26 -1.75 120.40 124.01 2vuy s VAL 375 Ca 0.53 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 61.94 2vuy s VAL 375 Cb -0.07 -2.47 0.05 0.00 0.00 0.00 0.00 36.38 33.88 2vuy s VAL 375 CO 0.31 0.41 -0.11 0.21 0.00 0.00 0.00 175.10 175.93 2vuy s ASN 376 N 1.45 3.68 0.00 3.32 3.04 -0.31 -4.98 114.94 121.14 2vuy s ASN 376 Ca 0.05 -1.02 0.06 0.00 0.04 0.00 0.00 52.86 51.99 2vuy s ASN 376 Cb -0.14 -1.33 0.36 0.00 -1.54 0.00 0.00 41.25 38.60 2vuy s ASN 376 CO -0.04 -0.15 1.12 0.80 -3.04 0.00 0.00 177.10 175.78 2vuy n MET 377 N 4.62 0.87 -1.92 0.43 0.00 -1.26 -2.78 117.12 117.07 2vuy n MET 377 Ca -0.15 0.00 -0.12 0.00 -0.00 0.00 0.00 57.70 57.43 2vuy n MET 377 Cb 0.45 -1.11 0.06 0.00 0.00 0.00 0.00 33.22 32.62 2vuy n MET 377 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 175.97 175.86 2vuy n LEU 378 N -0.61 3.61 -4.84 -0.89 7.94 -1.26 -4.86 117.00 116.08 2vuy n LEU 378 Ca 0.05 -4.07 -0.32 0.00 -1.11 0.00 0.00 56.01 50.56 2vuy n LEU 378 Cb 0.02 -0.18 0.00 0.00 0.53 0.00 0.00 43.42 43.79 2vuy n LEU 378 CO 0.03 1.67 0.71 0.54 -1.11 0.00 0.00 177.39 179.22 2vuy s ASN 379 N -3.48 6.17 0.26 1.96 4.22 -1.12 -4.87 114.94 118.08 2vuy s ASN 379 Ca 0.43 1.55 -0.04 0.00 -2.14 0.00 0.00 52.86 52.66 2vuy s ASN 379 Cb 0.38 -2.49 0.52 0.00 1.28 0.00 0.00 41.25 40.94 2vuy s ASN 379 CO -0.01 -0.91 1.63 0.74 -2.04 0.00 0.00 177.10 176.52 2vuy h THR 380 N 0.12 0.31 0.20 0.54 2.02 -1.92 -2.24 112.91 111.94 2vuy h THR 380 Ca -0.45 -0.04 0.01 0.00 0.77 0.00 0.00 66.41 66.70 2vuy h THR 380 Cb 1.20 0.18 -0.04 0.00 -1.74 0.00 0.00 68.15 67.74 2vuy h THR 380 CO 0.60 0.02 -0.41 0.15 0.37 0.00 0.00 175.52 176.25 2vuy h PHE 381 N 0.12 -1.15 -0.32 3.16 -0.00 -1.92 -1.33 116.94 115.50 2vuy h PHE 381 Ca 0.46 0.02 0.04 0.00 -0.00 0.00 0.00 57.97 58.49 2vuy h PHE 381 Cb 0.85 0.48 -0.02 0.00 -0.00 0.00 0.00 35.95 37.26 2vuy h PHE 381 CO -0.40 -0.53 0.22 0.74 -0.00 0.00 0.00 178.31 178.34 2vuy h PHE 382 N -0.70 0.27 -0.21 0.41 -1.00 -1.77 -0.91 116.94 113.02 2vuy h PHE 382 Ca 0.00 0.01 -0.12 0.00 2.81 0.00 0.00 57.97 60.68 2vuy h PHE 382 Cb 0.70 -0.09 -0.00 0.00 3.61 0.00 0.00 35.95 40.17 2vuy h PHE 382 CO -0.32 0.15 -0.32 0.82 -1.61 0.00 0.00 178.31 177.03 2vuy h ILE 383 N 0.27 1.33 -0.38 -0.55 1.08 -1.01 -1.69 117.51 116.56 2vuy h ILE 383 Ca 0.13 -1.53 -0.10 0.00 -0.39 0.00 0.00 64.86 62.98 2vuy h ILE 383 Cb 0.20 1.79 -0.02 0.00 -3.07 0.00 0.00 36.82 35.72 2vuy h ILE 383 CO -0.03 0.47 -0.19 0.00 -0.69 0.00 0.00 178.15 177.71 2vuy h ALA 384 N 0.63 0.96 -0.05 1.87 0.00 -0.81 -2.74 119.26 119.12 2vuy h ALA 384 Ca 0.02 -0.35 -0.00 0.00 0.00 0.00 0.00 54.91 54.58 2vuy h ALA 384 Cb 0.90 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 2vuy h ALA 384 CO 0.07 0.61 0.03 1.25 0.00 0.00 0.00 179.25 181.21 2vuy h LEU 385 N 0.64 0.06 -2.13 0.00 7.12 -1.10 -1.63 115.31 118.27 2vuy h LEU 385 Ca 0.10 -0.09 -0.01 0.00 0.13 0.00 0.00 57.88 58.01 2vuy h LEU 385 Cb 0.67 -0.02 -0.00 0.00 -0.53 0.00 0.00 40.66 40.79 2vuy h LEU 385 CO 0.05 0.13 -0.03 -0.61 -0.13 0.00 0.00 178.44 177.85 2vuy h GLN 386 N -0.01 0.00 0.00 1.25 4.15 -1.17 -2.72 115.11 116.61 2vuy h GLN 386 Ca 0.02 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.44 2vuy h GLN 386 Cb 0.08 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.77 2vuy h GLN 386 CO -0.00 0.03 -1.18 0.00 -1.93 0.00 0.00 178.83 175.76 2vuy n GLN 387 N -4.16 0.22 -1.73 1.69 -0.00 -1.05 -4.77 117.38 107.57 2vuy n GLN 387 Ca -0.03 -0.04 -0.42 0.00 -0.00 0.00 0.00 57.00 56.51 2vuy n GLN 387 Cb 0.12 -1.53 -0.03 0.00 -0.00 0.00 0.00 30.24 28.80 2vuy n GLN 387 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 2vuy s ASP 388 N -3.58 6.40 0.28 2.61 2.15 -0.63 -4.88 116.67 119.01 2vuy s ASP 388 Ca 0.04 2.82 0.01 0.00 0.43 0.00 0.00 52.55 55.85 2vuy s ASP 388 Cb 0.15 -2.59 0.56 0.00 -0.30 0.00 0.00 42.92 40.75 2vuy s ASP 388 CO 0.85 -0.98 1.81 -0.65 -0.17 0.00 0.00 175.17 176.03 2vuy h PRO 389 N 7.37 0.83 0.00 4.34 0.11 -1.92 -2.18 132.00 140.56 2vuy h PRO 389 Ca -0.44 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 65.55 2vuy h PRO 389 Cb 1.21 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 2vuy h PRO 389 CO 0.95 0.55 -0.42 0.82 -0.21 0.00 0.00 178.00 179.69 2vuy h ILE 390 N 0.85 1.17 0.00 4.15 2.04 -1.96 -3.38 117.51 120.38 2vuy h ILE 390 Ca 0.49 -2.02 -0.00 0.00 1.00 0.00 0.00 64.86 64.33 2vuy h ILE 390 Cb 0.58 2.35 -0.00 0.00 -0.74 0.00 0.00 36.82 39.01 2vuy h ILE 390 CO -0.30 0.39 -0.01 -0.07 0.00 0.00 0.00 178.15 178.16 2vuy h LEU 391 N -1.00 0.00 -0.27 1.44 3.38 -1.86 -2.24 115.31 114.76 2vuy h LEU 391 Ca -0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.86 2vuy h LEU 391 Cb 0.93 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.68 2vuy h LEU 391 CO -0.06 0.01 0.00 -1.54 0.09 0.00 0.00 178.44 176.94 2vuy n SER 392 N -3.13 0.41 -0.08 -0.43 3.41 -0.82 -3.24 113.62 109.73 2vuy n SER 392 Ca -0.01 -1.61 0.04 0.00 -0.26 0.00 0.00 58.87 57.03 2vuy n SER 392 Cb 0.19 -0.03 -0.03 0.00 -0.26 0.00 0.00 64.21 64.08 2vuy n SER 392 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2vuy n GLN 393 N -0.46 3.42 -3.21 4.33 1.13 -0.84 -5.03 117.38 116.71 2vuy n GLN 393 Ca 0.12 -0.23 -0.18 0.00 -1.94 0.00 0.00 57.00 54.76 2vuy n GLN 393 Cb 0.11 -0.95 -0.00 0.00 0.11 0.00 0.00 30.24 29.51 2vuy n GLN 393 CO 0.00 0.00 0.00 0.14 -1.44 0.00 0.00 177.06 175.76 2vuy s VAL 394 N -1.55 2.94 0.20 5.09 -7.23 -1.20 -5.09 120.40 113.57 2vuy s VAL 394 Ca 0.05 -1.11 -0.30 0.00 -1.81 0.00 0.00 61.98 58.80 2vuy s VAL 394 Cb 0.06 -3.02 -0.08 0.00 0.56 0.00 0.00 36.38 33.91 2vuy s VAL 394 CO 0.29 -0.01 0.94 -0.54 -0.31 0.00 0.00 175.10 175.47 2vuy s LYS 395 N -4.27 4.81 -0.11 4.82 1.02 -1.00 -4.99 119.74 120.01 2vuy s LYS 395 Ca 0.52 1.47 0.01 0.00 0.02 0.00 0.00 55.97 58.00 2vuy s LYS 395 Cb -0.08 -3.31 0.02 0.00 -0.52 0.00 0.00 37.83 33.94 2vuy s LYS 395 CO 0.31 0.43 -0.12 -0.51 -0.92 0.00 0.00 175.35 174.54 2vuy s LEU 396 N -0.83 1.55 0.01 3.17 1.43 -1.26 -1.55 118.68 121.21 2vuy s LEU 396 Ca 0.43 -0.39 0.06 0.00 -1.03 0.00 0.00 54.13 53.19 2vuy s LEU 396 Cb -0.25 -1.01 -0.02 0.00 0.03 0.00 0.00 46.19 44.94 2vuy s LEU 396 CO 0.31 -0.04 -0.18 -0.63 0.23 0.00 0.00 176.35 176.04 2vuy s ILE 397 N 1.27 1.45 -0.03 -0.59 1.01 0.72 -0.77 121.20 124.26 2vuy s ILE 397 Ca -0.01 -0.93 0.03 0.00 0.00 0.00 0.00 60.65 59.73 2vuy s ILE 397 Cb -0.14 -1.24 0.00 0.00 0.01 0.00 0.00 42.46 41.10 2vuy s ILE 397 CO -0.05 0.29 -0.10 0.00 0.00 0.00 0.00 174.94 175.08 2vuy s ALA 398 N -0.59 0.92 -0.33 9.38 0.00 -0.13 0.85 121.76 131.87 2vuy s ALA 398 Ca 0.06 -0.36 -0.29 0.00 0.00 0.00 0.00 51.96 51.38 2vuy s ALA 398 Cb -0.08 -0.34 -0.07 0.00 0.00 0.00 0.00 23.12 22.64 2vuy s ALA 398 CO 0.00 0.15 2.28 -1.91 0.00 0.00 0.00 175.76 176.29 2vuy n GLU 399 N 3.28 1.55 -0.85 0.00 2.13 -0.81 -0.87 120.64 125.07 2vuy n GLU 399 Ca -0.18 0.35 -0.11 0.00 0.66 0.00 0.00 57.16 57.88 2vuy n GLU 399 Cb 0.54 -3.14 -0.04 0.00 0.27 0.00 0.00 31.44 29.07 2vuy n GLU 399 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 2vuy n PRO 400 N 8.75 1.63 -3.58 5.31 -0.04 -1.26 -1.31 135.00 144.50 2vuy n PRO 400 Ca 0.34 -0.96 -0.11 0.00 -0.04 0.00 0.00 63.50 62.73 2vuy n PRO 400 Cb 0.43 -1.55 -0.05 0.00 -0.04 0.00 0.00 33.50 32.29 2vuy n PRO 400 CO 0.00 0.00 0.00 1.67 -0.04 0.00 0.00 175.50 177.13 2vuy s TRP 401 N -0.48 -0.41 0.00 0.54 -2.14 -1.26 -0.03 118.94 115.17 2vuy s TRP 401 Ca 0.32 0.73 0.00 0.00 2.66 0.00 0.00 56.10 59.81 2vuy s TRP 401 Cb 0.19 0.44 0.00 0.00 -3.10 0.00 0.00 33.47 31.00 2vuy s TRP 401 CO -0.03 -0.36 0.00 -0.40 -2.66 0.00 0.00 176.95 173.50 2vuy n ASP 402 N 0.88 1.32 -0.99 -2.66 3.85 -1.13 -3.84 116.55 113.99 2vuy n ASP 402 Ca -0.11 -0.69 0.11 0.00 -0.71 0.00 0.00 54.79 53.39 2vuy n ASP 402 Cb 0.58 0.00 0.15 0.00 -1.35 0.00 0.00 41.12 40.50 2vuy n ASP 402 CO 0.00 0.00 0.00 1.33 -1.01 0.00 0.00 177.20 177.52 2vuy n VAL 403 N -0.23 0.29 -2.05 2.12 0.24 -0.87 -4.60 118.33 113.23 2vuy n VAL 403 Ca 0.00 -0.65 -0.28 0.00 -2.04 0.00 0.00 64.34 61.37 2vuy n VAL 403 Cb 0.00 1.18 0.14 0.00 -1.47 0.00 0.00 33.84 33.69 2vuy n VAL 403 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2vuy s GLY 404 N -1.58 1.73 0.12 7.63 0.00 -1.24 -4.98 107.32 109.01 2vuy s GLY 404 Ca 0.31 -1.14 -0.31 0.00 0.00 0.00 0.00 44.72 43.59 2vuy s GLY 404 CO 0.28 -0.50 1.28 1.62 0.00 0.00 0.00 173.10 175.79 2vuy s GLN 405 N -5.65 4.39 -0.70 2.90 0.74 -1.26 -2.34 119.66 117.74 2vuy s GLN 405 Ca 0.69 1.94 0.00 0.00 0.05 0.00 0.00 55.36 58.04 2vuy s GLN 405 Cb -0.06 -3.27 0.00 0.00 1.10 0.00 0.00 33.01 30.78 2vuy s GLN 405 CO 0.50 -0.29 0.00 0.41 -0.55 0.00 0.00 175.29 175.36 2vuy n GLY 406 N 3.01 0.67 0.01 2.59 0.00 -1.26 -4.92 105.19 105.29 2vuy n GLY 406 Ca 0.09 -0.69 0.13 0.00 0.00 0.00 0.00 46.02 45.55 2vuy n GLY 406 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vuy n GLY 407 N -1.79 -1.42 3.57 -0.02 0.00 -0.99 -4.77 105.19 99.77 2vuy n GLY 407 Ca -0.07 -0.19 -0.41 0.00 0.00 0.00 0.00 46.02 45.35 2vuy n GLY 407 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2vuy s TYR 408 N -3.01 2.12 -0.30 1.61 5.04 -1.26 -2.82 117.35 118.73 2vuy s TYR 408 Ca 0.13 0.46 0.08 0.00 -2.44 0.00 0.00 57.07 55.30 2vuy s TYR 408 Cb 0.18 -4.35 0.50 0.00 0.35 0.00 0.00 41.96 38.64 2vuy s TYR 408 CO 0.60 -2.12 1.46 1.04 -1.34 0.00 0.00 175.55 175.19 2vuy n GLN 409 N 8.89 1.90 -1.69 4.97 1.13 0.96 -5.00 117.38 128.53 2vuy n GLN 409 Ca 0.13 -3.25 -0.44 0.00 -1.94 0.00 0.00 57.00 51.51 2vuy n GLN 409 Cb 0.50 -1.84 -0.02 0.00 0.11 0.00 0.00 30.24 28.99 2vuy n GLN 409 CO 0.00 0.00 0.00 0.28 -1.44 0.00 0.00 177.06 175.90 2vuy n VAL 410 N -1.11 1.22 0.00 5.09 0.31 -1.16 -1.84 118.33 120.85 2vuy n VAL 410 Ca 0.34 -0.31 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 2vuy n VAL 410 Cb 1.02 -1.58 0.00 0.00 -0.91 0.00 0.00 33.84 32.37 2vuy n VAL 410 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2vuy n GLY 411 N 1.81 2.86 0.03 2.92 0.00 -1.26 -4.78 105.19 106.76 2vuy n GLY 411 Ca 0.09 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.24 2vuy n GLY 411 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2vuy n ASN 412 N 0.16 0.38 -4.78 1.61 5.03 -0.77 -4.91 115.26 111.98 2vuy n ASN 412 Ca 0.00 0.26 -0.33 0.00 0.87 0.00 0.00 54.58 55.38 2vuy n ASN 412 Cb 0.00 -0.26 0.02 0.00 -1.02 0.00 0.00 39.78 38.52 2vuy n ASN 412 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 2vuy s PHE 413 N -3.04 2.74 1.30 3.10 0.40 -1.25 -4.97 117.98 116.26 2vuy s PHE 413 Ca 0.11 1.54 -0.21 0.00 -0.60 0.00 0.00 56.93 57.78 2vuy s PHE 413 Cb 0.17 -3.15 0.32 0.00 0.51 0.00 0.00 43.02 40.86 2vuy s PHE 413 CO 0.61 -1.48 1.04 -2.14 0.70 0.00 0.00 175.22 173.96 2vuy s PRO 414 N -3.85 -1.96 0.21 0.24 0.02 -1.26 -4.83 135.00 123.58 2vuy s PRO 414 Ca 0.68 -0.01 0.02 0.00 0.02 0.00 0.00 61.00 61.70 2vuy s PRO 414 Cb -0.20 -1.51 0.18 0.00 0.02 0.00 0.00 34.50 32.99 2vuy s PRO 414 CO 0.36 -4.21 1.52 1.88 -0.33 0.00 0.00 177.00 176.22 2vuy h TYR 415 N -2.94 0.43 0.00 6.54 0.99 -1.97 -2.11 116.97 117.92 2vuy h TYR 415 Ca -0.44 -0.17 0.00 0.00 2.00 0.00 0.00 58.73 60.12 2vuy h TYR 415 Cb 1.31 -0.08 0.00 0.00 1.00 0.00 0.00 36.73 38.96 2vuy h TYR 415 CO -2.67 0.87 0.00 0.94 -0.00 0.00 0.00 178.16 177.30 2vuy n GLN 416 N -3.88 0.06 -3.55 4.88 7.27 -1.26 -4.80 117.38 116.09 2vuy n GLN 416 Ca -0.03 0.34 -0.37 0.00 0.07 0.00 0.00 57.00 57.01 2vuy n GLN 416 Cb 0.64 -1.62 -0.08 0.00 2.41 0.00 0.00 30.24 31.58 2vuy n GLN 416 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 2vuy s TRP 417 N -3.11 3.36 0.31 3.69 0.52 -0.80 -4.17 118.94 118.75 2vuy s TRP 417 Ca 0.05 0.42 -0.21 0.00 0.02 0.00 0.00 56.10 56.38 2vuy s TRP 417 Cb 0.08 -2.36 -0.09 0.00 -1.15 0.00 0.00 33.47 29.95 2vuy s TRP 417 CO 0.27 0.08 0.83 0.00 0.02 0.00 0.00 176.95 178.15 2vuy s ALA 418 N 1.02 3.26 0.13 0.98 0.00 0.05 -4.72 121.76 122.48 2vuy s ALA 418 Ca 0.13 0.29 0.11 0.00 0.00 0.00 0.00 51.96 52.48 2vuy s ALA 418 Cb -0.14 -2.98 -0.04 0.00 0.00 0.00 0.00 23.12 19.97 2vuy s ALA 418 CO 0.05 0.25 -0.27 -1.21 0.00 0.00 0.00 175.76 174.58 2vuy s GLU 419 N -2.45 1.41 0.01 0.00 2.02 0.59 -0.95 118.70 119.33 2vuy s GLU 419 Ca 0.51 -1.35 -0.30 0.00 0.02 0.00 0.00 54.97 53.85 2vuy s GLU 419 Cb -0.14 -1.91 -0.06 0.00 0.10 0.00 0.00 34.13 32.12 2vuy s GLU 419 CO 0.19 0.45 1.39 -1.58 0.02 0.00 0.00 175.26 175.74 2vuy s TRP 420 N -1.07 2.91 -1.08 1.61 0.52 -0.05 -1.36 118.94 120.42 2vuy s TRP 420 Ca 0.14 0.84 -0.15 0.00 0.02 0.00 0.00 56.10 56.96 2vuy s TRP 420 Cb -0.10 -3.66 0.18 0.00 -1.15 0.00 0.00 33.47 28.74 2vuy s TRP 420 CO 0.06 -2.41 1.25 1.21 0.02 0.00 0.00 176.95 177.08 2vuy s ASN 421 N 1.79 6.94 0.43 2.95 3.84 -0.50 -4.69 114.94 125.69 2vuy s ASN 421 Ca 0.64 -2.75 0.14 0.00 0.21 0.00 0.00 52.86 51.09 2vuy s ASN 421 Cb -0.32 -2.36 0.93 0.00 -0.55 0.00 0.00 41.25 38.95 2vuy s ASN 421 CO 0.27 -0.77 1.95 1.23 -2.79 0.00 0.00 177.10 176.99 2vuy h GLY 422 N 9.41 0.02 1.20 1.21 0.00 -1.92 -2.24 103.07 110.75 2vuy h GLY 422 Ca 0.23 -0.01 -0.01 0.00 0.00 0.00 0.00 47.33 47.54 2vuy h GLY 422 CO 1.13 0.01 0.43 1.70 0.00 0.00 0.00 176.54 179.81 2vuy h LYS 423 N 0.02 1.06 0.12 4.80 1.63 -1.98 -0.41 116.57 121.80 2vuy h LYS 423 Ca 0.00 -0.11 -0.01 0.00 -0.85 0.00 0.00 60.65 59.68 2vuy h LYS 423 Cb 0.39 -0.21 0.00 0.00 -0.60 0.00 0.00 32.23 31.81 2vuy h LYS 423 CO 0.03 0.77 -0.06 -0.92 -3.45 0.00 0.00 179.45 175.82 2vuy h TYR 424 N 1.07 -0.15 -0.47 1.91 3.20 -1.77 -0.87 116.97 119.90 2vuy h TYR 424 Ca 0.27 -0.00 0.09 0.00 3.14 0.00 0.00 58.73 62.23 2vuy h TYR 424 Cb 0.01 0.05 -0.09 0.00 1.54 0.00 0.00 36.73 38.24 2vuy h TYR 424 CO 0.01 0.12 -0.08 -0.09 -1.64 0.00 0.00 178.16 176.48 2vuy h ARG 425 N -0.41 0.03 0.71 1.82 2.43 -1.14 0.30 114.38 118.13 2vuy h ARG 425 Ca -0.02 -0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 59.12 2vuy h ARG 425 Cb 0.33 -0.01 0.01 0.00 -0.42 0.00 0.00 29.97 29.88 2vuy h ARG 425 CO 0.03 0.02 -0.34 -0.44 -1.51 0.00 0.00 179.97 177.72 2vuy h ASP 426 N 0.03 -0.81 -0.09 -3.80 3.45 -1.00 -1.40 116.42 112.80 2vuy h ASP 426 Ca 0.23 0.01 0.04 0.00 0.43 0.00 0.00 57.03 57.74 2vuy h ASP 426 Cb 0.35 0.21 -0.06 0.00 -0.56 0.00 0.00 39.33 39.27 2vuy h ASP 426 CO -0.45 -0.45 -0.36 0.28 -1.57 0.00 0.00 179.24 176.69 2vuy h SER 427 N -1.21 -1.10 -0.25 6.45 0.02 -1.01 0.15 113.55 116.59 2vuy h SER 427 Ca -0.10 0.15 0.05 0.00 -0.84 0.00 0.00 61.79 61.05 2vuy h SER 427 Cb 0.75 0.45 -0.01 0.00 0.14 0.00 0.00 62.40 63.73 2vuy h SER 427 CO 0.16 -0.40 0.17 0.40 -1.14 0.00 0.00 176.83 176.03 2vuy h ILE 428 N -0.46 0.93 -0.23 3.27 5.03 -1.01 0.98 117.51 126.01 2vuy h ILE 428 Ca 0.08 -0.04 -0.12 0.00 -0.12 0.00 0.00 64.86 64.66 2vuy h ILE 428 Cb 0.59 0.81 -0.00 0.00 -3.03 0.00 0.00 36.82 35.19 2vuy h ILE 428 CO -0.34 0.02 -0.33 -0.09 -0.68 0.00 0.00 178.15 176.72 2vuy h ARG 429 N 0.11 0.63 -0.09 2.37 2.43 0.04 -3.16 114.38 116.72 2vuy h ARG 429 Ca 0.11 -0.37 -0.17 0.00 -0.81 0.00 0.00 59.98 58.74 2vuy h ARG 429 Cb 0.32 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.89 2vuy h ARG 429 CO -0.01 0.98 -0.69 0.00 -1.51 0.00 0.00 179.97 178.74 2vuy h ARG 430 N 0.33 0.38 0.19 0.20 3.08 0.26 -3.11 114.38 115.71 2vuy h ARG 430 Ca 0.02 -0.29 0.00 0.00 0.07 0.00 0.00 59.98 59.78 2vuy h ARG 430 Cb 0.92 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 31.01 2vuy h ARG 430 CO 0.08 0.93 -0.16 0.35 -1.07 0.00 0.00 179.97 180.10 2vuy h PHE 431 N 0.27 -0.41 0.00 3.04 3.57 -0.88 -2.26 116.94 120.27 2vuy h PHE 431 Ca -0.02 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.48 2vuy h PHE 431 Cb 1.25 0.15 0.00 0.00 2.79 0.00 0.00 35.95 40.14 2vuy h PHE 431 CO 0.04 -0.24 0.00 0.91 -2.23 0.00 0.00 178.31 176.79 2vuy n TRP 432 N -5.28 0.00 0.16 0.41 7.02 -1.20 -2.21 117.44 116.35 2vuy n TRP 432 Ca -0.08 0.00 0.07 0.00 -1.02 0.00 0.00 57.50 56.47 2vuy n TRP 432 Cb 0.20 -0.41 0.08 0.00 -2.42 0.00 0.00 31.31 28.75 2vuy n TRP 432 CO 0.00 0.00 0.00 -0.09 -2.02 0.00 0.00 177.69 175.58 2vuy h ARG 433 N 0.00 0.00 0.00 -0.99 2.43 -1.34 -3.48 114.38 111.00 2vuy h ARG 433 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 2vuy h ARG 433 Cb 0.28 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.83 2vuy h ARG 433 CO 0.00 0.22 0.00 0.41 -1.51 0.00 0.00 179.97 179.09 2vuy n GLY 434 N 1.18 1.34 3.59 2.80 0.00 -0.94 -5.02 105.19 108.14 2vuy n GLY 434 Ca 0.02 -0.24 -0.46 0.00 0.00 0.00 0.00 46.02 45.33 2vuy n GLY 434 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2vuy n GLU 435 N 0.00 1.30 -3.46 1.61 1.02 -0.96 -4.91 120.64 115.24 2vuy n GLU 435 Ca 0.00 0.46 -0.42 0.00 -0.02 0.00 0.00 57.16 57.18 2vuy n GLU 435 Cb 0.00 -1.89 -0.10 0.00 -0.02 0.00 0.00 31.44 29.43 2vuy n GLU 435 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2vuy s ALA 436 N -0.66 3.48 0.24 0.62 0.00 -1.26 -4.27 121.76 119.91 2vuy s ALA 436 Ca 0.65 -1.57 0.07 0.00 0.00 0.00 0.00 51.96 51.11 2vuy s ALA 436 Cb -0.76 -2.83 -0.04 0.00 0.00 0.00 0.00 23.12 19.49 2vuy s ALA 436 CO 0.56 -1.30 0.22 -0.51 0.00 0.00 0.00 175.76 174.73 2vuy s LEU 437 N 1.76 3.89 0.22 0.00 1.02 -1.17 -4.53 118.68 119.87 2vuy s LEU 437 Ca 0.06 -0.19 -0.32 0.00 0.02 0.00 0.00 54.13 53.70 2vuy s LEU 437 Cb -0.18 -2.43 -0.13 0.00 0.02 0.00 0.00 46.19 43.47 2vuy s LEU 437 CO 0.11 -0.04 1.48 -2.65 0.02 0.00 0.00 176.35 175.27 2vuy n PRO 438 N -1.16 2.15 -0.29 1.29 -0.02 -1.26 -1.32 135.00 134.39 2vuy n PRO 438 Ca -0.08 0.77 0.12 0.00 -2.02 0.00 0.00 63.50 62.29 2vuy n PRO 438 Cb 0.58 -2.48 0.28 0.00 -0.02 0.00 0.00 33.50 31.86 2vuy n PRO 438 CO 0.00 0.00 0.00 -0.92 1.98 0.00 0.00 175.50 176.56 2vuy h TYR 439 N 4.83 0.48 -1.00 6.00 -0.00 -1.52 0.22 116.97 125.99 2vuy h TYR 439 Ca -0.45 0.04 0.05 0.00 -0.00 0.00 0.00 58.73 58.37 2vuy h TYR 439 Cb 1.26 -0.07 -0.06 0.00 -0.00 0.00 0.00 36.73 37.86 2vuy h TYR 439 CO 0.59 -0.12 0.65 0.66 -0.00 0.00 0.00 178.16 179.93 2vuy h SER 440 N 0.30 1.07 0.22 -2.11 4.64 -1.13 -0.09 113.55 116.44 2vuy h SER 440 Ca 0.54 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.85 2vuy h SER 440 Cb 1.04 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 62.90 2vuy h SER 440 CO -0.58 0.71 -0.11 -0.08 -0.87 0.00 0.00 176.83 175.90 2vuy h GLU 441 N 1.22 -0.28 -0.02 4.77 4.57 -0.85 -0.18 114.58 123.81 2vuy h GLU 441 Ca 0.41 0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 58.61 2vuy h GLU 441 Cb 0.08 0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 28.74 2vuy h GLU 441 CO -0.15 -0.14 0.01 0.82 -1.18 0.00 0.00 179.01 178.37 2vuy h ILE 442 N -0.35 1.12 -0.85 2.32 1.08 -1.23 -2.79 117.51 116.80 2vuy h ILE 442 Ca -0.03 -0.35 0.10 0.00 -0.39 0.00 0.00 64.86 64.19 2vuy h ILE 442 Cb 0.27 1.32 -0.07 0.00 -3.07 0.00 0.00 36.82 35.27 2vuy h ILE 442 CO 0.05 0.09 0.50 0.00 -0.69 0.00 0.00 178.15 178.10 2vuy h ALA 443 N 0.86 1.22 -0.48 1.87 0.00 -0.97 -1.61 119.26 120.16 2vuy h ALA 443 Ca 0.01 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 2vuy h ALA 443 Cb 0.15 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2vuy h ALA 443 CO -0.00 0.13 0.29 -0.91 0.00 0.00 0.00 179.25 178.76 2vuy h ASN 444 N 0.83 0.58 0.09 0.00 2.35 -0.91 -0.50 115.58 118.02 2vuy h ASN 444 Ca 0.41 -0.06 -0.00 0.00 -0.55 0.00 0.00 56.30 56.10 2vuy h ASN 444 Cb 0.36 -0.15 -0.00 0.00 0.05 0.00 0.00 38.32 38.59 2vuy h ASN 444 CO -0.24 0.46 -0.06 0.03 -1.65 0.00 0.00 177.43 175.97 2vuy h ARG 445 N 0.64 -0.15 -0.07 0.81 2.47 -1.12 0.65 114.38 117.61 2vuy h ARG 445 Ca 0.17 0.01 0.02 0.00 -1.26 0.00 0.00 59.98 58.92 2vuy h ARG 445 Cb -0.01 0.03 -0.00 0.00 -1.65 0.00 0.00 29.97 28.34 2vuy h ARG 445 CO -0.03 -0.10 0.05 -0.07 0.56 0.00 0.00 179.97 180.38 2vuy h LEU 446 N -0.16 0.00 -3.01 3.04 3.38 -1.02 -2.21 115.31 115.33 2vuy h LEU 446 Ca -0.01 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2vuy h LEU 446 Cb 0.14 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2vuy h LEU 446 CO 0.00 0.00 0.01 0.18 0.09 0.00 0.00 178.44 178.72 2vuy n LEU 447 N -4.44 4.74 0.00 1.67 4.32 -0.22 -0.26 117.00 122.80 2vuy n LEU 447 Ca -0.01 -2.41 0.00 0.00 -0.02 0.00 0.00 56.01 53.57 2vuy n LEU 447 Cb 0.16 -0.65 0.00 0.00 -1.62 0.00 0.00 43.42 41.31 2vuy n LEU 447 CO 0.34 0.55 0.00 0.61 -1.22 0.00 0.00 177.39 177.67 2vuy n GLY 448 N 0.46 0.69 3.09 -0.72 0.00 -0.83 -4.45 105.19 103.42 2vuy n GLY 448 Ca 0.22 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.11 2vuy n GLY 448 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2vuy n SER 449 N 0.00 -5.72 0.20 1.61 7.64 0.22 -4.78 113.62 112.80 2vuy n SER 449 Ca 0.00 -0.63 0.04 0.00 1.01 0.00 0.00 58.87 59.29 2vuy n SER 449 Cb 0.00 -4.74 0.43 0.00 -1.01 0.00 0.00 64.21 58.89 2vuy n SER 449 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 2vuy h PRO 450 N -1.06 0.00 0.00 1.43 0.11 -1.78 -1.98 132.00 128.72 2vuy h PRO 450 Ca -0.55 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.56 2vuy h PRO 450 Cb 1.28 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.39 2vuy h PRO 450 CO 0.40 0.29 -0.02 0.38 -0.21 0.00 0.00 178.00 178.84 2vuy h ASP 451 N 0.00 0.00 0.00 -2.05 2.03 -1.90 0.21 116.42 114.71 2vuy h ASP 451 Ca -0.00 0.00 -0.33 0.00 -0.73 0.00 0.00 57.03 55.97 2vuy h ASP 451 Cb 0.52 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 38.97 2vuy h ASP 451 CO 0.04 0.02 -1.88 -0.38 -1.03 0.00 0.00 179.24 176.00 2vuy n ILE 452 N -3.41 1.52 0.03 4.15 5.41 -0.78 -4.74 119.36 121.55 2vuy n ILE 452 Ca -0.03 -0.19 0.11 0.00 1.00 0.00 0.00 62.75 63.64 2vuy n ILE 452 Cb 0.12 -2.00 -0.17 0.00 -0.71 0.00 0.00 39.64 36.89 2vuy n ILE 452 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 2vuy n TYR 453 N -4.35 0.00 0.30 1.39 4.02 -1.00 -4.38 117.16 113.14 2vuy n TYR 453 Ca -0.42 0.00 0.17 0.00 -0.01 0.00 0.00 57.90 57.64 2vuy n TYR 453 Cb 0.76 -0.47 0.70 0.00 -0.02 0.00 0.00 39.34 40.30 2vuy n TYR 453 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 176.86 177.10 2vuy h LEU 454 N 0.00 0.00 -0.17 7.72 5.85 -0.76 -0.49 115.31 127.46 2vuy h LEU 454 Ca 0.00 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.60 2vuy h LEU 454 Cb 0.97 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.00 2vuy h LEU 454 CO 0.00 0.00 -0.35 1.23 -0.34 0.00 0.00 178.44 178.98 2vuy h GLY 455 N 1.87 0.59 -3.75 3.75 0.00 -1.76 -3.25 103.07 100.51 2vuy h GLY 455 Ca 0.00 -0.70 -0.48 0.00 0.00 0.00 0.00 47.33 46.15 2vuy h GLY 455 CO 0.00 0.63 0.61 0.70 0.00 0.00 0.00 176.54 178.48 2vuy n ASN 456 N -4.32 6.97 -1.02 0.19 4.13 -1.14 -4.86 115.26 115.22 2vuy n ASN 456 Ca -0.06 -3.36 -0.11 0.00 1.68 0.00 0.00 54.58 52.72 2vuy n ASN 456 Cb 0.50 -1.04 -0.05 0.00 -1.54 0.00 0.00 39.78 37.66 2vuy n ASN 456 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 2vuy n ASN 457 N -0.13 -4.29 -4.90 6.41 4.13 -1.23 -4.96 115.26 110.29 2vuy n ASN 457 Ca 0.44 0.27 -0.28 0.00 1.68 0.00 0.00 54.58 56.69 2vuy n ASN 457 Cb 0.60 -3.50 0.05 0.00 -1.54 0.00 0.00 39.78 35.39 2vuy n ASN 457 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 2vuy s LYS 458 N -2.79 2.70 0.45 3.52 -0.14 -0.21 -5.02 119.74 118.25 2vuy s LYS 458 Ca 0.00 0.17 0.06 0.00 -1.36 0.00 0.00 55.97 54.84 2vuy s LYS 458 Cb 0.00 -2.12 -0.04 0.00 -1.68 0.00 0.00 37.83 34.00 2vuy s LYS 458 CO 0.00 -1.01 0.14 0.95 -0.76 0.00 0.00 175.35 174.67 2vuy s THR 459 N -3.24 1.89 0.60 2.17 -4.23 -1.26 -4.28 115.64 107.29 2vuy s THR 459 Ca 0.57 -1.79 0.29 0.00 -1.18 0.00 0.00 61.69 59.58 2vuy s THR 459 Cb -0.11 -2.68 0.37 0.00 1.34 0.00 0.00 72.50 71.41 2vuy s THR 459 CO 0.48 0.00 1.91 -0.65 -0.54 0.00 0.00 174.62 175.82 2vuy h PRO 460 N 1.37 0.00 -0.09 3.99 0.11 -1.84 -1.01 132.00 134.54 2vuy h PRO 460 Ca -0.42 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.67 2vuy h PRO 460 Cb 1.27 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.38 2vuy h PRO 460 CO 0.71 0.00 -0.02 0.74 -0.21 0.00 0.00 178.00 179.22 2vuy h PHE 461 N 0.00 0.12 0.00 0.65 0.04 -1.87 -1.78 116.94 114.10 2vuy h PHE 461 Ca 0.17 -0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.94 2vuy h PHE 461 Cb 1.06 -0.04 -0.00 0.00 2.20 0.00 0.00 35.95 39.17 2vuy h PHE 461 CO 0.00 0.15 -0.00 0.00 -0.60 0.00 0.00 178.31 177.86 2vuy h ALA 462 N 1.86 1.28 -2.28 2.45 0.00 -1.46 -3.41 119.26 117.70 2vuy h ALA 462 Ca 0.03 -0.00 -0.63 0.00 0.00 0.00 0.00 54.91 54.31 2vuy h ALA 462 Cb 0.13 -0.00 -0.13 0.00 0.00 0.00 0.00 17.79 17.78 2vuy h ALA 462 CO 0.00 0.01 0.18 0.45 0.00 0.00 0.00 179.25 179.89 2vuy s SER 463 N -5.71 6.44 -0.65 0.00 0.15 -0.67 -0.30 113.70 112.96 2vuy s SER 463 Ca -0.05 0.13 -0.16 0.00 0.70 0.00 0.00 55.95 56.57 2vuy s SER 463 Cb 0.14 -2.34 0.15 0.00 -1.71 0.00 0.00 66.02 62.26 2vuy s SER 463 CO 0.49 -0.64 0.65 -0.63 1.20 0.00 0.00 173.24 174.31 2vuy s ILE 464 N 2.79 5.20 0.15 6.45 -1.09 -0.46 -1.10 121.20 133.13 2vuy s ILE 464 Ca 0.25 -1.65 -0.29 0.00 -2.23 0.00 0.00 60.65 56.74 2vuy s ILE 464 Cb -0.14 -4.43 -0.07 0.00 -1.58 0.00 0.00 42.46 36.24 2vuy s ILE 464 CO 0.16 -1.01 0.91 0.20 -1.23 0.00 0.00 174.94 173.97 2vuy s ASN 465 N 3.23 7.50 -0.07 3.58 0.01 0.14 -1.42 114.94 127.91 2vuy s ASN 465 Ca 0.11 1.78 -0.23 0.00 -0.71 0.00 0.00 52.86 53.81 2vuy s ASN 465 Cb -0.22 -2.57 0.05 0.00 0.41 0.00 0.00 41.25 38.92 2vuy s ASN 465 CO -0.00 0.04 0.52 -0.72 -1.51 0.00 0.00 177.10 175.42 2vuy s TYR 466 N -0.46 -0.47 -0.07 2.20 1.13 -1.26 -0.57 117.35 117.84 2vuy s TYR 466 Ca 0.43 0.89 0.16 0.00 -1.41 0.00 0.00 57.07 57.14 2vuy s TYR 466 Cb -0.24 0.26 -0.24 0.00 -1.10 0.00 0.00 41.96 40.64 2vuy s TYR 466 CO 0.29 -0.47 0.37 1.33 -2.51 0.00 0.00 175.55 174.57 2vuy n VAL 467 N 1.42 0.00 -3.69 -3.49 0.24 -1.26 -3.58 118.33 107.98 2vuy n VAL 467 Ca -0.19 -0.35 -0.13 0.00 -2.04 0.00 0.00 64.34 61.63 2vuy n VAL 467 Cb 0.56 0.20 -0.07 0.00 -1.47 0.00 0.00 33.84 33.06 2vuy n VAL 467 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 2vuy s THR 468 N -3.05 0.05 0.17 3.34 -1.32 -1.26 -4.97 115.64 108.59 2vuy s THR 468 Ca -0.05 -0.42 -0.04 0.00 -1.21 0.00 0.00 61.69 59.97 2vuy s THR 468 Cb 0.10 -0.84 0.02 0.00 -1.51 0.00 0.00 72.50 70.26 2vuy s THR 468 CO 0.66 -0.23 0.29 -1.54 -2.21 0.00 0.00 174.62 171.58 2vuy n SER 469 N 0.82 -0.83 0.32 8.08 3.41 -1.26 -4.14 113.62 120.02 2vuy n SER 469 Ca -0.20 -1.76 0.20 0.00 -0.26 0.00 0.00 58.87 56.85 2vuy n SER 469 Cb 0.58 1.44 1.09 0.00 -0.26 0.00 0.00 64.21 67.06 2vuy n SER 469 CO 0.00 0.00 0.00 1.12 -0.16 0.00 0.00 175.04 176.00 2vuy h HIS 470 N 1.44 0.00 -3.39 7.33 2.07 -1.95 -3.39 115.15 117.26 2vuy h HIS 470 Ca -0.14 0.00 -0.59 0.00 -2.85 0.00 0.00 60.37 56.79 2vuy h HIS 470 Cb 0.53 0.00 -0.09 0.00 2.57 0.00 0.00 27.41 30.42 2vuy h HIS 470 CO 0.00 0.00 0.25 -0.51 -3.07 0.00 0.00 177.93 174.60 2vuy s ASP 471 N -5.58 6.74 0.00 3.10 1.01 -1.26 -4.81 116.67 115.87 2vuy s ASP 471 Ca -0.05 0.90 0.00 0.00 0.71 0.00 0.00 52.55 54.11 2vuy s ASP 471 Cb 0.14 -2.38 0.00 0.00 1.01 0.00 0.00 42.92 41.69 2vuy s ASP 471 CO 0.47 -0.36 0.00 0.61 0.21 0.00 0.00 175.17 176.09 2vuy n GLY 472 N 3.81 -0.19 3.73 0.21 0.00 -0.93 -4.95 105.19 106.88 2vuy n GLY 472 Ca 0.01 -1.44 -0.29 0.00 0.00 0.00 0.00 46.02 44.31 2vuy n GLY 472 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2vuy s PHE 473 N 0.00 2.35 0.57 1.61 2.99 -1.26 -4.28 117.98 119.97 2vuy s PHE 473 Ca 0.00 0.99 0.07 0.00 0.00 0.00 0.00 56.93 57.99 2vuy s PHE 473 Cb 0.00 -3.28 0.10 0.00 0.00 0.00 0.00 43.02 39.84 2vuy s PHE 473 CO 0.00 -2.53 0.79 0.25 -0.00 0.00 0.00 175.22 173.73 2vuy n THR 474 N -3.92 0.00 -0.10 0.64 -2.24 -1.26 -4.29 114.28 103.11 2vuy n THR 474 Ca 0.06 -1.72 -0.13 0.00 -2.27 0.00 0.00 64.05 59.99 2vuy n THR 474 Cb 0.58 -0.64 -0.04 0.00 -2.10 0.00 0.00 70.33 68.13 2vuy n THR 474 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2vuy h LEU 475 N 0.00 0.80 -0.14 3.22 5.85 -1.94 -0.51 115.31 122.59 2vuy h LEU 475 Ca -0.27 -0.47 -0.00 0.00 0.84 0.00 0.00 57.88 57.98 2vuy h LEU 475 Cb 1.16 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.95 2vuy h LEU 475 CO 0.35 1.11 0.08 -0.08 -0.34 0.00 0.00 178.44 179.56 2vuy h GLU 476 N 0.51 0.19 0.00 1.25 4.57 -1.87 -2.74 114.58 116.49 2vuy h GLU 476 Ca 0.05 -0.02 -0.06 0.00 -1.18 0.00 0.00 59.36 58.15 2vuy h GLU 476 Cb 0.88 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.42 2vuy h GLU 476 CO 0.08 0.16 -0.29 -0.44 -1.18 0.00 0.00 179.01 177.34 2vuy h ASP 477 N 0.16 0.00 0.30 1.04 3.45 -1.76 -2.82 116.42 116.78 2vuy h ASP 477 Ca 0.05 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.51 2vuy h ASP 477 Cb 0.02 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 38.79 2vuy h ASP 477 CO -0.01 0.29 -0.01 0.25 -1.57 0.00 0.00 179.24 178.19 2vuy h LEU 478 N 0.00 0.00 -3.02 1.55 5.85 -0.76 -1.61 115.31 117.32 2vuy h LEU 478 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2vuy h LEU 478 Cb 0.68 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.71 2vuy h LEU 478 CO 0.04 0.01 0.00 1.33 -0.34 0.00 0.00 178.44 179.48 2vuy n VAL 479 N -3.19 1.44 -0.31 1.05 0.24 -1.07 -3.31 118.33 113.18 2vuy n VAL 479 Ca -0.02 -1.46 0.00 0.00 -2.04 0.00 0.00 64.34 60.82 2vuy n VAL 479 Cb 0.15 0.19 0.00 0.00 -1.47 0.00 0.00 33.84 32.71 2vuy n VAL 479 CO 0.00 0.00 0.00 -1.20 -2.14 0.00 0.00 176.83 173.49 2vuy n SER 480 N -0.49 0.60 -3.83 -1.34 7.64 -0.66 -3.69 113.62 111.86 2vuy n SER 480 Ca 0.10 -0.94 -0.12 0.00 1.01 0.00 0.00 58.87 58.92 2vuy n SER 480 Cb 0.50 0.06 -0.13 0.00 -1.01 0.00 0.00 64.21 63.62 2vuy n SER 480 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 2vuy s TYR 481 N -0.06 -0.11 -0.55 1.43 1.51 -0.91 -1.09 117.35 117.58 2vuy s TYR 481 Ca 0.00 0.27 0.23 0.00 -1.01 0.00 0.00 57.07 56.56 2vuy s TYR 481 Cb 0.00 0.02 0.12 0.00 -0.11 0.00 0.00 41.96 41.99 2vuy s TYR 481 CO 0.00 -0.06 1.09 0.09 -1.11 0.00 0.00 175.55 175.57 2vuy n ASN 482 N 3.12 0.65 -3.53 2.29 3.02 -1.26 -3.78 115.26 115.77 2vuy n ASN 482 Ca -0.13 -0.03 -0.11 0.00 -0.03 0.00 0.00 54.58 54.27 2vuy n ASN 482 Cb 0.59 0.61 -0.03 0.00 -0.61 0.00 0.00 39.78 40.33 2vuy n ASN 482 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2vuy s GLN 483 N -3.22 1.17 0.63 3.52 -2.07 -1.26 -4.83 119.66 113.59 2vuy s GLN 483 Ca 0.03 -0.58 -0.17 0.00 -1.82 0.00 0.00 55.36 52.82 2vuy s GLN 483 Cb 0.13 0.53 -0.02 0.00 -1.09 0.00 0.00 33.01 32.57 2vuy s GLN 483 CO 0.78 -0.49 1.17 -1.59 -1.32 0.00 0.00 175.29 173.85 2vuy s LYS 484 N -3.75 2.82 -0.49 9.60 -2.85 -1.26 -5.00 119.74 118.81 2vuy s LYS 484 Ca 0.02 1.68 0.05 0.00 -1.00 0.00 0.00 55.97 56.73 2vuy s LYS 484 Cb 0.00 -1.93 0.20 0.00 -2.06 0.00 0.00 37.83 34.05 2vuy s LYS 484 CO -0.12 -1.29 0.47 0.72 0.10 0.00 0.00 175.35 175.22 2vuy n HIS 485 N -1.96 0.58 -1.47 1.78 8.25 0.00 -4.97 115.22 117.43 2vuy n HIS 485 Ca 0.13 -3.67 -0.22 0.00 -0.26 0.00 0.00 57.72 53.70 2vuy n HIS 485 Cb 0.50 -0.17 0.13 0.00 1.12 0.00 0.00 29.99 31.58 2vuy n HIS 485 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2vuy n ASN 486 N 2.06 4.82 -0.29 0.41 3.02 -1.26 -3.70 115.26 120.32 2vuy n ASN 486 Ca 0.26 -3.75 -0.05 0.00 -0.03 0.00 0.00 54.58 51.01 2vuy n ASN 486 Cb 0.46 -0.74 0.07 0.00 -0.61 0.00 0.00 39.78 38.96 2vuy n ASN 486 CO 0.00 0.00 0.00 -0.33 -2.62 0.00 0.00 177.26 174.31 2vuy h GLU 487 N 1.52 1.09 -0.14 3.52 3.07 -1.95 -2.56 114.58 119.14 2vuy h GLU 487 Ca 0.46 -0.13 0.04 0.00 -0.50 0.00 0.00 59.36 59.24 2vuy h GLU 487 Cb 1.65 -0.21 -0.01 0.00 -0.84 0.00 0.00 28.75 29.34 2vuy h GLU 487 CO 1.00 0.81 0.63 0.00 -1.40 0.00 0.00 179.01 180.05 2vuy h ALA 488 N 1.22 1.78 0.00 3.43 0.00 -2.03 0.61 119.26 124.26 2vuy h ALA 488 Ca 0.28 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.18 2vuy h ALA 488 Cb 0.03 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2vuy h ALA 488 CO -0.04 -0.70 -0.20 0.09 0.00 0.00 0.00 179.25 178.39 2vuy n ASN 489 N -2.89 0.40 -0.63 0.00 3.02 -0.97 -4.95 115.26 109.25 2vuy n ASN 489 Ca 0.02 0.30 -0.06 0.00 -0.03 0.00 0.00 54.58 54.81 2vuy n ASN 489 Cb 0.70 -0.31 -0.01 0.00 -0.61 0.00 0.00 39.78 39.55 2vuy n ASN 489 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2vuy n GLY 490 N 1.43 0.42 0.84 7.41 0.00 0.21 -4.92 105.19 110.59 2vuy n GLY 490 Ca 0.06 -0.68 0.02 0.00 0.00 0.00 0.00 46.02 45.42 2vuy n GLY 490 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2vuy n PHE 491 N -3.51 0.71 -3.98 1.61 3.72 -1.26 -4.94 117.46 109.80 2vuy n PHE 491 Ca -0.07 -1.33 -0.28 0.00 -0.05 0.00 0.00 57.45 55.72 2vuy n PHE 491 Cb 0.41 -0.36 -0.01 0.00 -0.94 0.00 0.00 39.48 38.58 2vuy n PHE 491 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 176.76 175.00 2vuy n ASN 492 N -1.04 -1.76 -2.70 4.37 4.05 -1.26 -1.04 115.26 115.88 2vuy n ASN 492 Ca 0.26 -0.95 -0.15 0.00 0.45 0.00 0.00 54.58 54.18 2vuy n ASN 492 Cb 0.89 -3.22 -0.00 0.00 1.23 0.00 0.00 39.78 38.67 2vuy n ASN 492 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 177.26 171.01 2vuy n ASN 493 N -2.90 -3.83 0.10 1.20 4.05 -1.26 -4.84 115.26 107.78 2vuy n ASN 493 Ca -0.17 0.04 0.08 0.00 0.45 0.00 0.00 54.58 54.98 2vuy n ASN 493 Cb 0.62 -3.23 -0.01 0.00 1.23 0.00 0.00 39.78 38.39 2vuy n ASN 493 CO 0.00 0.00 0.00 1.56 -3.05 0.00 0.00 177.26 175.77 2vuy h GLN 494 N -0.30 0.00 -6.84 1.20 1.08 -1.42 -3.48 115.11 105.36 2vuy h GLN 494 Ca -0.32 0.00 -0.48 0.00 -1.45 0.00 0.00 58.65 56.39 2vuy h GLN 494 Cb 1.23 0.00 0.03 0.00 -0.05 0.00 0.00 27.48 28.69 2vuy h GLN 494 CO 0.39 0.10 0.03 0.16 -0.95 0.00 0.00 178.83 178.56 2vuy s ASP 495 N -5.61 6.15 0.00 1.46 -4.77 -1.26 -5.00 116.67 107.64 2vuy s ASP 495 Ca -0.00 0.73 0.00 0.00 -3.30 0.00 0.00 52.55 49.98 2vuy s ASP 495 Cb 0.09 -2.06 0.00 0.00 -1.09 0.00 0.00 42.92 39.85 2vuy s ASP 495 CO 0.78 -0.58 0.00 0.61 0.70 0.00 0.00 175.17 176.68 2vuy n GLY 496 N -2.17 -0.13 3.76 2.12 0.00 -1.26 -4.91 105.19 102.59 2vuy n GLY 496 Ca -0.00 -1.62 -0.39 0.00 0.00 0.00 0.00 46.02 44.01 2vuy n GLY 496 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2vuy n MET 497 N 0.19 2.08 -0.04 1.61 2.81 -1.26 -4.93 117.12 117.57 2vuy n MET 497 Ca 0.00 0.75 -0.07 0.00 -1.81 0.00 0.00 57.70 56.56 2vuy n MET 497 Cb 0.00 -2.62 -0.14 0.00 -0.71 0.00 0.00 33.22 29.75 2vuy n MET 497 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 2vuy n ASN 498 N -0.46 0.53 -4.46 7.83 3.02 -1.26 -4.76 115.26 115.69 2vuy n ASN 498 Ca 0.07 0.25 -0.39 0.00 -0.03 0.00 0.00 54.58 54.48 2vuy n ASN 498 Cb 0.42 0.42 -0.11 0.00 -0.61 0.00 0.00 39.78 39.90 2vuy n ASN 498 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 2vuy s GLU 499 N -2.64 3.38 0.00 3.52 2.56 -1.26 -4.87 118.70 119.39 2vuy s GLU 499 Ca -0.06 -0.70 0.08 0.00 0.00 0.00 0.00 54.97 54.28 2vuy s GLU 499 Cb 0.08 -3.62 0.02 0.00 2.00 0.00 0.00 34.13 32.61 2vuy s GLU 499 CO 0.83 -0.42 0.62 0.09 -0.56 0.00 0.00 175.26 175.82 2vuy n ASN 500 N 5.01 1.27 -3.87 -1.70 4.13 -1.26 -5.01 115.26 113.84 2vuy n ASN 500 Ca -0.14 -1.14 -0.26 0.00 1.68 0.00 0.00 54.58 54.72 2vuy n ASN 500 Cb 0.49 0.29 -0.00 0.00 -1.54 0.00 0.00 39.78 39.02 2vuy n ASN 500 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 2vuy n TYR 501 N -0.02 -1.73 -4.68 3.10 4.02 -1.26 -4.96 117.16 111.62 2vuy n TYR 501 Ca 0.04 0.68 -0.31 0.00 -0.01 0.00 0.00 57.90 58.30 2vuy n TYR 501 Cb 0.17 -3.75 -0.08 0.00 -0.02 0.00 0.00 39.34 35.67 2vuy n TYR 501 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 2vuy s SER 502 N -4.17 3.71 -0.29 7.72 1.04 -1.26 -4.47 113.70 115.97 2vuy s SER 502 Ca 0.11 -1.68 -0.13 0.00 0.48 0.00 0.00 55.95 54.73 2vuy s SER 502 Cb -0.04 0.56 0.11 0.00 0.10 0.00 0.00 66.02 66.75 2vuy s SER 502 CO 0.87 -0.90 0.70 0.86 0.98 0.00 0.00 173.24 175.76 2vuy s TRP 503 N -2.99 -1.16 -1.58 5.02 -0.00 -1.21 -4.84 118.94 112.18 2vuy s TRP 503 Ca 0.11 2.13 0.00 0.00 -0.00 0.00 0.00 56.10 58.34 2vuy s TRP 503 Cb 0.02 0.70 0.00 0.00 -0.00 0.00 0.00 33.47 34.18 2vuy s TRP 503 CO 0.06 -0.58 0.58 0.27 -0.00 0.00 0.00 176.95 177.28 2vuy n ASN 504 N 4.88 0.30 -0.72 5.86 2.04 -1.25 -4.00 115.26 122.38 2vuy n ASN 504 Ca -0.15 -1.45 -0.09 0.00 -0.44 0.00 0.00 54.58 52.45 2vuy n ASN 504 Cb 0.54 -0.15 -0.04 0.00 -2.53 0.00 0.00 39.78 37.60 2vuy n ASN 504 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 2vuy n GLY 506 N 0.30 1.00 3.58 0.00 0.00 -1.26 -4.71 105.19 104.09 2vuy n GLY 506 Ca -0.09 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.92 2vuy n GLY 506 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vuy s ALA 507 N -2.00 -2.33 -0.14 4.61 0.00 -1.08 -5.06 121.76 115.76 2vuy s ALA 507 Ca 0.00 2.20 -0.29 0.00 0.00 0.00 0.00 51.96 53.87 2vuy s ALA 507 Cb 0.00 -1.78 -0.03 0.00 0.00 0.00 0.00 23.12 21.31 2vuy s ALA 507 CO 0.00 -0.56 1.42 -2.00 0.00 0.00 0.00 175.76 174.62 2vuy s GLU 508 N 1.79 4.16 1.28 0.00 2.56 -1.26 -4.73 118.70 122.51 2vuy s GLU 508 Ca -0.07 1.81 0.00 0.00 0.00 0.00 0.00 54.97 56.70 2vuy s GLU 508 Cb -0.05 -3.87 0.00 0.00 2.00 0.00 0.00 34.13 32.21 2vuy s GLU 508 CO -0.16 -0.83 0.00 0.41 -0.56 0.00 0.00 175.26 174.12 2vuy n GLY 509 N 3.91 -1.81 3.72 -1.50 0.00 -0.25 -4.92 105.19 104.34 2vuy n GLY 509 Ca 0.15 -1.46 -0.40 0.00 0.00 0.00 0.00 46.02 44.31 2vuy n GLY 509 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2vuy n PRO 510 N 0.00 1.92 -4.22 1.61 -0.02 -1.26 -4.97 135.00 128.06 2vuy n PRO 510 Ca 0.00 0.69 -0.14 0.00 -2.02 0.00 0.00 63.50 62.03 2vuy n PRO 510 Cb 0.00 -2.45 -0.10 0.00 -0.02 0.00 0.00 33.50 30.93 2vuy n PRO 510 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2vuy s THR 511 N -1.22 0.00 0.00 3.45 2.01 -1.26 -5.02 115.64 113.59 2vuy s THR 511 Ca 0.63 -2.00 0.00 0.00 0.31 0.00 0.00 61.69 60.64 2vuy s THR 511 Cb -0.48 -2.50 0.00 0.00 0.01 0.00 0.00 72.50 69.53 2vuy s THR 511 CO 0.56 0.00 0.07 0.59 -0.69 0.00 0.00 174.62 175.15 2vuy n ASN 512 N -0.56 0.14 -4.56 3.53 3.02 -1.26 -4.95 115.26 110.62 2vuy n ASN 512 Ca 0.03 -0.50 -0.24 0.00 -0.03 0.00 0.00 54.58 53.84 2vuy n ASN 512 Cb 0.65 0.62 -0.06 0.00 -0.61 0.00 0.00 39.78 40.39 2vuy n ASN 512 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2vuy s ASP 513 N -0.62 4.88 0.41 6.41 -1.08 -1.26 -4.80 116.67 120.60 2vuy s ASP 513 Ca 0.00 -0.65 0.25 0.00 -0.52 0.00 0.00 52.55 51.63 2vuy s ASP 513 Cb 0.00 -2.56 1.34 0.00 -1.46 0.00 0.00 42.92 40.23 2vuy s ASP 513 CO 0.00 -3.02 1.64 1.56 0.52 0.00 0.00 175.17 175.87 2vuy h GLN 514 N 11.38 0.13 0.00 4.34 1.08 -1.99 1.73 115.11 131.79 2vuy h GLN 514 Ca 0.09 -0.01 -0.03 0.00 -1.45 0.00 0.00 58.65 57.25 2vuy h GLN 514 Cb 1.00 -0.03 -0.00 0.00 -0.05 0.00 0.00 27.48 28.39 2vuy h GLN 514 CO 1.17 0.09 -0.15 -0.91 -0.95 0.00 0.00 178.83 178.08 2vuy h ASN 515 N 0.14 0.00 0.36 1.46 2.35 -2.00 0.15 115.58 118.03 2vuy h ASN 515 Ca 0.79 0.00 -0.32 0.00 -0.55 0.00 0.00 56.30 56.22 2vuy h ASN 515 Cb 2.31 0.00 0.02 0.00 0.05 0.00 0.00 38.32 40.69 2vuy h ASN 515 CO -0.48 0.15 -1.51 1.62 -1.65 0.00 0.00 177.43 175.55 2vuy h VAL 516 N 0.00 1.21 -0.76 2.81 3.04 0.23 -3.07 116.25 119.72 2vuy h VAL 516 Ca -0.00 -2.75 -0.05 0.00 -1.01 0.00 0.00 66.70 62.89 2vuy h VAL 516 Cb 0.27 2.90 -0.03 0.00 -2.01 0.00 0.00 31.29 32.42 2vuy h VAL 516 CO 0.02 0.84 0.28 1.62 -1.01 0.00 0.00 177.57 179.32 2vuy h VAL 517 N 0.11 1.26 -0.33 1.51 3.04 -0.75 -1.80 116.25 119.28 2vuy h VAL 517 Ca -0.25 -0.84 -0.02 0.00 -1.01 0.00 0.00 66.70 64.59 2vuy h VAL 517 Cb 2.09 0.37 -0.01 0.00 -2.01 0.00 0.00 31.29 31.72 2vuy h VAL 517 CO 0.22 0.34 0.14 0.40 -1.01 0.00 0.00 177.57 177.65 2vuy h ILE 518 N 1.11 1.18 -0.22 3.17 2.04 -1.07 0.48 117.51 124.20 2vuy h ILE 518 Ca 0.25 -0.55 0.06 0.00 1.00 0.00 0.00 64.86 65.62 2vuy h ILE 518 Cb 0.24 0.92 -0.06 0.00 -0.74 0.00 0.00 36.82 37.18 2vuy h ILE 518 CO -0.02 0.19 -0.18 0.00 0.00 0.00 0.00 178.15 178.15 2vuy h ARG 520 N -0.18 -0.35 -0.42 0.00 -0.00 -0.92 -0.91 114.38 111.60 2vuy h ARG 520 Ca 0.13 0.02 -0.00 0.00 -0.50 0.00 0.00 59.98 59.63 2vuy h ARG 520 Cb 0.38 0.08 -0.02 0.00 0.00 0.00 0.00 29.97 30.41 2vuy h ARG 520 CO -0.33 -0.23 0.24 0.93 0.00 0.00 0.00 179.97 180.57 2vuy h GLU 521 N -0.36 0.56 -0.01 0.04 4.39 -0.52 -1.31 114.58 117.36 2vuy h GLU 521 Ca 0.07 -0.05 -0.16 0.00 0.34 0.00 0.00 59.36 59.56 2vuy h GLU 521 Cb 0.45 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.97 2vuy h GLU 521 CO -0.22 0.40 -0.75 -0.22 -1.16 0.00 0.00 179.01 177.06 2vuy h LYS 522 N 0.57 0.10 -0.10 2.33 3.64 -0.68 -2.98 116.57 119.45 2vuy h LYS 522 Ca 0.15 -0.09 -0.09 0.00 -1.27 0.00 0.00 60.65 59.34 2vuy h LYS 522 Cb -0.00 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 2vuy h LYS 522 CO -0.03 0.80 -0.30 1.96 -2.27 0.00 0.00 179.45 179.61 2vuy h GLN 523 N 0.06 0.38 -0.99 1.90 1.08 -0.51 -1.07 115.11 115.96 2vuy h GLN 523 Ca -0.02 -0.28 0.15 0.00 -1.45 0.00 0.00 58.65 57.05 2vuy h GLN 523 Cb 1.32 0.05 -0.09 0.00 -0.05 0.00 0.00 27.48 28.70 2vuy h GLN 523 CO 0.11 0.90 0.61 0.87 -0.95 0.00 0.00 178.83 180.36 2vuy h LYS 524 N -0.06 0.85 -0.06 1.46 1.57 -1.29 0.24 116.57 119.28 2vuy h LYS 524 Ca -0.01 -0.05 -0.15 0.00 -1.87 0.00 0.00 60.65 58.57 2vuy h LYS 524 Cb 0.92 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 33.03 2vuy h LYS 524 CO 0.06 0.56 -0.63 0.00 -0.57 0.00 0.00 179.45 178.87 2vuy h ARG 525 N 0.87 0.23 -0.73 3.15 3.08 -1.40 -2.32 114.38 117.26 2vuy h ARG 525 Ca 0.53 -0.17 -0.06 0.00 0.07 0.00 0.00 59.98 60.35 2vuy h ARG 525 Cb 0.67 0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.71 2vuy h ARG 525 CO -0.32 0.79 0.21 -0.91 -1.07 0.00 0.00 179.97 178.67 2vuy h ASN 526 N 0.17 1.08 -0.07 7.04 2.35 0.76 -0.85 115.58 126.06 2vuy h ASN 526 Ca -0.01 -0.21 -0.02 0.00 -0.55 0.00 0.00 56.30 55.51 2vuy h ASN 526 Cb 1.15 -0.28 -0.00 0.00 0.05 0.00 0.00 38.32 39.23 2vuy h ASN 526 CO 0.10 1.01 -0.02 -0.26 -1.65 0.00 0.00 177.43 176.61 2vuy h PHE 527 N 1.10 0.16 -0.68 1.19 -1.00 -1.00 -2.33 116.94 114.37 2vuy h PHE 527 Ca 0.23 -0.03 0.04 0.00 2.81 0.00 0.00 57.97 61.02 2vuy h PHE 527 Cb 0.33 -0.04 -0.05 0.00 3.61 0.00 0.00 35.95 39.80 2vuy h PHE 527 CO 0.03 0.47 0.41 0.52 -1.61 0.00 0.00 178.31 178.12 2vuy h MET 528 N -0.20 0.75 -0.43 1.51 2.86 -1.27 0.62 114.93 118.77 2vuy h MET 528 Ca 0.02 -0.05 -0.04 0.00 -2.06 0.00 0.00 59.70 57.58 2vuy h MET 528 Cb 0.42 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.89 2vuy h MET 528 CO 0.01 0.50 0.12 0.82 1.06 0.00 0.00 176.91 179.42 2vuy h ILE 529 N 0.77 1.22 -0.21 -1.22 2.04 -1.18 -1.42 117.51 117.52 2vuy h ILE 529 Ca 0.29 -0.75 -0.00 0.00 1.00 0.00 0.00 64.86 65.39 2vuy h ILE 529 Cb 0.09 0.90 -0.01 0.00 -0.74 0.00 0.00 36.82 37.06 2vuy h ILE 529 CO -0.14 0.27 0.12 0.74 0.00 0.00 0.00 178.15 179.14 2vuy h THR 530 N 0.56 1.09 0.46 -0.27 2.02 -0.89 -2.59 112.91 113.29 2vuy h THR 530 Ca 0.14 -0.21 -0.02 0.00 0.77 0.00 0.00 66.41 67.09 2vuy h THR 530 Cb 0.28 0.85 -0.01 0.00 -1.74 0.00 0.00 68.15 67.54 2vuy h THR 530 CO -0.00 0.08 -0.29 0.25 0.37 0.00 0.00 175.52 175.93 2vuy h LEU 531 N 0.25 -0.72 -1.10 2.58 5.85 -0.76 -2.66 115.31 118.75 2vuy h LEU 531 Ca 0.07 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.84 2vuy h LEU 531 Cb 0.03 0.21 0.00 0.00 0.37 0.00 0.00 40.66 41.27 2vuy h LEU 531 CO -0.01 -0.45 0.00 0.18 -0.34 0.00 0.00 178.44 177.81 2vuy n LEU 532 N -5.42 1.14 0.00 2.25 4.77 -0.55 -2.68 117.00 116.51 2vuy n LEU 532 Ca -0.11 -0.57 0.00 0.00 -0.03 0.00 0.00 56.01 55.30 2vuy n LEU 532 Cb 0.32 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 40.93 2vuy n LEU 532 CO 0.34 0.26 0.12 0.55 -1.33 0.00 0.00 177.39 177.33 2vuy n VAL 533 N 0.07 0.06 -3.62 4.08 3.14 -0.98 -4.58 118.33 116.50 2vuy n VAL 533 Ca 0.00 -0.14 -0.33 0.00 -2.96 0.00 0.00 64.34 60.91 2vuy n VAL 533 Cb 0.26 1.54 -0.05 0.00 -1.06 0.00 0.00 33.84 34.53 2vuy n VAL 533 CO 0.00 0.00 0.00 -0.44 -6.46 0.00 0.00 176.83 169.93 2vuy s SER 534 N -0.06 6.56 0.34 6.55 0.01 -1.03 -4.96 113.70 121.12 2vuy s SER 534 Ca 0.00 0.69 -0.27 0.00 1.31 0.00 0.00 55.95 57.68 2vuy s SER 534 Cb 0.00 -2.13 -0.09 0.00 0.21 0.00 0.00 66.02 64.00 2vuy s SER 534 CO 0.00 0.09 1.16 -1.10 0.41 0.00 0.00 173.24 173.79 2vuy s GLN 535 N -2.38 4.34 0.00 12.44 -1.52 0.64 -4.80 119.66 128.39 2vuy s GLN 535 Ca 0.38 1.86 0.00 0.00 -1.95 0.00 0.00 55.36 55.66 2vuy s GLN 535 Cb -0.13 -2.93 0.00 0.00 -0.22 0.00 0.00 33.01 29.73 2vuy s GLN 535 CO 0.22 -0.08 0.00 0.41 -0.25 0.00 0.00 175.29 175.59 2vuy n GLY 536 N 0.85 0.33 3.60 3.09 0.00 -1.26 -3.31 105.19 108.49 2vuy n GLY 536 Ca 0.02 -2.31 -0.38 0.00 0.00 0.00 0.00 46.02 43.35 2vuy n GLY 536 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2vuy s THR 537 N -0.94 5.29 0.16 2.61 2.01 -0.26 -4.89 115.64 119.62 2vuy s THR 537 Ca 0.00 0.24 -0.28 0.00 0.31 0.00 0.00 61.69 61.96 2vuy s THR 537 Cb 0.00 -3.56 -0.07 0.00 0.01 0.00 0.00 72.50 68.88 2vuy s THR 537 CO 0.00 0.24 0.88 -2.16 -0.69 0.00 0.00 174.62 172.89 2vuy s PRO 538 N 1.78 4.69 -0.10 4.92 0.04 -1.26 0.24 135.00 145.31 2vuy s PRO 538 Ca 0.08 1.33 0.04 0.00 0.04 0.00 0.00 61.00 62.50 2vuy s PRO 538 Cb -0.16 -3.31 0.00 0.00 0.04 0.00 0.00 34.50 31.07 2vuy s PRO 538 CO 0.11 0.43 -0.24 1.41 0.04 0.00 0.00 177.00 178.75 2vuy s MET 539 N -0.74 3.04 -0.12 4.56 1.75 0.26 -2.00 119.30 126.05 2vuy s MET 539 Ca 0.41 -0.88 -0.03 0.00 -1.25 0.00 0.00 55.69 53.94 2vuy s MET 539 Cb -0.24 -2.30 -0.03 0.00 2.84 0.00 0.00 34.83 35.10 2vuy s MET 539 CO 0.29 0.17 -0.03 0.42 -0.65 0.00 0.00 175.02 175.22 2vuy s ILE 540 N 0.36 3.97 -0.39 10.11 1.01 0.16 -4.53 121.20 131.88 2vuy s ILE 540 Ca -0.19 -0.35 -0.29 0.00 0.00 0.00 0.00 60.65 59.83 2vuy s ILE 540 Cb -0.18 -2.70 0.02 0.00 0.01 0.00 0.00 42.46 39.61 2vuy s ILE 540 CO 0.09 0.54 1.13 -0.22 0.00 0.00 0.00 174.94 176.48 2vuy s LEU 541 N -0.12 3.78 -0.04 2.97 1.98 -1.26 -1.15 118.68 124.84 2vuy s LEU 541 Ca 0.03 0.79 -0.38 0.00 -2.89 0.00 0.00 54.13 51.68 2vuy s LEU 541 Cb -0.13 -3.55 -0.17 0.00 0.66 0.00 0.00 46.19 43.01 2vuy s LEU 541 CO 0.02 -1.09 1.44 0.61 -1.89 0.00 0.00 176.35 175.45 2vuy n GLY 542 N 4.39 0.53 0.00 7.98 0.00 0.11 -1.57 105.19 116.63 2vuy n GLY 542 Ca 0.12 0.78 0.00 0.00 0.00 0.00 0.00 46.02 46.92 2vuy n GLY 542 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vuy n GLY 543 N 2.96 1.28 0.32 -0.02 0.00 -1.26 -4.92 105.19 103.56 2vuy n GLY 543 Ca 0.21 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.36 2vuy n GLY 543 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2vuy h ASP 544 N 1.32 0.11 0.74 1.61 3.32 -1.63 0.32 116.42 122.21 2vuy h ASP 544 Ca 0.00 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.00 2vuy h ASP 544 Cb 0.00 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 2vuy h ASP 544 CO 0.00 0.07 -0.25 -0.33 -1.72 0.00 0.00 179.24 177.01 2vuy h GLU 545 N 0.13 0.00 -0.07 3.56 3.07 -1.93 -1.10 114.58 118.24 2vuy h GLU 545 Ca 0.15 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.01 2vuy h GLU 545 Cb 0.45 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.36 2vuy h GLU 545 CO -0.02 0.25 0.00 1.28 -1.40 0.00 0.00 179.01 179.12 2vuy n LEU 546 N -3.52 2.10 -2.39 1.33 4.32 0.98 -3.56 117.00 116.27 2vuy n LEU 546 Ca -0.01 -0.75 -0.17 0.00 -0.02 0.00 0.00 56.01 55.07 2vuy n LEU 546 Cb 0.41 -0.04 0.03 0.00 -1.62 0.00 0.00 43.42 42.20 2vuy n LEU 546 CO 0.34 0.37 0.03 -1.20 -1.22 0.00 0.00 177.39 175.71 2vuy n SER 547 N 0.63 -5.04 -4.49 -1.43 7.64 -0.38 -4.93 113.62 105.63 2vuy n SER 547 Ca 0.17 -0.24 -0.43 0.00 1.01 0.00 0.00 58.87 59.38 2vuy n SER 547 Cb 0.44 -3.86 -0.00 0.00 -1.01 0.00 0.00 64.21 59.78 2vuy n SER 547 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2vuy n ARG 548 N -3.30 0.73 -4.29 1.43 1.74 -0.35 -4.79 116.66 107.83 2vuy n ARG 548 Ca -0.07 0.26 -0.18 0.00 -0.77 0.00 0.00 57.85 57.09 2vuy n ARG 548 Cb 0.58 -1.55 -0.15 0.00 -1.02 0.00 0.00 32.46 30.33 2vuy n ARG 548 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2vuy s THR 549 N -1.29 0.60 -0.22 0.55 2.01 -1.26 -4.08 115.64 111.94 2vuy s THR 549 Ca 0.62 -0.32 0.11 0.00 0.31 0.00 0.00 61.69 62.41 2vuy s THR 549 Cb -0.67 -0.51 0.43 0.00 0.01 0.00 0.00 72.50 71.76 2vuy s THR 549 CO 0.58 0.17 1.27 0.00 -0.69 0.00 0.00 174.62 175.96 2vuy n GLN 550 N 2.92 1.64 -2.89 4.92 6.02 -1.26 -4.72 117.38 124.01 2vuy n GLN 550 Ca -0.14 -3.22 -0.17 0.00 -0.01 0.00 0.00 57.00 53.47 2vuy n GLN 550 Cb 0.57 -1.66 -0.00 0.00 1.02 0.00 0.00 30.24 30.17 2vuy n GLN 550 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2vuy n ARG 551 N -1.14 -2.87 -0.53 -1.09 1.74 -1.26 -0.19 116.66 111.32 2vuy n ARG 551 Ca 0.22 0.49 0.00 0.00 -0.77 0.00 0.00 57.85 57.79 2vuy n ARG 551 Cb 0.77 -5.13 0.00 0.00 -1.02 0.00 0.00 32.46 27.07 2vuy n ARG 551 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2vuy n GLY 552 N -0.96 0.76 3.62 -0.13 0.00 -1.26 -4.81 105.19 102.42 2vuy n GLY 552 Ca -0.07 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.52 2vuy n GLY 552 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2vuy s ASN 553 N -2.89 6.82 -0.36 1.61 3.84 0.73 -0.82 114.94 123.87 2vuy s ASN 553 Ca 0.00 0.85 0.08 0.00 0.21 0.00 0.00 52.86 54.00 2vuy s ASN 553 Cb 0.00 -2.52 0.72 0.00 -0.55 0.00 0.00 41.25 38.89 2vuy s ASN 553 CO 0.00 -0.93 1.83 -0.46 -2.79 0.00 0.00 177.10 174.75 2vuy n ASN 554 N 7.00 4.42 -2.67 -4.21 2.04 -1.26 -4.36 115.26 116.22 2vuy n ASN 554 Ca 0.11 -3.36 -0.04 0.00 -0.44 0.00 0.00 54.58 50.84 2vuy n ASN 554 Cb 0.48 -0.77 0.12 0.00 -2.53 0.00 0.00 39.78 37.08 2vuy n ASN 554 CO 0.00 0.00 0.00 -3.20 -0.44 0.00 0.00 177.26 173.62 2vuy n ASN 555 N -0.50 -1.63 -2.29 0.53 4.05 -1.26 -2.18 115.26 111.98 2vuy n ASN 555 Ca 0.47 -2.30 -0.06 0.00 0.45 0.00 0.00 54.58 53.14 2vuy n ASN 555 Cb 1.47 0.82 -0.08 0.00 1.23 0.00 0.00 39.78 43.22 2vuy n ASN 555 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2vuy n ALA 556 N -1.13 3.59 0.20 5.20 0.00 -1.26 -4.36 120.51 122.76 2vuy n ALA 556 Ca -0.12 -0.90 0.10 0.00 0.00 0.00 0.00 53.44 52.52 2vuy n ALA 556 Cb 0.86 -2.30 0.16 0.00 0.00 0.00 0.00 19.45 18.16 2vuy n ALA 556 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2vuy h PHE 557 N 4.63 0.00 -0.17 0.00 -5.15 -1.95 -3.25 116.94 111.04 2vuy h PHE 557 Ca 0.10 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.87 2vuy h PHE 557 Cb 0.71 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.88 2vuy h PHE 557 CO 1.40 0.12 0.00 0.00 -2.00 0.00 0.00 178.31 177.83 2vuy s GLN 559 N -2.47 2.99 -1.15 0.00 2.00 -1.23 -3.78 119.66 116.02 2vuy s GLN 559 Ca 0.33 -2.37 -0.05 0.00 -2.00 0.00 0.00 55.36 51.27 2vuy s GLN 559 Cb 0.27 -4.06 0.25 0.00 0.80 0.00 0.00 33.01 30.27 2vuy s GLN 559 CO 0.07 -1.23 1.73 -3.47 -0.50 0.00 0.00 175.29 171.89 2vuy n ASP 560 N 3.93 6.33 0.00 6.67 4.64 -1.26 -4.41 116.55 132.45 2vuy n ASP 560 Ca 0.07 -3.34 0.00 0.00 -1.38 0.00 0.00 54.79 50.14 2vuy n ASP 560 Cb 0.42 -1.32 0.00 0.00 -1.04 0.00 0.00 41.12 39.18 2vuy n ASP 560 CO 0.00 0.00 0.00 -0.46 -0.82 0.00 0.00 177.20 175.92 2vuy n ASN 561 N 1.88 0.00 0.17 1.67 2.04 -1.26 -5.02 115.26 114.74 2vuy n ASN 561 Ca 0.36 0.00 0.12 0.00 -0.44 0.00 0.00 54.58 54.62 2vuy n ASN 561 Cb 0.32 0.00 0.62 0.00 -2.53 0.00 0.00 39.78 38.20 2vuy n ASN 561 CO 0.00 0.00 0.00 -0.33 -0.44 0.00 0.00 177.26 176.49 2vuy h GLU 562 N 0.00 0.00 -0.18 -3.83 3.07 -1.91 0.27 114.58 112.00 2vuy h GLU 562 Ca 0.00 0.00 -0.10 0.00 -0.50 0.00 0.00 59.36 58.76 2vuy h GLU 562 Cb 0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 27.90 2vuy h GLU 562 CO 0.00 0.00 -0.33 0.82 -1.40 0.00 0.00 179.01 178.10 2vuy h ILE 563 N 0.00 1.28 0.00 3.13 2.04 -1.89 -3.35 117.51 118.73 2vuy h ILE 563 Ca 0.00 -1.38 -0.15 0.00 1.00 0.00 0.00 64.86 64.33 2vuy h ILE 563 Cb 0.08 1.51 -0.03 0.00 -0.74 0.00 0.00 36.82 37.64 2vuy h ILE 563 CO 0.00 0.43 -1.57 0.35 0.00 0.00 0.00 178.15 177.36 2vuy n THR 564 N -4.08 0.57 -1.42 -0.27 -2.24 -0.55 -4.13 114.28 102.15 2vuy n THR 564 Ca -0.01 -0.33 -0.41 0.00 -2.27 0.00 0.00 64.05 61.02 2vuy n THR 564 Cb 0.44 -0.79 0.01 0.00 -2.10 0.00 0.00 70.33 67.89 2vuy n THR 564 CO 0.00 0.00 0.00 0.79 -0.57 0.00 0.00 175.07 175.29 2vuy n TRP 565 N -2.36 -0.85 -2.58 4.78 5.03 0.84 -4.83 117.44 117.47 2vuy n TRP 565 Ca -0.14 0.58 -0.41 0.00 3.03 0.00 0.00 57.50 60.56 2vuy n TRP 565 Cb 0.76 -1.94 -0.04 0.00 -1.03 0.00 0.00 31.31 29.06 2vuy n TRP 565 CO 0.00 0.00 0.00 -0.06 -0.03 0.00 0.00 177.69 177.60 2vuy s PHE 566 N -1.55 3.66 -0.39 -5.99 0.40 -0.08 -4.91 117.98 109.12 2vuy s PHE 566 Ca 0.63 1.65 -0.13 0.00 -0.60 0.00 0.00 56.93 58.48 2vuy s PHE 566 Cb -0.59 -3.21 0.02 0.00 0.51 0.00 0.00 43.02 39.76 2vuy s PHE 566 CO 0.59 -0.37 0.25 0.34 0.70 0.00 0.00 175.22 176.73 2vuy s ASP 567 N 0.03 5.90 -0.04 1.36 3.68 -1.26 -4.34 116.67 122.00 2vuy s ASP 567 Ca 0.49 -0.96 0.12 0.00 2.13 0.00 0.00 52.55 54.33 2vuy s ASP 567 Cb -0.27 -2.08 0.41 0.00 -1.45 0.00 0.00 42.92 39.52 2vuy s ASP 567 CO 0.33 -0.42 1.29 0.79 0.13 0.00 0.00 175.17 177.29 2vuy n TRP 568 N 5.07 0.75 -3.03 -5.34 7.02 -1.26 -4.75 117.44 115.90 2vuy n TRP 568 Ca -0.11 -0.32 -0.44 0.00 -1.02 0.00 0.00 57.50 55.60 2vuy n TRP 568 Cb 0.46 -0.10 -0.04 0.00 -2.42 0.00 0.00 31.31 29.22 2vuy n TRP 568 CO 0.00 0.00 0.00 1.21 -2.02 0.00 0.00 177.69 176.88 2vuy s ASN 569 N -0.84 6.21 -0.20 -0.99 2.47 -1.26 -5.03 114.94 115.30 2vuy s ASN 569 Ca 0.29 -1.36 -0.08 0.00 0.42 0.00 0.00 52.86 52.13 2vuy s ASN 569 Cb 0.18 -2.34 -0.04 0.00 -1.45 0.00 0.00 41.25 37.59 2vuy s ASN 569 CO 0.17 -1.20 0.09 -0.76 -3.72 0.00 0.00 177.10 171.68 2vuy s LEU 570 N 3.05 3.88 0.00 3.21 1.43 -1.26 -5.06 118.68 123.93 2vuy s LEU 570 Ca 0.16 0.07 -0.03 0.00 -1.03 0.00 0.00 54.13 53.30 2vuy s LEU 570 Cb -0.21 -2.00 0.07 0.00 0.03 0.00 0.00 46.19 44.08 2vuy s LEU 570 CO 0.06 0.13 0.43 -0.90 0.23 0.00 0.00 176.35 176.30 2vuy n ASP 571 N 3.85 0.24 -0.16 2.29 5.68 -1.26 -4.74 116.55 122.45 2vuy n ASP 571 Ca -0.16 -1.28 -0.06 0.00 -0.50 0.00 0.00 54.79 52.79 2vuy n ASP 571 Cb 0.52 -0.31 0.10 0.00 -1.14 0.00 0.00 41.12 40.29 2vuy n ASP 571 CO 0.00 0.00 0.00 -0.08 -1.33 0.00 0.00 177.20 175.79 2vuy h GLU 572 N 0.00 0.93 0.61 0.11 4.81 -1.99 0.30 114.58 119.34 2vuy h GLU 572 Ca -0.14 -0.26 -0.03 0.00 -0.13 0.00 0.00 59.36 58.80 2vuy h GLU 572 Cb 0.44 -0.10 0.01 0.00 0.63 0.00 0.00 28.75 29.72 2vuy h GLU 572 CO 0.12 0.91 -0.29 -0.09 -0.73 0.00 0.00 179.01 178.93 2vuy h ARG 573 N 0.86 -0.78 -0.55 1.92 2.43 -1.98 0.13 114.38 116.40 2vuy h ARG 573 Ca 0.16 0.05 -0.00 0.00 -0.81 0.00 0.00 59.98 59.38 2vuy h ARG 573 Cb 0.49 0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 30.19 2vuy h ARG 573 CO 0.02 -0.49 0.33 0.87 -1.51 0.00 0.00 179.97 179.19 2vuy h LYS 574 N -0.91 0.74 -0.85 0.20 1.57 -1.92 -1.92 116.57 113.49 2vuy h LYS 574 Ca -0.08 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.61 2vuy h LYS 574 Cb 0.66 -0.16 -0.04 0.00 0.08 0.00 0.00 32.23 32.77 2vuy h LYS 574 CO 0.14 0.54 0.47 1.03 -0.57 0.00 0.00 179.45 181.05 2vuy h SER 575 N 0.74 1.06 0.40 0.86 0.87 -0.89 -1.62 113.55 114.96 2vuy h SER 575 Ca 0.20 -0.10 -0.09 0.00 -1.23 0.00 0.00 61.79 60.57 2vuy h SER 575 Cb -0.01 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.66 2vuy h SER 575 CO -0.04 0.85 -0.41 0.50 -0.53 0.00 0.00 176.83 177.20 2vuy h LYS 576 N 1.18 0.02 0.00 2.24 3.64 -0.33 -2.43 116.57 120.91 2vuy h LYS 576 Ca 0.30 -0.01 -0.18 0.00 -1.27 0.00 0.00 60.65 59.49 2vuy h LYS 576 Cb 0.02 -0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.82 2vuy h LYS 576 CO -0.05 0.44 -0.85 0.35 -2.27 0.00 0.00 179.45 177.07 2vuy h PHE 577 N 0.02 0.13 -0.57 1.91 3.57 -0.93 -2.77 116.94 118.30 2vuy h PHE 577 Ca -0.00 -0.07 -0.02 0.00 3.53 0.00 0.00 57.97 61.40 2vuy h PHE 577 Cb 0.74 -0.01 -0.03 0.00 2.79 0.00 0.00 35.95 39.44 2vuy h PHE 577 CO 0.00 0.89 0.26 1.25 -2.23 0.00 0.00 178.31 178.48 2vuy h LEU 578 N 0.05 0.73 -0.60 0.59 5.85 -0.84 -1.28 115.31 119.81 2vuy h LEU 578 Ca -0.02 -0.08 -0.14 0.00 0.84 0.00 0.00 57.88 58.48 2vuy h LEU 578 Cb 1.48 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 42.30 2vuy h LEU 578 CO 0.12 0.64 -0.66 -0.33 -0.34 0.00 0.00 178.44 177.86 2vuy h GLU 579 N 0.81 0.00 -0.40 1.25 4.39 -1.36 -2.56 114.58 116.71 2vuy h GLU 579 Ca 0.20 0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.75 2vuy h GLU 579 Cb 0.11 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.75 2vuy h GLU 579 CO -0.02 0.66 -0.35 0.35 -1.16 0.00 0.00 179.01 178.49 2vuy h PHE 580 N 0.00 1.10 -0.55 4.33 3.04 -1.07 -2.40 116.94 121.40 2vuy h PHE 580 Ca -0.01 -0.31 -0.10 0.00 3.98 0.00 0.00 57.97 61.53 2vuy h PHE 580 Cb 1.22 -0.24 -0.02 0.00 2.56 0.00 0.00 35.95 39.48 2vuy h PHE 580 CO 0.00 1.14 -0.06 0.28 -2.02 0.00 0.00 178.31 177.65 2vuy h VAL 581 N 0.77 1.26 0.01 1.41 2.07 -1.18 -1.59 116.25 119.01 2vuy h VAL 581 Ca 0.07 -1.20 -0.00 0.00 0.82 0.00 0.00 66.70 66.40 2vuy h VAL 581 Cb 0.93 0.90 0.00 0.00 -1.52 0.00 0.00 31.29 31.61 2vuy h VAL 581 CO 0.09 0.43 -0.01 0.11 0.02 0.00 0.00 177.57 178.21 2vuy h LYS 582 N 0.90 -0.02 0.00 1.57 1.57 -1.34 -0.11 116.57 119.14 2vuy h LYS 582 Ca 0.15 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.87 2vuy h LYS 582 Cb 0.61 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.91 2vuy h LYS 582 CO 0.04 0.02 -0.28 0.87 -0.57 0.00 0.00 179.45 179.53 2vuy h LYS 583 N -0.06 0.00 -0.04 3.15 1.57 -1.36 -0.44 116.57 119.39 2vuy h LYS 583 Ca -0.00 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.62 2vuy h LYS 583 Cb 0.05 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.37 2vuy h LYS 583 CO 0.00 0.28 -0.59 0.52 -0.57 0.00 0.00 179.45 179.10 2vuy h MET 584 N 0.00 0.46 -0.62 3.15 2.86 -1.03 -1.19 114.93 118.57 2vuy h MET 584 Ca -0.00 -0.45 -0.04 0.00 -2.06 0.00 0.00 59.70 57.15 2vuy h MET 584 Cb 0.59 0.12 -0.03 0.00 0.06 0.00 0.00 31.60 32.34 2vuy h MET 584 CO 0.04 1.09 0.22 0.82 1.06 0.00 0.00 176.91 180.14 2vuy h ILE 585 N 0.00 1.23 -0.76 -1.22 2.04 -0.81 -1.07 117.51 116.92 2vuy h ILE 585 Ca -0.06 -0.75 -0.05 0.00 1.00 0.00 0.00 64.86 65.00 2vuy h ILE 585 Cb 1.27 0.52 -0.03 0.00 -0.74 0.00 0.00 36.82 37.83 2vuy h ILE 585 CO 0.12 0.29 0.29 1.56 0.00 0.00 0.00 178.15 180.41 2vuy h GLN 586 N 0.90 1.15 -0.26 2.37 4.20 -1.01 -1.90 115.11 120.56 2vuy h GLN 586 Ca 0.21 -0.22 -0.01 0.00 0.06 0.00 0.00 58.65 58.69 2vuy h GLN 586 Cb 0.22 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.81 2vuy h GLN 586 CO -0.01 0.95 0.13 0.35 -0.67 0.00 0.00 178.83 179.58 2vuy h PHE 587 N 1.11 0.36 -0.14 2.96 3.57 -0.47 -2.16 116.94 122.17 2vuy h PHE 587 Ca 0.25 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.78 2vuy h PHE 587 Cb 0.24 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 38.83 2vuy h PHE 587 CO 0.02 0.32 -0.10 -0.92 -2.23 0.00 0.00 178.31 175.40 2vuy h TYR 588 N 0.29 -0.24 0.00 0.41 3.20 -0.96 -2.30 116.97 117.37 2vuy h TYR 588 Ca 0.09 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 61.97 2vuy h TYR 588 Cb 0.09 0.13 -0.00 0.00 1.54 0.00 0.00 36.73 38.49 2vuy h TYR 588 CO -0.03 -0.15 -0.02 0.00 -1.64 0.00 0.00 178.16 176.32 2vuy h ARG 589 N -0.11 0.00 0.00 1.82 3.08 -1.23 -2.75 114.38 115.20 2vuy h ARG 589 Ca 0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.14 2vuy h ARG 589 Cb 0.23 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.28 2vuy h ARG 589 CO -0.21 0.02 -0.53 0.00 -1.07 0.00 0.00 179.97 178.18 2vuy n ALA 590 N -2.11 3.36 -3.97 0.04 0.00 -0.82 -4.82 120.51 112.19 2vuy n ALA 590 Ca -0.01 -0.32 -0.31 0.00 0.00 0.00 0.00 53.44 52.80 2vuy n ALA 590 Cb 0.20 -1.14 -0.16 0.00 0.00 0.00 0.00 19.45 18.35 2vuy n ALA 590 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2vuy s HIS 591 N -3.05 2.55 0.66 0.00 3.76 -1.04 -4.97 115.29 113.20 2vuy s HIS 591 Ca 0.10 -1.84 0.37 0.00 -0.15 0.00 0.00 55.06 53.55 2vuy s HIS 591 Cb 0.17 -1.64 2.05 0.00 1.11 0.00 0.00 32.58 34.26 2vuy s HIS 591 CO 0.70 -0.79 2.19 -1.35 -0.85 0.00 0.00 174.74 174.64 2vuy h PRO 592 N 7.93 0.00 0.00 8.40 0.11 -1.87 -2.16 132.00 144.40 2vuy h PRO 592 Ca -0.19 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.92 2vuy h PRO 592 Cb 1.07 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.18 2vuy h PRO 592 CO 0.43 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.22 2vuy h ALA 593 N 1.75 1.00 -0.08 -0.75 0.00 -1.92 -1.69 119.26 117.56 2vuy h ALA 593 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2vuy h ALA 593 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2vuy h ALA 593 CO -0.00 0.00 0.00 1.19 0.00 0.00 0.00 179.25 180.44 2vuy n PHE 594 N -2.45 0.10 -2.78 0.00 3.01 -0.81 -4.63 117.46 109.90 2vuy n PHE 594 Ca -0.01 -0.19 -0.21 0.00 1.01 0.00 0.00 57.45 58.06 2vuy n PHE 594 Cb 0.12 -0.01 -0.01 0.00 -0.01 0.00 0.00 39.48 39.57 2vuy n PHE 594 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 2vuy n ARG 595 N 0.27 2.30 -2.84 -1.08 1.74 -0.64 -4.45 116.66 111.96 2vuy n ARG 595 Ca 0.05 -4.04 -0.31 0.00 -0.77 0.00 0.00 57.85 52.78 2vuy n ARG 595 Cb 0.24 -1.88 -0.03 0.00 -1.02 0.00 0.00 32.46 29.77 2vuy n ARG 595 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 2vuy s ARG 596 N -3.19 3.81 -0.01 5.56 0.52 -1.21 -4.76 118.95 119.67 2vuy s ARG 596 Ca 0.41 0.52 0.21 0.00 -0.52 0.00 0.00 55.73 56.35 2vuy s ARG 596 Cb 0.38 -2.38 -0.25 0.00 0.52 0.00 0.00 34.95 33.22 2vuy s ARG 596 CO -0.10 -0.04 0.75 -1.91 0.02 0.00 0.00 175.30 174.03 2vuy n GLU 597 N -1.25 0.26 -4.13 3.54 2.13 -1.26 -4.64 120.64 115.29 2vuy n GLU 597 Ca 0.03 -0.07 -0.16 0.00 0.66 0.00 0.00 57.16 57.62 2vuy n GLU 597 Cb 0.54 -1.51 -0.12 0.00 0.27 0.00 0.00 31.44 30.62 2vuy n GLU 597 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 2vuy s ARG 598 N -3.20 0.71 0.55 5.31 0.52 -1.26 -4.29 118.95 117.28 2vuy s ARG 598 Ca 0.02 -0.91 -0.18 0.00 -0.52 0.00 0.00 55.73 54.14 2vuy s ARG 598 Cb 0.15 -0.57 -0.06 0.00 0.52 0.00 0.00 34.95 35.00 2vuy s ARG 598 CO 0.88 0.11 1.06 0.71 0.02 0.00 0.00 175.30 178.09 2vuy s TYR 599 N -1.50 2.92 0.29 -0.53 1.51 -1.26 -4.91 117.35 113.86 2vuy s TYR 599 Ca -0.04 1.54 -0.29 0.00 -1.01 0.00 0.00 57.07 57.27 2vuy s TYR 599 Cb -0.09 -3.09 -0.10 0.00 -0.11 0.00 0.00 41.96 38.58 2vuy s TYR 599 CO 0.01 -1.12 1.14 -0.06 -1.11 0.00 0.00 175.55 174.42 2vuy s PHE 600 N -2.15 3.47 -0.27 2.71 0.40 -1.26 -4.94 117.98 115.94 2vuy s PHE 600 Ca 0.67 1.63 0.22 0.00 -0.60 0.00 0.00 56.93 58.85 2vuy s PHE 600 Cb -0.18 -3.37 0.06 0.00 0.51 0.00 0.00 43.02 40.04 2vuy s PHE 600 CO 0.29 -0.84 1.14 1.96 0.70 0.00 0.00 175.22 178.47 2vuy h GLN 601 N 3.80 0.00 -1.01 0.44 4.20 -1.96 -3.48 115.11 117.09 2vuy h GLN 601 Ca -0.47 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.24 2vuy h GLN 601 Cb 1.21 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.00 2vuy h GLN 601 CO 0.67 0.01 -0.01 0.41 -0.67 0.00 0.00 178.83 179.24 2vuy n GLY 602 N 1.17 0.93 3.85 3.46 0.00 -1.26 -5.06 105.19 108.29 2vuy n GLY 602 Ca 0.01 -0.68 -0.07 0.00 0.00 0.00 0.00 46.02 45.28 2vuy n GLY 602 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2vuy s LYS 603 N -4.98 1.82 0.26 1.61 -2.85 -1.26 -4.93 119.74 109.41 2vuy s LYS 603 Ca 0.01 -1.02 -0.30 0.00 -1.00 0.00 0.00 55.97 53.66 2vuy s LYS 603 Cb -0.00 0.61 -0.09 0.00 -2.06 0.00 0.00 37.83 36.28 2vuy s LYS 603 CO 0.01 -0.83 1.10 0.15 0.10 0.00 0.00 175.35 175.87 2vuy s LYS 604 N -3.79 4.64 0.18 1.78 1.02 -1.26 -2.19 119.74 120.12 2vuy s LYS 604 Ca 0.11 1.79 0.07 0.00 0.02 0.00 0.00 55.97 57.96 2vuy s LYS 604 Cb -0.06 -3.20 -0.05 0.00 -0.52 0.00 0.00 37.83 34.00 2vuy s LYS 604 CO 0.07 0.19 -0.13 -0.51 -0.92 0.00 0.00 175.35 174.05 2vuy s LEU 605 N -1.27 2.54 -1.59 3.17 1.43 -1.26 -4.84 118.68 116.85 2vuy s LEU 605 Ca 0.45 -1.00 -0.16 0.00 -1.03 0.00 0.00 54.13 52.39 2vuy s LEU 605 Cb -0.32 -0.57 0.12 0.00 0.03 0.00 0.00 46.19 45.45 2vuy s LEU 605 CO 0.40 -0.21 0.83 0.49 0.23 0.00 0.00 176.35 178.09 2vuy n PHE 606 N -0.25 -1.97 -1.00 0.29 3.01 -1.26 -0.83 117.46 115.43 2vuy n PHE 606 Ca -0.09 0.80 -0.00 0.00 1.01 0.00 0.00 57.45 59.17 2vuy n PHE 606 Cb 0.60 -3.35 -0.00 0.00 -0.01 0.00 0.00 39.48 36.72 2vuy n PHE 606 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2vuy n GLY 607 N -1.48 0.16 3.84 1.37 0.00 -1.26 -4.97 105.19 102.84 2vuy n GLY 607 Ca 0.06 -0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 2vuy n GLY 607 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2vuy s MET 608 N -1.43 4.03 -0.12 1.61 -1.94 -0.01 -4.97 119.30 116.47 2vuy s MET 608 Ca 0.00 0.95 0.04 0.00 -1.71 0.00 0.00 55.69 54.97 2vuy s MET 608 Cb 0.00 -2.19 0.32 0.00 2.01 0.00 0.00 34.83 34.96 2vuy s MET 608 CO 0.00 -0.14 1.12 -0.35 -0.01 0.00 0.00 175.02 175.64 2vuy n PRO 609 N -1.17 2.26 -4.06 2.03 -0.04 -1.26 -4.37 135.00 128.39 2vuy n PRO 609 Ca 0.06 -1.26 -0.13 0.00 -0.04 0.00 0.00 63.50 62.13 2vuy n PRO 609 Cb 0.54 -1.71 -0.13 0.00 -0.04 0.00 0.00 33.50 32.16 2vuy n PRO 609 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2vuy s LEU 610 N -1.19 2.15 0.21 1.53 1.43 -1.26 -5.06 118.68 116.49 2vuy s LEU 610 Ca 0.22 -0.33 -0.29 0.00 -1.03 0.00 0.00 54.13 52.70 2vuy s LEU 610 Cb 0.18 -0.15 -0.08 0.00 0.03 0.00 0.00 46.19 46.16 2vuy s LEU 610 CO 0.06 -0.11 0.92 -0.54 0.23 0.00 0.00 176.35 176.92 2vuy s LYS 611 N -0.91 4.81 0.56 1.70 1.02 -1.26 -4.05 119.74 121.59 2vuy s LYS 611 Ca -0.06 1.45 0.25 0.00 0.02 0.00 0.00 55.97 57.63 2vuy s LYS 611 Cb -0.06 -3.29 1.51 0.00 -0.52 0.00 0.00 37.83 35.47 2vuy s LYS 611 CO -0.00 0.49 2.10 0.38 -0.92 0.00 0.00 175.35 177.39 2vuy h ASP 612 N 4.35 0.00 -3.60 2.83 2.03 -1.67 -3.38 116.42 116.99 2vuy h ASP 612 Ca -0.45 0.00 -0.11 0.00 -0.73 0.00 0.00 57.03 55.74 2vuy h ASP 612 Cb 1.20 0.00 -0.25 0.00 -0.83 0.00 0.00 39.33 39.45 2vuy h ASP 612 CO 0.68 0.00 -0.24 0.54 -1.03 0.00 0.00 179.24 179.19 2vuy s VAL 613 N -4.84 -0.01 -0.02 4.15 0.11 -1.26 -0.84 120.40 117.70 2vuy s VAL 613 Ca -0.05 0.04 0.01 0.00 -2.93 0.00 0.00 61.98 59.05 2vuy s VAL 613 Cb 0.17 -0.61 0.01 0.00 -1.53 0.00 0.00 36.38 34.42 2vuy s VAL 613 CO 0.62 0.02 -0.03 -0.89 -3.33 0.00 0.00 175.10 171.49 2vuy s THR 614 N 0.73 0.32 -0.21 5.04 2.01 -0.75 -4.58 115.64 118.20 2vuy s THR 614 Ca -0.04 -0.09 -0.06 0.00 0.31 0.00 0.00 61.69 61.81 2vuy s THR 614 Cb -0.05 -0.33 -0.03 0.00 0.01 0.00 0.00 72.50 72.10 2vuy s THR 614 CO -0.05 0.13 0.03 -0.36 -0.69 0.00 0.00 174.62 173.68 2vuy s PHE 615 N 0.41 3.09 0.43 4.92 0.40 -1.26 -0.43 117.98 125.54 2vuy s PHE 615 Ca -0.04 -0.34 0.08 0.00 -0.60 0.00 0.00 56.93 56.03 2vuy s PHE 615 Cb -0.08 -2.13 -0.02 0.00 0.51 0.00 0.00 43.02 41.31 2vuy s PHE 615 CO -0.01 -0.19 0.37 0.71 0.70 0.00 0.00 175.22 176.80 2vuy s TYR 616 N 1.05 2.63 0.36 0.36 1.51 0.26 0.26 117.35 123.77 2vuy s TYR 616 Ca 0.03 -0.52 0.09 0.00 -1.01 0.00 0.00 57.07 55.66 2vuy s TYR 616 Cb -0.14 -2.15 -0.07 0.00 -0.11 0.00 0.00 41.96 39.49 2vuy s TYR 616 CO 0.02 -0.13 -0.07 0.95 -1.11 0.00 0.00 175.55 175.21 2vuy s THR 617 N -2.50 2.18 0.11 -0.71 -4.23 -1.03 -4.04 115.64 105.42 2vuy s THR 617 Ca 0.47 -2.16 -0.15 0.00 -1.18 0.00 0.00 61.69 58.67 2vuy s THR 617 Cb -0.03 -2.72 0.04 0.00 1.34 0.00 0.00 72.50 71.13 2vuy s THR 617 CO 0.27 -0.16 0.93 -0.11 -0.54 0.00 0.00 174.62 175.01 2vuy n LEU 618 N -0.83 -0.53 0.26 4.79 7.94 -1.26 0.15 117.00 127.51 2vuy n LEU 618 Ca -0.05 1.06 0.15 0.00 -1.11 0.00 0.00 56.01 56.06 2vuy n LEU 618 Cb 0.64 -0.18 0.54 0.00 0.53 0.00 0.00 43.42 44.95 2vuy n LEU 618 CO 0.45 -0.90 0.92 -0.33 -1.11 0.00 0.00 177.39 176.41 2vuy h GLU 619 N 0.00 0.00 0.00 1.96 3.07 -1.89 -1.43 114.58 116.28 2vuy h GLU 619 Ca 0.14 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.00 2vuy h GLU 619 Cb 0.30 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.21 2vuy h GLU 619 CO -0.58 0.04 0.00 0.41 -1.40 0.00 0.00 179.01 177.48 2vuy n GLY 620 N 0.27 1.49 3.68 -3.84 0.00 0.12 -4.29 105.19 102.63 2vuy n GLY 620 Ca 0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.71 2vuy n GLY 620 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2vuy s ARG 621 N -0.06 2.70 0.18 1.61 1.70 -1.26 -4.80 118.95 119.02 2vuy s ARG 621 Ca 0.00 -0.69 -0.32 0.00 -0.47 0.00 0.00 55.73 54.25 2vuy s ARG 621 Cb 0.00 -2.62 -0.16 0.00 -0.57 0.00 0.00 34.95 31.60 2vuy s ARG 621 CO 0.00 0.59 1.04 -1.91 -1.08 0.00 0.00 175.30 173.95 2vuy n GLU 622 N 1.11 0.94 -1.73 3.89 2.13 -1.26 -2.47 120.64 123.25 2vuy n GLU 622 Ca -0.13 0.33 -0.42 0.00 0.66 0.00 0.00 57.16 57.60 2vuy n GLU 622 Cb 0.52 -1.74 -0.00 0.00 0.27 0.00 0.00 31.44 30.49 2vuy n GLU 622 CO 0.00 0.00 0.00 1.55 -0.41 0.00 0.00 177.13 178.27 2vuy n VAL 623 N 1.08 1.93 -4.03 6.31 3.14 0.14 -4.85 118.33 122.05 2vuy n VAL 623 Ca 0.15 -0.48 -0.19 0.00 -2.96 0.00 0.00 64.34 60.86 2vuy n VAL 623 Cb 0.25 -1.76 -0.02 0.00 -1.06 0.00 0.00 33.84 31.25 2vuy n VAL 623 CO 0.00 0.00 0.00 -0.90 -6.46 0.00 0.00 176.83 169.47 2vuy n ASP 624 N 0.73 2.45 -0.19 6.55 3.85 -1.26 -4.94 116.55 123.73 2vuy n ASP 624 Ca 0.04 -2.35 -0.12 0.00 -0.71 0.00 0.00 54.79 51.64 2vuy n ASP 624 Cb 0.37 0.07 -0.09 0.00 -1.35 0.00 0.00 41.12 40.12 2vuy n ASP 624 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.20 176.11 2vuy h GLU 625 N 0.00 -0.28 -0.06 0.11 4.57 -1.99 -1.36 114.58 115.57 2vuy h GLU 625 Ca -0.25 0.02 -0.08 0.00 -1.18 0.00 0.00 59.36 57.87 2vuy h GLU 625 Cb 0.85 0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.51 2vuy h GLU 625 CO 0.40 -0.19 -0.27 1.57 -1.18 0.00 0.00 179.01 179.35 2vuy h LYS 626 N -0.29 0.29 0.00 1.92 2.10 -1.99 -3.20 116.57 115.40 2vuy h LYS 626 Ca 0.09 -0.23 -0.00 0.00 -2.00 0.00 0.00 60.65 58.51 2vuy h LYS 626 Cb 0.52 0.05 -0.00 0.00 -0.90 0.00 0.00 32.23 31.90 2vuy h LYS 626 CO -0.64 0.87 -0.00 0.00 -2.00 0.00 0.00 179.45 177.68 2vuy h THR 627 N -0.22 0.08 0.00 0.07 1.03 -1.92 -1.09 112.91 110.85 2vuy h THR 627 Ca -0.02 -0.04 -0.17 0.00 -0.01 0.00 0.00 66.41 66.17 2vuy h THR 627 Cb 0.92 1.04 -0.02 0.00 -1.07 0.00 0.00 68.15 69.01 2vuy h THR 627 CO 0.06 0.00 -0.81 -0.25 -0.01 0.00 0.00 175.52 174.51 2vuy h TRP 628 N 0.00 0.00 -0.19 0.00 2.91 -1.24 -3.28 115.95 114.16 2vuy h TRP 628 Ca -0.00 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.02 2vuy h TRP 628 Cb 0.04 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 28.69 2vuy h TRP 628 CO 0.00 0.81 0.00 -1.13 -1.03 0.00 0.00 178.44 177.09 2vuy n SER 629 N -3.48 2.71 -4.85 2.65 3.41 -0.51 -0.54 113.62 113.02 2vuy n SER 629 Ca -0.00 -1.79 -0.37 0.00 -0.26 0.00 0.00 58.87 56.45 2vuy n SER 629 Cb 0.80 -0.12 -0.06 0.00 -0.26 0.00 0.00 64.21 64.58 2vuy n SER 629 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2vuy s SER 630 N -1.24 6.72 0.58 4.04 0.01 -0.64 -4.69 113.70 118.47 2vuy s SER 630 Ca 0.24 0.87 -0.18 0.00 1.31 0.00 0.00 55.95 58.19 2vuy s SER 630 Cb 0.15 -2.21 -0.08 0.00 0.21 0.00 0.00 66.02 64.09 2vuy s SER 630 CO 0.21 0.26 0.55 -2.65 0.41 0.00 0.00 173.24 172.03 2vuy n PRO 631 N 1.44 0.53 -3.57 12.44 -0.02 -1.26 -2.66 135.00 141.90 2vuy n PRO 631 Ca -0.12 0.21 -0.11 0.00 -2.02 0.00 0.00 63.50 61.46 2vuy n PRO 631 Cb 0.52 -1.74 -0.04 0.00 -0.02 0.00 0.00 33.50 32.23 2vuy n PRO 631 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 2vuy s THR 632 N -1.71 0.05 0.00 3.45 -1.32 -0.43 -4.78 115.64 110.89 2vuy s THR 632 Ca 0.69 -0.38 0.00 0.00 -1.21 0.00 0.00 61.69 60.79 2vuy s THR 632 Cb -0.44 -1.10 0.00 0.00 -1.51 0.00 0.00 72.50 69.45 2vuy s THR 632 CO 0.54 -0.21 0.86 0.00 -2.21 0.00 0.00 174.62 173.59 2vuy n GLN 633 N -0.22 2.13 -3.94 7.08 6.02 -1.26 -3.06 117.38 124.13 2vuy n GLN 633 Ca -0.17 -1.22 -0.18 0.00 -0.01 0.00 0.00 57.00 55.43 2vuy n GLN 633 Cb 0.64 -0.88 -0.16 0.00 1.02 0.00 0.00 30.24 30.86 2vuy n GLN 633 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 2vuy s LEU 634 N -0.72 1.10 -0.04 1.08 2.96 -1.26 0.25 118.68 122.06 2vuy s LEU 634 Ca 0.00 -0.04 0.04 0.00 -0.22 0.00 0.00 54.13 53.91 2vuy s LEU 634 Cb 0.00 -0.27 -0.00 0.00 0.50 0.00 0.00 46.19 46.41 2vuy s LEU 634 CO 0.00 -0.11 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.06 2vuy s VAL 635 N 1.13 1.40 -0.12 1.68 1.01 -0.42 -4.99 120.40 120.10 2vuy s VAL 635 Ca -0.08 -0.71 -0.04 0.00 0.00 0.00 0.00 61.98 61.15 2vuy s VAL 635 Cb -0.13 -1.20 0.06 0.00 0.00 0.00 0.00 36.38 35.10 2vuy s VAL 635 CO -0.02 0.40 0.19 -0.63 0.00 0.00 0.00 175.10 175.05 2vuy s ILE 636 N -0.04 -0.30 0.04 2.22 1.01 -1.26 -0.68 121.20 122.20 2vuy s ILE 636 Ca -0.02 0.24 -0.01 0.00 0.00 0.00 0.00 60.65 60.87 2vuy s ILE 636 Cb -0.11 -0.40 -0.04 0.00 0.01 0.00 0.00 42.46 41.93 2vuy s ILE 636 CO 0.02 0.07 -0.03 0.72 0.00 0.00 0.00 174.94 175.71 2vuy s PHE 637 N 2.32 0.47 -0.15 3.97 -0.12 -0.80 0.93 117.98 124.60 2vuy s PHE 637 Ca 0.03 -0.97 0.01 0.00 -0.05 0.00 0.00 56.93 55.95 2vuy s PHE 637 Cb -0.13 -0.35 0.02 0.00 -0.63 0.00 0.00 43.02 41.93 2vuy s PHE 637 CO -0.07 -0.34 -0.16 0.08 -0.05 0.00 0.00 175.22 174.67 2vuy s VAL 638 N -3.45 1.67 -0.28 -2.49 1.01 0.43 -0.72 120.40 116.57 2vuy s VAL 638 Ca 0.03 -0.70 -0.15 0.00 0.00 0.00 0.00 61.98 61.16 2vuy s VAL 638 Cb 0.05 -1.55 -0.04 0.00 0.00 0.00 0.00 36.38 34.84 2vuy s VAL 638 CO -0.08 0.48 0.35 -0.76 0.00 0.00 0.00 175.10 175.09 2vuy s LEU 639 N 1.38 4.09 -1.07 3.92 1.43 0.12 -1.80 118.68 126.74 2vuy s LEU 639 Ca 0.03 0.19 -0.16 0.00 -1.03 0.00 0.00 54.13 53.17 2vuy s LEU 639 Cb -0.13 -2.38 0.16 0.00 0.03 0.00 0.00 46.19 43.87 2vuy s LEU 639 CO -0.10 -0.19 1.27 -0.70 0.23 0.00 0.00 176.35 176.86 2vuy s GLU 640 N 2.04 3.87 0.53 1.70 2.56 -0.02 -1.63 118.70 127.74 2vuy s GLU 640 Ca 0.14 -2.26 0.21 0.00 0.00 0.00 0.00 54.97 53.06 2vuy s GLU 640 Cb -0.16 -4.96 1.16 0.00 2.00 0.00 0.00 34.13 32.17 2vuy s GLU 640 CO 0.10 -1.73 1.61 0.78 -0.56 0.00 0.00 175.26 175.46 2vuy h GLY 641 N 9.81 0.00 -1.06 -1.50 0.00 -1.63 -0.62 103.07 108.07 2vuy h GLY 641 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.57 2vuy h GLY 641 CO 1.16 0.00 -0.00 1.44 0.00 0.00 0.00 176.54 179.13 2vuy n SER 642 N -2.52 2.11 -2.23 0.19 7.64 -1.21 -1.06 113.62 116.53 2vuy n SER 642 Ca -0.01 -1.70 -0.12 0.00 1.01 0.00 0.00 58.87 58.04 2vuy n SER 642 Cb 0.39 0.00 0.04 0.00 -1.01 0.00 0.00 64.21 63.64 2vuy n SER 642 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 2vuy n VAL 643 N 0.65 1.95 -3.69 0.44 0.24 -0.24 -5.00 118.33 112.68 2vuy n VAL 643 Ca 0.17 -3.56 -0.38 0.00 -2.04 0.00 0.00 64.34 58.53 2vuy n VAL 643 Cb 0.45 -0.09 -0.06 0.00 -1.47 0.00 0.00 33.84 32.67 2vuy n VAL 643 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 2vuy s MET 644 N -3.52 3.68 -1.28 7.34 -1.94 -1.25 -4.50 119.30 117.83 2vuy s MET 644 Ca 0.41 0.15 -0.08 0.00 -1.71 0.00 0.00 55.69 54.46 2vuy s MET 644 Cb 0.37 -3.21 -0.04 0.00 2.01 0.00 0.00 34.83 33.97 2vuy s MET 644 CO -0.00 0.74 2.86 -3.47 -0.01 0.00 0.00 175.02 175.13 2vuy n ASP 645 N 1.90 8.03 -4.34 3.03 4.64 -1.26 -4.77 116.55 123.77 2vuy n ASP 645 Ca -0.17 -2.77 -0.35 0.00 -1.38 0.00 0.00 54.79 50.12 2vuy n ASP 645 Cb 0.54 -1.46 -0.14 0.00 -1.04 0.00 0.00 41.12 39.02 2vuy n ASP 645 CO 0.00 0.00 0.00 -1.61 -0.82 0.00 0.00 177.20 174.77 2vuy s GLU 646 N 0.80 3.43 -0.12 -0.67 0.41 -1.26 -4.82 118.70 116.46 2vuy s GLU 646 Ca 0.64 -0.61 0.03 0.00 -0.41 0.00 0.00 54.97 54.63 2vuy s GLU 646 Cb 0.21 -3.01 0.00 0.00 -1.78 0.00 0.00 34.13 29.56 2vuy s GLU 646 CO -0.07 -0.14 -0.23 0.42 -0.49 0.00 0.00 175.26 174.75 2vuy s ILE 647 N 1.33 2.07 0.77 -1.63 -1.09 -1.26 0.03 121.20 121.43 2vuy s ILE 647 Ca 0.04 -1.00 -0.11 0.00 -2.23 0.00 0.00 60.65 57.35 2vuy s ILE 647 Cb -0.14 -1.80 0.07 0.00 -1.58 0.00 0.00 42.46 39.00 2vuy s ILE 647 CO -0.02 0.56 1.13 0.54 -1.23 0.00 0.00 174.94 175.92 2vuy s ASN 648 N 0.54 4.72 0.00 3.58 2.20 -0.50 -4.89 114.94 120.59 2vuy s ASN 648 Ca -0.14 0.78 0.00 0.00 -0.94 0.00 0.00 52.86 52.56 2vuy s ASN 648 Cb -0.17 -1.35 0.00 0.00 -2.00 0.00 0.00 41.25 37.73 2vuy s ASN 648 CO 0.04 -1.75 0.68 1.15 -2.94 0.00 0.00 177.10 174.28 2vuy n MET 649 N -3.19 0.00 -0.26 3.55 0.00 -1.26 -0.82 117.12 115.14 2vuy n MET 649 Ca 0.08 0.21 0.09 0.00 0.00 0.00 0.00 57.70 58.08 2vuy n MET 649 Cb 0.60 -1.52 0.24 0.00 0.00 0.00 0.00 33.22 32.54 2vuy n MET 649 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 2vuy n TYR 650 N -1.18 0.69 -0.98 3.17 4.02 -1.26 -4.95 117.16 116.67 2vuy n TYR 650 Ca 0.00 -0.44 0.00 0.00 -0.01 0.00 0.00 57.90 57.45 2vuy n TYR 650 Cb 0.02 -0.01 0.00 0.00 -0.02 0.00 0.00 39.34 39.33 2vuy n TYR 650 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2vuy n GLY 651 N 1.21 0.77 3.81 2.72 0.00 0.00 -5.03 105.19 108.67 2vuy n GLY 651 Ca 0.19 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 2vuy n GLY 651 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2vuy s GLU 652 N -0.02 4.24 -0.07 1.61 2.02 -1.26 -4.85 118.70 120.37 2vuy s GLU 652 Ca 0.00 0.83 -0.24 0.00 0.02 0.00 0.00 54.97 55.58 2vuy s GLU 652 Cb 0.00 -2.98 -0.03 0.00 0.10 0.00 0.00 34.13 31.22 2vuy s GLU 652 CO 0.00 0.46 0.74 0.50 0.02 0.00 0.00 175.26 176.98 2vuy s ARG 653 N -1.76 4.44 0.09 1.61 3.52 -1.26 -1.41 118.95 124.18 2vuy s ARG 653 Ca 0.39 0.95 -0.15 0.00 -0.13 0.00 0.00 55.73 56.79 2vuy s ARG 653 Cb -0.18 -3.46 -0.06 0.00 -1.56 0.00 0.00 34.95 29.69 2vuy s ARG 653 CO 0.21 0.01 0.51 0.42 -0.81 0.00 0.00 175.30 175.64 2vuy s ILE 654 N 0.96 4.89 0.26 4.11 1.01 0.10 -4.97 121.20 127.57 2vuy s ILE 654 Ca 0.39 0.88 0.09 0.00 0.00 0.00 0.00 60.65 62.01 2vuy s ILE 654 Cb -0.18 -3.76 -0.05 0.00 0.01 0.00 0.00 42.46 38.48 2vuy s ILE 654 CO 0.19 0.39 -0.14 0.00 0.00 0.00 0.00 174.94 175.38 2vuy s ALA 655 N -1.29 2.44 0.30 9.38 0.00 -1.26 -4.62 121.76 126.71 2vuy s ALA 655 Ca 0.32 -1.83 -0.13 0.00 0.00 0.00 0.00 51.96 50.32 2vuy s ALA 655 Cb -0.16 -0.09 0.01 0.00 0.00 0.00 0.00 23.12 22.88 2vuy s ALA 655 CO 0.18 0.11 0.59 0.34 0.00 0.00 0.00 175.76 176.99 2vuy s ASP 656 N -3.44 0.09 1.04 0.00 3.68 -0.23 -4.84 116.67 112.98 2vuy s ASP 656 Ca 0.28 -1.02 -0.13 0.00 2.13 0.00 0.00 52.55 53.81 2vuy s ASP 656 Cb -0.01 0.69 0.21 0.00 -1.45 0.00 0.00 42.92 42.36 2vuy s ASP 656 CO 0.12 -1.34 1.08 -1.81 0.13 0.00 0.00 175.17 173.35 2vuy s ASP 657 N -3.05 2.23 -0.28 -0.34 -0.00 -1.26 -3.32 116.67 110.65 2vuy s ASP 657 Ca 0.20 1.24 -0.09 0.00 -0.00 0.00 0.00 52.55 53.90 2vuy s ASP 657 Cb -0.03 -1.93 -0.03 0.00 -0.00 0.00 0.00 42.92 40.93 2vuy s ASP 657 CO 0.11 -3.39 0.14 -0.44 -0.00 0.00 0.00 175.17 171.60 2vuy s SER 658 N -3.27 5.58 0.03 0.27 0.01 -1.26 -2.65 113.70 112.41 2vuy s SER 658 Ca 0.66 -0.25 0.03 0.00 1.31 0.00 0.00 55.95 57.71 2vuy s SER 658 Cb -0.20 -2.02 -0.04 0.00 0.21 0.00 0.00 66.02 63.97 2vuy s SER 658 CO 0.59 -0.10 -0.02 -0.36 0.41 0.00 0.00 173.24 173.76 2vuy s PHE 659 N 1.67 2.98 -0.25 2.43 0.40 -0.65 -1.49 117.98 123.07 2vuy s PHE 659 Ca 0.06 0.00 -0.00 0.00 -0.60 0.00 0.00 56.93 56.39 2vuy s PHE 659 Cb -0.16 -1.60 0.04 0.00 0.51 0.00 0.00 43.02 41.81 2vuy s PHE 659 CO 0.07 0.44 -0.09 -1.17 0.70 0.00 0.00 175.22 175.17 2vuy s LEU 660 N -1.77 3.20 -0.16 -0.37 2.96 0.62 -0.70 118.68 122.47 2vuy s LEU 660 Ca 0.21 -1.04 -0.05 0.00 -0.22 0.00 0.00 54.13 53.03 2vuy s LEU 660 Cb -0.11 -1.61 -0.04 0.00 0.50 0.00 0.00 46.19 44.93 2vuy s LEU 660 CO 0.12 -0.14 0.02 -0.63 -1.32 0.00 0.00 176.35 174.40 2vuy s ILE 661 N 1.25 4.45 -0.20 6.68 1.01 0.10 -0.45 121.20 134.04 2vuy s ILE 661 Ca -0.02 -0.16 0.00 0.00 0.00 0.00 0.00 60.65 60.47 2vuy s ILE 661 Cb -0.17 -2.97 0.05 0.00 0.01 0.00 0.00 42.46 39.38 2vuy s ILE 661 CO -0.05 0.50 -0.07 -0.63 0.00 0.00 0.00 174.94 174.68 2vuy s ILE 662 N 0.15 1.45 -0.36 2.92 1.01 -0.15 -1.90 121.20 124.32 2vuy s ILE 662 Ca 0.02 -0.96 -0.02 0.00 0.00 0.00 0.00 60.65 59.69 2vuy s ILE 662 Cb -0.13 -1.61 0.08 0.00 0.01 0.00 0.00 42.46 40.81 2vuy s ILE 662 CO 0.01 0.08 0.11 -0.76 0.00 0.00 0.00 174.94 174.38 2vuy s LEU 663 N 1.47 4.62 -0.48 2.97 1.43 0.14 -1.04 118.68 127.78 2vuy s LEU 663 Ca -0.02 -1.66 -0.10 0.00 -1.03 0.00 0.00 54.13 51.32 2vuy s LEU 663 Cb -0.17 -1.78 0.12 0.00 0.03 0.00 0.00 46.19 44.40 2vuy s LEU 663 CO -0.07 -0.41 0.37 0.21 0.23 0.00 0.00 176.35 176.68 2vuy s ASN 664 N 1.52 5.79 0.19 2.29 2.47 -0.43 -1.29 114.94 125.47 2vuy s ASN 664 Ca 0.02 -1.90 0.24 0.00 0.42 0.00 0.00 52.86 51.65 2vuy s ASN 664 Cb -0.21 -2.04 0.37 0.00 -1.45 0.00 0.00 41.25 37.92 2vuy s ASN 664 CO -0.03 -0.72 1.40 0.00 -3.72 0.00 0.00 177.10 174.03 2vuy h ALA 665 N 8.52 0.70 -2.19 1.71 0.00 -0.48 -0.92 119.26 126.60 2vuy h ALA 665 Ca -0.23 0.00 -0.60 0.00 0.00 0.00 0.00 54.91 54.09 2vuy h ALA 665 Cb 1.08 0.00 0.06 0.00 0.00 0.00 0.00 17.79 18.93 2vuy h ALA 665 CO 0.89 0.00 0.73 -1.71 0.00 0.00 0.00 179.25 179.16 2vuy n ASN 666 N -2.37 2.85 0.29 0.00 2.85 -0.90 -4.24 115.26 113.74 2vuy n ASN 666 Ca 0.03 1.09 0.17 0.00 -0.11 0.00 0.00 54.58 55.77 2vuy n ASN 666 Cb 0.47 -1.39 0.89 0.00 1.24 0.00 0.00 39.78 40.99 2vuy n ASN 666 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2vuy h PRO 667 N 5.58 0.00 -6.77 1.20 0.13 -1.91 -2.05 132.00 128.18 2vuy h PRO 667 Ca -0.45 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.22 2vuy h PRO 667 Cb 1.27 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.43 2vuy h PRO 667 CO 0.86 0.05 -0.05 -0.80 -0.23 0.00 0.00 178.00 177.82 2vuy s ASN 668 N -5.75 5.73 0.83 1.44 0.02 -1.26 -4.07 114.94 111.86 2vuy s ASN 668 Ca -0.03 0.29 -0.12 0.00 -1.02 0.00 0.00 52.86 51.99 2vuy s ASN 668 Cb 0.12 -1.46 0.09 0.00 0.02 0.00 0.00 41.25 40.02 2vuy s ASN 668 CO 0.52 -0.80 1.11 0.20 0.02 0.00 0.00 177.10 178.14 2vuy s ASN 669 N -4.26 4.26 -0.01 -1.22 0.02 -1.26 -2.92 114.94 109.55 2vuy s ASN 669 Ca 0.50 1.19 -0.19 0.00 -1.02 0.00 0.00 52.86 53.34 2vuy s ASN 669 Cb -0.10 -1.87 0.04 0.00 0.02 0.00 0.00 41.25 39.33 2vuy s ASN 669 CO 0.39 -2.10 0.41 0.68 0.02 0.00 0.00 177.10 176.50 2vuy s VAL 670 N -3.21 0.05 -0.46 1.60 -7.23 -0.47 -4.87 120.40 105.81 2vuy s VAL 670 Ca 0.62 -0.38 -0.03 0.00 -1.81 0.00 0.00 61.98 60.38 2vuy s VAL 670 Cb -0.14 -0.79 0.12 0.00 0.56 0.00 0.00 36.38 36.13 2vuy s VAL 670 CO 0.54 -0.21 0.26 -0.54 -0.31 0.00 0.00 175.10 174.84 2vuy s LYS 671 N -1.62 2.15 0.08 4.82 1.02 -1.26 -0.15 119.74 124.77 2vuy s LYS 671 Ca -0.11 -1.97 -0.20 0.00 0.02 0.00 0.00 55.97 53.71 2vuy s LYS 671 Cb -0.03 -3.63 -0.07 0.00 -0.52 0.00 0.00 37.83 33.58 2vuy s LYS 671 CO 0.04 -1.10 0.60 0.14 -0.92 0.00 0.00 175.35 174.10 2vuy s VAL 672 N 0.89 4.71 -0.45 3.17 -7.23 -1.03 -4.72 120.40 115.74 2vuy s VAL 672 Ca 0.10 1.28 -0.17 0.00 -1.81 0.00 0.00 61.98 61.38 2vuy s VAL 672 Cb -0.22 -3.93 0.04 0.00 0.56 0.00 0.00 36.38 32.83 2vuy s VAL 672 CO -0.04 0.54 0.44 -0.75 -0.31 0.00 0.00 175.10 174.98 2vuy s LYS 673 N -1.02 3.04 0.44 4.82 2.20 -0.54 -1.88 119.74 126.81 2vuy s LYS 673 Ca 0.30 -1.02 -0.24 0.00 -0.36 0.00 0.00 55.97 54.66 2vuy s LYS 673 Cb -0.20 -4.05 -0.10 0.00 -1.51 0.00 0.00 37.83 31.98 2vuy s LYS 673 CO 0.20 -0.97 1.04 1.19 -0.36 0.00 0.00 175.35 176.45 2vuy n PHE 674 N 5.52 1.28 -1.46 4.03 3.01 -0.83 -4.16 117.46 124.85 2vuy n PHE 674 Ca -0.09 0.53 -0.29 0.00 1.01 0.00 0.00 57.45 58.61 2vuy n PHE 674 Cb 0.46 -2.24 0.12 0.00 -0.01 0.00 0.00 39.48 37.81 2vuy n PHE 674 CO 0.00 0.00 0.00 -1.25 1.01 0.00 0.00 176.76 176.52 2vuy s PRO 675 N -2.13 1.49 0.33 -1.08 0.04 -1.26 -4.25 135.00 128.15 2vuy s PRO 675 Ca 0.64 0.53 -0.26 0.00 0.04 0.00 0.00 61.00 61.96 2vuy s PRO 675 Cb -0.53 -1.86 -0.14 0.00 0.04 0.00 0.00 34.50 32.01 2vuy s PRO 675 CO 0.56 -2.01 0.79 1.63 0.04 0.00 0.00 177.00 178.01 2vuy n LYS 676 N -3.68 0.89 0.00 4.56 5.02 -1.26 -4.42 118.16 119.28 2vuy n LYS 676 Ca 0.07 0.32 0.00 0.00 -2.02 0.00 0.00 58.31 56.67 2vuy n LYS 676 Cb 0.57 -1.63 0.00 0.00 -0.02 0.00 0.00 35.03 33.96 2vuy n LYS 676 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2vuy n GLY 677 N 1.51 0.60 3.22 0.72 0.00 -1.26 -4.98 105.19 105.00 2vuy n GLY 677 Ca 0.11 -2.32 -0.35 0.00 0.00 0.00 0.00 46.02 43.47 2vuy n GLY 677 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2vuy s LYS 678 N -0.97 2.82 -0.02 1.61 2.20 0.81 -3.47 119.74 122.72 2vuy s LYS 678 Ca 0.00 -1.00 -0.00 0.00 -0.36 0.00 0.00 55.97 54.61 2vuy s LYS 678 Cb 0.00 -3.09 -0.04 0.00 -1.51 0.00 0.00 37.83 33.20 2vuy s LYS 678 CO 0.00 -0.44 0.05 -1.58 -0.36 0.00 0.00 175.35 173.01 2vuy s TRP 679 N 1.35 3.22 -0.14 4.03 0.52 0.26 -0.82 118.94 127.35 2vuy s TRP 679 Ca -0.00 0.18 0.01 0.00 0.02 0.00 0.00 56.10 56.31 2vuy s TRP 679 Cb -0.17 -1.73 -0.00 0.00 -1.15 0.00 0.00 33.47 30.42 2vuy s TRP 679 CO -0.03 0.52 -0.18 -2.00 0.02 0.00 0.00 176.95 175.29 2vuy s GLU 680 N -1.53 3.17 0.37 4.98 2.12 -0.35 -1.07 118.70 126.39 2vuy s GLU 680 Ca 0.20 -0.79 -0.27 0.00 0.36 0.00 0.00 54.97 54.47 2vuy s GLU 680 Cb -0.12 -2.54 -0.09 0.00 0.26 0.00 0.00 34.13 31.64 2vuy s GLU 680 CO 0.11 0.06 1.30 -1.17 -0.54 0.00 0.00 175.26 175.01 2vuy s LEU 681 N 0.69 4.32 0.00 2.70 1.98 0.72 -0.73 118.68 128.36 2vuy s LEU 681 Ca -0.08 2.65 0.00 0.00 -2.89 0.00 0.00 54.13 53.81 2vuy s LEU 681 Cb -0.16 -3.78 0.00 0.00 0.66 0.00 0.00 46.19 42.91 2vuy s LEU 681 CO 0.02 -0.68 0.00 0.55 -1.89 0.00 0.00 176.35 174.35 2vuy n VAL 682 N 0.46 0.00 -3.75 1.68 3.14 -0.48 -4.88 118.33 114.51 2vuy n VAL 682 Ca 0.02 0.00 -0.13 0.00 -2.96 0.00 0.00 64.34 61.27 2vuy n VAL 682 Cb 0.43 -0.12 -0.10 0.00 -1.06 0.00 0.00 33.84 32.99 2vuy n VAL 682 CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 2vuy s ILE 683 N -0.97 0.01 0.16 1.55 1.01 -1.10 -4.99 121.20 116.87 2vuy s ILE 683 Ca 0.00 -0.12 -0.23 0.00 0.00 0.00 0.00 60.65 60.30 2vuy s ILE 683 Cb 0.00 -0.54 0.07 0.00 0.01 0.00 0.00 42.46 41.99 2vuy s ILE 683 CO 0.00 -0.06 0.65 -0.94 0.00 0.00 0.00 174.94 174.59 2vuy s SER 684 N -0.20 -0.49 0.00 3.58 1.04 -1.26 -0.87 113.70 115.50 2vuy s SER 684 Ca -0.03 -0.10 0.27 0.00 0.48 0.00 0.00 55.95 56.56 2vuy s SER 684 Cb -0.03 0.60 0.85 0.00 0.10 0.00 0.00 66.02 67.53 2vuy s SER 684 CO 0.02 -0.99 1.62 -1.54 0.98 0.00 0.00 173.24 173.33 2vuy n SER 685 N -0.38 1.20 -4.70 7.02 3.41 -0.85 -4.92 113.62 114.40 2vuy n SER 685 Ca -0.14 -1.11 -0.43 0.00 -0.26 0.00 0.00 58.87 56.93 2vuy n SER 685 Cb 0.64 0.09 -0.02 0.00 -0.26 0.00 0.00 64.21 64.66 2vuy n SER 685 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2vuy n TYR 686 N -0.35 2.43 -0.10 7.33 0.53 -1.26 -4.59 117.16 121.15 2vuy n TYR 686 Ca 0.14 0.42 -0.13 0.00 -1.02 0.00 0.00 57.90 57.31 2vuy n TYR 686 Cb 0.35 -2.49 -0.14 0.00 -1.03 0.00 0.00 39.34 36.03 2vuy n TYR 686 CO 0.00 0.00 0.00 1.28 -1.02 0.00 0.00 176.86 177.12 2vuy n LEU 687 N 1.67 1.31 -4.59 7.72 4.77 -1.26 -4.95 117.00 121.67 2vuy n LEU 687 Ca 0.08 -0.00 -0.29 0.00 -0.03 0.00 0.00 56.01 55.77 2vuy n LEU 687 Cb 0.35 -0.14 0.22 0.00 -2.33 0.00 0.00 43.42 41.52 2vuy n LEU 687 CO 0.63 0.67 0.60 0.00 -1.33 0.00 0.00 177.39 177.96 2vuy s ARG 688 N -2.51 -0.60 0.13 3.23 1.70 -1.26 -4.97 118.95 114.67 2vuy s ARG 688 Ca -0.19 0.33 -0.30 0.00 -0.47 0.00 0.00 55.73 55.10 2vuy s ARG 688 Cb 0.07 -1.63 -0.06 0.00 -0.57 0.00 0.00 34.95 32.75 2vuy s ARG 688 CO 0.74 -3.38 0.95 -2.00 -1.08 0.00 0.00 175.30 170.53 2vuy s GLU 689 N -5.04 4.72 0.19 3.89 2.12 -1.26 -5.00 118.70 118.32 2vuy s GLU 689 Ca 0.68 1.44 -0.30 0.00 0.36 0.00 0.00 54.97 57.15 2vuy s GLU 689 Cb -0.16 -3.36 -0.09 0.00 0.26 0.00 0.00 34.13 30.78 2vuy s GLU 689 CO 0.58 0.28 1.29 0.96 -0.54 0.00 0.00 175.26 177.83 2vuy s ILE 690 N -0.24 3.27 0.40 -3.70 -0.00 -1.26 -5.01 121.20 114.66 2vuy s ILE 690 Ca 0.45 1.05 -0.24 0.00 -0.00 0.00 0.00 60.65 61.91 2vuy s ILE 690 Cb -0.24 -3.67 -0.09 0.00 -0.00 0.00 0.00 42.46 38.46 2vuy s ILE 690 CO 0.30 0.16 1.01 -0.54 -0.00 0.00 0.00 174.94 175.87 2vuy s LYS 691 N -0.10 4.22 0.37 0.37 1.02 -1.26 -4.96 119.74 119.40 2vuy s LYS 691 Ca 0.56 1.41 0.16 0.00 0.02 0.00 0.00 55.97 58.12 2vuy s LYS 691 Cb -0.36 -2.50 1.04 0.00 -0.52 0.00 0.00 37.83 35.49 2vuy s LYS 691 CO 0.38 -0.07 1.74 -1.35 -0.92 0.00 0.00 175.35 175.13 2vuy h PRO 692 N 2.46 0.43 0.00 -1.68 0.11 -2.02 0.21 132.00 131.51 2vuy h PRO 692 Ca -0.48 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2vuy h PRO 692 Cb 1.21 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.22 2vuy h PRO 692 CO 0.62 0.28 0.00 -0.85 -0.21 0.00 0.00 178.00 177.85 2vuy n GLU 693 N -4.75 0.85 -0.03 1.05 0.00 -1.26 -3.04 120.64 113.46 2vuy n GLU 693 Ca 0.27 0.00 0.05 0.00 0.00 0.00 0.00 57.16 57.48 2vuy n GLU 693 Cb 0.87 -1.50 -0.15 0.00 0.00 0.00 0.00 31.44 30.65 2vuy n GLU 693 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 2vuy n GLU 694 N -1.00 0.71 0.03 3.44 1.02 0.73 -4.51 120.64 121.05 2vuy n GLU 694 Ca 0.21 -0.13 -0.02 0.00 -0.02 0.00 0.00 57.16 57.19 2vuy n GLU 694 Cb 0.10 -1.48 0.23 0.00 -0.02 0.00 0.00 31.44 30.27 2vuy n GLU 694 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2vuy h ARG 695 N 0.00 0.44 -3.41 3.49 3.08 -1.50 -3.41 114.38 113.07 2vuy h ARG 695 Ca -0.15 -0.15 -0.32 0.00 0.07 0.00 0.00 59.98 59.43 2vuy h ARG 695 Cb 1.28 -0.03 -0.36 0.00 0.08 0.00 0.00 29.97 30.94 2vuy h ARG 695 CO 0.01 0.64 -0.72 0.42 -1.07 0.00 0.00 179.97 179.24 2vuy s ILE 696 N -4.56 -0.08 -0.16 2.04 1.01 -1.26 -0.20 121.20 117.99 2vuy s ILE 696 Ca -0.07 0.30 0.01 0.00 0.00 0.00 0.00 60.65 60.89 2vuy s ILE 696 Cb 0.14 -0.12 0.00 0.00 0.01 0.00 0.00 42.46 42.49 2vuy s ILE 696 CO 0.78 0.12 -0.16 -0.63 0.00 0.00 0.00 174.94 175.05 2vuy s ILE 697 N 1.52 2.54 0.29 2.92 -1.09 -0.23 -4.90 121.20 122.24 2vuy s ILE 697 Ca -0.04 -0.81 0.07 0.00 -2.23 0.00 0.00 60.65 57.65 2vuy s ILE 697 Cb -0.13 -2.07 -0.06 0.00 -1.58 0.00 0.00 42.46 38.63 2vuy s ILE 697 CO -0.03 0.52 -0.07 -0.70 -1.23 0.00 0.00 174.94 173.43 2vuy s GLU 698 N 0.89 1.61 -1.25 2.79 2.12 -1.26 -0.58 118.70 123.02 2vuy s GLU 698 Ca -0.04 -1.82 -0.22 0.00 0.36 0.00 0.00 54.97 53.25 2vuy s GLU 698 Cb -0.15 -1.28 0.02 0.00 0.26 0.00 0.00 34.13 32.97 2vuy s GLU 698 CO -0.02 0.07 0.62 0.41 -0.54 0.00 0.00 175.26 175.80 2vuy n GLY 699 N -0.63 -0.74 3.15 -1.50 0.00 -1.23 -2.88 105.19 101.37 2vuy n GLY 699 Ca -0.05 0.34 -0.14 0.00 0.00 0.00 0.00 46.02 46.17 2vuy n GLY 699 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2vuy n GLU 700 N -4.63 -0.96 -1.96 1.61 0.28 -1.26 -4.91 120.64 108.82 2vuy n GLU 700 Ca -0.15 0.04 -0.29 0.00 -0.16 0.00 0.00 57.16 56.60 2vuy n GLU 700 Cb 0.60 -1.57 0.16 0.00 1.43 0.00 0.00 31.44 32.06 2vuy n GLU 700 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 2vuy s LYS 701 N -4.57 0.94 0.00 3.44 1.02 -1.14 -4.48 119.74 114.94 2vuy s LYS 701 Ca 0.07 -0.35 -0.01 0.00 0.02 0.00 0.00 55.97 55.70 2vuy s LYS 701 Cb -0.04 -1.89 -0.04 0.00 -0.52 0.00 0.00 37.83 35.34 2vuy s LYS 701 CO 0.42 -2.22 0.11 -1.21 -0.92 0.00 0.00 175.35 171.53 2vuy s GLU 702 N -5.80 3.15 -0.03 1.68 2.02 -1.26 -1.96 118.70 116.50 2vuy s GLU 702 Ca 0.71 -0.46 0.03 0.00 0.02 0.00 0.00 54.97 55.28 2vuy s GLU 702 Cb -0.05 -2.91 -0.00 0.00 0.10 0.00 0.00 34.13 31.27 2vuy s GLU 702 CO 0.52 0.65 -0.12 -1.17 0.02 0.00 0.00 175.26 175.15 2vuy s LEU 703 N -1.83 1.86 0.08 1.80 2.96 -0.79 -4.98 118.68 117.78 2vuy s LEU 703 Ca 0.24 -0.25 -0.26 0.00 -0.22 0.00 0.00 54.13 53.65 2vuy s LEU 703 Cb -0.12 -0.71 -0.06 0.00 0.50 0.00 0.00 46.19 45.80 2vuy s LEU 703 CO 0.16 0.11 0.79 -0.70 -1.32 0.00 0.00 176.35 175.39 2vuy s GLU 704 N 0.07 4.54 -0.19 1.98 2.12 -1.26 -2.45 118.70 123.50 2vuy s GLU 704 Ca -0.02 1.14 0.01 0.00 0.36 0.00 0.00 54.97 56.45 2vuy s GLU 704 Cb -0.09 -3.34 0.04 0.00 0.26 0.00 0.00 34.13 31.00 2vuy s GLU 704 CO 0.01 0.34 -0.08 0.42 -0.54 0.00 0.00 175.26 175.40 2vuy s ILE 705 N -0.29 1.50 0.72 -3.70 1.01 0.79 -4.96 121.20 116.27 2vuy s ILE 705 Ca 0.39 -0.94 -0.16 0.00 0.00 0.00 0.00 60.65 59.94 2vuy s ILE 705 Cb -0.21 -1.62 0.00 0.00 0.01 0.00 0.00 42.46 40.64 2vuy s ILE 705 CO 0.25 0.13 0.95 -0.62 0.00 0.00 0.00 174.94 175.64 2vuy n GLU 706 N 4.73 0.50 -1.62 2.79 1.02 -1.26 -1.37 120.64 125.43 2vuy n GLU 706 Ca -0.14 0.23 -0.36 0.00 -0.02 0.00 0.00 57.16 56.87 2vuy n GLU 706 Cb 0.47 -2.20 0.08 0.00 -0.02 0.00 0.00 31.44 29.76 2vuy n GLU 706 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2vuy s GLY 707 N -1.62 2.66 -0.83 0.62 0.00 -1.15 -3.76 107.32 103.23 2vuy s GLY 707 Ca 0.73 1.08 -0.03 0.00 0.00 0.00 0.00 44.72 46.50 2vuy s GLY 707 CO 0.51 1.50 0.71 0.54 0.00 0.00 0.00 173.10 176.36 2vuy n ARG 708 N -2.22 -1.45 -3.81 2.90 1.74 -0.58 -4.93 116.66 108.31 2vuy n ARG 708 Ca 0.15 1.18 -0.13 0.00 -0.77 0.00 0.00 57.85 58.28 2vuy n ARG 708 Cb 0.49 -4.93 -0.13 0.00 -1.02 0.00 0.00 32.46 26.87 2vuy n ARG 708 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 2vuy s THR 709 N -3.09 -0.01 -0.08 0.55 2.01 -0.46 -4.88 115.64 109.68 2vuy s THR 709 Ca 0.10 0.04 0.04 0.00 0.31 0.00 0.00 61.69 62.18 2vuy s THR 709 Cb -0.02 -0.21 -0.01 0.00 0.01 0.00 0.00 72.50 72.27 2vuy s THR 709 CO 0.79 0.02 -0.22 0.00 -0.69 0.00 0.00 174.62 174.51 2vuy s ALA 710 N 0.31 2.27 0.01 7.40 0.00 -1.26 -1.32 121.76 129.16 2vuy s ALA 710 Ca -0.02 -0.99 0.01 0.00 0.00 0.00 0.00 51.96 50.96 2vuy s ALA 710 Cb -0.03 -0.83 -0.01 0.00 0.00 0.00 0.00 23.12 22.26 2vuy s ALA 710 CO -0.01 0.35 -0.04 -0.51 0.00 0.00 0.00 175.76 175.55 2vuy s LEU 711 N 0.08 2.06 -0.18 0.00 1.02 -0.21 -2.00 118.68 119.45 2vuy s LEU 711 Ca -0.10 -0.16 0.01 0.00 0.02 0.00 0.00 54.13 53.90 2vuy s LEU 711 Cb -0.16 -0.15 0.03 0.00 0.02 0.00 0.00 46.19 45.94 2vuy s LEU 711 CO 0.06 -0.02 -0.13 -0.69 0.02 0.00 0.00 176.35 175.58 2vuy s VAL 712 N -0.37 1.71 0.13 -1.59 1.01 -0.05 -0.98 120.40 120.26 2vuy s VAL 712 Ca -0.02 -0.88 0.06 0.00 0.00 0.00 0.00 61.98 61.15 2vuy s VAL 712 Cb -0.03 -1.67 -0.04 0.00 0.00 0.00 0.00 36.38 34.64 2vuy s VAL 712 CO -0.00 0.34 -0.00 -0.31 0.00 0.00 0.00 175.10 175.12 2vuy s TYR 713 N 1.40 2.92 -0.13 5.22 1.51 0.41 -1.38 117.35 127.29 2vuy s TYR 713 Ca 0.02 -0.08 0.02 0.00 -1.01 0.00 0.00 57.07 56.02 2vuy s TYR 713 Cb -0.14 -1.47 0.01 0.00 -0.11 0.00 0.00 41.96 40.25 2vuy s TYR 713 CO -0.10 0.49 -0.20 0.50 -1.11 0.00 0.00 175.55 175.14 2vuy s ARG 714 N -2.59 2.76 0.05 -0.62 3.52 0.09 -0.27 118.95 121.89 2vuy s ARG 714 Ca 0.26 -0.76 -0.31 0.00 -0.13 0.00 0.00 55.73 54.80 2vuy s ARG 714 Cb -0.11 -2.28 -0.07 0.00 -1.56 0.00 0.00 34.95 30.94 2vuy s ARG 714 CO 0.18 -0.05 1.41 0.50 -0.81 0.00 0.00 175.30 176.52 2vuy s ARG 715 N 0.93 4.30 0.00 5.12 3.52 -0.55 -1.21 118.95 131.06 2vuy s ARG 715 Ca -0.05 2.03 0.05 0.00 -0.13 0.00 0.00 55.73 57.62 2vuy s ARG 715 Cb -0.15 -3.44 0.05 0.00 -1.56 0.00 0.00 34.95 29.86 2vuy s ARG 715 CO -0.03 -0.52 0.74 0.44 -0.81 0.00 0.00 175.30 175.12 2vuy n ILE 716 N 4.35 0.19 -3.64 4.11 -5.35 0.00 -4.69 119.36 114.34 2vuy n ILE 716 Ca 0.12 -0.60 -0.07 0.00 -0.27 0.00 0.00 62.75 61.94 2vuy n ILE 716 Cb 0.43 0.98 -0.07 0.00 -1.74 0.00 0.00 39.64 39.24 2vuy n ILE 716 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 2vuy s GLU 717 N -0.51 0.35 0.00 6.28 2.12 -1.20 -4.97 118.70 120.77 2vuy s GLU 717 Ca 0.06 0.41 0.00 0.00 0.36 0.00 0.00 54.97 55.80 2vuy s GLU 717 Cb 0.04 0.17 0.00 0.00 0.26 0.00 0.00 34.13 34.60 2vuy s GLU 717 CO 0.06 -0.04 0.00 -0.11 -0.54 0.00 0.00 175.26 174.63