#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vuy n ASP 9 N 0.00 -4.02 -3.71 6.15 8.00 -1.26 -4.86 116.55 116.85 2vuy n ASP 9 Ca 0.00 0.35 -0.13 0.00 0.71 0.00 0.00 54.79 55.73 2vuy n ASP 9 Cb 0.00 -3.66 -0.07 0.00 -0.02 0.00 0.00 41.12 37.37 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 -3.43 0.85 0.16 -1.24 1.04 -1.26 -5.15 118.95 109.92 2vuy s ARG 10 Ca 0.00 -0.37 -0.31 0.00 -1.04 0.00 0.00 55.73 54.01 2vuy s ARG 10 Cb 0.00 0.38 -0.09 0.00 -2.04 0.00 0.00 34.95 33.19 2vuy s ARG 10 CO 0.00 -0.28 1.48 -2.14 -0.04 0.00 0.00 175.30 174.33 2vuy s PRO 11 N -2.30 4.26 0.26 3.89 0.02 -1.26 -5.02 135.00 134.86 2vuy s PRO 11 Ca -0.07 2.24 -0.07 0.00 0.02 0.00 0.00 61.00 63.13 2vuy s PRO 11 Cb -0.01 -3.18 -0.01 0.00 0.02 0.00 0.00 34.50 31.31 2vuy s PRO 11 CO -0.01 -0.52 0.39 -0.51 -0.33 0.00 0.00 177.00 176.02 2vuy s LEU 12 N 0.92 0.73 0.02 -5.54 1.43 -1.26 -4.41 118.68 110.57 2vuy s LEU 12 Ca 0.66 -1.21 -0.00 0.00 -1.03 0.00 0.00 54.13 52.56 2vuy s LEU 12 Cb -0.41 1.34 -0.02 0.00 0.03 0.00 0.00 46.19 47.13 2vuy s LEU 12 CO 0.32 -1.11 -0.03 -0.13 0.23 0.00 0.00 176.35 175.63 2vuy s ARG 13 N -3.77 0.31 0.41 1.70 0.52 -0.21 -4.98 118.95 112.93 2vuy s ARG 13 Ca 0.29 -0.60 0.14 0.00 -0.52 0.00 0.00 55.73 55.04 2vuy s ARG 13 Cb 0.01 0.11 1.00 0.00 0.52 0.00 0.00 34.95 36.59 2vuy s ARG 13 CO 0.13 -0.05 1.92 -1.00 0.02 0.00 0.00 175.30 176.32 2vuy h PRO 14 N 4.68 0.46 -1.94 3.54 0.13 -1.90 0.30 132.00 137.27 2vuy h PRO 14 Ca -0.32 -0.03 0.22 0.00 -0.87 0.00 0.00 66.00 65.01 2vuy h PRO 14 Cb 1.21 -0.10 -0.07 0.00 0.13 0.00 0.00 31.00 32.16 2vuy h PRO 14 CO 0.41 0.30 -0.43 0.41 -0.23 0.00 0.00 178.00 178.47 2vuy n GLY 15 N -1.50 -2.03 3.72 1.56 0.00 -1.26 -3.53 105.19 102.15 2vuy n GLY 15 Ca 0.14 -1.29 -0.31 0.00 0.00 0.00 0.00 46.02 44.57 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 -5.72 5.23 0.43 1.61 1.01 -1.26 -4.85 116.67 113.12 2vuy s ASP 16 Ca 0.00 -0.09 0.28 0.00 0.71 0.00 0.00 52.55 53.45 2vuy s ASP 16 Cb 0.00 -1.32 0.96 0.00 1.01 0.00 0.00 42.92 43.57 2vuy s ASP 16 CO 0.00 0.19 1.81 1.55 0.21 0.00 0.00 175.17 178.94 2vuy h PRO 17 N 3.53 0.00 -6.36 8.23 0.13 -1.92 -3.44 132.00 132.17 2vuy h PRO 17 Ca -0.48 0.00 -0.64 0.00 -0.87 0.00 0.00 66.00 64.02 2vuy h PRO 17 Cb 1.17 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 32.02 2vuy h PRO 17 CO 0.62 0.00 -0.86 0.71 -0.23 0.00 0.00 178.00 178.23 2vuy s TYR 18 N -3.42 2.06 0.62 1.56 2.02 -1.26 -4.07 117.35 114.85 2vuy s TYR 18 Ca 0.04 -0.39 -0.08 0.00 -0.37 0.00 0.00 57.07 56.27 2vuy s TYR 18 Cb 0.08 -1.26 -0.00 0.00 -0.40 0.00 0.00 41.96 40.38 2vuy s TYR 18 CO 0.56 0.06 0.98 -1.25 -1.57 0.00 0.00 175.55 174.33 2vuy s PRO 19 N -1.00 3.06 0.47 -1.71 0.04 -1.26 -5.12 135.00 129.48 2vuy s PRO 19 Ca 0.09 0.28 -0.23 0.00 0.04 0.00 0.00 61.00 61.19 2vuy s PRO 19 Cb -0.09 -2.17 -0.07 0.00 0.04 0.00 0.00 34.50 32.21 2vuy s PRO 19 CO 0.01 -0.75 1.21 -0.51 0.04 0.00 0.00 177.00 177.00 2vuy s LEU 20 N -5.12 3.99 0.00 -3.56 1.43 -1.26 -4.62 118.68 109.54 2vuy s LEU 20 Ca 0.55 2.42 0.00 0.00 -1.03 0.00 0.00 54.13 56.06 2vuy s LEU 20 Cb -0.11 -4.23 0.00 0.00 0.03 0.00 0.00 46.19 41.88 2vuy s LEU 20 CO 0.49 -1.05 0.00 0.61 0.23 0.00 0.00 176.35 176.63 2vuy n GLY 21 N 0.52 -1.74 3.85 -3.19 0.00 0.25 -4.90 105.19 99.98 2vuy n GLY 21 Ca 0.08 -2.02 -0.37 0.00 0.00 0.00 0.00 46.02 43.71 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 6.31 -0.06 1.61 1.04 -1.26 -1.36 113.70 115.99 2vuy s SER 22 Ca 0.00 0.43 -0.01 0.00 0.48 0.00 0.00 55.95 56.84 2vuy s SER 22 Cb 0.00 -2.04 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 0.00 173.24 174.81 2vuy s ASN 23 N -0.86 1.25 -0.20 7.02 -0.87 0.25 -4.83 114.94 116.70 2vuy s ASN 23 Ca 0.14 -0.04 -0.29 0.00 -1.57 0.00 0.00 52.86 51.10 2vuy s ASN 23 Cb -0.12 -0.33 -0.02 0.00 -0.02 0.00 0.00 41.25 40.75 2vuy s ASN 23 CO 0.03 -0.18 1.54 0.86 -2.57 0.00 0.00 177.10 176.78 2vuy s TRP 24 N 1.80 2.25 -0.95 2.20 -0.00 -1.26 -1.12 118.94 121.86 2vuy s TRP 24 Ca 0.02 0.59 -0.03 0.00 -0.00 0.00 0.00 56.10 56.68 2vuy s TRP 24 Cb -0.13 -3.91 0.25 0.00 -0.00 0.00 0.00 33.47 29.68 2vuy s TRP 24 CO -0.04 -2.75 0.93 -0.89 -0.00 0.00 0.00 176.95 174.20 2vuy n ILE 25 N 6.14 3.58 -0.31 5.86 5.41 -0.46 -4.95 119.36 134.63 2vuy n ILE 25 Ca 0.17 -5.27 0.06 0.00 1.00 0.00 0.00 62.75 58.71 2vuy n ILE 25 Cb 0.45 -2.38 0.13 0.00 -0.71 0.00 0.00 39.64 37.13 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 2.19 -0.08 0.07 0.38 2.13 -1.26 -0.13 120.64 123.94 2vuy n GLU 26 Ca 0.23 1.33 0.07 0.00 0.66 0.00 0.00 57.16 59.46 2vuy n GLU 26 Cb 0.37 -2.00 0.34 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 -5.38 0.29 -0.15 4.31 10.43 -1.26 -2.22 116.55 122.58 2vuy n ASP 27 Ca 0.14 0.60 0.02 0.00 2.57 0.00 0.00 54.79 58.12 2vuy n ASP 27 Cb 0.45 -0.65 0.03 0.00 1.84 0.00 0.00 41.12 42.79 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 -1.85 1.67 -3.67 -2.24 10.43 0.81 -5.03 116.55 116.67 2vuy n ASP 28 Ca 0.01 -1.48 -0.28 0.00 2.57 0.00 0.00 54.79 55.61 2vuy n ASP 28 Cb 0.11 -0.03 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 0.02 -5.44 -3.98 -2.24 2.03 -0.94 -4.80 116.55 101.21 2vuy n ASP 29 Ca 0.02 -0.92 0.05 0.00 0.52 0.00 0.00 54.79 54.46 2vuy n ASP 29 Cb 0.17 -3.13 0.01 0.00 -0.72 0.00 0.00 41.12 37.45 2vuy n ASP 29 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 2vuy s GLY 30 N -3.33 -0.23 0.01 0.27 0.00 -1.25 -0.10 107.32 102.69 2vuy s GLY 30 Ca 0.34 0.21 0.08 0.00 0.00 0.00 0.00 44.72 45.35 2vuy s GLY 30 CO 0.87 6.39 -0.25 0.14 0.00 0.00 0.00 173.10 180.25 2vuy s VAL 31 N -2.01 1.99 -0.21 1.40 1.01 -0.83 -1.36 120.40 120.39 2vuy s VAL 31 Ca 0.31 -1.18 -0.08 0.00 0.00 0.00 0.00 61.98 61.03 2vuy s VAL 31 Cb 0.01 -1.68 -0.04 0.00 0.00 0.00 0.00 36.38 34.67 2vuy s VAL 31 CO -0.03 0.46 0.09 0.21 0.00 0.00 0.00 175.10 175.83 2vuy s ASN 32 N -0.85 5.62 -0.17 3.32 3.84 -0.27 -1.12 114.94 125.30 2vuy s ASN 32 Ca 0.10 0.01 -0.03 0.00 0.21 0.00 0.00 52.86 53.16 2vuy s ASN 32 Cb -0.10 -1.99 -0.02 0.00 -0.55 0.00 0.00 41.25 38.60 2vuy s ASN 32 CO 0.00 0.10 -0.06 -0.36 -2.79 0.00 0.00 177.10 173.99 2vuy s PHE 33 N 0.84 2.95 -0.02 0.43 0.40 0.45 -0.58 117.98 122.45 2vuy s PHE 33 Ca 0.05 -0.60 0.01 0.00 -0.60 0.00 0.00 56.93 55.79 2vuy s PHE 33 Cb -0.13 -1.99 0.01 0.00 0.51 0.00 0.00 43.02 41.42 2vuy s PHE 33 CO 0.02 -0.26 -0.04 0.45 0.70 0.00 0.00 175.22 176.10 2vuy s SER 34 N 0.78 0.65 -0.17 1.36 0.15 -0.47 -1.43 113.70 114.57 2vuy s SER 34 Ca -0.02 -0.09 -0.09 0.00 0.70 0.00 0.00 55.95 56.45 2vuy s SER 34 Cb -0.15 -0.22 0.06 0.00 -1.71 0.00 0.00 66.02 64.01 2vuy s SER 34 CO 0.02 -0.01 0.41 -0.22 1.20 0.00 0.00 173.24 174.64 2vuy s LEU 35 N 0.45 -0.11 -0.06 3.45 2.96 -0.28 -0.58 118.68 124.51 2vuy s LEU 35 Ca -0.05 0.90 -0.21 0.00 -0.22 0.00 0.00 54.13 54.55 2vuy s LEU 35 Cb -0.09 1.36 -0.04 0.00 0.50 0.00 0.00 46.19 47.92 2vuy s LEU 35 CO -0.00 -0.19 0.62 0.12 -1.32 0.00 0.00 176.35 175.57 2vuy s PHE 36 N 1.42 3.59 -0.30 5.38 5.36 -1.26 -0.78 117.98 131.39 2vuy s PHE 36 Ca -0.09 1.15 -0.09 0.00 -0.96 0.00 0.00 56.93 56.94 2vuy s PHE 36 Cb -0.08 -2.70 0.18 0.00 -0.34 0.00 0.00 43.02 40.08 2vuy s PHE 36 CO -0.13 0.18 0.88 0.45 -1.46 0.00 0.00 175.22 175.14 2vuy s SER 37 N 0.50 -0.81 0.00 6.13 0.15 -0.86 -4.80 113.70 114.02 2vuy s SER 37 Ca 0.33 0.55 0.29 0.00 0.70 0.00 0.00 55.95 57.82 2vuy s SER 37 Cb -0.17 1.69 1.17 0.00 -1.71 0.00 0.00 66.02 67.00 2vuy s SER 37 CO 0.16 -0.15 1.81 -1.84 1.20 0.00 0.00 173.24 174.42 2vuy n GLU 38 N 5.42 1.23 -0.00 5.44 0.28 -1.26 -3.81 120.64 127.95 2vuy n GLU 38 Ca -0.05 -0.59 0.00 0.00 -0.16 0.00 0.00 57.16 56.36 2vuy n GLU 38 Cb 0.53 -1.49 -0.00 0.00 1.43 0.00 0.00 31.44 31.91 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 -0.37 3.70 -4.76 -1.84 3.02 -1.26 -5.03 115.26 108.72 2vuy n ASN 39 Ca 0.18 -0.13 -0.39 0.00 -0.03 0.00 0.00 54.58 54.21 2vuy n ASN 39 Cb 0.30 1.01 0.03 0.00 -0.61 0.00 0.00 39.78 40.51 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 -1.76 3.05 -0.14 5.41 0.00 -1.25 -4.74 121.76 122.33 2vuy s ALA 40 Ca -0.00 1.43 0.18 0.00 0.00 0.00 0.00 51.96 53.57 2vuy s ALA 40 Cb 0.00 -3.59 -0.25 0.00 0.00 0.00 0.00 23.12 19.28 2vuy s ALA 40 CO 0.01 -1.31 0.33 0.39 0.00 0.00 0.00 175.76 175.17 2vuy n GLU 41 N -0.60 0.67 -3.57 0.00 1.02 0.59 -4.99 120.64 113.76 2vuy n GLU 41 Ca 0.08 -0.00 -0.16 0.00 -0.02 0.00 0.00 57.16 57.06 2vuy n GLU 41 Cb 0.43 -1.58 -0.06 0.00 -0.02 0.00 0.00 31.44 30.21 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 -2.82 1.00 0.01 3.49 2.20 -1.17 -5.02 119.74 117.43 2vuy s LYS 42 Ca -0.08 0.02 0.02 0.00 -0.36 0.00 0.00 55.97 55.57 2vuy s LYS 42 Cb 0.08 0.47 -0.01 0.00 -1.51 0.00 0.00 37.83 36.86 2vuy s LYS 42 CO 0.85 -0.33 -0.06 0.08 -0.36 0.00 0.00 175.35 175.52 2vuy s VAL 43 N -1.68 0.50 -0.07 4.02 1.01 -1.26 -0.91 120.40 122.02 2vuy s VAL 43 Ca -0.09 -0.44 0.02 0.00 0.00 0.00 0.00 61.98 61.47 2vuy s VAL 43 Cb -0.01 -0.45 0.01 0.00 0.00 0.00 0.00 36.38 35.93 2vuy s VAL 43 CO 0.05 0.02 -0.12 -1.61 0.00 0.00 0.00 175.10 173.45 2vuy s GLU 44 N -0.46 1.66 -0.01 2.72 2.02 -0.51 -1.42 118.70 122.70 2vuy s GLU 44 Ca -0.00 -0.39 -0.19 0.00 0.02 0.00 0.00 54.97 54.41 2vuy s GLU 44 Cb -0.04 -1.40 -0.05 0.00 0.10 0.00 0.00 34.13 32.73 2vuy s GLU 44 CO -0.00 -0.00 0.53 -1.17 0.02 0.00 0.00 175.26 174.64 2vuy s LEU 45 N 0.77 4.42 -0.11 1.80 2.96 0.24 -1.50 118.68 127.25 2vuy s LEU 45 Ca -0.13 1.07 0.03 0.00 -0.22 0.00 0.00 54.13 54.88 2vuy s LEU 45 Cb -0.15 -2.81 -0.00 0.00 0.50 0.00 0.00 46.19 43.73 2vuy s LEU 45 CO 0.02 0.15 -0.21 -0.76 -1.32 0.00 0.00 176.35 174.24 2vuy s LEU 46 N -0.35 2.27 -0.13 -0.68 1.43 0.12 -1.27 118.68 120.07 2vuy s LEU 46 Ca 0.28 -0.50 -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 0.15 0.15 -0.10 -0.76 0.23 0.00 0.00 176.35 176.02 2vuy s LEU 47 N 0.42 2.88 0.49 1.79 1.43 -1.00 -1.25 118.68 123.44 2vuy s LEU 47 Ca -0.15 -0.25 0.04 0.00 -1.03 0.00 0.00 54.13 52.74 2vuy s LEU 47 Cb -0.17 -1.65 -0.02 0.00 0.03 0.00 0.00 46.19 44.38 2vuy s LEU 47 CO 0.07 0.19 0.11 -0.31 0.23 0.00 0.00 176.35 176.64 2vuy s TYR 48 N 0.19 1.99 0.27 0.29 1.51 -0.39 -0.56 117.35 120.65 2vuy s TYR 48 Ca -0.06 -0.85 0.09 0.00 -1.01 0.00 0.00 57.07 55.24 2vuy s TYR 48 Cb -0.15 -1.74 -0.05 0.00 -0.11 0.00 0.00 41.96 39.90 2vuy s TYR 48 CO 0.04 0.10 -0.12 -1.54 -1.11 0.00 0.00 175.55 172.92 2vuy s SER 49 N -3.95 3.05 0.11 2.29 1.04 -1.15 -4.28 113.70 110.81 2vuy s SER 49 Ca 0.20 -1.11 -0.31 0.00 0.48 0.00 0.00 55.95 55.21 2vuy s SER 49 Cb 0.02 -0.22 -0.10 0.00 0.10 0.00 0.00 66.02 65.83 2vuy s SER 49 CO 0.11 -0.18 1.59 -0.07 0.98 0.00 0.00 173.24 175.67 2vuy h LEU 50 N 2.32 -1.26 -0.65 2.42 -0.00 -1.98 -3.01 115.31 113.15 2vuy h LEU 50 Ca -0.40 0.14 0.09 0.00 -0.00 0.00 0.00 57.88 57.72 2vuy h LEU 50 Cb 1.24 0.48 -0.07 0.00 -0.00 0.00 0.00 40.66 42.31 2vuy h LEU 50 CO 0.65 -0.48 0.29 0.71 -0.00 0.00 0.00 178.44 179.60 2vuy h THR 51 N -0.64 0.81 -3.86 0.22 1.35 -2.04 -3.39 112.91 105.38 2vuy h THR 51 Ca 0.03 -0.17 -0.67 0.00 -0.55 0.00 0.00 66.41 65.04 2vuy h THR 51 Cb 0.68 0.27 -0.37 0.00 -1.73 0.00 0.00 68.15 67.00 2vuy h THR 51 CO -0.26 0.09 -0.79 0.21 -0.25 0.00 0.00 175.52 174.52 2vuy s ASN 52 N -5.44 4.49 -0.07 5.36 2.47 -1.14 -4.94 114.94 115.67 2vuy s ASN 52 Ca -0.13 -1.38 0.10 0.00 0.42 0.00 0.00 52.86 51.87 2vuy s ASN 52 Cb 0.17 -1.57 0.22 0.00 -1.45 0.00 0.00 41.25 38.63 2vuy s ASN 52 CO 0.75 -0.20 1.15 0.00 -3.72 0.00 0.00 177.10 175.09 2vuy n GLN 53 N 4.45 2.43 -0.10 0.43 6.02 -1.26 -2.94 117.38 126.42 2vuy n GLN 53 Ca -0.14 -2.13 -0.19 0.00 -0.01 0.00 0.00 57.00 54.53 2vuy n GLN 53 Cb 0.42 -1.33 -0.09 0.00 1.02 0.00 0.00 30.24 30.26 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 -0.63 0.55 -4.59 -1.09 4.01 -1.26 -4.66 118.16 110.49 2vuy n LYS 54 Ca 0.10 0.52 -0.31 0.00 -0.51 0.00 0.00 58.31 58.12 2vuy n LYS 54 Cb 0.50 -1.70 -0.12 0.00 -0.51 0.00 0.00 35.03 33.19 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 0.54 2.13 4.12 -1.26 -3.75 117.35 119.34 2vuy s TYR 55 Ca -0.28 -0.24 -0.21 0.00 0.02 0.00 0.00 57.07 56.36 2vuy s TYR 55 Cb 0.06 -1.46 -0.05 0.00 -1.52 0.00 0.00 41.96 39.00 2vuy s TYR 55 CO 0.51 0.28 1.29 -2.14 0.02 0.00 0.00 175.55 175.51 2vuy s PRO 56 N -1.55 3.19 0.04 -1.71 0.02 -1.26 -4.85 135.00 128.88 2vuy s PRO 56 Ca 0.15 2.07 0.24 0.00 0.02 0.00 0.00 61.00 63.48 2vuy s PRO 56 Cb -0.11 -2.21 0.27 0.00 0.02 0.00 0.00 34.50 32.48 2vuy s PRO 56 CO 0.06 -1.10 1.23 0.36 -0.33 0.00 0.00 177.00 177.23 2vuy n LYS 57 N -1.07 0.15 -3.58 5.54 2.85 0.28 -4.92 118.16 117.41 2vuy n LYS 57 Ca 0.11 0.02 -0.12 0.00 -1.05 0.00 0.00 58.31 57.26 2vuy n LYS 57 Cb 0.46 -1.57 -0.06 0.00 -0.65 0.00 0.00 35.03 33.22 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 -3.10 0.69 -0.13 -1.58 2.12 -1.18 -5.04 118.70 110.49 2vuy s GLU 58 Ca 0.07 0.29 0.01 0.00 0.36 0.00 0.00 54.97 55.71 2vuy s GLU 58 Cb 0.16 0.33 0.02 0.00 0.26 0.00 0.00 34.13 34.89 2vuy s GLU 58 CO 0.75 -0.19 -0.15 0.42 -0.54 0.00 0.00 175.26 175.55 2vuy s ILE 59 N -0.82 1.56 -0.16 -3.70 1.01 -1.26 -2.37 121.20 115.45 2vuy s ILE 59 Ca -0.03 -0.66 0.00 0.00 0.00 0.00 0.00 60.65 59.97 2vuy s ILE 59 Cb -0.01 -1.43 0.00 0.00 0.01 0.00 0.00 42.46 41.03 2vuy s ILE 59 CO 0.02 0.45 -0.16 -0.63 0.00 0.00 0.00 174.94 174.62 2vuy s ILE 60 N 1.17 2.53 -0.34 2.92 1.01 -0.40 -4.97 121.20 123.12 2vuy s ILE 60 Ca -0.02 -0.81 -0.24 0.00 0.00 0.00 0.00 60.65 59.58 2vuy s ILE 60 Cb -0.14 -2.07 0.01 0.00 0.01 0.00 0.00 42.46 40.27 2vuy s ILE 60 CO -0.05 0.52 0.84 -0.70 0.00 0.00 0.00 174.94 175.55 2vuy s GLU 61 N 0.92 3.88 -0.52 2.79 2.12 -1.26 0.80 118.70 127.43 2vuy s GLU 61 Ca -0.04 0.54 -0.28 0.00 0.36 0.00 0.00 54.97 55.56 2vuy s GLU 61 Cb -0.15 -3.77 -0.00 0.00 0.26 0.00 0.00 34.13 30.47 2vuy s GLU 61 CO -0.02 -0.81 1.64 0.08 -0.54 0.00 0.00 175.26 175.61 2vuy s VAL 62 N 3.17 3.58 -0.12 3.70 1.01 -0.51 -4.84 120.40 126.40 2vuy s VAL 62 Ca 0.34 0.49 0.17 0.00 0.00 0.00 0.00 61.98 62.98 2vuy s VAL 62 Cb -0.13 -4.09 -0.19 0.00 0.00 0.00 0.00 36.38 31.98 2vuy s VAL 62 CO 0.15 -0.89 0.64 0.29 0.00 0.00 0.00 175.10 175.29 2vuy n LYS 63 N 8.75 0.64 -2.95 2.72 5.02 -1.26 -4.44 118.16 126.64 2vuy n LYS 63 Ca 0.17 0.15 -0.40 0.00 -2.02 0.00 0.00 58.31 56.21 2vuy n LYS 63 Cb 0.49 -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 -5.64 7.23 -0.07 4.39 -0.87 -1.25 -5.01 114.94 113.72 2vuy s ASN 64 Ca -0.05 1.47 -0.03 0.00 -1.57 0.00 0.00 52.86 52.69 2vuy s ASN 64 Cb 0.09 -2.48 0.04 0.00 -0.02 0.00 0.00 41.25 38.87 2vuy s ASN 64 CO 0.83 -0.02 0.06 -0.75 -2.57 0.00 0.00 177.10 174.65 2vuy s LYS 65 N 0.06 0.01 -0.47 -0.60 2.20 -1.26 -1.34 119.74 118.34 2vuy s LYS 65 Ca 0.40 0.24 -0.10 0.00 -0.36 0.00 0.00 55.97 56.15 2vuy s LYS 65 Cb -0.21 -0.87 0.11 0.00 -1.51 0.00 0.00 37.83 35.35 2vuy s LYS 65 CO 0.24 -0.41 0.35 0.99 -0.36 0.00 0.00 175.35 176.15 2vuy s THR 66 N 2.14 4.30 0.00 3.43 2.01 0.27 -4.92 115.64 122.88 2vuy s THR 66 Ca 0.04 -1.70 0.00 0.00 0.31 0.00 0.00 61.69 60.34 2vuy s THR 66 Cb -0.13 -3.80 0.00 0.00 0.01 0.00 0.00 72.50 68.58 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 4.94 1.51 1.36 4.40 0.00 -1.26 -2.82 105.19 113.33 2vuy n GLY 67 Ca -0.09 -0.56 -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 8.26 3.88 -4.08 1.61 3.85 -1.26 -4.94 116.55 123.87 2vuy n ASP 68 Ca 0.00 -3.28 -0.29 0.00 -0.71 0.00 0.00 54.79 50.51 2vuy n ASP 68 Cb 0.00 -0.64 -0.17 0.00 -1.35 0.00 0.00 41.12 38.96 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 -3.00 1.57 0.10 2.12 1.01 -1.13 -2.03 121.20 119.85 2vuy s ILE 69 Ca 0.48 -0.70 -0.12 0.00 0.00 0.00 0.00 60.65 60.30 2vuy s ILE 69 Cb 0.39 -1.42 -0.06 0.00 0.01 0.00 0.00 42.46 41.38 2vuy s ILE 69 CO 0.08 0.46 0.47 0.26 0.00 0.00 0.00 174.94 176.21 2vuy s TRP 70 N 0.87 3.61 0.03 3.97 0.52 0.04 -0.56 118.94 127.43 2vuy s TRP 70 Ca -0.09 0.93 -0.28 0.00 0.02 0.00 0.00 56.10 56.69 2vuy s TRP 70 Cb -0.15 -2.27 0.07 0.00 -1.15 0.00 0.00 33.47 29.97 2vuy s TRP 70 CO -0.00 0.49 0.67 -3.38 0.02 0.00 0.00 176.95 174.75 2vuy s HIS 71 N -1.39 -0.59 -0.05 -1.98 -3.43 -0.45 -1.12 115.29 106.28 2vuy s HIS 71 Ca 0.34 0.74 -0.30 0.00 -0.80 0.00 0.00 55.06 55.04 2vuy s HIS 71 Cb -0.15 0.48 0.08 0.00 -1.43 0.00 0.00 32.58 31.56 2vuy s HIS 71 CO 0.18 -0.70 0.71 0.54 -2.00 0.00 0.00 174.74 173.48 2vuy s VAL 72 N -2.33 0.00 -0.18 -5.38 0.11 -0.51 -3.88 120.40 108.23 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 -0.00 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 -1.34 2.87 -0.33 1.54 5.36 0.11 -0.41 117.98 125.78 2vuy s PHE 73 Ca -0.09 -0.99 -0.09 0.00 -0.96 0.00 0.00 56.93 54.80 2vuy s PHE 73 Cb -0.00 -1.98 0.01 0.00 -0.34 0.00 0.00 43.02 40.71 2vuy s PHE 73 CO 0.08 -0.50 0.15 0.08 -1.46 0.00 0.00 175.22 173.57 2vuy s VAL 74 N 1.08 4.33 0.40 3.12 1.01 -0.28 -1.04 120.40 129.02 2vuy s VAL 74 Ca 0.00 -0.73 -0.26 0.00 0.00 0.00 0.00 61.98 60.99 2vuy s VAL 74 Cb -0.15 -3.32 -0.09 0.00 0.00 0.00 0.00 36.38 32.83 2vuy s VAL 74 CO -0.02 -0.07 1.28 -2.84 0.00 0.00 0.00 175.10 173.45 2vuy s PRO 75 N 1.54 4.03 0.00 2.72 0.02 -1.26 -1.97 135.00 140.07 2vuy s PRO 75 Ca 0.02 2.10 0.00 0.00 0.02 0.00 0.00 61.00 63.15 2vuy s PRO 75 Cb -0.18 -2.78 0.00 0.00 0.02 0.00 0.00 34.50 31.56 2vuy s PRO 75 CO 0.05 -0.42 0.00 0.41 -0.33 0.00 0.00 177.00 176.71 2vuy n GLY 76 N 0.69 2.81 3.80 0.52 0.00 0.86 -4.93 105.19 108.94 2vuy n GLY 76 Ca 0.03 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.72 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 3.86 0.38 0.99 1.43 -1.24 -4.89 118.68 119.21 2vuy s LEU 77 Ca 0.00 1.86 0.05 0.00 -1.03 0.00 0.00 54.13 55.01 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 -0.68 0.19 -0.13 0.23 0.00 0.00 176.35 175.96 2vuy s ARG 78 N -3.25 1.86 0.33 1.70 0.52 -1.26 -3.81 118.95 115.04 2vuy s ARG 78 Ca 0.66 -2.12 -0.29 0.00 -0.52 0.00 0.00 55.73 53.46 2vuy s ARG 78 Cb -0.14 -0.22 -0.11 0.00 0.52 0.00 0.00 34.95 35.00 2vuy s ARG 78 CO 0.19 -0.56 1.45 -2.14 0.02 0.00 0.00 175.30 174.26 2vuy s PRO 79 N -3.61 4.20 0.00 3.54 0.02 -1.26 -2.68 135.00 135.21 2vuy s PRO 79 Ca 0.30 2.44 0.00 0.00 0.02 0.00 0.00 61.00 63.76 2vuy s PRO 79 Cb 0.02 -3.02 0.00 0.00 0.02 0.00 0.00 34.50 31.52 2vuy s PRO 79 CO 0.20 -0.44 0.00 0.41 -0.33 0.00 0.00 177.00 176.84 2vuy n GLY 80 N 1.05 1.74 3.68 0.52 0.00 0.24 -4.99 105.19 107.43 2vuy n GLY 80 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 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 4.16 0.02 1.61 2.00 -1.09 -4.70 119.66 121.25 2vuy s GLN 81 Ca 0.00 2.50 -0.25 0.00 -2.00 0.00 0.00 55.36 55.60 2vuy s GLN 81 Cb 0.00 -3.86 -0.05 0.00 0.80 0.00 0.00 33.01 29.90 2vuy s GLN 81 CO 0.00 -0.87 0.78 -0.51 -0.50 0.00 0.00 175.29 174.20 2vuy s LEU 82 N 3.54 4.42 0.22 3.68 1.43 -1.26 -1.66 118.68 129.04 2vuy s LEU 82 Ca 0.81 1.43 -0.13 0.00 -1.03 0.00 0.00 54.13 55.22 2vuy s LEU 82 Cb -0.42 -3.25 0.00 0.00 0.03 0.00 0.00 46.19 42.55 2vuy s LEU 82 CO 0.37 -0.04 0.45 -0.72 0.23 0.00 0.00 176.35 176.63 2vuy s TYR 83 N 0.23 0.26 0.28 0.29 -0.85 0.59 -1.27 117.35 116.88 2vuy s TYR 83 Ca 0.40 -0.62 -0.21 0.00 -0.52 0.00 0.00 57.07 56.13 2vuy s TYR 83 Cb -0.20 0.19 0.04 0.00 0.38 0.00 0.00 41.96 42.36 2vuy s TYR 83 CO 0.23 -0.92 0.80 0.00 -1.52 0.00 0.00 175.55 174.14 2vuy s ALA 84 N -3.97 -1.21 0.24 9.51 0.00 -0.38 -0.58 121.76 125.36 2vuy s ALA 84 Ca 0.18 -0.33 0.10 0.00 0.00 0.00 0.00 51.96 51.91 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 0.04 -1.03 -0.17 0.71 0.00 0.00 0.00 175.76 175.31 2vuy s TYR 85 N -3.33 1.98 -0.08 0.00 1.51 -0.92 0.14 117.35 116.65 2vuy s TYR 85 Ca 0.13 -0.46 0.01 0.00 -1.01 0.00 0.00 57.07 55.74 2vuy s TYR 85 Cb -0.05 -0.89 0.02 0.00 -0.11 0.00 0.00 41.96 40.93 2vuy s TYR 85 CO 0.07 0.52 -0.09 1.03 -1.11 0.00 0.00 175.55 175.97 2vuy s ARG 86 N -3.54 1.47 -0.18 -0.62 0.52 -0.56 -0.22 118.95 115.81 2vuy s ARG 86 Ca 0.25 -0.29 0.00 0.00 -0.52 0.00 0.00 55.73 55.18 2vuy s ARG 86 Cb -0.03 -1.38 0.01 0.00 0.52 0.00 0.00 34.95 34.08 2vuy s ARG 86 CO 0.10 -0.11 -0.17 0.08 0.02 0.00 0.00 175.30 175.22 2vuy s VAL 87 N 1.15 2.32 0.06 3.52 1.01 -1.26 -1.42 120.40 125.78 2vuy s VAL 87 Ca -0.06 -0.86 -0.19 0.00 0.00 0.00 0.00 61.98 60.88 2vuy s VAL 87 Cb -0.14 -1.99 -0.06 0.00 0.00 0.00 0.00 36.38 34.19 2vuy s VAL 87 CO -0.02 0.52 0.54 -0.31 0.00 0.00 0.00 175.10 175.84 2vuy s TYR 88 N 1.23 3.79 -0.05 5.22 2.02 -0.08 -3.38 117.35 126.09 2vuy s TYR 88 Ca 0.03 1.23 -0.20 0.00 -0.37 0.00 0.00 57.07 57.75 2vuy s TYR 88 Cb -0.14 -2.47 0.07 0.00 -0.40 0.00 0.00 41.96 39.02 2vuy s TYR 88 CO -0.09 0.58 0.91 0.41 -1.57 0.00 0.00 175.55 175.79 2vuy n GLY 89 N 1.78 0.22 3.77 0.71 0.00 -1.26 -0.30 105.19 110.10 2vuy n GLY 89 Ca -0.11 -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 -2.00 4.43 -0.48 1.61 0.02 -1.26 -4.68 135.00 132.63 2vuy s PRO 90 Ca 0.22 2.11 0.00 0.00 0.02 0.00 0.00 61.00 63.34 2vuy s PRO 90 Cb -0.00 -3.10 0.13 0.00 0.02 0.00 0.00 34.50 31.55 2vuy s PRO 90 CO -0.02 -0.09 0.25 -0.47 -0.33 0.00 0.00 177.00 176.35 2vuy s TYR 91 N -1.15 3.48 -0.39 6.54 5.04 -1.26 -2.92 117.35 126.68 2vuy s TYR 91 Ca 0.48 -2.80 0.07 0.00 -2.44 0.00 0.00 57.07 52.38 2vuy s TYR 91 Cb -0.38 -3.06 0.24 0.00 0.35 0.00 0.00 41.96 39.10 2vuy s TYR 91 CO 0.50 -0.88 0.49 1.63 -1.34 0.00 0.00 175.55 175.95 2vuy n LYS 92 N 3.86 0.62 -0.36 4.97 5.02 0.17 -4.99 118.16 127.43 2vuy n LYS 92 Ca 0.04 -3.20 0.34 0.00 -2.02 0.00 0.00 58.31 53.46 2vuy n LYS 92 Cb 0.38 -1.29 0.61 0.00 -0.02 0.00 0.00 35.03 34.71 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 4.29 0.01 0.00 1.97 0.11 -1.87 1.09 132.00 137.61 2vuy h PRO 93 Ca 0.10 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.21 2vuy h PRO 93 Cb 0.89 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.99 2vuy h PRO 93 CO 0.44 0.01 0.00 0.39 -0.21 0.00 0.00 178.00 178.63 2vuy n GLU 94 N -5.10 0.16 0.00 1.05 4.71 -1.26 -1.89 120.64 118.31 2vuy n GLU 94 Ca 0.38 0.54 0.03 0.00 -0.01 0.00 0.00 57.16 58.10 2vuy n GLU 94 Cb 1.36 -1.91 0.03 0.00 -1.01 0.00 0.00 31.44 29.91 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 -2.23 1.57 0.00 -4.62 4.77 0.37 -4.23 117.00 112.63 2vuy n LEU 95 Ca 0.00 -1.00 0.00 0.00 -0.03 0.00 0.00 56.01 54.98 2vuy n LEU 95 Cb 0.12 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.21 2vuy n LEU 95 CO 0.14 0.32 0.00 0.61 -1.33 0.00 0.00 177.39 177.13 2vuy n GLY 96 N 0.38 1.01 3.53 -0.72 0.00 -0.79 -4.80 105.19 103.80 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 -0.34 0.99 1.43 -1.18 -4.06 118.68 119.49 2vuy s LEU 97 Ca 0.00 -0.33 0.06 0.00 -1.03 0.00 0.00 54.13 52.83 2vuy s LEU 97 Cb 0.00 -2.84 0.46 0.00 0.03 0.00 0.00 46.19 43.84 2vuy s LEU 97 CO 0.00 -1.33 1.28 0.54 0.23 0.00 0.00 176.35 177.07 2vuy n ARG 98 N 7.77 3.51 -2.24 1.70 1.74 -1.26 0.43 116.66 128.31 2vuy n ARG 98 Ca 0.03 -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 -0.03 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 -3.62 3.18 -0.42 -1.55 0.40 -1.15 -4.62 117.98 110.19 2vuy s PHE 99 Ca 0.52 1.52 0.06 0.00 -0.60 0.00 0.00 56.93 58.43 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 0.02 -1.43 0.54 1.21 0.70 0.00 0.00 175.22 176.26 2vuy s ASN 100 N -0.72 -0.32 0.00 1.36 3.84 -1.25 -4.56 114.94 113.28 2vuy s ASN 100 Ca 0.50 -1.49 0.00 0.00 0.21 0.00 0.00 52.86 52.08 2vuy s ASN 100 Cb -0.36 1.25 0.00 0.00 -0.55 0.00 0.00 41.25 41.59 2vuy s ASN 100 CO 0.47 -0.17 0.71 -0.81 -2.79 0.00 0.00 177.10 174.51 2vuy n PRO 101 N 3.87 0.00 0.12 0.43 -0.04 -1.22 -0.32 135.00 137.84 2vuy n PRO 101 Ca 0.14 0.25 -0.01 0.00 -0.04 0.00 0.00 63.50 63.84 2vuy n PRO 101 Cb 0.52 -1.55 0.03 0.00 -0.04 0.00 0.00 33.50 32.46 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 -3.35 3.54 4.21 -1.91 -3.44 115.58 114.64 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 0.09 0.00 -0.09 0.00 -1.12 0.00 0.00 38.32 37.20 2vuy h ASN 102 CO 0.00 0.67 0.32 -0.54 -1.29 0.00 0.00 177.43 176.59 2vuy s LYS 103 N -3.01 4.21 0.11 0.81 -0.14 0.56 -2.92 119.74 119.35 2vuy s LYS 103 Ca 0.02 0.83 -0.30 0.00 -1.36 0.00 0.00 55.97 55.16 2vuy s LYS 103 Cb 0.09 -3.61 -0.06 0.00 -1.68 0.00 0.00 37.83 32.58 2vuy s LYS 103 CO 0.77 -0.38 1.05 0.08 -0.76 0.00 0.00 175.35 176.11 2vuy s VAL 104 N 2.36 4.27 0.21 3.17 1.01 -1.26 -4.62 120.40 125.54 2vuy s VAL 104 Ca 0.33 1.81 0.08 0.00 0.00 0.00 0.00 61.98 64.20 2vuy s VAL 104 Cb -0.16 -4.16 -0.04 0.00 0.00 0.00 0.00 36.38 32.02 2vuy s VAL 104 CO 0.10 0.24 0.04 -0.76 0.00 0.00 0.00 175.10 174.72 2vuy s LEU 105 N 0.23 3.40 -0.11 3.92 2.01 0.69 -4.78 118.68 124.05 2vuy s LEU 105 Ca 0.51 -0.41 -0.13 0.00 0.01 0.00 0.00 54.13 54.10 2vuy s LEU 105 Cb -0.26 -2.00 -0.05 0.00 0.01 0.00 0.00 46.19 43.89 2vuy s LEU 105 CO 0.31 0.05 0.31 -0.63 1.01 0.00 0.00 176.35 177.39 2vuy s ILE 106 N -1.94 5.26 0.00 -0.59 1.01 -0.87 -2.17 121.20 121.90 2vuy s ILE 106 Ca 0.30 0.59 -0.30 0.00 0.00 0.00 0.00 60.65 61.24 2vuy s ILE 106 Cb -0.08 -3.62 -0.08 0.00 0.01 0.00 0.00 42.46 38.69 2vuy s ILE 106 CO 0.20 0.48 1.91 -0.62 0.00 0.00 0.00 174.94 176.91 2vuy s ASP 107 N -0.23 6.45 0.58 3.58 -1.08 -1.26 -4.71 116.67 119.99 2vuy s ASP 107 Ca 0.19 2.53 0.28 0.00 -0.52 0.00 0.00 52.55 55.03 2vuy s ASP 107 Cb -0.14 -2.53 1.57 0.00 -1.46 0.00 0.00 42.92 40.36 2vuy s ASP 107 CO 0.07 -1.07 2.03 -0.65 0.52 0.00 0.00 175.17 176.07 2vuy h PRO 108 N 10.59 0.00 -0.63 4.34 0.11 -1.95 -0.11 132.00 144.34 2vuy h PRO 108 Ca -0.47 0.00 -0.26 0.00 0.11 0.00 0.00 66.00 65.38 2vuy h PRO 108 Cb 1.22 0.00 -0.15 0.00 0.11 0.00 0.00 31.00 32.18 2vuy h PRO 108 CO 0.95 0.00 0.23 0.66 -0.21 0.00 0.00 178.00 179.63 2vuy n TYR 109 N -3.84 2.01 -2.23 0.65 4.02 -1.26 -4.35 117.16 112.16 2vuy n TYR 109 Ca 0.04 -1.45 -0.41 0.00 -0.01 0.00 0.00 57.90 56.07 2vuy n TYR 109 Cb 0.45 -0.65 -0.03 0.00 -0.02 0.00 0.00 39.34 39.09 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 -3.13 3.48 -1.88 -0.72 0.00 -0.06 -4.50 121.76 114.95 2vuy s ALA 110 Ca 0.51 1.13 0.23 0.00 0.00 0.00 0.00 51.96 53.83 2vuy s ALA 110 Cb 0.43 -3.44 0.09 0.00 0.00 0.00 0.00 23.12 20.20 2vuy s ALA 110 CO 0.08 -0.49 1.15 1.63 0.00 0.00 0.00 175.76 178.13 2vuy n LYS 111 N 1.34 1.02 -3.64 0.00 4.76 -1.26 -3.37 118.16 117.01 2vuy n LYS 111 Ca 0.01 -0.82 -0.08 0.00 -2.87 0.00 0.00 58.31 54.56 2vuy n LYS 111 Cb 0.43 -1.48 -0.07 0.00 -1.84 0.00 0.00 35.03 32.07 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 -2.54 -1.93 -0.16 7.82 0.00 -1.26 -4.29 121.76 119.41 2vuy s ALA 112 Ca 0.18 2.30 0.01 0.00 0.00 0.00 0.00 51.96 54.46 2vuy s ALA 112 Cb 0.18 -1.43 0.01 0.00 0.00 0.00 0.00 23.12 21.88 2vuy s ALA 112 CO 0.60 -0.36 -0.20 0.42 0.00 0.00 0.00 175.76 176.22 2vuy s ILE 113 N 1.32 2.20 -1.04 0.00 1.01 -1.26 -0.13 121.20 123.31 2vuy s ILE 113 Ca -0.08 -0.91 -0.22 0.00 0.00 0.00 0.00 60.65 59.44 2vuy s ILE 113 Cb -0.05 -1.91 0.05 0.00 0.01 0.00 0.00 42.46 40.57 2vuy s ILE 113 CO -0.15 0.54 1.46 0.21 0.00 0.00 0.00 174.94 177.00 2vuy s ASN 114 N 1.01 6.54 0.00 3.58 2.47 0.41 -4.73 114.94 124.22 2vuy s ASN 114 Ca -0.02 -1.56 0.00 0.00 0.42 0.00 0.00 52.86 51.70 2vuy s ASN 114 Cb -0.15 -2.56 0.00 0.00 -1.45 0.00 0.00 41.25 37.09 2vuy s ASN 114 CO -0.06 -1.46 0.00 0.61 -3.72 0.00 0.00 177.10 172.47 2vuy n GLY 115 N 6.70 -2.01 0.38 1.21 0.00 -1.26 -3.64 105.19 106.57 2vuy n GLY 115 Ca 0.34 -1.93 -0.03 0.00 0.00 0.00 0.00 46.02 44.39 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 0.17 2.00 -4.78 1.61 2.88 -1.26 -4.80 113.62 109.43 2vuy n SER 116 Ca 0.00 -1.23 -0.38 0.00 -1.33 0.00 0.00 58.87 55.92 2vuy n SER 116 Cb 0.00 0.05 -0.06 0.00 -0.75 0.00 0.00 64.21 63.45 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 -1.26 4.37 -0.46 2.46 1.01 -1.26 -3.76 120.40 121.50 2vuy s VAL 117 Ca 0.00 1.65 -0.10 0.00 0.00 0.00 0.00 61.98 63.53 2vuy s VAL 117 Cb 0.00 -4.07 0.10 0.00 0.00 0.00 0.00 36.38 32.41 2vuy s VAL 117 CO 0.00 0.40 0.33 -0.63 0.00 0.00 0.00 175.10 175.21 2vuy s ILE 118 N -1.29 4.40 0.23 2.22 1.01 0.31 -5.00 121.20 123.08 2vuy s ILE 118 Ca 0.39 -1.54 -0.31 0.00 0.00 0.00 0.00 60.65 59.19 2vuy s ILE 118 Cb -0.21 -3.79 -0.14 0.00 0.01 0.00 0.00 42.46 38.33 2vuy s ILE 118 CO 0.25 -0.66 1.29 0.79 0.00 0.00 0.00 174.94 176.61 2vuy n TRP 119 N 4.97 1.83 -3.64 3.97 7.02 -1.26 -4.77 117.44 125.56 2vuy n TRP 119 Ca -0.10 0.54 -0.07 0.00 -1.02 0.00 0.00 57.50 56.85 2vuy n TRP 119 Cb 0.42 -2.38 -0.07 0.00 -2.42 0.00 0.00 31.31 26.86 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 0.08 -0.33 0.10 -0.99 3.84 -1.26 -5.02 114.94 111.36 2vuy s ASN 120 Ca 0.68 0.63 0.05 0.00 0.21 0.00 0.00 52.86 54.42 2vuy s ASN 120 Cb -0.71 0.63 0.25 0.00 -0.55 0.00 0.00 41.25 40.88 2vuy s ASN 120 CO 0.52 -0.12 1.02 0.47 -2.79 0.00 0.00 177.10 176.20 2vuy n ASP 121 N 1.95 0.12 -0.12 -4.21 8.00 -1.26 -1.66 116.55 119.37 2vuy n ASP 121 Ca -0.12 0.43 0.14 0.00 0.71 0.00 0.00 54.79 55.96 2vuy n ASP 121 Cb 0.56 -0.42 0.67 0.00 -0.02 0.00 0.00 41.12 41.91 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 -1.43 2.71 -1.29 2.24 0.00 -1.26 -3.71 120.51 117.76 2vuy n ALA 122 Ca -0.00 -0.26 -0.19 0.00 0.00 0.00 0.00 53.44 52.98 2vuy n ALA 122 Cb 0.18 -1.36 0.19 0.00 0.00 0.00 0.00 19.45 18.45 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 -0.87 3.04 -0.02 0.00 0.24 -0.66 -4.02 118.33 116.04 2vuy n VAL 123 Ca 0.17 -2.14 0.02 0.00 -2.04 0.00 0.00 64.34 60.35 2vuy n VAL 123 Cb 0.25 -0.43 -0.07 0.00 -1.47 0.00 0.00 33.84 32.12 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 -1.13 0.00 0.00 6.34 3.01 -1.24 -1.62 117.46 122.81 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 1.51 -0.28 0.00 0.00 -0.01 0.00 0.00 39.48 40.71 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 2.15 3.11 3.14 1.37 0.00 -1.26 -4.11 105.19 109.59 2vuy n GLY 125 Ca -0.06 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.82 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 -1.47 0.94 -0.39 1.61 -0.85 -1.26 -2.33 117.35 113.59 2vuy s TYR 126 Ca 0.00 -0.62 -0.28 0.00 -0.52 0.00 0.00 57.07 55.65 2vuy s TYR 126 Cb 0.00 -0.53 -0.01 0.00 0.38 0.00 0.00 41.96 41.80 2vuy s TYR 126 CO 0.00 -0.04 1.67 0.15 -1.52 0.00 0.00 175.55 175.81 2vuy s LYS 127 N -2.44 3.33 0.18 -3.49 1.02 -1.26 -4.51 119.74 112.58 2vuy s LYS 127 Ca 0.01 1.15 -0.22 0.00 0.02 0.00 0.00 55.97 56.93 2vuy s LYS 127 Cb -0.05 -4.16 0.11 0.00 -0.52 0.00 0.00 37.83 33.21 2vuy s LYS 127 CO -0.00 -1.86 1.58 0.82 -0.92 0.00 0.00 175.35 174.97 2vuy h ILE 128 N 6.69 0.14 0.00 2.17 1.08 -1.95 -2.47 117.51 123.17 2vuy h ILE 128 Ca -0.31 0.00 -0.10 0.00 -0.39 0.00 0.00 64.86 64.07 2vuy h ILE 128 Cb 1.14 0.14 -0.01 0.00 -3.07 0.00 0.00 36.82 35.02 2vuy h ILE 128 CO 1.07 0.00 -0.45 1.23 -0.69 0.00 0.00 178.15 179.31 2vuy h GLY 129 N -0.17 0.00 -4.07 5.37 0.00 -1.98 -3.47 103.07 98.74 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 -0.69 0.00 -0.61 1.34 0.00 0.00 0.00 176.54 176.58 2vuy n ASP 130 N -3.28 -1.65 0.12 0.19 -0.08 -0.93 -4.88 116.55 106.04 2vuy n ASP 130 Ca 0.02 0.87 -0.01 0.00 -1.51 0.00 0.00 54.79 54.15 2vuy n ASP 130 Cb 0.67 -1.03 0.24 0.00 2.34 0.00 0.00 41.12 43.35 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 0.59 0.14 -0.55 -0.67 4.15 -1.91 -2.92 115.11 113.94 2vuy h GLN 131 Ca -0.39 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 58.96 2vuy h GLN 131 Cb 1.42 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.11 2vuy h GLN 131 CO 0.50 0.56 0.00 0.09 -1.93 0.00 0.00 178.83 178.05 2vuy n ASN 132 N -4.00 2.96 0.00 -0.69 4.13 -1.26 -4.98 115.26 111.42 2vuy n ASN 132 Ca -0.02 -2.15 0.00 0.00 1.68 0.00 0.00 54.58 54.09 2vuy n ASN 132 Cb 0.49 -0.40 0.00 0.00 -1.54 0.00 0.00 39.78 38.33 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 0.79 0.00 0.00 3.52 6.02 -1.11 -1.86 117.38 124.74 2vuy n GLN 133 Ca 0.17 0.00 0.02 0.00 -0.01 0.00 0.00 57.00 57.18 2vuy n GLN 133 Cb 0.52 0.00 0.13 0.00 1.02 0.00 0.00 30.24 31.91 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 -0.66 0.00 0.04 1.08 5.75 -1.26 0.04 116.55 121.54 2vuy n ASP 134 Ca 0.00 -0.21 0.12 0.00 -0.01 0.00 0.00 54.79 54.68 2vuy n ASP 134 Cb 0.00 0.00 0.10 0.00 -1.03 0.00 0.00 41.12 40.19 2vuy n ASP 134 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2vuy n LEU 135 N -0.89 0.65 -4.96 -2.12 4.77 -0.78 -4.84 117.00 108.83 2vuy n LEU 135 Ca 0.03 0.11 -0.27 0.00 -0.03 0.00 0.00 56.01 55.85 2vuy n LEU 135 Cb 0.02 -0.14 0.15 0.00 -2.33 0.00 0.00 43.42 41.11 2vuy n LEU 135 CO 0.02 -0.00 0.73 0.42 -1.33 0.00 0.00 177.39 177.23 2vuy s THR 136 N -3.18 2.07 -0.38 -5.08 -4.23 0.11 -4.86 115.64 100.08 2vuy s THR 136 Ca 0.05 -0.26 0.01 0.00 -1.18 0.00 0.00 61.69 60.32 2vuy s THR 136 Cb 0.14 -2.81 0.14 0.00 1.34 0.00 0.00 72.50 71.31 2vuy s THR 136 CO 0.76 0.00 0.24 -0.47 -0.54 0.00 0.00 174.62 174.61 2vuy s TYR 137 N -3.55 1.02 -0.02 3.99 6.14 -1.26 -4.37 117.35 119.31 2vuy s TYR 137 Ca 0.70 -1.90 -0.30 0.00 0.64 0.00 0.00 57.07 56.21 2vuy s TYR 137 Cb -0.05 -1.09 -0.04 0.00 0.42 0.00 0.00 41.96 41.19 2vuy s TYR 137 CO 0.49 -0.82 1.25 0.34 0.64 0.00 0.00 175.55 177.46 2vuy s ASP 138 N 0.74 7.00 -0.28 4.32 -1.08 -0.98 -4.80 116.67 121.59 2vuy s ASP 138 Ca 0.21 1.93 0.12 0.00 -0.52 0.00 0.00 52.55 54.29 2vuy s ASP 138 Cb -0.18 -2.56 0.79 0.00 -1.46 0.00 0.00 42.92 39.51 2vuy s ASP 138 CO -0.03 -0.60 1.78 -0.62 0.52 0.00 0.00 175.17 176.22 2vuy n GLU 139 N 5.02 4.43 -2.92 4.34 1.02 -1.26 -4.63 120.64 126.63 2vuy n GLU 139 Ca 0.11 -3.14 -0.34 0.00 -0.02 0.00 0.00 57.16 53.76 2vuy n GLU 139 Cb 0.45 -2.25 -0.07 0.00 -0.02 0.00 0.00 31.44 29.56 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 -2.87 4.28 0.05 3.49 0.52 -1.26 -4.97 118.95 118.18 2vuy s ARG 140 Ca 0.55 1.04 -0.30 0.00 -0.52 0.00 0.00 55.73 56.49 2vuy s ARG 140 Cb 0.43 -2.51 -0.05 0.00 0.52 0.00 0.00 34.95 33.34 2vuy s ARG 140 CO 0.15 0.16 1.15 0.34 0.02 0.00 0.00 175.30 177.12 2vuy s ASP 141 N -1.97 7.14 0.00 0.23 -1.08 -1.26 -4.52 116.67 115.21 2vuy s ASP 141 Ca 0.54 1.94 0.23 0.00 -0.52 0.00 0.00 52.55 54.74 2vuy s ASP 141 Cb -0.13 -2.58 0.07 0.00 -1.46 0.00 0.00 42.92 38.82 2vuy s ASP 141 CO 0.18 -0.43 1.11 -1.54 0.52 0.00 0.00 175.17 175.01 2vuy n SER 142 N 3.93 0.98 -0.35 -0.34 3.41 -1.15 -4.68 113.62 115.42 2vuy n SER 142 Ca 0.08 -0.84 0.02 0.00 -0.26 0.00 0.00 58.87 57.87 2vuy n SER 142 Cb 0.47 0.67 0.08 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 -1.78 0.00 5.00 0.00 -1.26 -1.27 105.19 107.36 2vuy n GLY 143 Ca 0.06 1.03 0.10 0.00 0.00 0.00 0.00 46.02 47.21 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 -5.46 0.71 0.00 1.61 0.28 -1.25 -3.02 120.64 113.51 2vuy n GLU 144 Ca 0.12 0.00 0.01 0.00 -0.16 0.00 0.00 57.16 57.13 2vuy n GLU 144 Cb 0.42 -1.45 -0.00 0.00 1.43 0.00 0.00 31.44 31.84 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 -0.95 0.00 -4.25 -1.84 4.02 -0.40 -4.94 117.16 108.81 2vuy n TYR 145 Ca 0.15 0.00 -0.34 0.00 -0.01 0.00 0.00 57.90 57.70 2vuy n TYR 145 Cb 0.07 0.00 -0.12 0.00 -0.02 0.00 0.00 39.34 39.27 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 -0.67 4.11 0.89 -0.72 1.01 -1.14 -0.53 120.40 123.36 2vuy s VAL 146 Ca 0.01 -0.27 -0.11 0.00 0.00 0.00 0.00 61.98 61.61 2vuy s VAL 146 Cb 0.01 -2.83 0.12 0.00 0.00 0.00 0.00 36.38 33.69 2vuy s VAL 146 CO 0.05 0.47 1.12 -0.81 0.00 0.00 0.00 175.10 175.93 2vuy n PRO 147 N 3.67 -0.27 -3.97 2.72 -0.04 -1.25 -4.95 135.00 130.91 2vuy n PRO 147 Ca -0.17 -0.01 -0.30 0.00 -0.04 0.00 0.00 63.50 62.98 2vuy n PRO 147 Cb 0.52 -2.36 -0.05 0.00 -0.04 0.00 0.00 33.50 31.57 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 -4.42 3.24 0.29 0.54 3.01 -1.24 -4.87 119.74 116.29 2vuy s LYS 148 Ca 0.68 -0.57 -0.25 0.00 -1.01 0.00 0.00 55.97 54.82 2vuy s LYS 148 Cb -0.25 -2.91 -0.09 0.00 -1.01 0.00 0.00 37.83 33.57 2vuy s LYS 148 CO 0.56 0.57 0.89 -1.12 0.51 0.00 0.00 175.35 176.76 2vuy s SER 149 N -2.64 7.30 -0.13 2.83 0.01 0.25 -0.45 113.70 120.88 2vuy s SER 149 Ca 0.33 1.74 0.03 0.00 1.31 0.00 0.00 55.95 59.36 2vuy s SER 149 Cb -0.12 -2.54 0.01 0.00 0.21 0.00 0.00 66.02 63.57 2vuy s SER 149 CO 0.26 -0.01 -0.22 -0.69 0.41 0.00 0.00 173.24 172.99 2vuy s VAL 150 N -1.54 2.11 -0.10 3.43 1.01 0.82 -0.30 120.40 125.84 2vuy s VAL 150 Ca 0.47 -0.98 -0.30 0.00 0.00 0.00 0.00 61.98 61.18 2vuy s VAL 150 Cb -0.19 -1.83 -0.03 0.00 0.00 0.00 0.00 36.38 34.33 2vuy s VAL 150 CO 0.24 0.55 1.37 -0.69 0.00 0.00 0.00 175.10 176.57 2vuy s VAL 151 N 0.63 4.02 0.47 2.92 1.01 -0.66 -4.00 120.40 124.79 2vuy s VAL 151 Ca -0.11 1.28 0.08 0.00 0.00 0.00 0.00 61.98 63.22 2vuy s VAL 151 Cb -0.16 -3.82 0.02 0.00 0.00 0.00 0.00 36.38 32.41 2vuy s VAL 151 CO 0.02 -0.08 0.48 0.27 0.00 0.00 0.00 175.10 175.80 2vuy s ILE 152 N 3.29 2.40 -0.35 2.22 -4.36 -1.26 0.82 121.20 123.96 2vuy s ILE 152 Ca 0.61 -1.27 -0.04 0.00 -0.26 0.00 0.00 60.65 59.69 2vuy s ILE 152 Cb -0.26 -2.67 0.06 0.00 1.25 0.00 0.00 42.46 40.84 2vuy s ILE 152 CO 0.21 0.00 0.10 0.21 0.24 0.00 0.00 174.94 175.70 2vuy s ASN 153 N -4.29 5.18 0.66 4.36 3.04 -1.26 -4.56 114.94 118.07 2vuy s ASN 153 Ca 0.49 -1.41 0.40 0.00 0.04 0.00 0.00 52.86 52.37 2vuy s ASN 153 Cb -0.04 -1.82 2.19 0.00 -1.54 0.00 0.00 41.25 40.04 2vuy s ASN 153 CO 0.29 -0.37 2.27 1.55 -3.04 0.00 0.00 177.10 177.80 2vuy h PRO 154 N 8.12 0.00 -6.86 0.43 0.13 -1.98 -3.45 132.00 128.39 2vuy h PRO 154 Ca -0.20 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.36 2vuy h PRO 154 Cb 1.07 0.00 0.14 0.00 0.13 0.00 0.00 31.00 32.34 2vuy h PRO 154 CO 0.61 0.00 0.35 0.98 -0.23 0.00 0.00 178.00 179.72 2vuy n TYR 155 N -3.17 1.61 0.00 1.56 9.36 -1.26 -5.01 117.16 120.25 2vuy n TYR 155 Ca -0.03 0.47 0.00 0.00 3.32 0.00 0.00 57.90 61.67 2vuy n TYR 155 Cb 0.14 -2.27 0.00 0.00 -0.63 0.00 0.00 39.34 36.58 2vuy n TYR 155 CO 0.00 0.00 0.00 0.34 0.22 0.00 0.00 176.86 177.42 2vuy n PHE 156 N -0.96 0.00 -3.31 2.98 7.35 -1.26 -5.11 117.46 117.15 2vuy n PHE 156 Ca 0.10 0.00 -0.42 0.00 -0.76 0.00 0.00 57.45 56.37 2vuy n PHE 156 Cb 0.43 0.00 -0.09 0.00 0.35 0.00 0.00 39.48 40.18 2vuy n PHE 156 CO 0.00 0.00 0.00 -1.83 -0.76 0.00 0.00 176.76 174.17 2vuy s GLU 157 N 0.00 3.38 -0.68 -4.13 -1.05 -1.26 -5.01 118.70 109.95 2vuy s GLU 157 Ca 0.00 -0.48 -0.23 0.00 -0.15 0.00 0.00 54.97 54.11 2vuy s GLU 157 Cb 0.00 -3.88 0.07 0.00 -0.44 0.00 0.00 34.13 29.88 2vuy s GLU 157 CO 0.00 -0.72 1.01 -1.58 0.95 0.00 0.00 175.26 174.93 2vuy s TRP 158 N 2.22 2.63 -0.02 4.83 0.52 -1.26 -5.01 118.94 122.84 2vuy s TRP 158 Ca 0.14 -0.50 -0.30 0.00 0.02 0.00 0.00 56.10 55.46 2vuy s TRP 158 Cb -0.16 -4.34 -0.04 0.00 -1.15 0.00 0.00 33.47 27.77 2vuy s TRP 158 CO 0.13 -1.71 1.23 0.16 0.02 0.00 0.00 176.95 176.79 2vuy s ASP 159 N 3.70 7.02 0.00 2.95 3.84 -1.26 -3.51 116.67 129.41 2vuy s ASP 159 Ca 0.24 1.91 0.00 0.00 -0.00 0.00 0.00 52.55 54.70 2vuy s ASP 159 Cb -0.15 -2.56 0.00 0.00 -1.38 0.00 0.00 42.92 38.82 2vuy s ASP 159 CO 0.10 -0.58 0.00 0.47 -0.00 0.00 0.00 175.17 175.16 2vuy n ASP 160 N 4.95 0.00 0.12 2.11 8.00 -1.26 -4.68 116.55 125.79 2vuy n ASP 160 Ca 0.11 0.00 -0.01 0.00 0.71 0.00 0.00 54.79 55.60 2vuy n ASP 160 Cb 0.46 -1.45 0.09 0.00 -0.02 0.00 0.00 41.12 40.20 2vuy n ASP 160 CO 0.00 0.00 0.00 -0.08 -0.39 0.00 0.00 177.20 176.73 2vuy h GLU 161 N 0.37 0.00 0.00 -1.24 4.22 -1.92 -2.61 114.58 113.40 2vuy h GLU 161 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.44 2vuy h GLU 161 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2vuy h GLU 161 CO 0.00 0.67 0.01 -0.40 -2.18 0.00 0.00 179.01 177.12 2vuy n ASP 162 N -3.53 0.00 -0.10 1.04 5.75 -1.26 -2.98 116.55 115.47 2vuy n ASP 162 Ca -0.00 0.13 -0.20 0.00 -0.01 0.00 0.00 54.79 54.71 2vuy n ASP 162 Cb 0.71 -0.13 -0.09 0.00 -1.03 0.00 0.00 41.12 40.57 2vuy n ASP 162 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 2vuy n PHE 163 N -1.10 0.82 0.10 2.11 0.99 -0.98 -3.66 117.46 115.73 2vuy n PHE 163 Ca 0.00 0.36 0.00 0.00 -0.00 0.00 0.00 57.45 57.81 2vuy n PHE 163 Cb 0.01 -1.01 0.02 0.00 -1.00 0.00 0.00 39.48 37.49 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 -4.44 0.00 1.08 4.37 3.06 -1.16 -1.04 119.36 121.23 2vuy n ILE 164 Ca -0.31 0.00 0.13 0.00 -2.50 0.00 0.00 62.75 60.07 2vuy n ILE 164 Cb 0.64 -0.64 0.39 0.00 0.54 0.00 0.00 39.64 40.57 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 -0.67 0.18 0.00 9.51 4.76 -1.24 -4.62 118.16 126.08 2vuy n LYS 165 Ca 0.00 -0.09 0.00 0.00 -2.87 0.00 0.00 58.31 55.36 2vuy n LYS 165 Cb 0.00 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.69 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 1.45 0.89 3.69 0.72 0.00 -0.21 -4.87 105.19 106.86 2vuy n GLY 166 Ca 0.08 -0.55 -0.42 0.00 0.00 0.00 0.00 46.02 45.13 2vuy n GLY 166 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2vuy s LYS 167 N 0.31 4.17 0.45 1.61 -2.85 -1.26 -4.98 119.74 117.19 2vuy s LYS 167 Ca 0.00 2.46 0.07 0.00 -1.00 0.00 0.00 55.97 57.50 2vuy s LYS 167 Cb 0.00 -3.67 -0.01 0.00 -2.06 0.00 0.00 37.83 32.08 2vuy s LYS 167 CO 0.00 -0.81 0.33 0.21 0.10 0.00 0.00 175.35 175.18 2vuy s LYS 168 N 2.94 2.36 -0.64 1.78 2.20 -1.26 -4.94 119.74 122.18 2vuy s LYS 168 Ca 0.78 -1.77 -0.33 0.00 -0.36 0.00 0.00 55.97 54.29 2vuy s LYS 168 Cb -0.42 -2.18 -0.15 0.00 -1.51 0.00 0.00 37.83 33.57 2vuy s LYS 168 CO 0.35 -0.30 2.42 0.28 -0.36 0.00 0.00 175.35 177.74 2vuy n VAL 169 N -1.52 0.03 -0.86 4.02 0.31 -1.26 -4.88 118.33 114.17 2vuy n VAL 169 Ca 0.01 -0.24 -0.34 0.00 -0.01 0.00 0.00 64.34 63.76 2vuy n VAL 169 Cb 0.63 -1.30 0.09 0.00 -0.91 0.00 0.00 33.84 32.36 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 8.38 -0.22 0.06 5.55 -0.02 -1.26 -4.91 135.00 142.58 2vuy n PRO 170 Ca 0.52 -0.04 -0.08 0.00 -2.02 0.00 0.00 63.50 61.87 2vuy n PRO 170 Cb 0.18 -1.55 0.06 0.00 -0.02 0.00 0.00 33.50 32.17 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 -1.38 0.41 -0.59 2.45 3.38 -2.00 -3.28 115.31 114.29 2vuy h LEU 171 Ca -0.44 -0.26 -0.15 0.00 0.09 0.00 0.00 57.88 57.12 2vuy h LEU 171 Cb 1.29 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.91 2vuy h LEU 171 CO 0.30 0.97 -0.67 0.07 0.09 0.00 0.00 178.44 179.20 2vuy h LYS 172 N 0.25 0.15 -0.47 1.13 2.10 -1.91 -3.21 116.57 114.61 2vuy h LYS 172 Ca -0.02 -0.12 0.00 0.00 -2.00 0.00 0.00 60.65 58.51 2vuy h LYS 172 Cb 1.23 0.02 0.00 0.00 -0.90 0.00 0.00 32.23 32.59 2vuy h LYS 172 CO 0.11 0.77 0.00 -0.25 -2.00 0.00 0.00 179.45 178.08 2vuy n ASP 173 N -3.79 2.47 -4.81 7.07 8.00 -1.24 -4.65 116.55 119.60 2vuy n ASP 173 Ca -0.02 -2.06 -0.32 0.00 0.71 0.00 0.00 54.79 53.09 2vuy n ASP 173 Cb 0.66 -0.32 0.00 0.00 -0.02 0.00 0.00 41.12 41.44 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 -1.49 4.01 -0.27 -3.53 2.01 -1.22 -4.89 115.64 110.27 2vuy s THR 174 Ca 0.29 0.94 -0.01 0.00 0.31 0.00 0.00 61.69 63.23 2vuy s THR 174 Cb 0.16 -3.48 0.15 0.00 0.01 0.00 0.00 72.50 69.34 2vuy s THR 174 CO 0.18 -0.58 0.40 -0.69 -0.69 0.00 0.00 174.62 173.25 2vuy s VAL 175 N -2.53 -0.63 0.08 3.82 1.01 -1.26 -4.52 120.40 116.35 2vuy s VAL 175 Ca 0.62 -0.17 -0.26 0.00 0.00 0.00 0.00 61.98 62.17 2vuy s VAL 175 Cb -0.14 -0.90 -0.06 0.00 0.00 0.00 0.00 36.38 35.28 2vuy s VAL 175 CO 0.37 -0.19 0.80 -0.63 0.00 0.00 0.00 175.10 175.44 2vuy s ILE 176 N 2.56 4.63 -0.29 2.22 1.01 -0.84 -2.70 121.20 127.79 2vuy s ILE 176 Ca 0.12 1.72 0.02 0.00 0.00 0.00 0.00 60.65 62.50 2vuy s ILE 176 Cb -0.14 -4.15 0.07 0.00 0.01 0.00 0.00 42.46 38.24 2vuy s ILE 176 CO -0.23 0.38 -0.04 -0.47 0.00 0.00 0.00 174.94 174.59 2vuy s TYR 177 N -0.22 3.39 -0.39 3.97 5.04 -0.37 0.21 117.35 128.99 2vuy s TYR 177 Ca 0.39 -2.40 -0.24 0.00 -2.44 0.00 0.00 57.07 52.38 2vuy s TYR 177 Cb -0.21 -2.25 0.02 0.00 0.35 0.00 0.00 41.96 39.86 2vuy s TYR 177 CO 0.25 -0.89 0.85 -2.00 -1.34 0.00 0.00 175.55 172.42 2vuy s GLU 178 N 1.09 3.71 0.27 4.97 2.12 -0.32 -0.04 118.70 130.49 2vuy s GLU 178 Ca -0.03 0.33 0.07 0.00 0.36 0.00 0.00 54.97 55.70 2vuy s GLU 178 Cb -0.20 -3.84 -0.06 0.00 0.26 0.00 0.00 34.13 30.30 2vuy s GLU 178 CO -0.05 -0.96 -0.07 0.14 -0.54 0.00 0.00 175.26 173.78 2vuy s VAL 179 N 3.33 1.64 -0.19 3.70 -7.23 -0.82 -0.12 120.40 120.71 2vuy s VAL 179 Ca 0.34 -2.14 -0.03 0.00 -1.81 0.00 0.00 61.98 58.35 2vuy s VAL 179 Cb -0.12 -2.39 -0.01 0.00 0.56 0.00 0.00 36.38 34.42 2vuy s VAL 179 CO 0.19 -0.34 -0.08 -2.28 -0.31 0.00 0.00 175.10 172.28 2vuy s HIS 180 N -3.01 2.91 0.34 2.82 2.46 -1.26 -1.79 115.29 117.76 2vuy s HIS 180 Ca 0.28 -0.92 0.12 0.00 0.47 0.00 0.00 55.06 55.02 2vuy s HIS 180 Cb 0.03 -2.03 0.95 0.00 -0.13 0.00 0.00 32.58 31.40 2vuy s HIS 180 CO 0.11 -0.48 1.74 0.28 -2.47 0.00 0.00 174.74 173.92 2vuy h VAL 181 N 5.64 0.54 0.00 0.89 2.07 -1.93 -0.55 116.25 122.92 2vuy h VAL 181 Ca -0.38 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 66.95 2vuy h VAL 181 Cb 1.17 -0.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.90 2vuy h VAL 181 CO 0.60 0.10 0.00 1.17 0.02 0.00 0.00 177.57 179.46 2vuy n LYS 182 N -4.80 0.00 -0.24 1.57 3.00 -1.26 -3.71 118.16 112.72 2vuy n LYS 182 Ca 0.26 0.48 0.28 0.00 -0.00 0.00 0.00 58.31 59.34 2vuy n LYS 182 Cb 0.78 -1.10 0.68 0.00 0.00 0.00 0.00 35.03 35.38 2vuy n LYS 182 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.40 178.18 2vuy h GLY 183 N 0.00 0.28 0.80 3.14 0.00 -1.86 -1.82 103.07 103.61 2vuy h GLY 183 Ca 0.00 -0.05 0.11 0.00 0.00 0.00 0.00 47.33 47.39 2vuy h GLY 183 CO 0.00 -0.02 0.51 -2.75 0.00 0.00 0.00 176.54 174.28 2vuy h PHE 184 N 0.11 0.71 0.00 5.60 3.57 -1.25 -0.29 116.94 125.38 2vuy h PHE 184 Ca 0.49 0.02 0.00 0.00 3.53 0.00 0.00 57.97 62.01 2vuy h PHE 184 Cb 1.76 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 40.27 2vuy h PHE 184 CO -0.00 0.32 0.00 0.25 -2.23 0.00 0.00 178.31 176.64 2vuy n THR 185 N -4.51 0.08 -0.07 4.41 -2.24 -0.91 -4.81 114.28 106.23 2vuy n THR 185 Ca 0.14 -0.25 -0.07 0.00 -2.27 0.00 0.00 64.05 61.60 2vuy n THR 185 Cb 0.38 1.44 -0.01 0.00 -2.10 0.00 0.00 70.33 70.04 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 0.05 -1.28 -0.78 1.63 -1.44 -2.18 116.57 112.57 2vuy h LYS 186 Ca 0.00 -0.00 -0.36 0.00 -0.85 0.00 0.00 60.65 59.44 2vuy h LYS 186 Cb 0.39 -0.01 -0.17 0.00 -0.60 0.00 0.00 32.23 31.84 2vuy h LYS 186 CO 0.00 0.03 0.46 1.28 -3.45 0.00 0.00 179.45 177.78 2vuy n LEU 187 N -5.19 6.19 -4.13 5.20 4.32 -1.26 -4.73 117.00 117.40 2vuy n LEU 187 Ca -0.00 -3.23 -0.38 0.00 -0.02 0.00 0.00 56.01 52.38 2vuy n LEU 187 Cb 0.15 -0.93 -0.07 0.00 -1.62 0.00 0.00 43.42 40.96 2vuy n LEU 187 CO 0.22 1.12 0.23 -0.60 -1.22 0.00 0.00 177.39 177.14 2vuy s ARG 188 N -2.10 3.02 0.00 3.23 6.06 -0.82 -4.44 118.95 123.90 2vuy s ARG 188 Ca 0.36 -2.86 0.07 0.00 -2.50 0.00 0.00 55.73 50.80 2vuy s ARG 188 Cb 0.29 -3.92 0.42 0.00 0.06 0.00 0.00 34.95 31.80 2vuy s ARG 188 CO 0.02 -1.23 0.83 1.28 -2.50 0.00 0.00 175.30 173.70 2vuy n LEU 189 N 3.03 0.00 0.09 -0.88 7.99 -1.26 -2.15 117.00 123.82 2vuy n LEU 189 Ca 0.15 0.00 -0.23 0.00 -0.01 0.00 0.00 56.01 55.92 2vuy n LEU 189 Cb 0.38 0.00 -0.13 0.00 -0.11 0.00 0.00 43.42 43.56 2vuy n LEU 189 CO 0.35 0.00 -0.08 -0.78 -1.51 0.00 0.00 177.39 175.37 2vuy h ASP 190 N 0.00 0.88 -3.79 -1.43 1.82 -1.95 -3.45 116.42 108.50 2vuy h ASP 190 Ca 0.00 -0.83 -0.49 0.00 -0.39 0.00 0.00 57.03 55.32 2vuy h ASP 190 Cb 0.00 -0.28 -0.02 0.00 0.68 0.00 0.00 39.33 39.72 2vuy h ASP 190 CO 0.00 1.62 0.15 -0.76 -1.61 0.00 0.00 179.24 178.64 2vuy s LEU 191 N -7.86 3.96 0.51 2.28 1.43 -0.91 -5.05 118.68 113.05 2vuy s LEU 191 Ca -0.10 1.31 -0.20 0.00 -1.03 0.00 0.00 54.13 54.12 2vuy s LEU 191 Cb 0.05 -4.15 -0.10 0.00 0.03 0.00 0.00 46.19 42.03 2vuy s LEU 191 CO 0.93 -0.29 0.54 -0.81 0.23 0.00 0.00 176.35 176.95 2vuy n PRO 192 N -0.70 0.57 -0.07 1.29 -0.04 -1.26 -4.80 135.00 130.00 2vuy n PRO 192 Ca 0.04 0.22 0.01 0.00 -0.04 0.00 0.00 63.50 63.73 2vuy n PRO 192 Cb 0.53 -1.65 0.04 0.00 -0.04 0.00 0.00 33.50 32.39 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 0.20 1.30 0.00 0.54 2.13 -1.26 -2.69 120.64 120.86 2vuy n GLU 193 Ca 0.11 -0.31 0.00 0.00 0.66 0.00 0.00 57.16 57.63 2vuy n GLU 193 Cb 0.45 -1.32 0.00 0.00 0.27 0.00 0.00 31.44 30.83 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 -0.10 1.06 0.00 4.31 6.94 -1.26 -4.60 115.26 121.60 2vuy n ASN 194 Ca 0.03 -1.29 0.00 0.00 -0.02 0.00 0.00 54.58 53.29 2vuy n ASN 194 Cb 0.21 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.63 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 -0.15 0.25 -2.23 1.53 -5.35 -1.10 -4.81 119.36 107.51 2vuy n ILE 195 Ca 0.00 -0.50 -0.42 0.00 -0.27 0.00 0.00 62.75 61.56 2vuy n ILE 195 Cb 0.16 1.04 -0.03 0.00 -1.74 0.00 0.00 39.64 39.07 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 -0.25 4.32 -0.24 6.28 0.52 -1.25 -2.86 118.95 125.47 2vuy s ARG 196 Ca 0.00 1.98 0.00 0.00 -0.52 0.00 0.00 55.73 57.19 2vuy s ARG 196 Cb 0.00 -3.40 0.00 0.00 0.52 0.00 0.00 34.95 32.07 2vuy s ARG 196 CO 0.00 -0.47 0.00 0.41 0.02 0.00 0.00 175.30 175.26 2vuy n GLY 197 N 3.52 0.42 3.53 -3.53 0.00 -1.25 -4.60 105.19 103.28 2vuy n GLY 197 Ca 0.12 -0.88 -0.25 0.00 0.00 0.00 0.00 46.02 45.01 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 -2.11 1.29 0.07 2.61 -4.23 -1.14 -4.01 115.64 108.12 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 -2.70 -0.17 0.00 1.34 0.00 0.00 72.50 70.97 2vuy s THR 198 CO 0.00 0.00 1.62 1.88 -0.54 0.00 0.00 174.62 177.58 2vuy h TYR 199 N 1.90 -0.22 -0.97 3.99 0.99 -1.37 -1.93 116.97 119.36 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 1.26 0.07 -0.09 0.00 1.00 0.00 0.00 36.73 38.97 2vuy h TYR 199 CO 0.86 -0.07 0.61 1.49 -0.00 0.00 0.00 178.16 181.05 2vuy h GLU 200 N -0.32 0.71 -0.26 4.88 4.81 -1.82 -1.70 114.58 120.88 2vuy h GLU 200 Ca -0.02 -0.04 -0.08 0.00 -0.13 0.00 0.00 59.36 59.09 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 0.04 0.47 -0.14 0.78 -0.73 0.00 0.00 179.01 179.43 2vuy h GLY 201 N 0.73 0.60 1.31 1.92 0.00 -1.42 -2.87 103.07 103.34 2vuy h GLY 201 Ca 0.52 -0.55 0.09 0.00 0.00 0.00 0.00 47.33 47.40 2vuy h GLY 201 CO -0.29 0.50 0.25 -2.00 0.00 0.00 0.00 176.54 175.00 2vuy h LEU 202 N 0.28 0.00 -3.44 3.11 6.46 -0.53 -0.84 115.31 120.34 2vuy h LEU 202 Ca 0.06 0.00 -0.03 0.00 -0.12 0.00 0.00 57.88 57.79 2vuy h LEU 202 Cb 0.66 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 40.57 2vuy h LEU 202 CO 0.04 0.00 0.03 0.00 -0.62 0.00 0.00 178.44 177.89 2vuy n ALA 203 N -2.55 3.58 -1.28 1.25 0.00 -1.07 -4.51 120.51 115.93 2vuy n ALA 203 Ca 0.05 -2.19 -0.32 0.00 0.00 0.00 0.00 53.44 50.98 2vuy n ALA 203 Cb 0.42 -0.94 0.09 0.00 0.00 0.00 0.00 19.45 19.02 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 -1.39 4.46 0.28 0.00 1.04 -0.32 -4.75 113.70 113.01 2vuy s SER 204 Ca 0.49 1.99 -0.01 0.00 0.48 0.00 0.00 55.95 58.91 2vuy s SER 204 Cb 0.39 -2.55 0.48 0.00 0.10 0.00 0.00 66.02 64.44 2vuy s SER 204 CO 0.12 -2.07 1.87 -0.33 0.98 0.00 0.00 173.24 173.82 2vuy h GLU 205 N -0.74 1.06 -0.64 4.02 3.07 -1.91 -0.54 114.58 118.91 2vuy h GLU 205 Ca -0.45 -0.06 -0.03 0.00 -0.50 0.00 0.00 59.36 58.32 2vuy h GLU 205 Cb 1.25 -0.24 -0.03 0.00 -0.84 0.00 0.00 28.75 28.89 2vuy h GLU 205 CO 0.51 0.70 0.28 1.96 -1.40 0.00 0.00 179.01 181.07 2vuy h GLN 206 N 1.10 0.93 -0.08 2.33 7.50 -1.93 -1.63 115.11 123.33 2vuy h GLN 206 Ca 0.45 -0.15 -0.20 0.00 0.50 0.00 0.00 58.65 59.25 2vuy h GLN 206 Cb 0.28 -0.16 -0.00 0.00 0.05 0.00 0.00 27.48 27.64 2vuy h GLN 206 CO -0.20 0.76 -0.77 0.52 -1.50 0.00 0.00 178.83 177.65 2vuy h MET 207 N 0.88 0.46 -0.48 1.46 2.86 -1.68 -2.51 114.93 115.92 2vuy h MET 207 Ca 0.22 -0.39 -0.11 0.00 -2.06 0.00 0.00 59.70 57.35 2vuy h MET 207 Cb 0.15 0.09 -0.02 0.00 0.06 0.00 0.00 31.60 31.88 2vuy h MET 207 CO -0.02 1.03 -0.15 0.82 1.06 0.00 0.00 176.91 179.64 2vuy h ILE 208 N 0.30 1.27 -0.82 -1.22 2.04 -1.01 -0.94 117.51 117.13 2vuy h ILE 208 Ca -0.04 -1.28 -0.03 0.00 1.00 0.00 0.00 64.86 64.51 2vuy h ILE 208 Cb 1.36 1.06 -0.04 0.00 -0.74 0.00 0.00 36.82 38.46 2vuy h ILE 208 CO 0.14 0.44 0.41 0.28 0.00 0.00 0.00 178.15 179.42 2vuy h SER 209 N 0.81 1.06 0.01 1.72 0.02 -1.26 -0.19 113.55 115.72 2vuy h SER 209 Ca 0.12 -0.12 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2vuy h SER 209 Cb 0.69 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 62.96 2vuy h SER 209 CO 0.05 0.88 -0.01 0.22 -1.14 0.00 0.00 176.83 176.84 2vuy h TYR 210 N 1.16 -0.02 -0.67 3.45 3.20 -0.95 -0.03 116.97 123.11 2vuy h TYR 210 Ca 0.28 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.15 2vuy h TYR 210 Cb 0.09 0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.34 2vuy h TYR 210 CO 0.01 0.05 0.42 -0.07 -1.64 0.00 0.00 178.16 176.92 2vuy h LEU 211 N -0.07 0.80 -0.32 2.82 3.38 -0.81 -0.37 115.31 120.74 2vuy h LEU 211 Ca -0.00 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 2vuy h LEU 211 Cb 0.07 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 2vuy h LEU 211 CO 0.00 0.62 0.16 0.11 0.09 0.00 0.00 178.44 179.42 2vuy h LYS 212 N 0.92 0.45 -0.70 1.13 1.79 -0.86 -1.46 116.57 117.83 2vuy h LYS 212 Ca 0.24 -0.06 -0.04 0.00 -2.18 0.00 0.00 60.65 58.62 2vuy h LYS 212 Cb -0.05 -0.08 -0.03 0.00 -1.58 0.00 0.00 32.23 30.49 2vuy h LYS 212 CO -0.05 0.40 0.29 -0.44 -1.08 0.00 0.00 179.45 178.57 2vuy h ASP 213 N 0.38 0.94 0.51 0.86 3.32 -0.66 -1.58 116.42 120.21 2vuy h ASP 213 Ca 0.11 -0.13 -0.05 0.00 0.02 0.00 0.00 57.03 56.98 2vuy h ASP 213 Cb 0.09 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.39 2vuy h ASP 213 CO -0.02 0.83 -0.24 0.25 -1.72 0.00 0.00 179.24 178.35 2vuy h LEU 214 N 1.01 0.00 0.00 1.55 5.85 -0.80 -3.47 115.31 119.45 2vuy h LEU 214 Ca 0.24 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.96 2vuy h LEU 214 Cb 0.18 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.21 2vuy h LEU 214 CO -0.02 0.24 0.00 0.61 -0.34 0.00 0.00 178.44 178.93 2vuy n GLY 215 N -0.38 0.61 3.77 3.75 0.00 -0.57 -4.71 105.19 107.66 2vuy n GLY 215 Ca -0.01 -0.35 -0.38 0.00 0.00 0.00 0.00 46.02 45.28 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 4.14 -0.10 -0.61 -5.25 -1.20 -4.97 121.20 111.22 2vuy s ILE 216 Ca 0.00 1.86 -0.15 0.00 -0.99 0.00 0.00 60.65 61.37 2vuy s ILE 216 Cb 0.00 -4.07 -0.28 0.00 2.95 0.00 0.00 42.46 41.07 2vuy s ILE 216 CO 0.00 0.22 0.57 0.71 -1.79 0.00 0.00 174.94 174.65 2vuy h THR 217 N 2.72 1.02 -3.83 8.37 1.35 -1.85 -3.45 112.91 117.24 2vuy h THR 217 Ca -0.46 -2.41 -0.47 0.00 -0.55 0.00 0.00 66.41 62.52 2vuy h THR 217 Cb 1.19 2.72 -0.21 0.00 -1.73 0.00 0.00 68.15 70.13 2vuy h THR 217 CO 0.66 0.72 -0.79 0.42 -0.25 0.00 0.00 175.52 176.28 2vuy s THR 218 N -2.49 1.39 -0.13 6.82 -4.23 -1.10 -1.93 115.64 113.97 2vuy s THR 218 Ca -0.19 -1.50 -0.01 0.00 -1.18 0.00 0.00 61.69 58.81 2vuy s THR 218 Cb 0.04 -1.36 -0.02 0.00 1.34 0.00 0.00 72.50 72.50 2vuy s THR 218 CO 0.78 -0.21 -0.10 0.68 -0.54 0.00 0.00 174.62 175.22 2vuy s VAL 219 N -1.45 3.35 -0.70 2.29 -7.23 -0.67 -1.24 120.40 114.74 2vuy s VAL 219 Ca 0.04 -0.56 -0.12 0.00 -1.81 0.00 0.00 61.98 59.52 2vuy s VAL 219 Cb -0.09 -2.42 0.18 0.00 0.56 0.00 0.00 36.38 34.62 2vuy s VAL 219 CO 0.03 0.52 0.62 -0.70 -0.31 0.00 0.00 175.10 175.27 2vuy s GLU 220 N 0.21 3.21 0.21 4.82 2.12 0.94 -0.82 118.70 129.39 2vuy s GLU 220 Ca -0.06 -2.24 -0.31 0.00 0.36 0.00 0.00 54.97 52.71 2vuy s GLU 220 Cb -0.15 -4.25 -0.11 0.00 0.26 0.00 0.00 34.13 29.88 2vuy s GLU 220 CO 0.04 -1.27 1.57 -0.51 -0.54 0.00 0.00 175.26 174.55 2vuy s LEU 221 N 0.55 4.37 1.09 2.70 1.02 -0.45 -1.95 118.68 126.01 2vuy s LEU 221 Ca 0.13 2.72 -0.14 0.00 0.02 0.00 0.00 54.13 56.87 2vuy s LEU 221 Cb -0.17 -3.61 0.24 0.00 0.02 0.00 0.00 46.19 42.67 2vuy s LEU 221 CO -0.05 -0.84 1.07 -0.04 0.02 0.00 0.00 176.35 176.51 2vuy s MET 222 N 0.61 -0.32 0.10 1.70 -1.94 -0.74 -0.73 119.30 117.98 2vuy s MET 222 Ca 0.68 0.49 -0.35 0.00 -1.71 0.00 0.00 55.69 54.80 2vuy s MET 222 Cb -0.45 -1.65 -0.18 0.00 2.01 0.00 0.00 34.83 34.56 2vuy s MET 222 CO 0.36 -3.23 0.95 -2.30 -0.01 0.00 0.00 175.02 170.79 2vuy n PRO 223 N -4.52 0.32 0.00 2.03 -0.02 -1.26 -4.55 135.00 127.00 2vuy n PRO 223 Ca 0.05 0.11 0.00 0.00 -2.02 0.00 0.00 63.50 61.65 2vuy n PRO 223 Cb 0.57 -1.48 0.00 0.00 -0.02 0.00 0.00 33.50 32.57 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 1.12 0.00 -1.68 -1.45 0.24 -1.26 -4.83 118.33 110.47 2vuy n VAL 224 Ca 0.18 -0.30 -0.45 0.00 -2.04 0.00 0.00 64.34 61.73 2vuy n VAL 224 Cb 0.17 1.13 -0.04 0.00 -1.47 0.00 0.00 33.84 33.63 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 -0.41 2.47 -1.67 6.34 3.72 -1.26 0.07 117.46 126.72 2vuy n PHE 225 Ca 0.00 -0.00 -0.65 0.00 -0.05 0.00 0.00 57.45 56.75 2vuy n PHE 225 Cb 0.03 -2.67 -0.09 0.00 -0.94 0.00 0.00 39.48 35.81 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 5.22 1.43 -4.54 1.38 -0.00 0.06 -4.65 115.22 114.12 2vuy n HIS 226 Ca 0.19 1.09 -0.26 0.00 0.46 0.00 0.00 57.72 59.20 2vuy n HIS 226 Cb 0.33 -2.20 -0.09 0.00 -0.12 0.00 0.00 29.99 27.91 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 2.08 1.88 0.03 1.57 -0.12 -1.26 -2.59 117.98 119.56 2vuy s PHE 227 Ca 1.00 -1.11 0.06 0.00 -0.05 0.00 0.00 56.93 56.84 2vuy s PHE 227 Cb -1.40 -1.29 -0.02 0.00 -0.63 0.00 0.00 43.02 39.68 2vuy s PHE 227 CO 0.73 -0.10 -0.19 0.42 -0.05 0.00 0.00 175.22 176.04 2vuy s ILE 228 N -3.17 1.50 -0.23 -4.49 1.01 -1.09 -4.93 121.20 109.80 2vuy s ILE 228 Ca 0.25 -1.04 -0.29 0.00 0.00 0.00 0.00 60.65 59.57 2vuy s ILE 228 Cb 0.05 -1.30 0.00 0.00 0.01 0.00 0.00 42.46 41.22 2vuy s ILE 228 CO 0.13 0.23 1.13 -1.81 0.00 0.00 0.00 174.94 174.62 2vuy s ASP 229 N -0.95 7.00 0.34 3.58 1.01 -1.26 -4.88 116.67 121.50 2vuy s ASP 229 Ca 0.06 1.40 -0.27 0.00 0.71 0.00 0.00 52.55 54.45 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 -0.76 1.16 0.00 0.21 0.00 0.00 175.17 175.79 2vuy n GLN 230 N 6.56 1.77 -0.26 8.23 3.00 -1.26 -4.78 117.38 130.64 2vuy n GLN 230 Ca 0.13 0.62 0.09 0.00 -0.01 0.00 0.00 57.00 57.83 2vuy n GLN 230 Cb 0.46 -2.14 0.34 0.00 0.00 0.00 0.00 30.24 28.90 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 2.22 0.76 0.00 -1.09 2.43 -1.97 -0.21 114.38 116.52 2vuy h ARG 231 Ca -0.44 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.69 2vuy h ARG 231 Cb 1.31 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.69 2vuy h ARG 231 CO 0.61 0.51 0.00 0.27 -1.51 0.00 0.00 179.97 179.85 2vuy h PHE 232 N 0.79 0.00 0.12 2.20 -5.15 -1.97 0.29 116.94 113.22 2vuy h PHE 232 Ca 0.40 0.00 -0.33 0.00 -0.20 0.00 0.00 57.97 57.84 2vuy h PHE 232 Cb 0.49 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 36.65 2vuy h PHE 232 CO -0.00 0.00 -1.76 -0.07 -2.00 0.00 0.00 178.31 174.48 2vuy h LEU 233 N 0.00 0.41 -0.28 2.10 -0.00 -1.37 -3.33 115.31 112.84 2vuy h LEU 233 Ca 0.00 -0.89 -0.01 0.00 -0.00 0.00 0.00 57.88 56.98 2vuy h LEU 233 Cb 0.23 -0.13 -0.01 0.00 -0.00 0.00 0.00 40.66 40.75 2vuy h LEU 233 CO 0.00 1.76 0.14 0.74 -0.00 0.00 0.00 178.44 181.08 2vuy h THR 234 N -0.10 1.14 0.00 0.22 2.02 -0.87 0.25 112.91 115.56 2vuy h THR 234 Ca -0.38 -0.38 0.00 0.00 0.77 0.00 0.00 66.41 66.42 2vuy h THR 234 Cb 1.92 0.88 0.00 0.00 -1.74 0.00 0.00 68.15 69.21 2vuy h THR 234 CO 0.07 0.14 0.00 0.47 0.37 0.00 0.00 175.52 176.57 2vuy n ASP 235 N -4.81 0.00 -1.21 4.18 8.00 0.93 -2.10 116.55 121.53 2vuy n ASP 235 Ca -0.02 -0.52 0.04 0.00 0.71 0.00 0.00 54.79 55.00 2vuy n ASP 235 Cb 0.09 0.00 0.06 0.00 -0.02 0.00 0.00 41.12 41.25 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 -0.84 0.33 -0.82 -1.24 2.85 -0.79 -5.00 118.16 112.65 2vuy n LYS 236 Ca 0.07 -2.18 0.00 0.00 -1.05 0.00 0.00 58.31 55.14 2vuy n LYS 236 Cb 0.03 -0.38 0.00 0.00 -0.65 0.00 0.00 35.03 34.03 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 0.11 0.50 0.84 2.58 0.00 -0.89 -4.99 105.19 103.33 2vuy n GLY 237 Ca 0.08 0.00 -0.04 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 -3.93 0.99 4.77 0.80 -4.98 117.00 114.65 2vuy n LEU 238 Ca 0.00 -0.52 -0.09 0.00 -0.03 0.00 0.00 56.01 55.37 2vuy n LEU 238 Cb 0.04 -0.10 -0.05 0.00 -2.33 0.00 0.00 43.42 40.98 2vuy n LEU 238 CO 0.00 -0.56 0.20 0.28 -1.33 0.00 0.00 177.39 175.98 2vuy s THR 239 N 0.08 0.01 -0.50 -5.08 -1.32 -1.25 -3.72 115.64 103.86 2vuy s THR 239 Ca 0.13 -1.25 -0.19 0.00 -1.21 0.00 0.00 61.69 59.18 2vuy s THR 239 Cb -0.01 -2.02 0.06 0.00 -1.51 0.00 0.00 72.50 69.01 2vuy s THR 239 CO 0.09 -0.06 0.62 0.21 -2.21 0.00 0.00 174.62 173.27 2vuy s ASN 240 N -2.98 6.23 -0.14 8.08 3.84 -1.26 -4.20 114.94 124.51 2vuy s ASN 240 Ca 0.18 -0.89 -0.25 0.00 0.21 0.00 0.00 52.86 52.12 2vuy s ASN 240 Cb -0.01 -2.29 -0.26 0.00 -0.55 0.00 0.00 41.25 38.15 2vuy s ASN 240 CO 0.06 -0.88 0.65 0.22 -2.79 0.00 0.00 177.10 174.35 2vuy h TYR 241 N 8.98 0.14 0.24 0.43 3.20 -1.09 -3.39 116.97 125.48 2vuy h TYR 241 Ca -0.27 -0.10 -0.01 0.00 3.14 0.00 0.00 58.73 61.48 2vuy h TYR 241 Cb 1.10 -0.01 0.00 0.00 1.54 0.00 0.00 36.73 39.36 2vuy h TYR 241 CO 0.75 1.22 -0.12 -1.49 -1.64 0.00 0.00 178.16 176.88 2vuy h TRP 242 N -0.81 -0.30 0.00 -3.82 6.55 -1.79 -3.48 115.95 112.30 2vuy h TRP 242 Ca -0.13 -0.01 0.00 0.00 0.95 0.00 0.00 58.89 59.70 2vuy h TRP 242 Cb 1.26 0.10 0.00 0.00 -0.86 0.00 0.00 29.16 29.66 2vuy h TRP 242 CO 0.21 -0.04 0.00 0.41 -1.05 0.00 0.00 178.44 177.96 2vuy n GLY 243 N -0.68 1.11 2.64 1.49 0.00 -1.26 -4.13 105.19 104.37 2vuy n GLY 243 Ca -0.09 0.00 -0.41 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 -1.72 3.14 0.00 1.61 4.02 -1.26 -4.40 117.16 118.55 2vuy n TYR 244 Ca 0.00 -2.97 0.00 0.00 -0.01 0.00 0.00 57.90 54.92 2vuy n TYR 244 Cb 0.00 -2.41 0.00 0.00 -0.02 0.00 0.00 39.34 36.91 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 4.94 0.00 -4.97 7.72 4.64 -1.26 -5.03 116.55 122.59 2vuy n ASP 245 Ca 0.56 0.00 -0.21 0.00 -1.38 0.00 0.00 54.79 53.76 2vuy n ASP 245 Cb 0.34 0.00 0.04 0.00 -1.04 0.00 0.00 41.12 40.46 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 2.53 0.00 -0.67 0.04 -1.26 -2.68 135.00 132.96 2vuy s PRO 246 Ca 0.00 -0.76 0.00 0.00 0.04 0.00 0.00 61.00 60.28 2vuy s PRO 246 Cb 0.00 -2.48 0.00 0.00 0.04 0.00 0.00 34.50 32.06 2vuy s PRO 246 CO 0.00 -0.73 0.13 0.44 0.04 0.00 0.00 177.00 176.88 2vuy n ILE 247 N -2.36 0.00 -3.78 0.56 -6.64 -1.07 0.28 119.36 106.36 2vuy n ILE 247 Ca 0.08 -0.29 -0.13 0.00 -1.77 0.00 0.00 62.75 60.65 2vuy n ILE 247 Cb 0.60 1.19 -0.11 0.00 -1.44 0.00 0.00 39.64 39.88 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 -0.32 -0.28 -0.17 7.28 3.84 -1.25 -4.90 114.94 119.13 2vuy s ASN 248 Ca 0.00 0.53 0.16 0.00 0.21 0.00 0.00 52.86 53.76 2vuy s ASN 248 Cb 0.00 0.56 0.63 0.00 -0.55 0.00 0.00 41.25 41.89 2vuy s ASN 248 CO 0.00 -0.12 1.54 0.49 -2.79 0.00 0.00 177.10 176.22 2vuy n PHE 249 N 2.80 1.33 0.00 0.43 3.72 -1.26 -4.04 117.46 120.44 2vuy n PHE 249 Ca -0.13 -0.76 0.00 0.00 -0.05 0.00 0.00 57.45 56.51 2vuy n PHE 249 Cb 0.58 -0.34 0.00 0.00 -0.94 0.00 0.00 39.48 38.78 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 0.19 0.00 -3.84 1.38 3.01 -1.26 -4.82 117.46 112.11 2vuy n PHE 250 Ca 0.23 0.00 -0.36 0.00 1.01 0.00 0.00 57.45 58.33 2vuy n PHE 250 Cb 0.94 0.00 -0.07 0.00 -0.01 0.00 0.00 39.48 40.34 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 -0.83 6.26 0.52 4.37 0.01 -1.22 -4.65 113.70 118.16 2vuy s SER 251 Ca 0.00 0.36 -0.20 0.00 1.31 0.00 0.00 55.95 57.42 2vuy s SER 251 Cb 0.00 -2.06 -0.07 0.00 0.21 0.00 0.00 66.02 64.11 2vuy s SER 251 CO 0.00 0.32 1.11 -2.84 0.41 0.00 0.00 173.24 172.24 2vuy s PRO 252 N -0.47 3.52 0.21 12.44 0.02 -1.26 -0.76 135.00 148.69 2vuy s PRO 252 Ca 0.12 1.57 -0.32 0.00 0.02 0.00 0.00 61.00 62.38 2vuy s PRO 252 Cb -0.12 -2.08 -0.13 0.00 0.02 0.00 0.00 34.50 32.20 2vuy s PRO 252 CO 0.02 -0.70 1.64 -1.91 -0.33 0.00 0.00 177.00 175.71 2vuy n GLU 253 N -1.11 2.51 0.00 5.54 0.00 0.11 -4.44 120.64 123.26 2vuy n GLU 253 Ca 0.11 0.90 0.00 0.00 0.00 0.00 0.00 57.16 58.17 2vuy n GLU 253 Cb 0.51 -2.71 0.30 0.00 0.00 0.00 0.00 31.44 29.55 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 -4.28 0.27 -0.18 0.00 1.85 -1.26 -2.58 116.66 110.48 2vuy n ARG 255 Ca 0.01 0.07 0.09 0.00 -1.00 0.00 0.00 57.85 57.03 2vuy n ARG 255 Cb 0.24 -1.50 0.19 0.00 -1.05 0.00 0.00 32.46 30.34 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 -1.33 0.47 -3.17 2.89 4.01 -1.17 -4.93 117.16 113.93 2vuy n TYR 256 Ca 0.10 -0.30 -0.39 0.00 -0.16 0.00 0.00 57.90 57.16 2vuy n TYR 256 Cb 0.21 -0.01 -0.06 0.00 -0.31 0.00 0.00 39.34 39.18 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 -1.24 7.05 0.00 7.72 0.15 -1.07 -1.01 113.70 125.31 2vuy s SER 257 Ca 0.32 1.25 0.23 0.00 0.70 0.00 0.00 55.95 58.46 2vuy s SER 257 Cb 0.19 -2.39 0.15 0.00 -1.71 0.00 0.00 66.02 62.25 2vuy s SER 257 CO 0.26 0.12 1.17 -1.54 1.20 0.00 0.00 173.24 174.44 2vuy n SER 258 N 2.52 1.04 -2.18 5.45 3.41 -1.26 -4.44 113.62 118.16 2vuy n SER 258 Ca -0.07 -0.86 -0.22 0.00 -0.26 0.00 0.00 58.87 57.47 2vuy n SER 258 Cb 0.51 0.59 0.02 0.00 -0.26 0.00 0.00 64.21 65.06 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 -1.14 2.36 -0.71 6.66 -2.24 -1.26 -4.99 114.28 112.96 2vuy n THR 259 Ca 0.06 -4.18 0.00 0.00 -2.27 0.00 0.00 64.05 57.67 2vuy n THR 259 Cb 0.36 -0.89 0.00 0.00 -2.10 0.00 0.00 70.33 67.70 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 -0.65 -2.52 0.27 3.38 0.00 -1.26 -4.11 105.19 100.30 2vuy n GLY 260 Ca 0.39 -1.62 0.07 0.00 0.00 0.00 0.00 46.02 44.85 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 -0.93 5.35 0.00 0.00 7.99 -1.26 -3.82 117.00 124.34 2vuy n LEU 262 Ca 0.11 -2.75 0.00 0.00 -0.01 0.00 0.00 56.01 53.36 2vuy n LEU 262 Cb 0.68 -0.69 0.00 0.00 -0.11 0.00 0.00 43.42 43.29 2vuy n LEU 262 CO 0.00 0.67 0.00 0.61 -1.51 0.00 0.00 177.39 177.16 2vuy n GLY 263 N 0.20 1.39 0.28 -0.72 0.00 -1.26 -4.73 105.19 100.35 2vuy n GLY 263 Ca 0.30 0.00 0.10 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 0.04 1.07 -0.02 0.00 -1.71 -2.07 103.07 100.38 2vuy h GLY 264 Ca 0.00 -0.02 -0.11 0.00 0.00 0.00 0.00 47.33 47.20 2vuy h GLY 264 CO 0.00 0.01 -0.14 0.06 0.00 0.00 0.00 176.54 176.48 2vuy h GLN 265 N 0.04 0.96 -0.16 4.80 -0.00 -1.80 0.73 115.11 119.69 2vuy h GLN 265 Ca 0.05 -0.38 -0.15 0.00 -0.00 0.00 0.00 58.65 58.18 2vuy h GLN 265 Cb 0.17 -0.05 -0.01 0.00 -0.00 0.00 0.00 27.48 27.59 2vuy h GLN 265 CO -0.00 1.04 -0.53 -0.24 -0.00 0.00 0.00 178.83 179.10 2vuy h VAL 266 N 0.81 1.33 -0.13 1.86 3.04 -1.71 -2.13 116.25 119.33 2vuy h VAL 266 Ca 0.12 -1.78 -0.08 0.00 -1.01 0.00 0.00 66.70 63.96 2vuy h VAL 266 Cb 0.70 1.79 -0.00 0.00 -2.01 0.00 0.00 31.29 31.77 2vuy h VAL 266 CO 0.05 0.54 -0.22 0.25 -1.01 0.00 0.00 177.57 177.19 2vuy h LEU 267 N 0.35 0.41 -0.48 3.16 5.85 -1.24 -2.56 115.31 120.81 2vuy h LEU 267 Ca 0.01 -0.54 0.05 0.00 0.84 0.00 0.00 57.88 58.24 2vuy h LEU 267 Cb 1.04 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.91 2vuy h LEU 267 CO 0.09 0.87 0.22 0.28 -0.34 0.00 0.00 178.44 179.56 2vuy h SER 268 N -0.03 0.29 -0.32 1.25 0.02 -0.85 -2.36 113.55 111.55 2vuy h SER 268 Ca 0.01 0.04 0.03 0.00 -0.84 0.00 0.00 61.79 61.02 2vuy h SER 268 Cb 0.79 -0.01 -0.03 0.00 0.14 0.00 0.00 62.40 63.29 2vuy h SER 268 CO 0.05 0.21 0.15 0.15 -1.14 0.00 0.00 176.83 176.24 2vuy h PHE 269 N 0.43 0.27 -0.56 3.45 3.57 -1.36 -1.62 116.94 121.12 2vuy h PHE 269 Ca 0.21 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.73 2vuy h PHE 269 Cb 0.15 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 38.79 2vuy h PHE 269 CO -0.12 0.14 0.35 0.87 -2.23 0.00 0.00 178.31 177.32 2vuy h LYS 270 N 0.31 0.76 -0.85 1.11 1.57 -1.21 -1.43 116.57 116.84 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 0.07 -0.16 -0.04 0.00 0.08 0.00 0.00 32.23 32.17 2vuy h LYS 270 CO -0.11 0.53 0.42 0.87 -0.57 0.00 0.00 179.45 180.59 2vuy h LYS 271 N 0.76 1.21 -0.12 3.15 1.57 -1.21 0.89 116.57 122.83 2vuy h LYS 271 Ca 0.20 -0.17 0.01 0.00 -1.87 0.00 0.00 60.65 58.82 2vuy h LYS 271 Cb -0.04 -0.22 -0.01 0.00 0.08 0.00 0.00 32.23 32.04 2vuy h LYS 271 CO -0.04 0.92 0.04 1.98 -0.57 0.00 0.00 179.45 181.78 2vuy h MET 272 N 1.20 0.10 -0.66 3.15 4.05 -0.73 0.34 114.93 122.38 2vuy h MET 272 Ca 0.29 -0.01 -0.08 0.00 -0.28 0.00 0.00 59.70 59.63 2vuy h MET 272 Cb 0.10 -0.02 -0.03 0.00 -0.80 0.00 0.00 31.60 30.86 2vuy h MET 272 CO -0.04 0.06 0.11 0.28 0.23 0.00 0.00 176.91 177.56 2vuy h VAL 273 N 0.10 1.26 -0.55 -5.77 2.07 -0.92 -1.63 116.25 110.82 2vuy h VAL 273 Ca 0.05 -1.02 0.00 0.00 0.82 0.00 0.00 66.70 66.55 2vuy h VAL 273 Cb 0.03 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 30.42 2vuy h VAL 273 CO -0.05 0.38 0.35 -1.13 0.02 0.00 0.00 177.57 177.13 2vuy h ASN 274 N 1.00 0.64 -0.38 0.57 -0.73 -0.35 -1.52 115.58 114.83 2vuy h ASN 274 Ca 0.20 -0.04 -0.00 0.00 1.87 0.00 0.00 56.30 58.33 2vuy h ASN 274 Cb 0.43 -0.16 -0.02 0.00 0.27 0.00 0.00 38.32 38.84 2vuy h ASN 274 CO 0.01 0.49 0.23 -0.33 -0.37 0.00 0.00 177.43 177.47 2vuy h GLU 275 N 0.74 0.51 -0.84 6.67 4.39 0.02 -2.44 114.58 123.63 2vuy h GLU 275 Ca 0.20 -0.04 0.01 0.00 0.34 0.00 0.00 59.36 59.86 2vuy h GLU 275 Cb -0.05 -0.11 -0.04 0.00 -0.10 0.00 0.00 28.75 28.45 2vuy h GLU 275 CO -0.04 0.37 0.55 -0.07 -1.16 0.00 0.00 179.01 178.66 2vuy h LEU 276 N 0.50 0.97 -1.35 1.33 3.38 -1.00 -2.38 115.31 116.76 2vuy h LEU 276 Ca 0.14 -0.03 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 2vuy h LEU 276 Cb -0.01 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 2vuy h LEU 276 CO -0.03 0.71 -0.31 0.45 0.09 0.00 0.00 178.44 179.35 2vuy h HIS 277 N 1.14 0.00 0.00 1.13 3.86 -1.07 -0.92 115.15 119.29 2vuy h HIS 277 Ca 0.31 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.52 2vuy h HIS 277 Cb -0.12 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.35 2vuy h HIS 277 CO -0.01 0.31 0.00 0.09 0.86 0.00 0.00 177.93 179.18 2vuy n ASN 278 N -3.93 0.00 -0.53 2.45 5.03 -0.91 -1.63 115.26 115.74 2vuy n ASN 278 Ca -0.02 0.10 0.06 0.00 0.87 0.00 0.00 54.58 55.59 2vuy n ASN 278 Cb 0.38 -0.34 0.09 0.00 -1.02 0.00 0.00 39.78 38.89 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 -1.34 2.36 -2.56 5.41 0.00 -0.57 -4.99 120.51 118.83 2vuy n ALA 279 Ca 0.10 -0.81 -0.09 0.00 0.00 0.00 0.00 53.44 52.63 2vuy n ALA 279 Cb 0.21 -0.41 0.01 0.00 0.00 0.00 0.00 19.45 19.27 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 0.60 0.17 3.40 0.00 0.00 -0.64 -5.04 105.19 103.68 2vuy n GLY 280 Ca 0.09 -0.40 -0.33 0.00 0.00 0.00 0.00 46.02 45.37 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 -2.78 3.28 0.54 -0.61 1.01 -0.46 -4.96 121.20 117.22 2vuy s ILE 281 Ca 0.12 -0.58 -0.16 0.00 0.00 0.00 0.00 60.65 60.03 2vuy s ILE 281 Cb -0.05 -2.40 -0.07 0.00 0.01 0.00 0.00 42.46 39.95 2vuy s ILE 281 CO 0.15 0.51 1.01 -1.61 0.00 0.00 0.00 174.94 175.00 2vuy s GLU 282 N 0.38 3.77 -0.17 2.79 2.02 -0.82 -3.93 118.70 122.74 2vuy s GLU 282 Ca -0.09 0.99 0.00 0.00 0.02 0.00 0.00 54.97 55.90 2vuy s GLU 282 Cb -0.15 -2.11 0.04 0.00 0.10 0.00 0.00 34.13 32.01 2vuy s GLU 282 CO 0.05 -0.42 -0.09 0.08 0.02 0.00 0.00 175.26 174.90 2vuy s VAL 283 N -2.63 1.41 -0.13 2.63 1.01 -1.26 -1.68 120.40 119.75 2vuy s VAL 283 Ca 0.60 -0.77 -0.00 0.00 0.00 0.00 0.00 61.98 61.80 2vuy s VAL 283 Cb -0.11 -1.49 -0.02 0.00 0.00 0.00 0.00 36.38 34.76 2vuy s VAL 283 CO 0.34 0.22 -0.12 -0.63 0.00 0.00 0.00 175.10 174.91 2vuy s ILE 284 N 1.51 3.13 -0.06 2.22 1.01 -0.00 -0.74 121.20 128.27 2vuy s ILE 284 Ca 0.01 -0.63 -0.00 0.00 0.00 0.00 0.00 60.65 60.02 2vuy s ILE 284 Cb -0.15 -2.32 -0.03 0.00 0.01 0.00 0.00 42.46 39.97 2vuy s ILE 284 CO -0.08 0.52 -0.02 0.27 0.00 0.00 0.00 174.94 175.63 2vuy s ILE 285 N 0.34 4.09 -0.06 2.92 -4.36 -0.72 -1.35 121.20 122.06 2vuy s ILE 285 Ca -0.10 -0.40 -0.30 0.00 -0.26 0.00 0.00 60.65 59.59 2vuy s ILE 285 Cb -0.16 -2.73 -0.02 0.00 1.25 0.00 0.00 42.46 40.80 2vuy s ILE 285 CO 0.05 0.55 1.01 -0.62 0.24 0.00 0.00 174.94 176.18 2vuy s ASP 286 N -1.03 7.27 0.01 4.36 -1.08 0.10 -1.67 116.67 124.63 2vuy s ASP 286 Ca 0.14 1.61 0.06 0.00 -0.52 0.00 0.00 52.55 53.84 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 -0.39 -0.18 0.68 0.52 0.00 0.00 175.17 175.84 2vuy s VAL 287 N 1.64 1.47 -0.31 1.11 -7.23 -0.26 -4.03 120.40 112.79 2vuy s VAL 287 Ca 0.50 -0.91 -0.03 0.00 -1.81 0.00 0.00 61.98 59.73 2vuy s VAL 287 Cb -0.20 -1.24 0.04 0.00 0.56 0.00 0.00 36.38 35.54 2vuy s VAL 287 CO 0.22 0.32 0.03 -0.69 -0.31 0.00 0.00 175.10 174.67 2vuy s VAL 288 N -0.56 3.24 -0.04 1.32 1.01 -1.26 -1.42 120.40 122.69 2vuy s VAL 288 Ca 0.07 -1.26 0.01 0.00 0.00 0.00 0.00 61.98 60.79 2vuy s VAL 288 Cb -0.08 -2.83 -0.00 0.00 0.00 0.00 0.00 36.38 33.47 2vuy s VAL 288 CO 0.00 -0.10 0.22 -1.22 0.00 0.00 0.00 175.10 174.01 2vuy n TYR 289 N 4.69 0.00 0.11 5.22 4.02 -1.26 -4.75 117.16 125.18 2vuy n TYR 289 Ca -0.13 0.00 -0.22 0.00 -0.01 0.00 0.00 57.90 57.54 2vuy n TYR 289 Cb 0.44 0.00 -0.13 0.00 -0.02 0.00 0.00 39.34 39.63 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 0.05 0.80 -3.49 7.72 7.08 -1.90 -3.42 115.58 122.41 2vuy h ASN 290 Ca 0.00 -0.77 -0.50 0.00 -3.08 0.00 0.00 56.30 51.95 2vuy h ASN 290 Cb 0.02 -0.25 -0.14 0.00 -2.08 0.00 0.00 38.32 35.87 2vuy h ASN 290 CO 0.00 1.58 -0.56 -1.38 -2.08 0.00 0.00 177.43 175.00 2vuy s HIS 291 N -2.87 1.79 0.15 4.14 -3.43 -1.26 0.13 115.29 113.94 2vuy s HIS 291 Ca -0.08 -1.19 0.06 0.00 -0.80 0.00 0.00 55.06 53.05 2vuy s HIS 291 Cb 0.06 -1.13 -0.04 0.00 -1.43 0.00 0.00 32.58 30.03 2vuy s HIS 291 CO 0.93 -0.24 -0.14 0.99 -2.00 0.00 0.00 174.74 174.28 2vuy s THR 292 N -3.33 1.46 -2.00 -5.38 2.01 -1.26 -4.68 115.64 102.45 2vuy s THR 292 Ca 0.30 -1.93 0.15 0.00 0.31 0.00 0.00 61.69 60.52 2vuy s THR 292 Cb 0.05 -1.76 0.43 0.00 0.01 0.00 0.00 72.50 71.23 2vuy s THR 292 CO 0.15 -0.52 1.32 0.00 -0.69 0.00 0.00 174.62 174.89 2vuy n ALA 293 N 0.13 2.15 0.94 7.40 0.00 0.14 -2.55 120.51 128.72 2vuy n ALA 293 Ca -0.12 -0.09 0.13 0.00 0.00 0.00 0.00 53.44 53.36 2vuy n ALA 293 Cb 0.59 -1.24 0.48 0.00 0.00 0.00 0.00 19.45 19.27 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 -0.92 0.04 0.00 0.00 1.02 -1.26 -4.82 120.64 114.70 2vuy n GLU 294 Ca 0.11 0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.28 2vuy n GLU 294 Cb 0.05 -1.54 0.00 0.00 -0.02 0.00 0.00 31.44 29.93 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 -0.13 0.00 0.62 0.00 -1.06 -3.55 105.19 102.55 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 -3.16 0.00 -4.62 1.61 6.94 -1.16 -4.41 115.26 110.46 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 0.00 1.86 0.00 -2.53 -3.43 -1.26 -2.15 115.29 107.77 2vuy s HIS 297 Ca 0.00 1.06 0.00 0.00 -0.80 0.00 0.00 55.06 55.32 2vuy s HIS 297 Cb 0.00 -3.21 0.00 0.00 -1.43 0.00 0.00 32.58 27.94 2vuy s HIS 297 CO 0.00 -3.21 0.00 1.28 -2.00 0.00 0.00 174.74 170.81 2vuy n LEU 298 N -4.42 0.00 -4.93 5.38 4.77 -1.26 -4.96 117.00 111.58 2vuy n LEU 298 Ca 0.05 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.75 2vuy n LEU 298 Cb 0.56 -0.01 0.13 0.00 -2.33 0.00 0.00 43.42 41.76 2vuy n LEU 298 CO 0.57 0.00 0.76 -0.83 -1.33 0.00 0.00 177.39 176.56 2vuy s GLY 299 N -1.26 1.71 0.91 -0.72 0.00 -0.91 -5.06 107.32 101.98 2vuy s GLY 299 Ca 0.00 -1.06 -0.12 0.00 0.00 0.00 0.00 44.72 43.54 2vuy s GLY 299 CO 0.00 -0.47 1.10 2.56 0.00 0.00 0.00 173.10 176.29 2vuy s PRO 300 N -5.58 1.16 -0.67 2.90 0.04 -1.23 -4.84 135.00 126.79 2vuy s PRO 300 Ca 0.67 0.61 0.05 0.00 0.04 0.00 0.00 61.00 62.36 2vuy s PRO 300 Cb -0.07 -1.82 0.18 0.00 0.04 0.00 0.00 34.50 32.83 2vuy s PRO 300 CO 0.49 -2.25 0.50 2.41 0.04 0.00 0.00 177.00 178.18 2vuy n THR 301 N -3.86 1.35 -0.14 1.26 -1.04 -0.64 -4.81 114.28 106.40 2vuy n THR 301 Ca 0.06 -4.72 -0.30 0.00 -2.04 0.00 0.00 64.05 57.05 2vuy n THR 301 Cb 0.57 -2.12 -0.10 0.00 -1.82 0.00 0.00 70.33 66.86 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 1.98 1.96 0.00 -4.42 4.77 -1.26 -4.78 117.00 115.25 2vuy n LEU 302 Ca 0.22 0.34 0.00 0.00 -0.03 0.00 0.00 56.01 56.54 2vuy n LEU 302 Cb 0.37 -0.83 0.00 0.00 -2.33 0.00 0.00 43.42 40.63 2vuy n LEU 302 CO 0.26 0.57 0.00 -0.24 -1.33 0.00 0.00 177.39 176.65 2vuy n SER 303 N -4.25 0.00 -0.03 -1.43 2.88 -1.26 -2.04 113.62 107.49 2vuy n SER 303 Ca -0.54 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 56.87 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 0.06 -1.05 0.66 -1.00 -1.90 -2.53 116.94 111.17 2vuy h PHE 304 Ca 0.00 -0.02 0.29 0.00 2.81 0.00 0.00 57.97 61.04 2vuy h PHE 304 Cb 0.00 -0.01 -0.12 0.00 3.61 0.00 0.00 35.95 39.43 2vuy h PHE 304 CO 0.00 0.62 0.65 -0.09 -1.61 0.00 0.00 178.31 177.88 2vuy h ARG 305 N -0.51 0.40 0.00 1.51 2.43 -1.92 -0.34 114.38 115.94 2vuy h ARG 305 Ca 0.00 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.12 2vuy h ARG 305 Cb 0.62 -0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 30.07 2vuy h ARG 305 CO 0.01 0.27 -0.91 0.78 -1.51 0.00 0.00 179.97 178.60 2vuy h GLY 306 N 0.41 0.00 0.17 2.80 0.00 -1.78 -3.12 103.07 101.54 2vuy h GLY 306 Ca 0.66 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 47.76 2vuy h GLY 306 CO -0.41 0.00 -1.23 -2.22 0.00 0.00 0.00 176.54 172.68 2vuy h ILE 307 N 0.00 1.00 -0.66 2.60 2.04 -0.68 -3.43 117.51 118.39 2vuy h ILE 307 Ca -0.02 -2.25 -0.09 0.00 1.00 0.00 0.00 64.86 63.49 2vuy h ILE 307 Cb 1.09 2.47 -0.16 0.00 -0.74 0.00 0.00 36.82 39.48 2vuy h ILE 307 CO 0.01 0.48 -0.35 -0.67 0.00 0.00 0.00 178.15 177.62 2vuy n ASP 308 N -4.26 -2.69 -0.19 1.72 4.64 -0.54 -4.57 116.55 110.67 2vuy n ASP 308 Ca -0.28 -2.20 -0.00 0.00 -1.38 0.00 0.00 54.79 50.93 2vuy n ASP 308 Cb 0.74 1.37 0.10 0.00 -1.04 0.00 0.00 41.12 42.29 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 4.65 0.04 0.65 1.67 -1.24 -1.57 -2.02 115.58 117.76 2vuy h ASN 309 Ca 0.03 0.10 0.00 0.00 0.71 0.00 0.00 56.30 57.14 2vuy h ASN 309 Cb 1.13 0.13 0.00 0.00 0.73 0.00 0.00 38.32 40.31 2vuy h ASN 309 CO -0.03 0.04 0.00 0.35 -1.29 0.00 0.00 177.43 176.50 2vuy n THR 310 N -5.10 0.88 -0.09 -3.57 -2.24 -1.26 -2.65 114.28 100.26 2vuy n THR 310 Ca 0.08 0.26 -0.23 0.00 -2.27 0.00 0.00 64.05 61.89 2vuy n THR 310 Cb 0.29 -1.16 -0.12 0.00 -2.10 0.00 0.00 70.33 67.24 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 -1.72 1.04 0.08 6.98 0.00 -0.81 -4.62 120.51 121.45 2vuy n ALA 311 Ca 0.02 -0.79 -0.10 0.00 0.00 0.00 0.00 53.44 52.57 2vuy n ALA 311 Cb 0.21 -0.33 -0.02 0.00 0.00 0.00 0.00 19.45 19.31 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 -0.52 0.39 -3.49 0.00 -1.99 -1.42 -3.43 116.97 106.50 2vuy h TYR 312 Ca -0.50 -0.21 -0.66 0.00 2.00 0.00 0.00 58.73 59.36 2vuy h TYR 312 Cb 1.69 -0.04 -0.14 0.00 2.00 0.00 0.00 36.73 40.23 2vuy h TYR 312 CO 0.03 1.02 -0.71 0.71 -0.00 0.00 0.00 178.16 179.21 2vuy s TYR 313 N -3.24 2.83 -0.43 4.88 1.51 -1.08 -0.45 117.35 121.36 2vuy s TYR 313 Ca -0.04 -0.10 -0.29 0.00 -1.01 0.00 0.00 57.07 55.63 2vuy s TYR 313 Cb 0.10 -1.48 0.02 0.00 -0.11 0.00 0.00 41.96 40.48 2vuy s TYR 313 CO 0.84 0.44 1.33 -1.64 -1.11 0.00 0.00 175.55 175.41 2vuy s MET 314 N -2.20 3.61 -0.04 -0.62 -1.94 -0.47 -4.66 119.30 112.98 2vuy s MET 314 Ca 0.23 0.82 -0.03 0.00 -1.71 0.00 0.00 55.69 55.00 2vuy s MET 314 Cb -0.11 -3.99 -0.04 0.00 2.01 0.00 0.00 34.83 32.70 2vuy s MET 314 CO 0.15 -1.52 0.12 -0.51 -0.01 0.00 0.00 175.02 173.25 2vuy s LEU 315 N 5.16 4.16 -0.13 -0.03 1.43 -1.26 -1.28 118.68 126.72 2vuy s LEU 315 Ca 0.57 0.30 -0.32 0.00 -1.03 0.00 0.00 54.13 53.65 2vuy s LEU 315 Cb -0.12 -2.29 -0.10 0.00 0.03 0.00 0.00 46.19 43.72 2vuy s LEU 315 CO 0.32 0.32 2.02 1.67 0.23 0.00 0.00 176.35 180.91 2vuy n GLN 316 N 1.41 2.10 -0.38 1.70 7.27 -1.01 -4.76 117.38 123.71 2vuy n GLN 316 Ca -0.15 0.72 -0.03 0.00 0.07 0.00 0.00 57.00 57.61 2vuy n GLN 316 Cb 0.53 -2.81 0.02 0.00 2.41 0.00 0.00 30.24 30.39 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 11.15 -0.01 0.00 3.69 0.11 -1.96 0.80 132.00 145.78 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 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2vuy h PRO 317 CO 0.96 -0.01 0.00 -0.40 -0.21 0.00 0.00 178.00 178.34 2vuy n ASP 318 N -5.44 0.00 0.04 -2.05 5.68 -1.26 -4.44 116.55 109.07 2vuy n ASP 318 Ca 0.09 0.36 0.00 0.00 -0.50 0.00 0.00 54.79 54.74 2vuy n ASP 318 Cb 0.38 -0.45 0.00 0.00 -1.14 0.00 0.00 41.12 39.91 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 -1.45 0.23 0.00 -1.12 4.05 -0.40 -5.01 115.26 111.56 2vuy n ASN 319 Ca 0.07 0.11 0.00 0.00 0.45 0.00 0.00 54.58 55.22 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 -3.07 0.00 0.07 1.20 5.02 0.27 -4.37 118.16 117.27 2vuy n LYS 320 Ca 0.00 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.17 2vuy n LYS 320 Cb 0.18 -2.51 -0.13 0.00 -0.02 0.00 0.00 35.03 32.55 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 1.18 0.15 -6.48 1.97 2.43 -1.73 -3.16 114.38 108.73 2vuy h ARG 321 Ca 0.00 -0.25 -0.46 0.00 -0.81 0.00 0.00 59.98 58.46 2vuy h ARG 321 Cb 0.00 0.09 0.01 0.00 -0.42 0.00 0.00 29.97 29.65 2vuy h ARG 321 CO 0.00 1.06 -0.23 0.71 -1.51 0.00 0.00 179.97 180.00 2vuy s TYR 322 N -2.66 3.37 -0.11 2.20 1.51 -1.26 -4.80 117.35 115.60 2vuy s TYR 322 Ca -0.03 0.18 -0.01 0.00 -1.01 0.00 0.00 57.07 56.20 2vuy s TYR 322 Cb 0.08 -1.95 -0.03 0.00 -0.11 0.00 0.00 41.96 39.96 2vuy s TYR 322 CO 0.85 0.05 -0.06 0.71 -1.11 0.00 0.00 175.55 175.98 2vuy s TYR 323 N -2.29 2.96 0.07 2.71 2.02 -1.26 -2.40 117.35 119.15 2vuy s TYR 323 Ca 0.41 -0.18 -0.30 0.00 -0.37 0.00 0.00 57.07 56.63 2vuy s TYR 323 Cb -0.10 -1.82 -0.06 0.00 -0.40 0.00 0.00 41.96 39.59 2vuy s TYR 323 CO 0.35 0.13 1.17 -0.51 -1.57 0.00 0.00 175.55 175.11 2vuy s LEU 324 N -0.24 4.39 -0.28 -1.29 1.43 -0.41 -4.82 118.68 117.46 2vuy s LEU 324 Ca 0.03 2.00 0.02 0.00 -1.03 0.00 0.00 54.13 55.15 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 0.03 -0.42 -0.01 -0.62 0.23 0.00 0.00 176.35 175.56 2vuy s ASP 325 N 0.89 4.29 0.00 2.29 -1.08 -1.26 -2.61 116.67 119.19 2vuy s ASP 325 Ca 0.57 -1.60 0.13 0.00 -0.52 0.00 0.00 52.55 51.12 2vuy s ASP 325 Cb -0.29 -1.35 0.16 0.00 -1.46 0.00 0.00 42.92 39.98 2vuy s ASP 325 CO 0.30 -0.30 0.99 0.49 0.52 0.00 0.00 175.17 177.17 2vuy n PHE 326 N 4.52 0.12 0.15 -5.34 3.01 -1.26 -4.45 117.46 114.21 2vuy n PHE 326 Ca -0.06 -0.11 0.08 0.00 1.01 0.00 0.00 57.45 58.38 2vuy n PHE 326 Cb 0.43 -0.01 -0.13 0.00 -0.01 0.00 0.00 39.48 39.77 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 0.70 0.00 -1.04 4.37 -2.24 -1.26 -2.24 114.28 112.57 2vuy n THR 327 Ca 0.09 -0.33 -0.01 0.00 -2.27 0.00 0.00 64.05 61.52 2vuy n THR 327 Cb 0.35 0.29 -0.01 0.00 -2.10 0.00 0.00 70.33 68.86 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 1.50 0.50 0.00 3.38 0.00 -1.26 -4.86 105.19 104.45 2vuy n GLY 328 Ca -0.02 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.30 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 -2.94 0.89 0.00 2.61 -2.24 -1.26 -5.01 114.28 106.33 2vuy n THR 329 Ca -0.01 -0.94 0.00 0.00 -2.27 0.00 0.00 64.05 60.83 2vuy n THR 329 Cb 0.05 0.55 0.00 0.00 -2.10 0.00 0.00 70.33 68.84 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 -0.45 2.82 3.47 3.38 0.00 -1.26 -4.43 105.19 108.73 2vuy n GLY 330 Ca 0.00 -0.90 -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 -0.04 -0.05 -0.02 1.61 2.20 -1.26 -2.98 114.94 114.40 2vuy s ASN 331 Ca 0.00 -0.90 0.01 0.00 -0.94 0.00 0.00 52.86 51.03 2vuy s ASN 331 Cb 0.00 0.52 0.01 0.00 -2.00 0.00 0.00 41.25 39.77 2vuy s ASN 331 CO 0.00 -1.02 -0.05 -0.89 -2.94 0.00 0.00 177.10 172.20 2vuy s THR 332 N -4.00 0.46 0.25 0.54 2.01 -1.07 -4.52 115.64 109.31 2vuy s THR 332 Ca 0.21 -0.18 -0.30 0.00 0.31 0.00 0.00 61.69 61.73 2vuy s THR 332 Cb 0.01 -0.43 -0.09 0.00 0.01 0.00 0.00 72.50 72.00 2vuy s THR 332 CO 0.05 0.16 1.23 -0.22 -0.69 0.00 0.00 174.62 175.15 2vuy s LEU 333 N 0.28 4.46 -1.34 4.42 2.96 0.34 -1.37 118.68 128.44 2vuy s LEU 333 Ca -0.03 2.40 -0.16 0.00 -0.22 0.00 0.00 54.13 56.12 2vuy s LEU 333 Cb -0.07 -3.62 0.02 0.00 0.50 0.00 0.00 46.19 43.02 2vuy s LEU 333 CO -0.00 -0.40 2.06 -3.20 -1.32 0.00 0.00 176.35 173.49 2vuy n ASN 334 N 1.78 3.99 -0.12 3.68 4.05 0.40 -4.65 115.26 124.38 2vuy n ASN 334 Ca 0.02 -2.84 0.00 0.00 0.45 0.00 0.00 54.58 52.21 2vuy n ASN 334 Cb 0.43 -1.63 0.00 0.00 1.23 0.00 0.00 39.78 39.81 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 7.21 0.08 -0.55 1.20 7.99 -1.26 -2.09 117.00 129.59 2vuy n LEU 335 Ca 0.51 -0.04 0.07 0.00 -0.01 0.00 0.00 56.01 56.53 2vuy n LEU 335 Cb 0.41 -0.04 0.06 0.00 -0.11 0.00 0.00 43.42 43.74 2vuy n LEU 335 CO 0.87 0.02 0.47 -1.54 -1.51 0.00 0.00 177.39 175.70 2vuy n SER 336 N -0.31 2.16 -4.72 -1.43 3.41 -1.26 -4.47 113.62 107.00 2vuy n SER 336 Ca 0.00 -1.58 -0.37 0.00 -0.26 0.00 0.00 58.87 56.66 2vuy n SER 336 Cb 0.02 -0.01 -0.06 0.00 -0.26 0.00 0.00 64.21 63.89 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 -1.11 3.49 0.23 7.33 5.65 -0.89 -4.99 115.29 125.00 2vuy s HIS 337 Ca 0.16 0.75 -0.14 0.00 0.25 0.00 0.00 55.06 56.08 2vuy s HIS 337 Cb 0.11 -2.45 0.28 0.00 -1.18 0.00 0.00 32.58 29.34 2vuy s HIS 337 CO 0.17 0.20 1.59 -1.35 -0.65 0.00 0.00 174.74 174.69 2vuy h PRO 338 N 6.71 -0.04 -0.19 2.88 0.11 -1.92 0.23 132.00 139.79 2vuy h PRO 338 Ca -0.41 0.00 -0.14 0.00 0.11 0.00 0.00 66.00 65.56 2vuy h PRO 338 Cb 1.17 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 2vuy h PRO 338 CO 0.76 -0.02 -0.47 0.00 -0.21 0.00 0.00 178.00 178.05 2vuy h ARG 339 N -0.04 0.49 -0.49 1.05 2.47 -1.96 -0.44 114.38 115.45 2vuy h ARG 339 Ca 0.35 -0.27 -0.10 0.00 -1.26 0.00 0.00 59.98 58.70 2vuy h ARG 339 Cb 0.58 0.02 -0.02 0.00 -1.65 0.00 0.00 29.97 28.90 2vuy h ARG 339 CO -0.82 0.86 -0.07 0.28 0.56 0.00 0.00 179.97 180.78 2vuy h VAL 340 N 0.39 1.27 -0.53 2.04 2.07 -1.53 0.60 116.25 120.56 2vuy h VAL 340 Ca 0.02 -1.19 -0.01 0.00 0.82 0.00 0.00 66.70 66.34 2vuy h VAL 340 Cb 0.97 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 31.75 2vuy h VAL 340 CO 0.09 0.41 0.27 0.40 0.02 0.00 0.00 177.57 178.76 2vuy h ILE 341 N 0.77 1.19 -0.20 4.57 2.04 -0.44 -2.16 117.51 123.28 2vuy h ILE 341 Ca 0.13 -0.51 0.00 0.00 1.00 0.00 0.00 64.86 65.48 2vuy h ILE 341 Cb 0.61 0.55 -0.01 0.00 -0.74 0.00 0.00 36.82 37.23 2vuy h ILE 341 CO 0.04 0.21 0.13 -0.61 0.00 0.00 0.00 178.15 177.92 2vuy h GLN 342 N 0.71 0.27 -0.25 2.37 4.15 -0.75 -1.69 115.11 119.92 2vuy h GLN 342 Ca 0.18 -0.02 0.06 0.00 0.77 0.00 0.00 58.65 59.65 2vuy h GLN 342 Cb 0.08 -0.06 -0.07 0.00 0.21 0.00 0.00 27.48 27.65 2vuy h GLN 342 CO -0.03 0.18 -0.20 1.98 -1.93 0.00 0.00 178.83 178.83 2vuy h MET 343 N 0.27 -0.19 -0.25 1.69 4.05 -0.54 0.99 114.93 120.94 2vuy h MET 343 Ca 0.07 0.01 -0.00 0.00 -0.28 0.00 0.00 59.70 59.51 2vuy h MET 343 Cb -0.03 0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 30.80 2vuy h MET 343 CO -0.02 -0.13 0.16 0.28 0.23 0.00 0.00 176.91 177.43 2vuy h VAL 344 N -0.20 1.09 -0.68 -5.77 2.07 -1.25 0.28 116.25 111.79 2vuy h VAL 344 Ca 0.14 -0.21 -0.05 0.00 0.82 0.00 0.00 66.70 67.41 2vuy h VAL 344 Cb 0.41 0.77 -0.03 0.00 -1.52 0.00 0.00 31.29 30.92 2vuy h VAL 344 CO -0.37 0.09 0.24 -0.07 0.02 0.00 0.00 177.57 177.48 2vuy h LEU 345 N 0.32 0.95 -1.09 2.57 3.38 -0.74 -0.41 115.31 120.30 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 0.87 0.07 0.44 0.09 0.00 0.00 178.44 179.89 2vuy h ASP 346 N 1.00 0.67 0.34 -0.43 3.45 0.15 -1.68 116.42 119.92 2vuy h ASP 346 Ca 0.23 -0.13 -0.02 0.00 0.43 0.00 0.00 57.03 57.54 2vuy h ASP 346 Cb 0.24 -0.18 0.00 0.00 -0.56 0.00 0.00 39.33 38.84 2vuy h ASP 346 CO -0.01 0.70 -0.17 -1.28 -1.57 0.00 0.00 179.24 176.91 2vuy h SER 347 N 0.69 -0.39 -0.19 6.45 0.87 0.62 -1.31 113.55 120.28 2vuy h SER 347 Ca 0.15 -0.11 0.05 0.00 -1.23 0.00 0.00 61.79 60.64 2vuy h SER 347 Cb 0.32 0.10 -0.05 0.00 -0.44 0.00 0.00 62.40 62.33 2vuy h SER 347 CO 0.00 -0.10 -0.12 -0.07 -0.53 0.00 0.00 176.83 176.01 2vuy h LEU 348 N -0.69 -0.39 -1.06 2.23 3.38 -0.98 -0.53 115.31 117.27 2vuy h LEU 348 Ca -0.05 0.09 0.04 0.00 0.09 0.00 0.00 57.88 58.05 2vuy h LEU 348 Cb 0.48 0.20 -0.06 0.00 0.09 0.00 0.00 40.66 41.38 2vuy h LEU 348 CO 0.08 -0.15 0.63 0.03 0.09 0.00 0.00 178.44 179.12 2vuy h ARG 349 N -0.11 1.16 0.91 1.13 3.08 -1.32 -1.17 114.38 118.06 2vuy h ARG 349 Ca 0.11 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 60.05 2vuy h ARG 349 Cb 0.27 -0.26 0.01 0.00 0.08 0.00 0.00 29.97 30.07 2vuy h ARG 349 CO -0.26 0.77 -0.47 -0.92 -1.07 0.00 0.00 179.97 178.02 2vuy h TYR 350 N 1.20 -1.23 -0.18 3.04 3.20 -0.32 0.22 116.97 122.89 2vuy h TYR 350 Ca 0.39 -0.02 0.05 0.00 3.14 0.00 0.00 58.73 62.29 2vuy h TYR 350 Cb 0.05 0.42 -0.01 0.00 1.54 0.00 0.00 36.73 38.73 2vuy h TYR 350 CO -0.00 -0.74 0.24 -1.49 -1.64 0.00 0.00 178.16 174.52 2vuy h TRP 351 N -1.27 0.00 0.00 -3.82 4.06 -0.78 0.44 115.95 114.58 2vuy h TRP 351 Ca -0.12 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.83 2vuy h TRP 351 Cb 0.98 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.14 2vuy h TRP 351 CO -0.04 0.00 -0.12 0.28 -3.56 0.00 0.00 178.44 175.00 2vuy h VAL 352 N 0.00 0.00 0.00 1.49 2.07 -0.76 -0.42 116.25 118.64 2vuy h VAL 352 Ca 0.09 -0.44 -0.09 0.00 0.82 0.00 0.00 66.70 67.08 2vuy h VAL 352 Cb 0.55 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 2vuy h VAL 352 CO -0.00 0.00 -0.45 0.71 0.02 0.00 0.00 177.57 177.85 2vuy h THR 353 N -0.44 1.26 0.04 2.57 1.35 -0.51 -1.40 112.91 115.78 2vuy h THR 353 Ca 0.00 -1.56 -0.35 0.00 -0.55 0.00 0.00 66.41 63.94 2vuy h THR 353 Cb 0.12 1.86 -0.04 0.00 -1.73 0.00 0.00 68.15 68.35 2vuy h THR 353 CO 0.00 0.44 -2.01 1.21 -0.25 0.00 0.00 175.52 174.91 2vuy n GLU 354 N -3.92 0.65 -0.01 4.72 4.07 0.15 -4.46 120.64 121.85 2vuy n GLU 354 Ca -0.01 0.32 0.12 0.00 -0.06 0.00 0.00 57.16 57.53 2vuy n GLU 354 Cb 0.48 -1.64 0.18 0.00 -0.06 0.00 0.00 31.44 30.41 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 -3.84 2.22 -3.85 5.31 2.81 -1.07 -4.99 117.12 113.71 2vuy n MET 355 Ca -0.39 -1.78 -0.28 0.00 -1.81 0.00 0.00 57.70 53.44 2vuy n MET 355 Cb 0.91 -1.47 0.03 0.00 -0.71 0.00 0.00 33.22 31.98 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 1.14 -2.21 -2.64 2.03 8.25 -0.53 -4.88 115.22 116.39 2vuy n HIS 356 Ca 0.15 0.89 -0.33 0.00 -0.26 0.00 0.00 57.72 58.18 2vuy n HIS 356 Cb 0.55 -4.12 -0.05 0.00 1.12 0.00 0.00 29.99 27.49 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 -3.41 4.43 -0.59 1.59 1.01 -0.20 -4.92 120.40 118.31 2vuy s VAL 357 Ca 0.48 1.37 0.21 0.00 0.00 0.00 0.00 61.98 64.04 2vuy s VAL 357 Cb -0.24 -3.64 -0.27 0.00 0.00 0.00 0.00 36.38 32.23 2vuy s VAL 357 CO 0.82 -0.47 0.71 0.47 0.00 0.00 0.00 175.10 176.64 2vuy n ASP 358 N -1.03 0.62 -3.71 3.32 8.00 0.08 -4.60 116.55 119.23 2vuy n ASP 358 Ca 0.07 -0.59 0.03 0.00 0.71 0.00 0.00 54.79 55.01 2vuy n ASP 358 Cb 0.54 1.40 0.00 0.00 -0.02 0.00 0.00 41.12 43.04 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 -3.57 -0.34 0.01 0.44 0.00 -1.16 -2.39 107.32 100.31 2vuy s GLY 359 Ca 0.01 0.53 0.01 0.00 0.00 0.00 0.00 44.72 45.28 2vuy s GLY 359 CO 0.87 2.56 -0.05 -1.36 0.00 0.00 0.00 173.10 175.11 2vuy s PHE 360 N -2.14 0.44 -0.30 1.90 0.40 -0.65 -1.76 117.98 115.88 2vuy s PHE 360 Ca 0.21 -0.25 -0.00 0.00 -0.60 0.00 0.00 56.93 56.29 2vuy s PHE 360 Cb 0.04 -0.28 0.06 0.00 0.51 0.00 0.00 43.02 43.35 2vuy s PHE 360 CO -0.04 -0.05 -0.01 0.50 0.70 0.00 0.00 175.22 176.33 2vuy s ARG 361 N -0.70 2.27 -0.17 0.44 3.00 -0.67 0.15 118.95 123.28 2vuy s ARG 361 Ca -0.04 -1.38 -0.29 0.00 -1.00 0.00 0.00 55.73 53.02 2vuy s ARG 361 Cb -0.05 -3.14 0.00 0.00 0.00 0.00 0.00 34.95 31.76 2vuy s ARG 361 CO -0.00 -0.67 1.02 -0.06 0.00 0.00 0.00 175.30 175.59 2vuy s PHE 362 N 1.18 3.42 0.20 5.12 0.40 0.29 -1.10 117.98 127.49 2vuy s PHE 362 Ca -0.04 1.53 -0.30 0.00 -0.60 0.00 0.00 56.93 57.52 2vuy s PHE 362 Cb -0.20 -3.23 -0.08 0.00 0.51 0.00 0.00 43.02 40.02 2vuy s PHE 362 CO -0.03 -0.36 1.09 0.34 0.70 0.00 0.00 175.22 176.96 2vuy s ASP 363 N 1.15 7.29 -1.55 1.36 -1.08 -0.51 -1.73 116.67 121.61 2vuy s ASP 363 Ca 0.46 2.11 -0.02 0.00 -0.52 0.00 0.00 52.55 54.58 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 -0.18 0.13 0.18 0.52 0.00 0.00 175.17 175.93 2vuy n LEU 364 N 2.11 -1.20 -0.31 -1.34 4.77 -1.26 -4.71 117.00 115.06 2vuy n LEU 364 Ca 0.02 -1.22 0.16 0.00 -0.03 0.00 0.00 56.01 54.94 2vuy n LEU 364 Cb 0.46 -1.72 0.34 0.00 -2.33 0.00 0.00 43.42 40.17 2vuy n LEU 364 CO 0.54 0.44 0.95 0.00 -1.33 0.00 0.00 177.39 177.98 2vuy h ALA 365 N 0.81 1.43 -0.95 -1.18 0.00 -1.28 -1.74 119.26 116.34 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 1.39 0.34 -0.11 0.00 0.00 0.00 0.00 17.79 19.42 2vuy h ALA 365 CO 0.71 -0.54 0.53 0.00 0.00 0.00 0.00 179.25 179.95 2vuy h ALA 366 N 1.84 1.57 0.00 0.00 0.00 -1.59 0.76 119.26 121.85 2vuy h ALA 366 Ca 0.61 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.63 2vuy h ALA 366 Cb 1.31 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.09 2vuy h ALA 366 CO -0.70 -0.16 0.07 0.00 0.00 0.00 0.00 179.25 178.46 2vuy n ALA 367 N -2.38 0.90 0.93 0.00 0.00 -0.66 -0.12 120.51 119.19 2vuy n ALA 367 Ca 0.23 0.10 0.13 0.00 0.00 0.00 0.00 53.44 53.89 2vuy n ALA 367 Cb 0.60 -1.04 0.39 0.00 0.00 0.00 0.00 19.45 19.40 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 -1.86 0.36 -1.16 0.00 4.77 0.26 -3.39 117.00 115.97 2vuy n LEU 368 Ca -0.01 0.25 0.09 0.00 -0.03 0.00 0.00 56.01 56.31 2vuy n LEU 368 Cb 0.09 -0.34 0.28 0.00 -2.33 0.00 0.00 43.42 41.12 2vuy n LEU 368 CO 0.05 0.04 0.74 0.00 -1.33 0.00 0.00 177.39 176.88 2vuy n ALA 369 N -1.55 2.68 -2.64 -1.18 0.00 0.83 -4.87 120.51 113.77 2vuy n ALA 369 Ca 0.06 -1.53 -0.43 0.00 0.00 0.00 0.00 53.44 51.54 2vuy n ALA 369 Cb 0.35 -0.78 -0.02 0.00 0.00 0.00 0.00 19.45 19.00 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 -1.61 4.13 -0.44 0.00 1.81 -1.22 -1.11 118.95 120.52 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 -3.69 0.12 0.00 -0.45 0.00 0.00 34.95 31.18 2vuy s ARG 370 CO 0.21 -0.75 0.21 -1.21 -0.68 0.00 0.00 175.30 173.07 2vuy s GLU 371 N 3.36 1.93 4.03 3.54 2.02 -0.75 -4.74 118.70 128.09 2vuy s GLU 371 Ca 0.43 -2.10 0.00 0.00 0.02 0.00 0.00 54.97 53.32 2vuy s GLU 371 Cb -0.14 -3.45 0.00 0.00 0.10 0.00 0.00 34.13 30.65 2vuy s GLU 371 CO 0.11 -1.06 0.00 -0.11 0.02 0.00 0.00 175.26 174.23 2vuy n LEU 372 N 4.05 0.00 0.27 1.80 7.94 -1.26 -3.10 117.00 126.70 2vuy n LEU 372 Ca 0.03 0.00 0.19 0.00 -1.11 0.00 0.00 56.01 55.11 2vuy n LEU 372 Cb 0.39 0.00 0.95 0.00 0.53 0.00 0.00 43.42 45.29 2vuy n LEU 372 CO 0.30 0.00 1.05 1.88 -1.11 0.00 0.00 177.39 179.51 2vuy h TYR 373 N 0.00 0.00 -1.41 1.96 -1.99 -2.01 -3.45 116.97 110.08 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 -4.90 5.38 -0.23 3.88 1.04 -1.18 -4.96 113.70 112.73 2vuy s SER 374 Ca -0.03 -0.58 -0.03 0.00 0.48 0.00 0.00 55.95 55.79 2vuy s SER 374 Cb 0.11 -0.55 0.00 0.00 0.10 0.00 0.00 66.02 65.68 2vuy s SER 374 CO 0.38 -0.76 -0.06 -0.69 0.98 0.00 0.00 173.24 173.09 2vuy s VAL 375 N -2.42 3.15 -0.21 5.02 1.01 -1.26 -1.81 120.40 123.87 2vuy s VAL 375 Ca 0.52 -0.68 0.02 0.00 0.00 0.00 0.00 61.98 61.84 2vuy s VAL 375 Cb -0.07 -2.47 0.04 0.00 0.00 0.00 0.00 36.38 33.88 2vuy s VAL 375 CO 0.31 0.36 -0.13 0.21 0.00 0.00 0.00 175.10 175.86 2vuy s ASN 376 N 1.42 3.68 0.00 3.32 3.04 -0.26 -4.97 114.94 121.16 2vuy s ASN 376 Ca 0.04 -1.00 0.07 0.00 0.04 0.00 0.00 52.86 52.01 2vuy s ASN 376 Cb -0.15 -1.39 0.42 0.00 -1.54 0.00 0.00 41.25 38.58 2vuy s ASN 376 CO -0.04 -0.13 1.18 0.80 -3.04 0.00 0.00 177.10 175.87 2vuy n MET 377 N 4.59 0.90 -1.97 0.43 0.00 -1.26 -2.87 117.12 116.94 2vuy n MET 377 Ca -0.16 0.00 -0.14 0.00 -0.00 0.00 0.00 57.70 57.40 2vuy n MET 377 Cb 0.46 -1.12 0.05 0.00 0.00 0.00 0.00 33.22 32.61 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 -0.62 3.75 -4.85 -0.89 7.94 -1.26 -4.76 117.00 116.30 2vuy n LEU 378 Ca 0.05 -4.15 -0.32 0.00 -1.11 0.00 0.00 56.01 50.49 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 0.04 1.72 0.71 0.54 -1.11 0.00 0.00 177.39 179.28 2vuy s ASN 379 N -3.52 6.23 0.25 1.96 4.22 -1.14 -4.88 114.94 118.07 2vuy s ASN 379 Ca 0.43 1.53 -0.05 0.00 -2.14 0.00 0.00 52.86 52.63 2vuy s ASN 379 Cb 0.38 -2.49 0.49 0.00 1.28 0.00 0.00 41.25 40.91 2vuy s ASN 379 CO -0.00 -0.87 1.64 0.74 -2.04 0.00 0.00 177.10 176.57 2vuy h THR 380 N 0.12 0.33 0.17 0.54 2.02 -1.92 -2.30 112.91 111.87 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 1.19 0.20 -0.04 0.00 -1.74 0.00 0.00 68.15 67.76 2vuy h THR 380 CO 0.61 0.02 -0.44 0.15 0.37 0.00 0.00 175.52 176.23 2vuy h PHE 381 N 0.12 -1.22 -0.33 3.16 -0.00 -1.92 -1.26 116.94 115.49 2vuy h PHE 381 Ca 0.44 0.03 0.04 0.00 -0.00 0.00 0.00 57.97 58.47 2vuy h PHE 381 Cb 0.79 0.51 -0.02 0.00 -0.00 0.00 0.00 35.95 37.24 2vuy h PHE 381 CO -0.40 -0.54 0.22 0.74 -0.00 0.00 0.00 178.31 178.33 2vuy h PHE 382 N -0.71 0.28 -0.20 0.41 -1.00 -1.78 -1.05 116.94 112.89 2vuy h PHE 382 Ca 0.01 0.01 -0.10 0.00 2.81 0.00 0.00 57.97 60.70 2vuy h PHE 382 Cb 0.71 -0.09 -0.00 0.00 3.61 0.00 0.00 35.95 40.17 2vuy h PHE 382 CO -0.35 0.16 -0.26 0.82 -1.61 0.00 0.00 178.31 177.07 2vuy h ILE 383 N 0.29 1.33 -0.40 -0.55 1.08 -0.97 -1.63 117.51 116.66 2vuy h ILE 383 Ca 0.14 -1.45 -0.09 0.00 -0.39 0.00 0.00 64.86 63.06 2vuy h ILE 383 Cb 0.20 1.80 -0.02 0.00 -3.07 0.00 0.00 36.82 35.73 2vuy h ILE 383 CO -0.03 0.45 -0.14 0.00 -0.69 0.00 0.00 178.15 177.74 2vuy h ALA 384 N 0.63 1.01 -0.09 1.87 0.00 -0.85 -2.71 119.26 119.11 2vuy h ALA 384 Ca 0.02 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 2vuy h ALA 384 Cb 0.83 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 2vuy h ALA 384 CO 0.06 0.59 0.05 1.25 0.00 0.00 0.00 179.25 181.20 2vuy h LEU 385 N 0.65 0.12 -2.09 0.00 7.12 -1.13 -1.47 115.31 118.51 2vuy h LEU 385 Ca 0.11 -0.10 -0.01 0.00 0.13 0.00 0.00 57.88 58.01 2vuy h LEU 385 Cb 0.61 -0.03 -0.00 0.00 -0.53 0.00 0.00 40.66 40.71 2vuy h LEU 385 CO 0.04 0.19 -0.05 -0.61 -0.13 0.00 0.00 178.44 177.88 2vuy h GLN 386 N 0.05 0.00 0.00 1.25 4.15 -1.14 -2.79 115.11 116.63 2vuy h GLN 386 Ca 0.03 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.45 2vuy h GLN 386 Cb 0.09 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.78 2vuy h GLN 386 CO -0.00 0.05 -1.15 0.00 -1.93 0.00 0.00 178.83 175.80 2vuy n GLN 387 N -4.15 0.19 -1.77 1.69 -0.00 -1.04 -4.77 117.38 107.54 2vuy n GLN 387 Ca -0.03 -0.04 -0.42 0.00 -0.00 0.00 0.00 57.00 56.52 2vuy n GLN 387 Cb 0.13 -1.52 -0.03 0.00 -0.00 0.00 0.00 30.24 28.82 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 -3.49 6.43 0.27 2.61 2.15 -0.57 -4.88 116.67 119.18 2vuy s ASP 388 Ca 0.04 2.79 -0.01 0.00 0.43 0.00 0.00 52.55 55.81 2vuy s ASP 388 Cb 0.15 -2.59 0.53 0.00 -0.30 0.00 0.00 42.92 40.71 2vuy s ASP 388 CO 0.85 -0.95 1.78 -0.65 -0.17 0.00 0.00 175.17 176.03 2vuy h PRO 389 N 7.24 0.70 0.00 4.34 0.11 -1.91 -2.17 132.00 140.30 2vuy h PRO 389 Ca -0.44 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.58 2vuy h PRO 389 Cb 1.20 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 2vuy h PRO 389 CO 0.95 0.46 -0.33 0.82 -0.21 0.00 0.00 178.00 179.69 2vuy h ILE 390 N 0.72 1.25 0.00 4.15 2.04 -1.96 -3.38 117.51 120.33 2vuy h ILE 390 Ca 0.46 -2.05 -0.00 0.00 1.00 0.00 0.00 64.86 64.27 2vuy h ILE 390 Cb 0.60 2.47 -0.00 0.00 -0.74 0.00 0.00 36.82 39.15 2vuy h ILE 390 CO -0.33 0.42 -0.01 -0.07 0.00 0.00 0.00 178.15 178.16 2vuy h LEU 391 N -1.00 0.00 -0.24 1.44 3.38 -1.86 -2.26 115.31 114.77 2vuy h LEU 391 Ca -0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.89 2vuy h LEU 391 Cb 0.91 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.66 2vuy h LEU 391 CO -0.05 0.01 0.00 -1.54 0.09 0.00 0.00 178.44 176.95 2vuy n SER 392 N -3.13 0.37 -0.04 -0.43 3.41 -0.82 -3.27 113.62 109.70 2vuy n SER 392 Ca -0.01 -1.58 0.04 0.00 -0.26 0.00 0.00 58.87 57.06 2vuy n SER 392 Cb 0.20 -0.03 -0.04 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 -0.50 3.69 -3.26 4.33 1.13 -0.85 -5.04 117.38 116.89 2vuy n GLN 393 Ca 0.12 -0.12 -0.18 0.00 -1.94 0.00 0.00 57.00 54.87 2vuy n GLN 393 Cb 0.11 -0.94 -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 -1.71 3.14 0.25 5.09 -7.23 -1.20 -5.09 120.40 113.64 2vuy s VAL 394 Ca 0.04 -1.10 -0.30 0.00 -1.81 0.00 0.00 61.98 58.82 2vuy s VAL 394 Cb 0.07 -3.08 -0.09 0.00 0.56 0.00 0.00 36.38 33.84 2vuy s VAL 394 CO 0.33 -0.04 0.95 -0.54 -0.31 0.00 0.00 175.10 175.50 2vuy s LYS 395 N -4.25 4.83 -0.14 4.82 1.02 -1.01 -4.99 119.74 120.02 2vuy s LYS 395 Ca 0.51 1.52 -0.00 0.00 0.02 0.00 0.00 55.97 58.01 2vuy s LYS 395 Cb -0.08 -3.26 0.03 0.00 -0.52 0.00 0.00 37.83 34.00 2vuy s LYS 395 CO 0.31 0.49 -0.09 -0.51 -0.92 0.00 0.00 175.35 174.63 2vuy s LEU 396 N -1.23 1.48 0.03 3.17 1.43 -1.26 -1.63 118.68 120.66 2vuy s LEU 396 Ca 0.42 -0.47 0.09 0.00 -1.03 0.00 0.00 54.13 53.13 2vuy s LEU 396 Cb -0.26 -0.96 -0.03 0.00 0.03 0.00 0.00 46.19 44.97 2vuy s LEU 396 CO 0.33 -0.12 -0.26 -0.63 0.23 0.00 0.00 176.35 175.90 2vuy s ILE 397 N 1.62 2.06 -0.02 -0.59 1.01 0.12 -0.22 121.20 125.18 2vuy s ILE 397 Ca 0.04 -1.28 0.02 0.00 0.00 0.00 0.00 60.65 59.42 2vuy s ILE 397 Cb -0.14 -1.75 0.01 0.00 0.01 0.00 0.00 42.46 40.60 2vuy s ILE 397 CO -0.09 0.41 -0.05 0.00 0.00 0.00 0.00 174.94 175.21 2vuy s ALA 398 N -0.74 0.56 -0.31 9.38 0.00 -0.65 0.11 121.76 130.11 2vuy s ALA 398 Ca 0.11 -0.16 -0.28 0.00 0.00 0.00 0.00 51.96 51.63 2vuy s ALA 398 Cb -0.10 -0.25 -0.06 0.00 0.00 0.00 0.00 23.12 22.72 2vuy s ALA 398 CO 0.01 0.07 2.29 -1.91 0.00 0.00 0.00 175.76 176.22 2vuy n GLU 399 N 3.40 1.64 -0.65 0.00 2.13 -0.70 -1.57 120.64 124.88 2vuy n GLU 399 Ca -0.18 0.36 -0.06 0.00 0.66 0.00 0.00 57.16 57.93 2vuy n GLU 399 Cb 0.55 -3.26 0.01 0.00 0.27 0.00 0.00 31.44 29.00 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 8.82 1.31 -3.47 5.31 -0.04 -1.26 -1.46 135.00 144.20 2vuy n PRO 400 Ca 0.33 -0.57 -0.11 0.00 -0.04 0.00 0.00 63.50 63.10 2vuy n PRO 400 Cb 0.47 -1.24 -0.03 0.00 -0.04 0.00 0.00 33.50 32.66 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 -0.62 -0.47 0.00 0.54 -2.14 -1.26 0.06 118.94 115.05 2vuy s TRP 401 Ca 0.12 0.37 0.00 0.00 2.66 0.00 0.00 56.10 59.26 2vuy s TRP 401 Cb 0.09 0.53 0.00 0.00 -3.10 0.00 0.00 33.47 31.00 2vuy s TRP 401 CO -0.00 -0.69 0.00 -0.40 -2.66 0.00 0.00 176.95 173.19 2vuy n ASP 402 N -0.16 1.38 -1.02 -2.66 3.85 -0.97 -3.50 116.55 113.47 2vuy n ASP 402 Ca -0.14 -0.96 0.12 0.00 -0.71 0.00 0.00 54.79 53.10 2vuy n ASP 402 Cb 0.63 0.00 0.18 0.00 -1.35 0.00 0.00 41.12 40.58 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 0.00 0.24 -2.16 2.12 0.24 -0.95 -4.53 118.33 113.29 2vuy n VAL 403 Ca 0.00 -0.60 -0.27 0.00 -2.04 0.00 0.00 64.34 61.43 2vuy n VAL 403 Cb 0.00 1.17 0.14 0.00 -1.47 0.00 0.00 33.84 33.68 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 -1.75 1.75 0.12 7.63 0.00 -1.24 -4.98 107.32 108.85 2vuy s GLY 404 Ca 0.34 -1.28 -0.31 0.00 0.00 0.00 0.00 44.72 43.47 2vuy s GLY 404 CO 0.31 -0.64 1.26 1.62 0.00 0.00 0.00 173.10 175.65 2vuy s GLN 405 N -5.56 4.41 -0.70 2.90 0.74 -1.26 -2.37 119.66 117.82 2vuy s GLN 405 Ca 0.69 1.90 0.00 0.00 0.05 0.00 0.00 55.36 58.00 2vuy s GLN 405 Cb -0.06 -3.28 0.00 0.00 1.10 0.00 0.00 33.01 30.77 2vuy s GLN 405 CO 0.49 -0.26 0.00 0.41 -0.55 0.00 0.00 175.29 175.38 2vuy n GLY 406 N 2.96 0.59 0.04 2.59 0.00 -1.26 -4.92 105.19 105.18 2vuy n GLY 406 Ca 0.08 -0.67 0.13 0.00 0.00 0.00 0.00 46.02 45.56 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 -1.68 -1.47 3.57 -0.02 0.00 -1.00 -4.77 105.19 99.82 2vuy n GLY 407 Ca -0.08 -0.17 -0.41 0.00 0.00 0.00 0.00 46.02 45.36 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 -3.06 2.02 -0.29 1.61 5.04 -1.26 -2.30 117.35 119.10 2vuy s TYR 408 Ca 0.11 0.52 0.09 0.00 -2.44 0.00 0.00 57.07 55.35 2vuy s TYR 408 Cb 0.16 -4.29 0.50 0.00 0.35 0.00 0.00 41.96 38.67 2vuy s TYR 408 CO 0.63 -2.20 1.45 1.04 -1.34 0.00 0.00 175.55 175.12 2vuy n GLN 409 N 8.92 1.86 -1.68 4.97 1.13 0.11 -5.00 117.38 127.69 2vuy n GLN 409 Ca 0.15 -3.24 -0.45 0.00 -1.94 0.00 0.00 57.00 51.53 2vuy n GLN 409 Cb 0.50 -1.82 -0.03 0.00 0.11 0.00 0.00 30.24 29.00 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 -1.12 0.80 0.00 5.09 0.31 -1.09 -1.84 118.33 120.49 2vuy n VAL 410 Ca 0.33 -0.20 0.00 0.00 -0.01 0.00 0.00 64.34 64.46 2vuy n VAL 410 Cb 1.01 -1.54 0.00 0.00 -0.91 0.00 0.00 33.84 32.40 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 2.36 3.00 0.12 2.92 0.00 -1.26 -4.80 105.19 107.54 2vuy n GLY 411 Ca 0.12 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.26 2vuy n GLY 411 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2vuy h ASN 412 N 0.00 0.00 -4.01 1.61 -0.26 -1.73 -3.47 115.58 107.72 2vuy h ASN 412 Ca 0.00 -0.05 -0.56 0.00 -0.56 0.00 0.00 56.30 55.13 2vuy h ASN 412 Cb 0.00 0.00 0.16 0.00 -1.06 0.00 0.00 38.32 37.42 2vuy h ASN 412 CO 0.00 0.03 0.40 0.49 -1.06 0.00 0.00 177.43 177.29 2vuy n PHE 413 N -2.61 1.59 -0.15 1.19 3.01 -1.25 -4.96 117.46 114.27 2vuy n PHE 413 Ca 0.02 0.42 -0.07 0.00 1.01 0.00 0.00 57.45 58.82 2vuy n PHE 413 Cb 0.51 -2.22 0.07 0.00 -0.01 0.00 0.00 39.48 37.84 2vuy n PHE 413 CO 0.00 0.00 0.00 -2.30 1.01 0.00 0.00 176.76 175.47 2vuy n PRO 414 N -1.91 -1.20 0.03 -1.08 -0.02 -1.26 -4.87 135.00 124.69 2vuy n PRO 414 Ca 0.15 -0.34 -0.17 0.00 -2.02 0.00 0.00 63.50 61.12 2vuy n PRO 414 Cb 0.48 -0.59 -0.07 0.00 -0.02 0.00 0.00 33.50 33.31 2vuy n PRO 414 CO 0.00 0.00 0.00 1.88 1.98 0.00 0.00 175.50 179.36 2vuy h TYR 415 N -2.16 0.89 -0.00 6.00 0.99 -1.97 -3.28 116.97 117.44 2vuy h TYR 415 Ca -0.09 -0.45 0.00 0.00 2.00 0.00 0.00 58.73 60.18 2vuy h TYR 415 Cb 0.31 -0.11 0.00 0.00 1.00 0.00 0.00 36.73 37.93 2vuy h TYR 415 CO 0.00 1.28 -0.30 0.94 -0.00 0.00 0.00 178.16 180.07 2vuy n GLN 416 N -3.84 0.25 -2.82 4.88 7.27 -1.26 -4.83 117.38 117.03 2vuy n GLN 416 Ca -0.08 -0.12 -0.34 0.00 0.07 0.00 0.00 57.00 56.52 2vuy n GLN 416 Cb 0.82 -1.50 -0.07 0.00 2.41 0.00 0.00 30.24 31.91 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 -2.83 3.45 0.36 3.69 0.52 -1.24 -4.23 118.94 118.65 2vuy s TRP 417 Ca 0.17 1.65 0.04 0.00 0.02 0.00 0.00 56.10 57.97 2vuy s TRP 417 Cb 0.18 -2.86 -0.01 0.00 -1.15 0.00 0.00 33.47 29.63 2vuy s TRP 417 CO 0.60 0.01 0.52 0.00 0.02 0.00 0.00 176.95 178.11 2vuy s ALA 418 N -1.97 3.98 -0.04 0.98 0.00 0.70 -4.74 121.76 120.66 2vuy s ALA 418 Ca 0.57 -1.23 0.04 0.00 0.00 0.00 0.00 51.96 51.34 2vuy s ALA 418 Cb -0.12 -1.88 0.00 0.00 0.00 0.00 0.00 23.12 21.12 2vuy s ALA 418 CO 0.17 -0.09 -0.15 -1.21 0.00 0.00 0.00 175.76 174.48 2vuy s GLU 419 N -4.28 1.61 -0.33 0.00 2.02 0.97 -1.64 118.70 117.05 2vuy s GLU 419 Ca 0.44 -0.52 -0.39 0.00 0.02 0.00 0.00 54.97 54.52 2vuy s GLU 419 Cb -0.10 -1.40 -0.15 0.00 0.10 0.00 0.00 34.13 32.59 2vuy s GLU 419 CO 0.33 0.19 1.93 0.91 0.02 0.00 0.00 175.26 178.64 2vuy n TRP 420 N 3.27 1.82 -2.92 1.61 7.02 -0.61 -1.50 117.44 126.13 2vuy n TRP 420 Ca -0.19 0.48 -0.44 0.00 -1.02 0.00 0.00 57.50 56.34 2vuy n TRP 420 Cb 0.53 -2.46 -0.01 0.00 -2.42 0.00 0.00 31.31 26.95 2vuy n TRP 420 CO 0.00 0.00 0.00 1.21 -2.02 0.00 0.00 177.69 176.88 2vuy s ASN 421 N 5.03 6.90 0.44 -0.99 3.84 -0.56 -4.67 114.94 124.93 2vuy s ASN 421 Ca 1.04 -2.62 0.14 0.00 0.21 0.00 0.00 52.86 51.63 2vuy s ASN 421 Cb -1.05 -2.41 0.97 0.00 -0.55 0.00 0.00 41.25 38.20 2vuy s ASN 421 CO 0.61 -0.89 1.98 1.23 -2.79 0.00 0.00 177.10 177.24 2vuy h GLY 422 N 10.12 0.05 1.17 1.21 0.00 -1.90 -2.17 103.07 111.56 2vuy h GLY 422 Ca 0.26 -0.03 -0.01 0.00 0.00 0.00 0.00 47.33 47.55 2vuy h GLY 422 CO 1.21 0.03 0.45 1.70 0.00 0.00 0.00 176.54 179.92 2vuy h LYS 423 N 0.04 1.09 0.10 4.80 1.63 -1.98 -0.44 116.57 121.81 2vuy h LYS 423 Ca 0.01 -0.11 -0.00 0.00 -0.85 0.00 0.00 60.65 59.69 2vuy h LYS 423 Cb 0.32 -0.22 0.00 0.00 -0.60 0.00 0.00 32.23 31.73 2vuy h LYS 423 CO 0.02 0.78 -0.05 -0.92 -3.45 0.00 0.00 179.45 175.84 2vuy h TYR 424 N 1.10 -0.13 -0.44 1.91 3.20 -1.76 -1.19 116.97 119.66 2vuy h TYR 424 Ca 0.28 -0.00 0.09 0.00 3.14 0.00 0.00 58.73 62.24 2vuy h TYR 424 Cb -0.00 0.04 -0.09 0.00 1.54 0.00 0.00 36.73 38.22 2vuy h TYR 424 CO 0.01 0.16 -0.13 -0.09 -1.64 0.00 0.00 178.16 176.47 2vuy h ARG 425 N -0.41 -0.02 0.80 1.82 2.43 -1.13 0.09 114.38 117.97 2vuy h ARG 425 Ca -0.01 0.00 -0.04 0.00 -0.81 0.00 0.00 59.98 59.12 2vuy h ARG 425 Cb 0.34 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.91 2vuy h ARG 425 CO 0.02 -0.01 -0.39 -0.44 -1.51 0.00 0.00 179.97 177.64 2vuy h ASP 426 N -0.02 -0.91 -0.14 -3.80 3.45 -1.03 -1.28 116.42 112.68 2vuy h ASP 426 Ca 0.21 0.03 0.05 0.00 0.43 0.00 0.00 57.03 57.75 2vuy h ASP 426 Cb 0.34 0.24 -0.07 0.00 -0.56 0.00 0.00 39.33 39.29 2vuy h ASP 426 CO -0.47 -0.55 -0.34 0.28 -1.57 0.00 0.00 179.24 176.60 2vuy h SER 427 N -1.28 -1.06 -0.25 6.45 0.02 -1.09 0.14 113.55 116.47 2vuy h SER 427 Ca -0.11 0.15 0.04 0.00 -0.84 0.00 0.00 61.79 61.04 2vuy h SER 427 Cb 0.83 0.45 -0.01 0.00 0.14 0.00 0.00 62.40 63.80 2vuy h SER 427 CO 0.18 -0.37 0.17 0.40 -1.14 0.00 0.00 176.83 176.08 2vuy h ILE 428 N -0.41 0.95 -0.25 3.27 5.03 -1.05 0.12 117.51 125.17 2vuy h ILE 428 Ca 0.10 -0.05 -0.12 0.00 -0.12 0.00 0.00 64.86 64.66 2vuy h ILE 428 Cb 0.56 0.79 -0.00 0.00 -3.03 0.00 0.00 36.82 35.14 2vuy h ILE 428 CO -0.37 0.03 -0.33 -0.09 -0.68 0.00 0.00 178.15 176.71 2vuy h ARG 429 N 0.15 0.67 -0.06 2.37 2.43 0.16 -3.17 114.38 116.93 2vuy h ARG 429 Ca 0.11 -0.38 -0.18 0.00 -0.81 0.00 0.00 59.98 58.72 2vuy h ARG 429 Cb 0.26 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.83 2vuy h ARG 429 CO -0.02 1.00 -0.74 0.00 -1.51 0.00 0.00 179.97 178.70 2vuy h ARG 430 N 0.39 0.36 0.20 0.20 3.08 0.27 -3.12 114.38 115.75 2vuy h ARG 430 Ca 0.03 -0.30 -0.00 0.00 0.07 0.00 0.00 59.98 59.78 2vuy h ARG 430 Cb 0.91 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 31.01 2vuy h ARG 430 CO 0.08 0.94 -0.15 0.35 -1.07 0.00 0.00 179.97 180.12 2vuy h PHE 431 N 0.24 -0.39 0.00 3.04 3.57 -0.84 -2.27 116.94 120.29 2vuy h PHE 431 Ca -0.03 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.47 2vuy h PHE 431 Cb 1.31 0.15 0.00 0.00 2.79 0.00 0.00 35.95 40.20 2vuy h PHE 431 CO 0.04 -0.23 0.00 0.91 -2.23 0.00 0.00 178.31 176.80 2vuy n TRP 432 N -5.27 0.00 0.15 0.41 7.02 -1.20 -2.22 117.44 116.34 2vuy n TRP 432 Ca -0.08 0.00 0.07 0.00 -1.02 0.00 0.00 57.50 56.46 2vuy n TRP 432 Cb 0.19 -0.39 0.06 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 -1.36 -3.48 114.38 110.99 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 0.27 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.82 2vuy h ARG 433 CO 0.00 0.24 0.00 0.41 -1.51 0.00 0.00 179.97 179.11 2vuy n GLY 434 N 1.19 1.37 3.59 2.80 0.00 -0.94 -5.02 105.19 108.18 2vuy n GLY 434 Ca 0.01 -0.25 -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 1.34 -3.47 1.61 1.02 -0.92 -4.91 120.64 115.31 2vuy n GLU 435 Ca 0.00 0.47 -0.42 0.00 -0.02 0.00 0.00 57.16 57.19 2vuy n GLU 435 Cb 0.00 -1.91 -0.10 0.00 -0.02 0.00 0.00 31.44 29.41 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 -0.69 3.48 0.24 0.62 0.00 -1.26 -4.26 121.76 119.89 2vuy s ALA 436 Ca 0.64 -1.66 0.06 0.00 0.00 0.00 0.00 51.96 51.01 2vuy s ALA 436 Cb -0.75 -2.84 -0.03 0.00 0.00 0.00 0.00 23.12 19.50 2vuy s ALA 436 CO 0.57 -1.37 0.25 -0.51 0.00 0.00 0.00 175.76 174.69 2vuy s LEU 437 N 1.69 3.98 0.21 0.00 1.02 -1.17 -4.51 118.68 119.89 2vuy s LEU 437 Ca 0.05 -0.14 -0.32 0.00 0.02 0.00 0.00 54.13 53.74 2vuy s LEU 437 Cb -0.19 -2.52 -0.13 0.00 0.02 0.00 0.00 46.19 43.37 2vuy s LEU 437 CO 0.10 -0.04 1.51 -2.65 0.02 0.00 0.00 176.35 175.29 2vuy n PRO 438 N -1.22 2.16 -0.30 1.29 -0.02 -1.26 -1.38 135.00 134.28 2vuy n PRO 438 Ca -0.08 0.77 0.13 0.00 -2.02 0.00 0.00 63.50 62.30 2vuy n PRO 438 Cb 0.57 -2.50 0.29 0.00 -0.02 0.00 0.00 33.50 31.85 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 5.11 0.41 -1.00 6.00 -0.00 -1.53 0.29 116.97 126.24 2vuy h TYR 439 Ca -0.45 0.05 0.05 0.00 -0.00 0.00 0.00 58.73 58.38 2vuy h TYR 439 Cb 1.26 -0.04 -0.06 0.00 -0.00 0.00 0.00 36.73 37.89 2vuy h TYR 439 CO 0.59 -0.18 0.65 0.66 -0.00 0.00 0.00 178.16 179.89 2vuy h SER 440 N 0.24 1.07 0.25 -2.11 4.64 -1.16 -0.10 113.55 116.39 2vuy h SER 440 Ca 0.55 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.86 2vuy h SER 440 Cb 1.09 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 62.96 2vuy h SER 440 CO -0.62 0.71 -0.12 -0.08 -0.87 0.00 0.00 176.83 175.84 2vuy h GLU 441 N 1.22 -0.33 -0.04 4.77 4.57 -0.73 0.11 114.58 124.16 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 0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 28.74 2vuy h GLU 441 CO -0.15 -0.20 0.02 0.82 -1.18 0.00 0.00 179.01 178.32 2vuy h ILE 442 N -0.36 1.13 -0.80 2.32 1.08 -1.23 -2.80 117.51 116.85 2vuy h ILE 442 Ca -0.03 -0.38 0.09 0.00 -0.39 0.00 0.00 64.86 64.15 2vuy h ILE 442 Cb 0.28 1.32 -0.07 0.00 -3.07 0.00 0.00 36.82 35.27 2vuy h ILE 442 CO 0.06 0.10 0.45 0.00 -0.69 0.00 0.00 178.15 178.07 2vuy h ALA 443 N 0.86 1.13 -0.60 1.87 0.00 -0.96 -1.60 119.26 119.97 2vuy h ALA 443 Ca 0.01 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2vuy h ALA 443 Cb 0.16 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 2vuy h ALA 443 CO -0.00 0.08 0.38 -0.91 0.00 0.00 0.00 179.25 178.80 2vuy h ASN 444 N 0.77 0.71 0.13 0.00 2.35 -0.86 -0.86 115.58 117.81 2vuy h ASN 444 Ca 0.38 -0.04 -0.01 0.00 -0.55 0.00 0.00 56.30 56.08 2vuy h ASN 444 Cb 0.34 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.54 2vuy h ASN 444 CO -0.24 0.54 -0.06 0.03 -1.65 0.00 0.00 177.43 176.05 2vuy h ARG 445 N 0.81 -0.16 -0.04 0.81 2.47 -1.12 0.74 114.38 117.88 2vuy h ARG 445 Ca 0.22 0.01 0.01 0.00 -1.26 0.00 0.00 59.98 58.96 2vuy h ARG 445 Cb -0.05 0.04 -0.00 0.00 -1.65 0.00 0.00 29.97 28.31 2vuy h ARG 445 CO -0.04 -0.10 0.03 -0.07 0.56 0.00 0.00 179.97 180.35 2vuy h LEU 446 N -0.17 0.00 -3.01 3.04 3.38 -1.03 -2.16 115.31 115.35 2vuy h LEU 446 Ca -0.02 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 2vuy h LEU 446 Cb 0.13 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 2vuy h LEU 446 CO 0.03 0.00 0.00 0.18 0.09 0.00 0.00 178.44 178.74 2vuy n LEU 447 N -4.45 4.74 0.00 1.67 4.32 -0.35 -0.15 117.00 122.78 2vuy n LEU 447 Ca -0.02 -2.40 0.00 0.00 -0.02 0.00 0.00 56.01 53.57 2vuy n LEU 447 Cb 0.13 -0.65 0.00 0.00 -1.62 0.00 0.00 43.42 41.28 2vuy n LEU 447 CO 0.33 0.55 0.00 0.61 -1.22 0.00 0.00 177.39 177.66 2vuy n GLY 448 N 0.48 0.66 3.10 -0.72 0.00 -0.81 -4.46 105.19 103.44 2vuy n GLY 448 Ca 0.22 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.10 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 -5.39 0.22 1.61 7.64 0.25 -4.78 113.62 113.17 2vuy n SER 449 Ca 0.00 -0.62 0.05 0.00 1.01 0.00 0.00 58.87 59.30 2vuy n SER 449 Cb 0.00 -4.73 0.47 0.00 -1.01 0.00 0.00 64.21 58.94 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 -1.12 0.00 0.00 1.43 0.11 -1.78 -1.86 132.00 128.78 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 0.41 0.23 -0.01 0.38 -0.21 0.00 0.00 178.00 178.79 2vuy h ASP 451 N 0.00 0.00 0.00 -2.05 2.03 -1.90 0.23 116.42 114.73 2vuy h ASP 451 Ca -0.00 0.00 -0.35 0.00 -0.73 0.00 0.00 57.03 55.95 2vuy h ASP 451 Cb 0.41 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 38.85 2vuy h ASP 451 CO 0.03 0.01 -2.01 -0.38 -1.03 0.00 0.00 179.24 175.87 2vuy n ILE 452 N -3.24 1.52 0.01 4.15 5.41 -0.73 -4.75 119.36 121.73 2vuy n ILE 452 Ca -0.02 -0.23 0.11 0.00 1.00 0.00 0.00 62.75 63.61 2vuy n ILE 452 Cb 0.13 -1.98 -0.17 0.00 -0.71 0.00 0.00 39.64 36.90 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 -4.33 0.00 0.30 1.39 4.02 -1.02 -4.38 117.16 113.14 2vuy n TYR 453 Ca -0.44 0.00 0.18 0.00 -0.01 0.00 0.00 57.90 57.63 2vuy n TYR 453 Cb 0.78 -0.49 0.75 0.00 -0.02 0.00 0.00 39.34 40.36 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 -0.18 7.72 5.85 -0.71 -0.57 115.31 127.43 2vuy h LEU 454 Ca 0.00 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.62 2vuy h LEU 454 Cb 0.99 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.02 2vuy h LEU 454 CO 0.00 0.00 -0.27 1.23 -0.34 0.00 0.00 178.44 179.06 2vuy h GLY 455 N 1.70 0.53 -3.74 3.75 0.00 -1.76 -3.24 103.07 100.32 2vuy h GLY 455 Ca 0.00 -0.60 -0.47 0.00 0.00 0.00 0.00 47.33 46.26 2vuy h GLY 455 CO 0.00 0.54 0.60 0.70 0.00 0.00 0.00 176.54 178.38 2vuy n ASN 456 N -4.40 6.95 -1.12 0.19 4.13 -1.13 -4.85 115.26 115.03 2vuy n ASN 456 Ca -0.06 -3.35 -0.12 0.00 1.68 0.00 0.00 54.58 52.73 2vuy n ASN 456 Cb 0.45 -1.04 -0.05 0.00 -1.54 0.00 0.00 39.78 37.60 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 -0.11 -4.25 -4.91 6.41 4.13 -1.22 -4.96 115.26 110.35 2vuy n ASN 457 Ca 0.43 0.30 -0.28 0.00 1.68 0.00 0.00 54.58 56.71 2vuy n ASN 457 Cb 0.60 -3.56 0.05 0.00 -1.54 0.00 0.00 39.78 35.33 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 -2.91 2.66 0.45 3.52 -0.14 -0.23 -5.02 119.74 118.06 2vuy s LYS 458 Ca 0.00 0.12 0.06 0.00 -1.36 0.00 0.00 55.97 54.79 2vuy s LYS 458 Cb 0.00 -2.13 -0.04 0.00 -1.68 0.00 0.00 37.83 33.98 2vuy s LYS 458 CO 0.00 -1.01 0.12 0.95 -0.76 0.00 0.00 175.35 174.65 2vuy s THR 459 N -3.23 1.92 0.59 2.17 -4.23 -1.26 -4.28 115.64 107.33 2vuy s THR 459 Ca 0.57 -1.82 0.29 0.00 -1.18 0.00 0.00 61.69 59.55 2vuy s THR 459 Cb -0.11 -2.74 0.37 0.00 1.34 0.00 0.00 72.50 71.37 2vuy s THR 459 CO 0.48 0.00 1.89 -0.65 -0.54 0.00 0.00 174.62 175.80 2vuy h PRO 460 N 1.43 0.00 -0.02 3.99 0.11 -1.84 -0.83 132.00 134.84 2vuy h PRO 460 Ca -0.43 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.66 2vuy h PRO 460 Cb 1.27 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.37 2vuy h PRO 460 CO 0.73 0.00 -0.07 0.74 -0.21 0.00 0.00 178.00 179.18 2vuy h PHE 461 N 0.00 0.03 0.00 0.65 0.04 -1.87 -1.85 116.94 113.94 2vuy h PHE 461 Ca 0.20 -0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.96 2vuy h PHE 461 Cb 1.15 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 39.29 2vuy h PHE 461 CO 0.00 0.11 -0.02 0.00 -0.60 0.00 0.00 178.31 177.80 2vuy h ALA 462 N 1.90 1.31 -2.26 2.45 0.00 -1.43 -3.41 119.26 117.82 2vuy h ALA 462 Ca 0.01 -0.01 -0.63 0.00 0.00 0.00 0.00 54.91 54.28 2vuy h ALA 462 Cb 0.15 -0.00 -0.13 0.00 0.00 0.00 0.00 17.79 17.81 2vuy h ALA 462 CO 0.01 0.02 0.23 0.45 0.00 0.00 0.00 179.25 179.95 2vuy s SER 463 N -5.81 6.46 -0.63 0.00 0.15 -0.70 -0.02 113.70 113.15 2vuy s SER 463 Ca -0.05 0.19 -0.16 0.00 0.70 0.00 0.00 55.95 56.63 2vuy s SER 463 Cb 0.14 -2.35 0.14 0.00 -1.71 0.00 0.00 66.02 62.24 2vuy s SER 463 CO 0.51 -0.66 0.64 -0.63 1.20 0.00 0.00 173.24 174.30 2vuy s ILE 464 N 2.86 5.18 0.18 6.45 -1.09 -0.56 -1.02 121.20 133.20 2vuy s ILE 464 Ca 0.27 -1.60 -0.29 0.00 -2.23 0.00 0.00 60.65 56.80 2vuy s ILE 464 Cb -0.14 -4.43 -0.08 0.00 -1.58 0.00 0.00 42.46 36.24 2vuy s ILE 464 CO 0.16 -1.00 0.91 0.20 -1.23 0.00 0.00 174.94 173.98 2vuy s ASN 465 N 3.29 7.53 -0.09 3.58 0.01 0.14 -1.49 114.94 127.91 2vuy s ASN 465 Ca 0.10 1.82 -0.25 0.00 -0.71 0.00 0.00 52.86 53.81 2vuy s ASN 465 Cb -0.23 -2.58 0.06 0.00 0.41 0.00 0.00 41.25 38.91 2vuy s ASN 465 CO 0.01 0.09 0.59 -0.72 -1.51 0.00 0.00 177.10 175.56 2vuy s TYR 466 N -0.74 -0.57 -0.09 2.20 1.13 -1.26 -0.51 117.35 117.51 2vuy s TYR 466 Ca 0.42 1.09 0.16 0.00 -1.41 0.00 0.00 57.07 57.32 2vuy s TYR 466 Cb -0.24 0.30 -0.24 0.00 -1.10 0.00 0.00 41.96 40.68 2vuy s TYR 466 CO 0.30 -0.50 0.38 1.33 -2.51 0.00 0.00 175.55 174.55 2vuy n VAL 467 N 1.43 0.00 -3.67 -3.49 0.24 -1.26 -3.58 118.33 108.00 2vuy n VAL 467 Ca -0.18 -0.34 -0.13 0.00 -2.04 0.00 0.00 64.34 61.64 2vuy n VAL 467 Cb 0.56 0.22 -0.07 0.00 -1.47 0.00 0.00 33.84 33.09 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 -4.97 115.64 108.60 2vuy s THR 468 Ca -0.05 -0.42 -0.05 0.00 -1.21 0.00 0.00 61.69 59.97 2vuy s THR 468 Cb 0.10 -0.88 0.02 0.00 -1.51 0.00 0.00 72.50 70.23 2vuy s THR 468 CO 0.66 -0.23 0.31 -1.54 -2.21 0.00 0.00 174.62 171.61 2vuy n SER 469 N 0.72 -0.88 0.32 8.08 3.41 -1.26 -4.16 113.62 119.85 2vuy n SER 469 Ca -0.19 -1.76 0.20 0.00 -0.26 0.00 0.00 58.87 56.86 2vuy n SER 469 Cb 0.59 1.51 1.11 0.00 -0.26 0.00 0.00 64.21 67.16 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 1.45 0.00 -3.39 7.33 2.07 -1.95 -3.39 115.15 117.27 2vuy h HIS 470 Ca -0.14 0.00 -0.59 0.00 -2.85 0.00 0.00 60.37 56.78 2vuy h HIS 470 Cb 0.55 0.00 -0.09 0.00 2.57 0.00 0.00 27.41 30.43 2vuy h HIS 470 CO 0.00 0.00 0.23 -0.51 -3.07 0.00 0.00 177.93 174.58 2vuy s ASP 471 N -5.51 6.73 0.00 3.10 1.01 -1.26 -4.81 116.67 115.93 2vuy s ASP 471 Ca -0.05 0.89 0.00 0.00 0.71 0.00 0.00 52.55 54.10 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 0.46 -0.35 0.00 0.61 0.21 0.00 0.00 175.17 176.10 2vuy n GLY 472 N 3.81 -0.26 3.74 0.21 0.00 -0.95 -4.95 105.19 106.79 2vuy n GLY 472 Ca 0.01 -1.46 -0.29 0.00 0.00 0.00 0.00 46.02 44.28 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 2.37 0.60 1.61 2.99 -1.26 -4.29 117.98 120.00 2vuy s PHE 473 Ca 0.00 0.95 0.08 0.00 0.00 0.00 0.00 56.93 57.97 2vuy s PHE 473 Cb 0.00 -3.30 0.10 0.00 0.00 0.00 0.00 43.02 39.82 2vuy s PHE 473 CO 0.00 -2.53 0.83 0.25 -0.00 0.00 0.00 175.22 173.77 2vuy n THR 474 N -3.91 0.00 -0.11 0.64 -2.24 -1.26 -4.29 114.28 103.11 2vuy n THR 474 Ca 0.06 -1.89 -0.13 0.00 -2.27 0.00 0.00 64.05 59.82 2vuy n THR 474 Cb 0.58 -0.56 -0.03 0.00 -2.10 0.00 0.00 70.33 68.21 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 -0.13 3.22 5.85 -1.94 -0.24 115.31 122.87 2vuy h LEU 475 Ca -0.28 -0.45 -0.00 0.00 0.84 0.00 0.00 57.88 57.99 2vuy h LEU 475 Cb 1.25 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 42.05 2vuy h LEU 475 CO 0.38 1.08 0.08 -0.08 -0.34 0.00 0.00 178.44 179.56 2vuy h GLU 476 N 0.52 0.17 0.00 1.25 4.57 -1.87 -2.74 114.58 116.48 2vuy h GLU 476 Ca 0.06 -0.01 -0.05 0.00 -1.18 0.00 0.00 59.36 58.17 2vuy h GLU 476 Cb 0.83 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 29.37 2vuy h GLU 476 CO 0.07 0.15 -0.25 -0.44 -1.18 0.00 0.00 179.01 177.36 2vuy h ASP 477 N 0.15 0.00 0.36 1.04 3.45 -1.76 -2.85 116.42 116.81 2vuy h ASP 477 Ca 0.05 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.50 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 0.25 -0.01 0.25 -1.57 0.00 0.00 179.24 178.15 2vuy h LEU 478 N 0.00 0.00 -3.02 1.55 5.85 -0.71 -1.80 115.31 117.18 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 0.66 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.69 2vuy h LEU 478 CO 0.03 0.01 0.00 1.33 -0.34 0.00 0.00 178.44 179.48 2vuy n VAL 479 N -3.18 1.45 -0.25 1.05 0.24 -1.09 -3.28 118.33 113.28 2vuy n VAL 479 Ca -0.02 -1.47 0.00 0.00 -2.04 0.00 0.00 64.34 60.81 2vuy n VAL 479 Cb 0.16 0.18 0.00 0.00 -1.47 0.00 0.00 33.84 32.72 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 -0.51 0.55 -3.83 -1.34 7.64 -0.72 -3.68 113.62 111.73 2vuy n SER 480 Ca 0.10 -0.87 -0.12 0.00 1.01 0.00 0.00 58.87 58.99 2vuy n SER 480 Cb 0.50 0.14 -0.13 0.00 -1.01 0.00 0.00 64.21 63.70 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 -0.14 -0.10 -0.53 1.43 1.51 -0.94 -1.14 117.35 117.45 2vuy s TYR 481 Ca 0.00 0.25 0.23 0.00 -1.01 0.00 0.00 57.07 56.55 2vuy s TYR 481 Cb 0.00 0.01 0.15 0.00 -0.11 0.00 0.00 41.96 42.01 2vuy s TYR 481 CO 0.00 -0.06 1.13 0.09 -1.11 0.00 0.00 175.55 175.60 2vuy n ASN 482 N 3.18 0.67 -3.56 2.29 3.02 -1.26 -3.80 115.26 115.80 2vuy n ASN 482 Ca -0.14 0.03 -0.11 0.00 -0.03 0.00 0.00 54.58 54.33 2vuy n ASN 482 Cb 0.58 0.51 -0.04 0.00 -0.61 0.00 0.00 39.78 40.23 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 -3.23 1.17 0.61 3.52 -2.07 -1.26 -4.83 119.66 113.58 2vuy s GLN 483 Ca 0.04 -0.63 -0.18 0.00 -1.82 0.00 0.00 55.36 52.77 2vuy s GLN 483 Cb 0.13 0.52 -0.03 0.00 -1.09 0.00 0.00 33.01 32.54 2vuy s GLN 483 CO 0.77 -0.48 1.17 -1.59 -1.32 0.00 0.00 175.29 173.84 2vuy s LYS 484 N -3.79 2.94 -0.49 9.60 -2.85 -1.26 -4.99 119.74 118.90 2vuy s LYS 484 Ca 0.03 1.68 0.06 0.00 -1.00 0.00 0.00 55.97 56.74 2vuy s LYS 484 Cb 0.01 -1.94 0.21 0.00 -2.06 0.00 0.00 37.83 34.04 2vuy s LYS 484 CO -0.12 -1.20 0.48 0.72 0.10 0.00 0.00 175.35 175.34 2vuy n HIS 485 N -1.80 0.61 -1.43 1.78 8.25 -0.10 -4.97 115.22 117.57 2vuy n HIS 485 Ca 0.12 -3.68 -0.21 0.00 -0.26 0.00 0.00 57.72 53.70 2vuy n HIS 485 Cb 0.50 -0.20 0.14 0.00 1.12 0.00 0.00 29.99 31.56 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 1.95 4.51 -0.26 0.41 3.02 -1.26 -3.71 115.26 119.91 2vuy n ASN 486 Ca 0.25 -3.73 -0.05 0.00 -0.03 0.00 0.00 54.58 51.02 2vuy n ASN 486 Cb 0.46 -0.75 0.06 0.00 -0.61 0.00 0.00 39.78 38.94 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 1.40 0.98 -0.26 3.52 3.07 -1.95 -2.49 114.58 118.85 2vuy h GLU 487 Ca 0.47 -0.07 0.08 0.00 -0.50 0.00 0.00 59.36 59.33 2vuy h GLU 487 Cb 1.81 -0.21 -0.01 0.00 -0.84 0.00 0.00 28.75 29.49 2vuy h GLU 487 CO 0.97 0.67 0.75 0.00 -1.40 0.00 0.00 179.01 180.00 2vuy h ALA 488 N 1.25 2.00 0.00 3.43 0.00 -2.03 0.63 119.26 124.53 2vuy h ALA 488 Ca 0.26 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2vuy h ALA 488 Cb -0.07 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2vuy h ALA 488 CO -0.05 -0.88 -0.20 0.09 0.00 0.00 0.00 179.25 178.20 2vuy n ASN 489 N -2.96 0.48 -0.51 0.00 3.02 -0.94 -4.95 115.26 109.42 2vuy n ASN 489 Ca 0.05 0.33 -0.05 0.00 -0.03 0.00 0.00 54.58 54.88 2vuy n ASN 489 Cb 0.85 -0.35 -0.01 0.00 -0.61 0.00 0.00 39.78 39.66 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 1.41 0.45 0.86 7.41 0.00 0.22 -4.92 105.19 110.61 2vuy n GLY 490 Ca 0.06 -0.74 0.02 0.00 0.00 0.00 0.00 46.02 45.36 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 -3.47 0.74 -3.98 1.61 3.72 -1.26 -4.95 117.46 109.88 2vuy n PHE 491 Ca -0.06 -1.32 -0.28 0.00 -0.05 0.00 0.00 57.45 55.74 2vuy n PHE 491 Cb 0.37 -0.37 -0.01 0.00 -0.94 0.00 0.00 39.48 38.54 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 -1.02 -1.41 -2.69 4.37 4.05 -1.26 -1.09 115.26 116.20 2vuy n ASN 492 Ca 0.26 -0.97 -0.14 0.00 0.45 0.00 0.00 54.58 54.18 2vuy n ASN 492 Cb 0.90 -3.17 -0.00 0.00 1.23 0.00 0.00 39.78 38.73 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 -2.92 -3.57 0.09 1.20 4.05 -1.26 -4.84 115.26 108.02 2vuy n ASN 493 Ca -0.20 0.07 0.07 0.00 0.45 0.00 0.00 54.58 54.97 2vuy n ASN 493 Cb 0.63 -3.03 -0.01 0.00 1.23 0.00 0.00 39.78 38.60 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 -0.27 0.00 -6.85 1.20 1.08 -1.45 -3.48 115.11 105.35 2vuy h GLN 494 Ca -0.30 0.00 -0.48 0.00 -1.45 0.00 0.00 58.65 56.42 2vuy h GLN 494 Cb 1.21 0.00 0.03 0.00 -0.05 0.00 0.00 27.48 28.67 2vuy h GLN 494 CO 0.36 0.14 0.04 0.16 -0.95 0.00 0.00 178.83 178.58 2vuy s ASP 495 N -5.67 6.19 0.00 1.46 -4.77 -1.26 -5.00 116.67 107.62 2vuy s ASP 495 Ca -0.00 0.78 0.00 0.00 -3.30 0.00 0.00 52.55 50.02 2vuy s ASP 495 Cb 0.09 -2.12 0.00 0.00 -1.09 0.00 0.00 42.92 39.80 2vuy s ASP 495 CO 0.78 -0.57 0.00 0.61 0.70 0.00 0.00 175.17 176.70 2vuy n GLY 496 N -2.18 -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 -0.40 0.00 0.00 0.00 0.00 46.02 44.00 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 2.14 -0.04 1.61 2.81 -1.26 -4.93 117.12 117.64 2vuy n MET 497 Ca 0.00 0.77 -0.07 0.00 -1.81 0.00 0.00 57.70 56.59 2vuy n MET 497 Cb 0.00 -2.63 -0.14 0.00 -0.71 0.00 0.00 33.22 29.74 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 -0.40 0.53 -4.44 7.83 3.02 -1.26 -4.76 115.26 115.77 2vuy n ASN 498 Ca 0.06 0.25 -0.39 0.00 -0.03 0.00 0.00 54.58 54.47 2vuy n ASN 498 Cb 0.42 0.44 -0.11 0.00 -0.61 0.00 0.00 39.78 39.91 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 -2.66 3.29 0.00 3.52 2.56 -1.26 -4.87 118.70 119.28 2vuy s GLU 499 Ca -0.06 -0.75 0.08 0.00 0.00 0.00 0.00 54.97 54.23 2vuy s GLU 499 Cb 0.08 -3.61 0.03 0.00 2.00 0.00 0.00 34.13 32.63 2vuy s GLU 499 CO 0.83 -0.45 0.65 0.09 -0.56 0.00 0.00 175.26 175.81 2vuy n ASN 500 N 4.99 1.35 -3.92 -1.70 4.13 -1.26 -5.00 115.26 113.86 2vuy n ASN 500 Ca -0.13 -1.18 -0.26 0.00 1.68 0.00 0.00 54.58 54.69 2vuy n ASN 500 Cb 0.49 0.23 -0.01 0.00 -1.54 0.00 0.00 39.78 38.95 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 0.07 -1.68 -4.71 3.10 4.02 -1.26 -4.96 117.16 111.74 2vuy n TYR 501 Ca 0.04 0.70 -0.32 0.00 -0.01 0.00 0.00 57.90 58.31 2vuy n TYR 501 Cb 0.18 -3.71 -0.08 0.00 -0.02 0.00 0.00 39.34 35.71 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 -4.25 3.86 -0.29 7.72 1.04 -1.26 -4.46 113.70 116.06 2vuy s SER 502 Ca 0.07 -1.67 -0.13 0.00 0.48 0.00 0.00 55.95 54.70 2vuy s SER 502 Cb -0.03 0.53 0.11 0.00 0.10 0.00 0.00 66.02 66.74 2vuy s SER 502 CO 0.88 -0.88 0.70 0.86 0.98 0.00 0.00 173.24 175.79 2vuy s TRP 503 N -2.95 -1.16 -1.58 5.02 -0.00 -1.20 -4.83 118.94 112.24 2vuy s TRP 503 Ca 0.09 2.14 0.00 0.00 -0.00 0.00 0.00 56.10 58.33 2vuy s TRP 503 Cb 0.02 0.69 0.00 0.00 -0.00 0.00 0.00 33.47 34.18 2vuy s TRP 503 CO 0.05 -0.57 0.59 0.27 -0.00 0.00 0.00 176.95 177.29 2vuy n ASN 504 N 4.84 0.31 -0.84 5.86 2.04 -1.25 -3.99 115.26 122.23 2vuy n ASN 504 Ca -0.16 -1.49 -0.10 0.00 -0.44 0.00 0.00 54.58 52.39 2vuy n ASN 504 Cb 0.54 -0.16 -0.04 0.00 -2.53 0.00 0.00 39.78 37.59 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 0.20 1.08 3.59 0.00 0.00 -1.26 -4.71 105.19 104.08 2vuy n GLY 506 Ca -0.10 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.39 -0.16 4.61 0.00 -1.08 -5.06 121.76 115.68 2vuy s ALA 507 Ca 0.00 2.16 -0.29 0.00 0.00 0.00 0.00 51.96 53.83 2vuy s ALA 507 Cb 0.00 -1.80 -0.02 0.00 0.00 0.00 0.00 23.12 21.30 2vuy s ALA 507 CO 0.00 -0.49 1.39 -2.00 0.00 0.00 0.00 175.76 174.66 2vuy s GLU 508 N 1.59 4.15 1.21 0.00 2.56 -1.26 -4.72 118.70 122.24 2vuy s GLU 508 Ca -0.08 1.74 0.00 0.00 0.00 0.00 0.00 54.97 56.64 2vuy s GLU 508 Cb -0.04 -3.85 0.00 0.00 2.00 0.00 0.00 34.13 32.24 2vuy s GLU 508 CO -0.15 -0.83 0.00 0.41 -0.56 0.00 0.00 175.26 174.13 2vuy n GLY 509 N 3.89 -1.84 3.71 -1.50 0.00 -0.29 -4.92 105.19 104.23 2vuy n GLY 509 Ca 0.15 -1.47 -0.41 0.00 0.00 0.00 0.00 46.02 44.29 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 1.96 -4.23 1.61 -0.02 -1.26 -4.97 135.00 128.09 2vuy n PRO 510 Ca 0.00 0.70 -0.14 0.00 -2.02 0.00 0.00 63.50 62.04 2vuy n PRO 510 Cb 0.00 -2.42 -0.10 0.00 -0.02 0.00 0.00 33.50 30.96 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 -1.20 0.03 0.00 3.45 2.01 -1.26 -5.03 115.64 113.64 2vuy s THR 511 Ca 0.61 -2.00 0.00 0.00 0.31 0.00 0.00 61.69 60.61 2vuy s THR 511 Cb -0.50 -2.50 0.00 0.00 0.01 0.00 0.00 72.50 69.51 2vuy s THR 511 CO 0.58 0.00 0.05 0.59 -0.69 0.00 0.00 174.62 175.15 2vuy n ASN 512 N -0.62 0.11 -4.56 3.53 3.02 -1.26 -4.95 115.26 110.53 2vuy n ASN 512 Ca 0.03 -0.47 -0.24 0.00 -0.03 0.00 0.00 54.58 53.87 2vuy n ASN 512 Cb 0.65 0.66 -0.06 0.00 -0.61 0.00 0.00 39.78 40.43 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 -0.66 4.84 0.40 6.41 -1.08 -1.26 -4.80 116.67 120.52 2vuy s ASP 513 Ca 0.00 -0.65 0.24 0.00 -0.52 0.00 0.00 52.55 51.63 2vuy s ASP 513 Cb 0.00 -2.56 1.32 0.00 -1.46 0.00 0.00 42.92 40.22 2vuy s ASP 513 CO 0.00 -3.05 1.64 1.56 0.52 0.00 0.00 175.17 175.83 2vuy h GLN 514 N 11.40 0.14 0.00 4.34 1.08 -1.99 1.65 115.11 131.74 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 -0.12 -0.91 -0.95 0.00 0.00 178.83 178.11 2vuy h ASN 515 N 0.14 0.00 0.30 1.46 4.21 -2.00 0.41 115.58 120.11 2vuy h ASN 515 Ca 0.79 0.00 -0.33 0.00 1.21 0.00 0.00 56.30 57.97 2vuy h ASN 515 Cb 2.26 0.00 0.02 0.00 -1.12 0.00 0.00 38.32 39.47 2vuy h ASN 515 CO -0.50 0.12 -1.59 1.62 -1.29 0.00 0.00 177.43 175.79 2vuy h VAL 516 N 0.00 1.13 -0.74 2.81 3.04 0.21 -3.09 116.25 119.62 2vuy h VAL 516 Ca -0.00 -2.67 -0.05 0.00 -1.01 0.00 0.00 66.70 62.97 2vuy h VAL 516 Cb 0.24 2.86 -0.03 0.00 -2.01 0.00 0.00 31.29 32.35 2vuy h VAL 516 CO 0.02 0.84 0.28 1.62 -1.01 0.00 0.00 177.57 179.31 2vuy h VAL 517 N 0.11 1.25 -0.34 1.51 3.04 -0.70 -1.78 116.25 119.35 2vuy h VAL 517 Ca -0.28 -0.81 -0.02 0.00 -1.01 0.00 0.00 66.70 64.58 2vuy h VAL 517 Cb 2.10 0.39 -0.01 0.00 -2.01 0.00 0.00 31.29 31.75 2vuy h VAL 517 CO 0.21 0.33 0.14 0.40 -1.01 0.00 0.00 177.57 177.63 2vuy h ILE 518 N 1.07 1.18 -0.24 3.17 2.04 -1.03 0.39 117.51 124.09 2vuy h ILE 518 Ca 0.24 -0.55 0.06 0.00 1.00 0.00 0.00 64.86 65.61 2vuy h ILE 518 Cb 0.23 0.91 -0.06 0.00 -0.74 0.00 0.00 36.82 37.16 2vuy h ILE 518 CO -0.02 0.19 -0.14 0.00 0.00 0.00 0.00 178.15 178.19 2vuy h ARG 520 N -0.11 -0.45 -0.27 0.00 -0.00 -0.92 -1.03 114.38 111.60 2vuy h ARG 520 Ca 0.13 0.03 0.00 0.00 -0.50 0.00 0.00 59.98 59.65 2vuy h ARG 520 Cb 0.31 0.10 -0.01 0.00 0.00 0.00 0.00 29.97 30.37 2vuy h ARG 520 CO -0.32 -0.30 0.18 0.93 0.00 0.00 0.00 179.97 180.46 2vuy h GLU 521 N -0.47 0.36 -0.01 0.04 4.39 -0.59 -1.26 114.58 117.05 2vuy h GLU 521 Ca 0.04 -0.02 -0.19 0.00 0.34 0.00 0.00 59.36 59.53 2vuy h GLU 521 Cb 0.52 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 29.07 2vuy h GLU 521 CO -0.19 0.24 -0.83 -0.22 -1.16 0.00 0.00 179.01 176.85 2vuy h LYS 522 N 0.37 0.18 -0.11 2.33 3.64 -0.74 -2.99 116.57 119.24 2vuy h LYS 522 Ca 0.10 -0.18 -0.07 0.00 -1.27 0.00 0.00 60.65 59.23 2vuy h LYS 522 Cb -0.04 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 2vuy h LYS 522 CO -0.02 0.91 -0.20 1.96 -2.27 0.00 0.00 179.45 179.82 2vuy h GLN 523 N 0.10 0.34 -0.91 1.90 1.08 -0.52 -0.93 115.11 116.18 2vuy h GLN 523 Ca -0.03 -0.21 0.15 0.00 -1.45 0.00 0.00 58.65 57.11 2vuy h GLN 523 Cb 1.44 0.02 -0.09 0.00 -0.05 0.00 0.00 27.48 28.79 2vuy h GLN 523 CO 0.12 0.80 0.51 0.87 -0.95 0.00 0.00 178.83 180.18 2vuy h LYS 524 N -0.09 0.70 -0.08 1.46 1.57 -1.30 0.30 116.57 119.14 2vuy h LYS 524 Ca 0.01 -0.04 -0.13 0.00 -1.87 0.00 0.00 60.65 58.61 2vuy h LYS 524 Cb 0.78 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.92 2vuy h LYS 524 CO 0.05 0.46 -0.54 0.00 -0.57 0.00 0.00 179.45 178.85 2vuy h ARG 525 N 0.72 0.22 -0.63 3.15 3.08 -1.38 -2.28 114.38 117.26 2vuy h ARG 525 Ca 0.49 -0.14 -0.08 0.00 0.07 0.00 0.00 59.98 60.33 2vuy h ARG 525 Cb 0.68 0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.72 2vuy h ARG 525 CO -0.35 0.71 0.09 -0.91 -1.07 0.00 0.00 179.97 178.44 2vuy h ASN 526 N 0.17 0.99 -0.05 7.04 2.35 0.95 -1.00 115.58 126.03 2vuy h ASN 526 Ca 0.00 -0.23 -0.01 0.00 -0.55 0.00 0.00 56.30 55.51 2vuy h ASN 526 Cb 1.01 -0.26 -0.00 0.00 0.05 0.00 0.00 38.32 39.11 2vuy h ASN 526 CO 0.08 0.99 -0.02 -0.26 -1.65 0.00 0.00 177.43 176.58 2vuy h PHE 527 N 0.97 0.11 -0.71 1.19 -1.00 -0.92 -2.44 116.94 114.14 2vuy h PHE 527 Ca 0.19 -0.03 0.05 0.00 2.81 0.00 0.00 57.97 61.00 2vuy h PHE 527 Cb 0.43 -0.03 -0.05 0.00 3.61 0.00 0.00 35.95 39.91 2vuy h PHE 527 CO 0.03 0.46 0.42 0.52 -1.61 0.00 0.00 178.31 178.13 2vuy h MET 528 N -0.27 0.77 -0.43 1.51 2.86 -1.29 0.63 114.93 118.71 2vuy h MET 528 Ca 0.01 -0.05 -0.04 0.00 -2.06 0.00 0.00 59.70 57.57 2vuy h MET 528 Cb 0.43 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.90 2vuy h MET 528 CO 0.01 0.51 0.12 0.82 1.06 0.00 0.00 176.91 179.42 2vuy h ILE 529 N 0.79 1.23 -0.26 -1.22 2.04 -1.22 -1.38 117.51 117.49 2vuy h ILE 529 Ca 0.30 -0.77 -0.01 0.00 1.00 0.00 0.00 64.86 65.39 2vuy h ILE 529 Cb 0.13 0.92 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 2vuy h ILE 529 CO -0.15 0.27 0.14 0.74 0.00 0.00 0.00 178.15 179.15 2vuy h THR 530 N 0.56 1.12 0.44 -0.27 2.02 -0.92 -2.59 112.91 113.27 2vuy h THR 530 Ca 0.14 -0.32 -0.02 0.00 0.77 0.00 0.00 66.41 66.98 2vuy h THR 530 Cb 0.30 0.87 -0.00 0.00 -1.74 0.00 0.00 68.15 67.57 2vuy h THR 530 CO -0.00 0.12 -0.25 0.25 0.37 0.00 0.00 175.52 176.01 2vuy h LEU 531 N 0.30 -0.61 -1.09 2.58 5.85 -0.78 -2.68 115.31 118.88 2vuy h LEU 531 Ca 0.09 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.84 2vuy h LEU 531 Cb 0.07 0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.27 2vuy h LEU 531 CO -0.01 -0.40 0.00 0.18 -0.34 0.00 0.00 178.44 177.86 2vuy n LEU 532 N -5.38 1.16 0.00 2.25 4.77 -0.53 -2.70 117.00 116.56 2vuy n LEU 532 Ca -0.11 -0.58 0.00 0.00 -0.03 0.00 0.00 56.01 55.29 2vuy n LEU 532 Cb 0.28 -0.49 0.00 0.00 -2.33 0.00 0.00 43.42 40.88 2vuy n LEU 532 CO 0.35 0.27 0.15 0.55 -1.33 0.00 0.00 177.39 177.38 2vuy n VAL 533 N 0.05 0.08 -3.70 4.08 3.14 -0.98 -4.58 118.33 116.42 2vuy n VAL 533 Ca 0.00 -0.13 -0.32 0.00 -2.96 0.00 0.00 64.34 60.93 2vuy n VAL 533 Cb 0.27 1.42 -0.05 0.00 -1.06 0.00 0.00 33.84 34.42 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 -0.08 6.49 0.34 6.55 0.01 -1.03 -4.96 113.70 121.01 2vuy s SER 534 Ca 0.00 0.57 -0.27 0.00 1.31 0.00 0.00 55.95 57.56 2vuy s SER 534 Cb 0.00 -2.08 -0.09 0.00 0.21 0.00 0.00 66.02 64.05 2vuy s SER 534 CO 0.00 0.09 1.14 -1.10 0.41 0.00 0.00 173.24 173.78 2vuy s GLN 535 N -2.50 4.37 0.00 12.44 -1.52 0.79 -4.81 119.66 128.43 2vuy s GLN 535 Ca 0.39 1.83 0.00 0.00 -1.95 0.00 0.00 55.36 55.63 2vuy s GLN 535 Cb -0.12 -2.93 0.00 0.00 -0.22 0.00 0.00 33.01 29.73 2vuy s GLN 535 CO 0.24 -0.04 0.00 0.41 -0.25 0.00 0.00 175.29 175.64 2vuy n GLY 536 N 0.86 0.41 3.58 3.09 0.00 -1.26 -3.30 105.19 108.57 2vuy n GLY 536 Ca 0.01 -2.31 -0.38 0.00 0.00 0.00 0.00 46.02 43.34 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 -0.88 5.25 0.17 2.61 2.01 -0.19 -4.89 115.64 119.71 2vuy s THR 537 Ca 0.00 0.14 -0.28 0.00 0.31 0.00 0.00 61.69 61.86 2vuy s THR 537 Cb 0.00 -3.50 -0.08 0.00 0.01 0.00 0.00 72.50 68.93 2vuy s THR 537 CO 0.00 0.25 0.86 -2.16 -0.69 0.00 0.00 174.62 172.88 2vuy s PRO 538 N 1.75 4.69 -0.09 4.92 0.04 -1.26 0.23 135.00 145.27 2vuy s PRO 538 Ca 0.07 1.32 0.04 0.00 0.04 0.00 0.00 61.00 62.47 2vuy s PRO 538 Cb -0.16 -3.30 -0.00 0.00 0.04 0.00 0.00 34.50 31.08 2vuy s PRO 538 CO 0.11 0.46 -0.24 1.41 0.04 0.00 0.00 177.00 178.78 2vuy s MET 539 N -0.84 2.93 -0.11 4.56 1.75 0.34 -1.98 119.30 125.94 2vuy s MET 539 Ca 0.40 -0.86 -0.02 0.00 -1.25 0.00 0.00 55.69 53.96 2vuy s MET 539 Cb -0.24 -2.24 -0.03 0.00 2.84 0.00 0.00 34.83 35.16 2vuy s MET 539 CO 0.29 0.20 -0.05 0.42 -0.65 0.00 0.00 175.02 175.22 2vuy s ILE 540 N 0.30 3.84 -0.43 10.11 1.01 0.13 -4.54 121.20 131.62 2vuy s ILE 540 Ca -0.17 -0.40 -0.29 0.00 0.00 0.00 0.00 60.65 59.79 2vuy s ILE 540 Cb -0.17 -2.63 0.03 0.00 0.01 0.00 0.00 42.46 39.69 2vuy s ILE 540 CO 0.08 0.55 1.12 -0.22 0.00 0.00 0.00 174.94 176.47 2vuy s LEU 541 N -0.22 3.72 -0.01 2.97 1.98 -1.26 -1.18 118.68 124.69 2vuy s LEU 541 Ca 0.04 0.63 -0.38 0.00 -2.89 0.00 0.00 54.13 51.52 2vuy s LEU 541 Cb -0.13 -3.55 -0.17 0.00 0.66 0.00 0.00 46.19 43.00 2vuy s LEU 541 CO 0.02 -1.15 1.37 0.61 -1.89 0.00 0.00 176.35 175.31 2vuy n GLY 542 N 4.58 0.40 0.00 7.98 0.00 0.84 -1.52 105.19 117.46 2vuy n GLY 542 Ca 0.12 0.76 0.00 0.00 0.00 0.00 0.00 46.02 46.90 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 2.68 1.54 0.32 -0.02 0.00 -1.26 -4.92 105.19 103.52 2vuy n GLY 543 Ca 0.20 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.32 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 1.11 0.22 0.61 1.61 3.32 -1.61 0.23 116.42 121.90 2vuy h ASP 544 Ca 0.00 -0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.99 2vuy h ASP 544 Cb 0.00 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 2vuy h ASP 544 CO 0.00 0.15 -0.27 -0.33 -1.72 0.00 0.00 179.24 177.07 2vuy h GLU 545 N 0.25 0.00 -0.03 3.56 3.07 -1.93 -0.76 114.58 118.75 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 0.29 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.20 2vuy h GLU 545 CO -0.03 0.27 0.00 1.28 -1.40 0.00 0.00 179.01 179.13 2vuy n LEU 546 N -3.66 1.81 -2.24 1.33 4.32 0.62 -3.53 117.00 115.65 2vuy n LEU 546 Ca -0.01 -0.61 -0.16 0.00 -0.02 0.00 0.00 56.01 55.21 2vuy n LEU 546 Cb 0.39 -0.01 0.03 0.00 -1.62 0.00 0.00 43.42 42.21 2vuy n LEU 546 CO 0.35 0.31 0.01 -1.20 -1.22 0.00 0.00 177.39 175.64 2vuy n SER 547 N 0.42 -4.83 -4.51 -1.43 7.64 -0.29 -4.93 113.62 105.69 2vuy n SER 547 Ca 0.18 -0.22 -0.44 0.00 1.01 0.00 0.00 58.87 59.40 2vuy n SER 547 Cb 0.40 -3.67 -0.01 0.00 -1.01 0.00 0.00 64.21 59.93 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 -3.12 0.83 -4.38 1.43 1.74 -0.15 -4.79 116.66 108.23 2vuy n ARG 548 Ca -0.07 0.29 -0.19 0.00 -0.77 0.00 0.00 57.85 57.11 2vuy n ARG 548 Cb 0.58 -1.57 -0.15 0.00 -1.02 0.00 0.00 32.46 30.30 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 -1.18 0.74 -0.24 0.55 2.01 -1.26 -4.07 115.64 112.19 2vuy s THR 549 Ca 0.61 -0.38 0.11 0.00 0.31 0.00 0.00 61.69 62.34 2vuy s THR 549 Cb -0.71 -0.63 0.45 0.00 0.01 0.00 0.00 72.50 71.62 2vuy s THR 549 CO 0.58 0.22 1.31 0.00 -0.69 0.00 0.00 174.62 176.04 2vuy n GLN 550 N 2.99 1.69 -3.05 4.92 6.02 -1.26 -4.72 117.38 123.97 2vuy n GLN 550 Ca -0.15 -3.23 -0.18 0.00 -0.01 0.00 0.00 57.00 53.43 2vuy n GLN 550 Cb 0.56 -1.69 -0.01 0.00 1.02 0.00 0.00 30.24 30.12 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 -1.13 -2.90 -0.52 -1.09 1.74 -1.26 -0.03 116.66 111.47 2vuy n ARG 551 Ca 0.24 0.42 0.00 0.00 -0.77 0.00 0.00 57.85 57.75 2vuy n ARG 551 Cb 0.82 -5.07 0.00 0.00 -1.02 0.00 0.00 32.46 27.19 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 -0.97 0.76 3.62 -0.13 0.00 -1.26 -4.81 105.19 102.40 2vuy n GLY 552 Ca -0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.55 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 -2.95 6.81 -0.36 1.61 3.84 0.95 -0.92 114.94 123.91 2vuy s ASN 553 Ca 0.00 0.82 0.08 0.00 0.21 0.00 0.00 52.86 53.97 2vuy s ASN 553 Cb 0.00 -2.52 0.72 0.00 -0.55 0.00 0.00 41.25 38.91 2vuy s ASN 553 CO 0.00 -0.91 1.84 -0.46 -2.79 0.00 0.00 177.10 174.78 2vuy n ASN 554 N 6.95 4.46 -2.68 -4.21 2.04 -1.26 -4.34 115.26 116.22 2vuy n ASN 554 Ca 0.10 -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 -0.49 -1.59 -2.23 0.53 4.05 -1.26 -2.24 115.26 112.03 2vuy n ASN 555 Ca 0.47 -2.32 -0.05 0.00 0.45 0.00 0.00 54.58 53.13 2vuy n ASN 555 Cb 1.48 0.80 -0.07 0.00 1.23 0.00 0.00 39.78 43.21 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 -1.16 3.43 0.21 5.20 0.00 -1.26 -4.35 120.51 122.57 2vuy n ALA 556 Ca -0.12 -0.79 0.10 0.00 0.00 0.00 0.00 53.44 52.64 2vuy n ALA 556 Cb 0.87 -2.23 0.20 0.00 0.00 0.00 0.00 19.45 18.28 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 4.47 0.00 -0.19 0.00 -5.15 -1.95 -3.23 116.94 110.89 2vuy h PHE 557 Ca 0.08 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.85 2vuy h PHE 557 Cb 0.69 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.86 2vuy h PHE 557 CO 1.30 0.11 0.00 0.00 -2.00 0.00 0.00 178.31 177.72 2vuy s GLN 559 N -2.32 3.09 -1.17 0.00 2.00 -1.22 -3.79 119.66 116.25 2vuy s GLN 559 Ca 0.32 -2.44 -0.05 0.00 -2.00 0.00 0.00 55.36 51.19 2vuy s GLN 559 Cb 0.25 -4.11 0.24 0.00 0.80 0.00 0.00 33.01 30.20 2vuy s GLN 559 CO 0.08 -1.24 1.81 -3.47 -0.50 0.00 0.00 175.29 171.97 2vuy n ASP 560 N 3.85 6.45 0.00 6.67 4.64 -1.26 -4.40 116.55 132.50 2vuy n ASP 560 Ca 0.09 -3.33 0.00 0.00 -1.38 0.00 0.00 54.79 50.17 2vuy n ASP 560 Cb 0.43 -1.33 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 1.89 0.00 0.18 1.67 2.04 -1.26 -5.02 115.26 114.76 2vuy n ASN 561 Ca 0.39 0.00 0.12 0.00 -0.44 0.00 0.00 54.58 54.66 2vuy n ASN 561 Cb 0.31 0.00 0.64 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 -0.15 -3.83 3.07 -1.90 0.29 114.58 112.05 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 -0.35 0.82 -1.40 0.00 0.00 179.01 178.08 2vuy h ILE 563 N 0.00 1.29 0.00 3.13 2.04 -1.88 -3.35 117.51 118.73 2vuy h ILE 563 Ca 0.00 -1.40 -0.13 0.00 1.00 0.00 0.00 64.86 64.33 2vuy h ILE 563 Cb 0.06 1.55 -0.02 0.00 -0.74 0.00 0.00 36.82 37.67 2vuy h ILE 563 CO 0.00 0.43 -1.50 0.35 0.00 0.00 0.00 178.15 177.43 2vuy n THR 564 N -4.07 0.50 -1.43 -0.27 -2.24 -0.50 -4.13 114.28 102.13 2vuy n THR 564 Ca -0.01 -0.30 -0.40 0.00 -2.27 0.00 0.00 64.05 61.06 2vuy n THR 564 Cb 0.44 -0.81 0.01 0.00 -2.10 0.00 0.00 70.33 67.88 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 -2.29 -0.85 -2.62 4.78 5.03 0.91 -4.84 117.44 117.55 2vuy n TRP 565 Ca -0.12 0.55 -0.41 0.00 3.03 0.00 0.00 57.50 60.55 2vuy n TRP 565 Cb 0.73 -1.94 -0.04 0.00 -1.03 0.00 0.00 31.31 29.03 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 -1.60 3.70 -0.41 -5.99 0.40 -0.12 -4.90 117.98 109.06 2vuy s PHE 566 Ca 0.64 1.69 -0.13 0.00 -0.60 0.00 0.00 56.93 58.52 2vuy s PHE 566 Cb -0.55 -3.17 0.04 0.00 0.51 0.00 0.00 43.02 39.85 2vuy s PHE 566 CO 0.58 -0.22 0.28 0.34 0.70 0.00 0.00 175.22 176.90 2vuy s ASP 567 N 0.06 5.93 -0.03 1.36 3.68 -1.26 -4.35 116.67 122.06 2vuy s ASP 567 Ca 0.49 -1.07 0.11 0.00 2.13 0.00 0.00 52.55 54.21 2vuy s ASP 567 Cb -0.26 -2.09 0.36 0.00 -1.45 0.00 0.00 42.92 39.47 2vuy s ASP 567 CO 0.32 -0.47 1.25 0.79 0.13 0.00 0.00 175.17 177.19 2vuy n TRP 568 N 5.08 0.65 -3.03 -5.34 7.02 -1.26 -4.74 117.44 115.82 2vuy n TRP 568 Ca -0.11 -0.28 -0.44 0.00 -1.02 0.00 0.00 57.50 55.64 2vuy n TRP 568 Cb 0.46 -0.08 -0.04 0.00 -2.42 0.00 0.00 31.31 29.23 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 -0.85 6.21 -0.20 -0.99 2.47 -1.26 -5.02 114.94 115.29 2vuy s ASN 569 Ca 0.26 -1.36 -0.08 0.00 0.42 0.00 0.00 52.86 52.10 2vuy s ASN 569 Cb 0.15 -2.34 -0.04 0.00 -1.45 0.00 0.00 41.25 37.57 2vuy s ASN 569 CO 0.15 -1.20 0.09 -0.76 -3.72 0.00 0.00 177.10 171.67 2vuy s LEU 570 N 3.04 3.90 0.00 3.21 1.43 -1.26 -5.06 118.68 123.94 2vuy s LEU 570 Ca 0.15 0.08 -0.03 0.00 -1.03 0.00 0.00 54.13 53.31 2vuy s LEU 570 Cb -0.21 -2.01 0.06 0.00 0.03 0.00 0.00 46.19 44.07 2vuy s LEU 570 CO 0.06 0.13 0.40 -0.90 0.23 0.00 0.00 176.35 176.28 2vuy n ASP 571 N 3.81 0.23 -0.16 2.29 5.68 -1.26 -4.74 116.55 122.40 2vuy n ASP 571 Ca -0.16 -1.26 -0.06 0.00 -0.50 0.00 0.00 54.79 52.80 2vuy n ASP 571 Cb 0.52 -0.29 0.10 0.00 -1.14 0.00 0.00 41.12 40.32 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 0.92 0.68 0.11 4.81 -1.99 0.33 114.58 119.44 2vuy h GLU 572 Ca -0.13 -0.26 -0.03 0.00 -0.13 0.00 0.00 59.36 58.80 2vuy h GLU 572 Cb 0.41 -0.10 0.01 0.00 0.63 0.00 0.00 28.75 29.70 2vuy h GLU 572 CO 0.11 0.91 -0.33 -0.09 -0.73 0.00 0.00 179.01 178.88 2vuy h ARG 573 N 0.85 -0.88 -0.57 1.92 2.43 -1.98 0.95 114.38 117.10 2vuy h ARG 573 Ca 0.16 0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.39 2vuy h ARG 573 Cb 0.49 0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 30.21 2vuy h ARG 573 CO 0.02 -0.56 0.37 0.87 -1.51 0.00 0.00 179.97 179.17 2vuy h LYS 574 N -1.01 0.75 -0.89 0.20 1.57 -1.93 -2.03 116.57 113.25 2vuy h LYS 574 Ca -0.09 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.62 2vuy h LYS 574 Cb 0.72 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 32.82 2vuy h LYS 574 CO 0.15 0.50 0.47 1.03 -0.57 0.00 0.00 179.45 181.03 2vuy h SER 575 N 0.77 1.12 0.44 0.86 0.87 -0.89 -1.67 113.55 115.05 2vuy h SER 575 Ca 0.21 -0.11 -0.09 0.00 -1.23 0.00 0.00 61.79 60.57 2vuy h SER 575 Cb -0.08 -0.29 -0.01 0.00 -0.44 0.00 0.00 62.40 61.58 2vuy h SER 575 CO -0.04 0.91 -0.43 0.50 -0.53 0.00 0.00 176.83 177.23 2vuy h LYS 576 N 1.24 0.00 0.01 2.24 3.64 -0.39 -2.50 116.57 120.81 2vuy h LYS 576 Ca 0.31 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 59.50 2vuy h LYS 576 Cb 0.05 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.85 2vuy h LYS 576 CO -0.05 0.43 -0.87 0.35 -2.27 0.00 0.00 179.45 177.04 2vuy h PHE 577 N 0.00 0.08 -0.56 1.91 3.57 -0.93 -2.75 116.94 118.26 2vuy h PHE 577 Ca -0.00 -0.05 -0.04 0.00 3.53 0.00 0.00 57.97 61.41 2vuy h PHE 577 Cb 0.76 -0.01 -0.03 0.00 2.79 0.00 0.00 35.95 39.47 2vuy h PHE 577 CO 0.00 0.89 0.20 1.25 -2.23 0.00 0.00 178.31 178.42 2vuy h LEU 578 N 0.02 0.75 -0.69 0.59 5.85 -0.91 -1.37 115.31 119.55 2vuy h LEU 578 Ca -0.02 -0.10 -0.13 0.00 0.84 0.00 0.00 57.88 58.47 2vuy h LEU 578 Cb 1.53 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 42.35 2vuy h LEU 578 CO 0.12 0.69 -0.62 -0.33 -0.34 0.00 0.00 178.44 177.96 2vuy h GLU 579 N 0.80 0.00 -0.36 1.25 4.39 -1.35 -2.53 114.58 116.78 2vuy h GLU 579 Ca 0.19 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.73 2vuy h GLU 579 Cb 0.20 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.84 2vuy h GLU 579 CO -0.01 0.62 -0.40 0.35 -1.16 0.00 0.00 179.01 178.41 2vuy h PHE 580 N 0.00 1.08 -0.61 4.33 3.04 -1.08 -2.40 116.94 121.30 2vuy h PHE 580 Ca -0.01 -0.33 -0.09 0.00 3.98 0.00 0.00 57.97 61.52 2vuy h PHE 580 Cb 1.15 -0.23 -0.02 0.00 2.56 0.00 0.00 35.95 39.41 2vuy h PHE 580 CO 0.00 1.14 0.02 0.28 -2.02 0.00 0.00 178.31 177.73 2vuy h VAL 581 N 0.73 1.27 -0.11 1.41 2.07 -1.17 -1.51 116.25 118.93 2vuy h VAL 581 Ca 0.06 -1.14 0.00 0.00 0.82 0.00 0.00 66.70 66.44 2vuy h VAL 581 Cb 0.99 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 2vuy h VAL 581 CO 0.10 0.41 0.07 0.11 0.02 0.00 0.00 177.57 178.28 2vuy h LYS 582 N 0.98 0.14 0.00 1.57 1.57 -1.32 0.06 116.57 119.56 2vuy h LYS 582 Ca 0.18 -0.01 -0.08 0.00 -1.87 0.00 0.00 60.65 58.87 2vuy h LYS 582 Cb 0.54 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.81 2vuy h LYS 582 CO 0.03 0.11 -0.36 0.87 -0.57 0.00 0.00 179.45 179.53 2vuy h LYS 583 N 0.13 0.00 -0.06 3.15 1.57 -1.35 -0.50 116.57 119.51 2vuy h LYS 583 Ca 0.04 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.69 2vuy h LYS 583 Cb -0.00 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.32 2vuy h LYS 583 CO -0.01 0.36 -0.47 0.52 -0.57 0.00 0.00 179.45 179.28 2vuy h MET 584 N 0.00 0.43 -0.60 3.15 2.86 -0.96 -0.99 114.93 118.81 2vuy h MET 584 Ca -0.00 -0.38 -0.03 0.00 -2.06 0.00 0.00 59.70 57.23 2vuy h MET 584 Cb 0.71 0.09 -0.03 0.00 0.06 0.00 0.00 31.60 32.43 2vuy h MET 584 CO 0.05 1.02 0.25 0.82 1.06 0.00 0.00 176.91 180.11 2vuy h ILE 585 N -0.04 1.21 -0.72 -1.22 2.04 -0.82 -1.07 117.51 116.89 2vuy h ILE 585 Ca -0.04 -0.64 -0.06 0.00 1.00 0.00 0.00 64.86 65.13 2vuy h ILE 585 Cb 1.14 0.48 -0.03 0.00 -0.74 0.00 0.00 36.82 37.67 2vuy h ILE 585 CO 0.10 0.26 0.24 1.56 0.00 0.00 0.00 178.15 180.30 2vuy h GLN 586 N 0.86 1.12 -0.29 2.37 4.20 -0.98 -1.93 115.11 120.45 2vuy h GLN 586 Ca 0.21 -0.23 -0.01 0.00 0.06 0.00 0.00 58.65 58.67 2vuy h GLN 586 Cb 0.15 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 27.75 2vuy h GLN 586 CO -0.02 0.95 0.15 0.35 -0.67 0.00 0.00 178.83 179.59 2vuy h PHE 587 N 1.06 0.41 -0.08 2.96 3.57 -0.39 -2.23 116.94 122.24 2vuy h PHE 587 Ca 0.23 -0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.75 2vuy h PHE 587 Cb 0.29 -0.13 -0.04 0.00 2.79 0.00 0.00 35.95 38.87 2vuy h PHE 587 CO 0.02 0.35 -0.12 -0.92 -2.23 0.00 0.00 178.31 175.42 2vuy h TYR 588 N 0.35 -0.30 0.00 0.41 3.20 -0.96 -2.36 116.97 117.31 2vuy h TYR 588 Ca 0.10 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.98 2vuy h TYR 588 Cb 0.09 0.15 -0.00 0.00 1.54 0.00 0.00 36.73 38.50 2vuy h TYR 588 CO -0.03 -0.18 -0.03 0.00 -1.64 0.00 0.00 178.16 176.29 2vuy h ARG 589 N -0.16 0.00 0.00 1.82 3.08 -1.24 -2.75 114.38 115.13 2vuy h ARG 589 Ca 0.07 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.12 2vuy h ARG 589 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.31 2vuy h ARG 589 CO -0.18 0.03 -0.52 0.00 -1.07 0.00 0.00 179.97 178.22 2vuy n ALA 590 N -2.13 3.42 -3.96 0.04 0.00 -0.85 -4.81 120.51 112.22 2vuy n ALA 590 Ca -0.02 -0.33 -0.30 0.00 0.00 0.00 0.00 53.44 52.79 2vuy n ALA 590 Cb 0.18 -1.13 -0.16 0.00 0.00 0.00 0.00 19.45 18.34 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 -3.03 2.48 0.65 0.00 3.76 -1.04 -4.97 115.29 113.15 2vuy s HIS 591 Ca 0.10 -1.80 0.36 0.00 -0.15 0.00 0.00 55.06 53.57 2vuy s HIS 591 Cb 0.17 -1.62 1.98 0.00 1.11 0.00 0.00 32.58 34.22 2vuy s HIS 591 CO 0.70 -0.78 2.15 -1.35 -0.85 0.00 0.00 174.74 174.61 2vuy h PRO 592 N 7.94 0.00 0.00 8.40 0.11 -1.87 -2.10 132.00 144.47 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 0.42 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.21 2vuy h ALA 593 N 1.69 1.00 -0.07 -0.75 0.00 -1.92 -1.75 119.26 117.45 2vuy h ALA 593 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2vuy h ALA 593 Cb 0.35 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.14 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 -2.47 0.09 -2.77 0.00 3.01 -0.79 -4.62 117.46 109.90 2vuy n PHE 594 Ca -0.01 -0.18 -0.21 0.00 1.01 0.00 0.00 57.45 58.07 2vuy n PHE 594 Cb 0.11 -0.01 -0.01 0.00 -0.01 0.00 0.00 39.48 39.56 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 0.24 2.39 -2.86 -1.08 1.74 -0.66 -4.46 116.66 111.96 2vuy n ARG 595 Ca 0.04 -4.09 -0.31 0.00 -0.77 0.00 0.00 57.85 52.72 2vuy n ARG 595 Cb 0.22 -1.91 -0.04 0.00 -1.02 0.00 0.00 32.46 29.72 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 -3.22 3.82 -0.00 5.56 0.52 -1.22 -4.75 118.95 119.65 2vuy s ARG 596 Ca 0.42 0.53 0.22 0.00 -0.52 0.00 0.00 55.73 56.37 2vuy s ARG 596 Cb 0.37 -2.38 -0.22 0.00 0.52 0.00 0.00 34.95 33.25 2vuy s ARG 596 CO -0.10 -0.03 0.80 -1.91 0.02 0.00 0.00 175.30 174.08 2vuy n GLU 597 N -1.21 0.22 -4.12 3.54 2.13 -1.26 -4.64 120.64 115.31 2vuy n GLU 597 Ca 0.03 -0.06 -0.15 0.00 0.66 0.00 0.00 57.16 57.64 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 -3.17 0.68 0.52 5.31 0.52 -1.26 -4.30 118.95 117.25 2vuy s ARG 598 Ca 0.03 -0.89 -0.19 0.00 -0.52 0.00 0.00 55.73 54.16 2vuy s ARG 598 Cb 0.15 -0.52 -0.07 0.00 0.52 0.00 0.00 34.95 35.03 2vuy s ARG 598 CO 0.87 0.10 1.06 0.71 0.02 0.00 0.00 175.30 178.06 2vuy s TYR 599 N -1.49 2.94 0.31 -0.53 1.51 -1.26 -4.91 117.35 113.92 2vuy s TYR 599 Ca -0.05 1.56 -0.29 0.00 -1.01 0.00 0.00 57.07 57.28 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 -1.02 1.17 -0.06 -1.11 0.00 0.00 175.55 174.54 2vuy s PHE 600 N -2.06 3.37 -0.25 2.71 0.40 -1.26 -4.94 117.98 115.95 2vuy s PHE 600 Ca 0.67 1.60 0.22 0.00 -0.60 0.00 0.00 56.93 58.83 2vuy s PHE 600 Cb -0.17 -3.41 0.04 0.00 0.51 0.00 0.00 43.02 39.98 2vuy s PHE 600 CO 0.25 -1.00 1.11 1.96 0.70 0.00 0.00 175.22 178.23 2vuy h GLN 601 N 3.55 0.00 -1.17 0.44 4.20 -1.96 -3.48 115.11 116.69 2vuy h GLN 601 Ca -0.48 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.22 2vuy h GLN 601 Cb 1.22 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.00 2vuy h GLN 601 CO 0.66 0.01 -0.02 0.41 -0.67 0.00 0.00 178.83 179.22 2vuy n GLY 602 N 1.18 0.90 3.85 3.46 0.00 -1.26 -5.06 105.19 108.27 2vuy n GLY 602 Ca 0.00 -0.65 -0.07 0.00 0.00 0.00 0.00 46.02 45.30 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 -5.02 1.80 0.25 1.61 -2.85 -1.26 -4.93 119.74 109.34 2vuy s LYS 603 Ca 0.02 -1.01 -0.30 0.00 -1.00 0.00 0.00 55.97 53.68 2vuy s LYS 603 Cb -0.01 0.60 -0.09 0.00 -2.06 0.00 0.00 37.83 36.28 2vuy s LYS 603 CO 0.02 -0.83 1.11 0.15 0.10 0.00 0.00 175.35 175.91 2vuy s LYS 604 N -3.79 4.61 0.18 1.78 1.02 -1.26 -2.13 119.74 120.15 2vuy s LYS 604 Ca 0.11 1.79 0.07 0.00 0.02 0.00 0.00 55.97 57.97 2vuy s LYS 604 Cb -0.06 -3.21 -0.04 0.00 -0.52 0.00 0.00 37.83 33.99 2vuy s LYS 604 CO 0.07 0.15 -0.14 -0.51 -0.92 0.00 0.00 175.35 174.00 2vuy s LEU 605 N -1.06 2.52 -1.58 3.17 1.43 -1.26 -4.85 118.68 117.05 2vuy s LEU 605 Ca 0.47 -0.97 -0.14 0.00 -1.03 0.00 0.00 54.13 52.46 2vuy s LEU 605 Cb -0.31 -0.60 0.10 0.00 0.03 0.00 0.00 46.19 45.41 2vuy s LEU 605 CO 0.39 -0.19 0.82 0.49 0.23 0.00 0.00 176.35 178.09 2vuy n PHE 606 N -0.14 -1.96 -1.02 0.29 3.01 -1.26 -1.01 117.46 115.38 2vuy n PHE 606 Ca -0.10 0.84 -0.01 0.00 1.01 0.00 0.00 57.45 59.19 2vuy n PHE 606 Cb 0.60 -3.52 -0.00 0.00 -0.01 0.00 0.00 39.48 36.55 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 -1.59 0.13 3.84 1.37 0.00 -1.26 -4.97 105.19 102.71 2vuy n GLY 607 Ca -0.00 -0.01 -0.32 0.00 0.00 0.00 0.00 46.02 45.69 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 -1.76 4.02 -0.14 1.61 -1.94 -0.18 -4.97 119.30 115.95 2vuy s MET 608 Ca 0.00 0.95 0.04 0.00 -1.71 0.00 0.00 55.69 54.98 2vuy s MET 608 Cb 0.00 -2.18 0.33 0.00 2.01 0.00 0.00 34.83 34.99 2vuy s MET 608 CO 0.00 -0.17 1.19 -0.35 -0.01 0.00 0.00 175.02 175.68 2vuy n PRO 609 N -1.24 2.26 -4.06 2.03 -0.04 -1.26 -4.39 135.00 128.30 2vuy n PRO 609 Ca 0.06 -1.36 -0.13 0.00 -0.04 0.00 0.00 63.50 62.03 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 -1.30 2.12 0.22 1.53 1.43 -1.26 -5.07 118.68 116.34 2vuy s LEU 610 Ca 0.24 -0.28 -0.30 0.00 -1.03 0.00 0.00 54.13 52.76 2vuy s LEU 610 Cb 0.19 -0.14 -0.08 0.00 0.03 0.00 0.00 46.19 46.19 2vuy s LEU 610 CO 0.06 -0.08 0.95 -0.54 0.23 0.00 0.00 176.35 176.97 2vuy s LYS 611 N -0.75 4.82 0.57 1.70 1.02 -1.26 -4.05 119.74 121.79 2vuy s LYS 611 Ca -0.05 1.49 0.26 0.00 0.02 0.00 0.00 55.97 57.70 2vuy s LYS 611 Cb -0.05 -3.29 1.56 0.00 -0.52 0.00 0.00 37.83 35.52 2vuy s LYS 611 CO -0.00 0.45 2.12 0.38 -0.92 0.00 0.00 175.35 177.38 2vuy h ASP 612 N 4.40 0.00 -3.61 2.83 2.03 -1.65 -3.38 116.42 117.04 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 39.46 2vuy h ASP 612 CO 0.69 0.00 -0.23 0.54 -1.03 0.00 0.00 179.24 179.20 2vuy s VAL 613 N -4.79 -0.01 -0.02 4.15 0.11 -1.26 -1.00 120.40 117.59 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 0.16 -0.62 0.01 0.00 -1.53 0.00 0.00 36.38 34.40 2vuy s VAL 613 CO 0.60 0.01 -0.03 -0.89 -3.33 0.00 0.00 175.10 171.47 2vuy s THR 614 N 0.71 0.28 -0.21 5.04 2.01 -0.78 -4.57 115.64 118.12 2vuy s THR 614 Ca -0.04 -0.07 -0.06 0.00 0.31 0.00 0.00 61.69 61.83 2vuy s THR 614 Cb -0.05 -0.29 -0.03 0.00 0.01 0.00 0.00 72.50 72.14 2vuy s THR 614 CO -0.05 0.12 0.02 -0.36 -0.69 0.00 0.00 174.62 173.66 2vuy s PHE 615 N 0.40 3.07 0.42 4.92 0.40 -1.26 -0.33 117.98 125.60 2vuy s PHE 615 Ca -0.04 -0.39 0.08 0.00 -0.60 0.00 0.00 56.93 55.97 2vuy s PHE 615 Cb -0.07 -2.12 -0.02 0.00 0.51 0.00 0.00 43.02 41.32 2vuy s PHE 615 CO -0.01 -0.23 0.37 0.71 0.70 0.00 0.00 175.22 176.77 2vuy s TYR 616 N 1.08 2.71 0.36 0.36 1.51 0.28 0.30 117.35 123.95 2vuy s TYR 616 Ca 0.03 -0.49 0.09 0.00 -1.01 0.00 0.00 57.07 55.68 2vuy s TYR 616 Cb -0.14 -2.16 -0.07 0.00 -0.11 0.00 0.00 41.96 39.48 2vuy s TYR 616 CO 0.02 -0.11 -0.06 0.95 -1.11 0.00 0.00 175.55 175.25 2vuy s THR 617 N -2.48 2.24 0.11 -0.71 -4.23 -1.05 -4.01 115.64 105.51 2vuy s THR 617 Ca 0.48 -2.13 -0.15 0.00 -1.18 0.00 0.00 61.69 58.71 2vuy s THR 617 Cb -0.03 -2.74 0.04 0.00 1.34 0.00 0.00 72.50 71.11 2vuy s THR 617 CO 0.28 -0.16 0.92 -0.11 -0.54 0.00 0.00 174.62 175.01 2vuy n LEU 618 N -0.86 -0.53 0.25 4.79 7.94 -1.26 0.07 117.00 127.41 2vuy n LEU 618 Ca -0.05 1.06 0.15 0.00 -1.11 0.00 0.00 56.01 56.05 2vuy n LEU 618 Cb 0.64 -0.18 0.53 0.00 0.53 0.00 0.00 43.42 44.94 2vuy n LEU 618 CO 0.45 -0.90 0.91 -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 -1.90 -1.45 114.58 116.26 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 0.29 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.20 2vuy h GLU 619 CO -0.58 0.06 0.00 0.41 -1.40 0.00 0.00 179.01 177.50 2vuy n GLY 620 N 0.28 1.50 3.66 -3.84 0.00 0.11 -4.29 105.19 102.61 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 2.66 0.18 1.61 1.70 -1.26 -4.80 118.95 118.99 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 -2.59 -0.16 0.00 -0.57 0.00 0.00 34.95 31.63 2vuy s ARG 621 CO 0.00 0.60 0.99 -1.91 -1.08 0.00 0.00 175.30 173.90 2vuy n GLU 622 N 1.27 0.82 -1.75 3.89 2.13 -1.26 -2.53 120.64 123.23 2vuy n GLU 622 Ca -0.14 0.29 -0.41 0.00 0.66 0.00 0.00 57.16 57.56 2vuy n GLU 622 Cb 0.52 -1.66 -0.00 0.00 0.27 0.00 0.00 31.44 30.57 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 0.96 2.08 -4.01 6.31 3.14 0.15 -4.85 118.33 122.11 2vuy n VAL 623 Ca 0.15 -0.50 -0.16 0.00 -2.96 0.00 0.00 64.34 60.87 2vuy n VAL 623 Cb 0.24 -1.82 -0.02 0.00 -1.06 0.00 0.00 33.84 31.19 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 0.50 2.30 -0.14 6.55 3.85 -1.26 -4.95 116.55 123.40 2vuy n ASP 624 Ca 0.03 -2.11 -0.13 0.00 -0.71 0.00 0.00 54.79 51.87 2vuy n ASP 624 Cb 0.38 0.07 -0.09 0.00 -1.35 0.00 0.00 41.12 40.13 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 -0.33 -0.07 0.11 4.57 -1.99 -1.36 114.58 115.50 2vuy h GLU 625 Ca -0.21 0.02 -0.08 0.00 -1.18 0.00 0.00 59.36 57.92 2vuy h GLU 625 Cb 0.69 0.08 0.00 0.00 -0.16 0.00 0.00 28.75 29.36 2vuy h GLU 625 CO 0.33 -0.22 -0.25 1.57 -1.18 0.00 0.00 179.01 179.26 2vuy h LYS 626 N -0.35 0.30 0.00 1.92 2.10 -1.99 -3.18 116.57 115.37 2vuy h LYS 626 Ca 0.07 -0.22 -0.00 0.00 -2.00 0.00 0.00 60.65 58.50 2vuy h LYS 626 Cb 0.53 0.04 -0.00 0.00 -0.90 0.00 0.00 32.23 31.90 2vuy h LYS 626 CO -0.56 0.85 -0.00 0.00 -2.00 0.00 0.00 179.45 177.74 2vuy h THR 627 N -0.20 0.03 0.00 0.07 1.03 -1.92 -0.83 112.91 111.09 2vuy h THR 627 Ca -0.01 -0.03 -0.17 0.00 -0.01 0.00 0.00 66.41 66.19 2vuy h THR 627 Cb 0.88 1.03 -0.02 0.00 -1.07 0.00 0.00 68.15 68.97 2vuy h THR 627 CO 0.05 0.00 -0.80 -0.25 -0.01 0.00 0.00 175.52 174.51 2vuy h TRP 628 N 0.00 0.00 -0.18 0.00 2.91 -1.23 -3.28 115.95 114.17 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 0.03 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 28.68 2vuy h TRP 628 CO 0.00 0.80 0.00 -1.13 -1.03 0.00 0.00 178.44 177.08 2vuy n SER 629 N -3.41 2.67 -4.85 2.65 3.41 -0.42 -0.57 113.62 113.11 2vuy n SER 629 Ca 0.00 -1.78 -0.37 0.00 -0.26 0.00 0.00 58.87 56.47 2vuy n SER 629 Cb 0.82 -0.11 -0.06 0.00 -0.26 0.00 0.00 64.21 64.60 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 -1.22 6.74 0.61 4.04 0.01 -0.57 -4.69 113.70 118.62 2vuy s SER 630 Ca 0.24 0.90 -0.18 0.00 1.31 0.00 0.00 55.95 58.22 2vuy s SER 630 Cb 0.15 -2.22 -0.08 0.00 0.21 0.00 0.00 66.02 64.07 2vuy s SER 630 CO 0.21 0.26 0.49 -2.65 0.41 0.00 0.00 173.24 171.96 2vuy n PRO 631 N 1.43 0.45 -3.53 12.44 -0.02 -1.26 -2.69 135.00 141.81 2vuy n PRO 631 Ca -0.11 0.18 -0.12 0.00 -2.02 0.00 0.00 63.50 61.43 2vuy n PRO 631 Cb 0.52 -1.70 -0.04 0.00 -0.02 0.00 0.00 33.50 32.27 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 -1.77 0.03 -0.00 3.45 -1.32 -0.48 -4.77 115.64 110.79 2vuy s THR 632 Ca 0.67 -0.28 0.00 0.00 -1.21 0.00 0.00 61.69 60.87 2vuy s THR 632 Cb -0.42 -1.07 0.00 0.00 -1.51 0.00 0.00 72.50 69.50 2vuy s THR 632 CO 0.56 -0.16 0.88 0.00 -2.21 0.00 0.00 174.62 173.69 2vuy n GLN 633 N -0.20 2.21 -3.90 7.08 6.02 -1.26 -3.05 117.38 124.27 2vuy n GLN 633 Ca -0.17 -1.26 -0.18 0.00 -0.01 0.00 0.00 57.00 55.38 2vuy n GLN 633 Cb 0.64 -0.88 -0.16 0.00 1.02 0.00 0.00 30.24 30.85 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 -0.77 1.04 -0.04 1.08 2.96 -1.26 0.18 118.68 121.87 2vuy s LEU 634 Ca 0.00 -0.03 0.04 0.00 -0.22 0.00 0.00 54.13 53.93 2vuy s LEU 634 Cb 0.00 -0.24 -0.00 0.00 0.50 0.00 0.00 46.19 46.45 2vuy s LEU 634 CO 0.00 -0.12 -0.17 -0.69 -1.32 0.00 0.00 176.35 174.05 2vuy s VAL 635 N 1.19 1.40 -0.12 1.68 1.01 -0.49 -4.99 120.40 120.08 2vuy s VAL 635 Ca -0.07 -0.71 -0.04 0.00 0.00 0.00 0.00 61.98 61.16 2vuy s VAL 635 Cb -0.13 -1.20 0.06 0.00 0.00 0.00 0.00 36.38 35.11 2vuy s VAL 635 CO -0.02 0.40 0.19 -0.63 0.00 0.00 0.00 175.10 175.04 2vuy s ILE 636 N -0.03 -0.30 0.04 2.22 1.01 -1.26 -0.81 121.20 122.09 2vuy s ILE 636 Ca -0.02 0.24 -0.01 0.00 0.00 0.00 0.00 60.65 60.86 2vuy s ILE 636 Cb -0.11 -0.40 -0.03 0.00 0.01 0.00 0.00 42.46 41.93 2vuy s ILE 636 CO 0.02 0.07 -0.02 0.72 0.00 0.00 0.00 174.94 175.72 2vuy s PHE 637 N 2.32 0.45 -0.15 3.97 -0.12 -0.80 1.00 117.98 124.64 2vuy s PHE 637 Ca 0.03 -0.93 0.00 0.00 -0.05 0.00 0.00 56.93 55.99 2vuy s PHE 637 Cb -0.13 -0.33 0.02 0.00 -0.63 0.00 0.00 43.02 41.95 2vuy s PHE 637 CO -0.07 -0.35 -0.15 0.08 -0.05 0.00 0.00 175.22 174.68 2vuy s VAL 638 N -3.39 1.63 -0.28 -2.49 1.01 0.55 -0.80 120.40 116.63 2vuy s VAL 638 Ca 0.02 -0.67 -0.15 0.00 0.00 0.00 0.00 61.98 61.18 2vuy s VAL 638 Cb 0.04 -1.52 -0.03 0.00 0.00 0.00 0.00 36.38 34.86 2vuy s VAL 638 CO -0.08 0.47 0.37 -0.76 0.00 0.00 0.00 175.10 175.10 2vuy s LEU 639 N 1.45 4.08 -1.05 3.92 1.43 0.08 -1.86 118.68 126.73 2vuy s LEU 639 Ca 0.05 0.23 -0.16 0.00 -1.03 0.00 0.00 54.13 53.22 2vuy s LEU 639 Cb -0.13 -2.41 0.16 0.00 0.03 0.00 0.00 46.19 43.84 2vuy s LEU 639 CO -0.11 -0.20 1.24 -0.70 0.23 0.00 0.00 176.35 176.81 2vuy s GLU 640 N 2.07 3.84 0.53 1.70 2.56 -0.18 -1.62 118.70 127.61 2vuy s GLU 640 Ca 0.15 -2.21 0.22 0.00 0.00 0.00 0.00 54.97 53.12 2vuy s GLU 640 Cb -0.16 -4.94 1.19 0.00 2.00 0.00 0.00 34.13 32.22 2vuy s GLU 640 CO 0.10 -1.72 1.63 0.78 -0.56 0.00 0.00 175.26 175.49 2vuy h GLY 641 N 9.82 0.00 -1.11 -1.50 0.00 -1.63 -0.78 103.07 107.88 2vuy h GLY 641 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.55 2vuy h GLY 641 CO 1.14 0.00 0.00 1.44 0.00 0.00 0.00 176.54 179.12 2vuy n SER 642 N -2.55 2.15 -2.35 0.19 7.64 -1.21 -1.17 113.62 116.32 2vuy n SER 642 Ca -0.01 -1.72 -0.14 0.00 1.01 0.00 0.00 58.87 58.01 2vuy n SER 642 Cb 0.39 -0.01 0.03 0.00 -1.01 0.00 0.00 64.21 63.61 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 0.68 2.00 -3.73 0.44 0.24 -0.30 -5.00 118.33 112.67 2vuy n VAL 643 Ca 0.17 -3.67 -0.37 0.00 -2.04 0.00 0.00 64.34 58.43 2vuy n VAL 643 Cb 0.46 -0.12 -0.06 0.00 -1.47 0.00 0.00 33.84 32.64 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 -3.67 3.64 -1.14 7.34 -1.94 -1.25 -4.49 119.30 117.79 2vuy s MET 644 Ca 0.41 0.08 -0.07 0.00 -1.71 0.00 0.00 55.69 54.39 2vuy s MET 644 Cb 0.37 -3.21 -0.05 0.00 2.01 0.00 0.00 34.83 33.95 2vuy s MET 644 CO 0.01 0.73 2.92 -3.47 -0.01 0.00 0.00 175.02 175.20 2vuy n ASP 645 N 1.96 7.73 -4.37 3.03 4.64 -1.26 -4.77 116.55 123.50 2vuy n ASP 645 Ca -0.18 -2.76 -0.35 0.00 -1.38 0.00 0.00 54.79 50.12 2vuy n ASP 645 Cb 0.54 -1.45 -0.13 0.00 -1.04 0.00 0.00 41.12 39.03 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 0.71 3.48 -0.11 -0.67 0.41 -1.26 -4.82 118.70 116.44 2vuy s GLU 646 Ca 0.64 -0.58 0.03 0.00 -0.41 0.00 0.00 54.97 54.66 2vuy s GLU 646 Cb 0.23 -3.05 0.00 0.00 -1.78 0.00 0.00 34.13 29.53 2vuy s GLU 646 CO -0.07 -0.11 -0.23 0.42 -0.49 0.00 0.00 175.26 174.78 2vuy s ILE 647 N 1.29 2.02 0.79 -1.63 -1.09 -1.26 -0.17 121.20 121.14 2vuy s ILE 647 Ca 0.04 -0.98 -0.11 0.00 -2.23 0.00 0.00 60.65 57.37 2vuy s ILE 647 Cb -0.14 -1.76 0.08 0.00 -1.58 0.00 0.00 42.46 39.05 2vuy s ILE 647 CO -0.00 0.55 1.14 0.54 -1.23 0.00 0.00 174.94 175.94 2vuy s ASN 648 N 0.50 4.58 0.00 3.58 2.20 -0.49 -4.90 114.94 120.41 2vuy s ASN 648 Ca -0.15 0.72 0.00 0.00 -0.94 0.00 0.00 52.86 52.48 2vuy s ASN 648 Cb -0.17 -1.24 0.00 0.00 -2.00 0.00 0.00 41.25 37.84 2vuy s ASN 648 CO 0.06 -1.84 0.66 1.15 -2.94 0.00 0.00 177.10 174.19 2vuy n MET 649 N -3.23 0.00 -0.27 3.55 0.00 -1.26 -0.95 117.12 114.95 2vuy n MET 649 Ca 0.08 0.17 0.09 0.00 0.00 0.00 0.00 57.70 58.03 2vuy n MET 649 Cb 0.61 -1.50 0.24 0.00 0.00 0.00 0.00 33.22 32.56 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 -1.16 0.72 -1.00 3.17 4.02 -1.26 -4.95 117.16 116.70 2vuy n TYR 650 Ca 0.00 -0.50 0.00 0.00 -0.01 0.00 0.00 57.90 57.39 2vuy n TYR 650 Cb 0.00 -0.01 0.00 0.00 -0.02 0.00 0.00 39.34 39.31 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 1.08 0.80 3.81 2.72 0.00 -0.13 -5.02 105.19 108.46 2vuy n GLY 651 Ca 0.18 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.01 4.26 -0.05 1.61 2.02 -1.26 -4.85 118.70 120.42 2vuy s GLU 652 Ca 0.00 0.84 -0.25 0.00 0.02 0.00 0.00 54.97 55.59 2vuy s GLU 652 Cb 0.00 -3.04 -0.04 0.00 0.10 0.00 0.00 34.13 31.16 2vuy s GLU 652 CO 0.00 0.49 0.76 0.50 0.02 0.00 0.00 175.26 177.03 2vuy s ARG 653 N -1.63 4.46 0.08 1.61 3.52 -1.26 -1.39 118.95 124.34 2vuy s ARG 653 Ca 0.38 0.99 -0.14 0.00 -0.13 0.00 0.00 55.73 56.83 2vuy s ARG 653 Cb -0.18 -3.45 -0.06 0.00 -1.56 0.00 0.00 34.95 29.69 2vuy s ARG 653 CO 0.21 0.04 0.48 0.42 -0.81 0.00 0.00 175.30 175.64 2vuy s ILE 654 N 0.85 4.94 0.26 4.11 1.01 0.76 -4.97 121.20 128.15 2vuy s ILE 654 Ca 0.40 0.81 0.09 0.00 0.00 0.00 0.00 60.65 61.96 2vuy s ILE 654 Cb -0.18 -3.73 -0.05 0.00 0.01 0.00 0.00 42.46 38.50 2vuy s ILE 654 CO 0.20 0.40 -0.14 0.00 0.00 0.00 0.00 174.94 175.40 2vuy s ALA 655 N -1.29 2.44 0.31 9.38 0.00 -1.26 -4.62 121.76 126.72 2vuy s ALA 655 Ca 0.31 -1.84 -0.13 0.00 0.00 0.00 0.00 51.96 50.30 2vuy s ALA 655 Cb -0.16 -0.08 0.02 0.00 0.00 0.00 0.00 23.12 22.90 2vuy s ALA 655 CO 0.17 0.11 0.60 0.34 0.00 0.00 0.00 175.76 176.98 2vuy s ASP 656 N -3.44 0.10 1.03 0.00 3.68 -0.32 -4.83 116.67 112.88 2vuy s ASP 656 Ca 0.28 -1.03 -0.12 0.00 2.13 0.00 0.00 52.55 53.80 2vuy s ASP 656 Cb -0.01 0.70 0.21 0.00 -1.45 0.00 0.00 42.92 42.36 2vuy s ASP 656 CO 0.12 -1.35 1.08 -1.81 0.13 0.00 0.00 175.17 173.34 2vuy s ASP 657 N -3.05 2.32 -0.29 -0.34 -0.00 -1.26 -3.35 116.67 110.69 2vuy s ASP 657 Ca 0.20 1.28 -0.10 0.00 -0.00 0.00 0.00 52.55 53.93 2vuy s ASP 657 Cb -0.03 -1.97 -0.03 0.00 -0.00 0.00 0.00 42.92 40.90 2vuy s ASP 657 CO 0.11 -3.33 0.15 -0.44 -0.00 0.00 0.00 175.17 171.66 2vuy s SER 658 N -3.26 5.62 0.03 0.27 0.01 -1.26 -2.65 113.70 112.45 2vuy s SER 658 Ca 0.66 -0.26 0.03 0.00 1.31 0.00 0.00 55.95 57.68 2vuy s SER 658 Cb -0.20 -2.03 -0.04 0.00 0.21 0.00 0.00 66.02 63.97 2vuy s SER 658 CO 0.59 -0.11 -0.01 -0.36 0.41 0.00 0.00 173.24 173.76 2vuy s PHE 659 N 1.67 3.01 -0.24 2.43 0.40 -0.64 -1.44 117.98 123.16 2vuy s PHE 659 Ca 0.06 0.02 0.00 0.00 -0.60 0.00 0.00 56.93 56.41 2vuy s PHE 659 Cb -0.16 -1.61 0.04 0.00 0.51 0.00 0.00 43.02 41.79 2vuy s PHE 659 CO 0.07 0.45 -0.10 -1.17 0.70 0.00 0.00 175.22 175.18 2vuy s LEU 660 N -1.77 3.11 -0.16 -0.37 2.96 0.68 -0.74 118.68 122.39 2vuy s LEU 660 Ca 0.21 -1.00 -0.05 0.00 -0.22 0.00 0.00 54.13 53.07 2vuy s LEU 660 Cb -0.11 -1.60 -0.03 0.00 0.50 0.00 0.00 46.19 44.94 2vuy s LEU 660 CO 0.12 -0.13 0.01 -0.63 -1.32 0.00 0.00 176.35 174.40 2vuy s ILE 661 N 1.25 4.34 -0.20 6.68 1.01 0.02 -0.42 121.20 133.88 2vuy s ILE 661 Ca -0.02 -0.20 0.00 0.00 0.00 0.00 0.00 60.65 60.43 2vuy s ILE 661 Cb -0.17 -2.91 0.05 0.00 0.01 0.00 0.00 42.46 39.43 2vuy s ILE 661 CO -0.06 0.50 -0.07 -0.63 0.00 0.00 0.00 174.94 174.68 2vuy s ILE 662 N 0.16 1.43 -0.35 2.92 1.01 -0.07 -1.90 121.20 124.39 2vuy s ILE 662 Ca 0.01 -0.93 -0.02 0.00 0.00 0.00 0.00 60.65 59.71 2vuy s ILE 662 Cb -0.13 -1.59 0.08 0.00 0.01 0.00 0.00 42.46 40.83 2vuy s ILE 662 CO 0.02 0.08 0.10 -0.76 0.00 0.00 0.00 174.94 174.38 2vuy s LEU 663 N 1.48 4.60 -0.51 2.97 1.43 0.01 -1.00 118.68 127.67 2vuy s LEU 663 Ca -0.02 -1.66 -0.11 0.00 -1.03 0.00 0.00 54.13 51.32 2vuy s LEU 663 Cb -0.17 -1.77 0.13 0.00 0.03 0.00 0.00 46.19 44.41 2vuy s LEU 663 CO -0.08 -0.40 0.40 0.21 0.23 0.00 0.00 176.35 176.71 2vuy s ASN 664 N 1.51 5.83 0.19 2.29 2.47 -0.39 -1.39 114.94 125.45 2vuy s ASN 664 Ca 0.02 -1.96 0.25 0.00 0.42 0.00 0.00 52.86 51.58 2vuy s ASN 664 Cb -0.21 -2.05 0.47 0.00 -1.45 0.00 0.00 41.25 38.00 2vuy s ASN 664 CO -0.03 -0.71 1.48 0.00 -3.72 0.00 0.00 177.10 174.12 2vuy h ALA 665 N 8.45 0.76 -2.25 1.71 0.00 -0.54 -1.02 119.26 126.36 2vuy h ALA 665 Ca -0.21 0.00 -0.59 0.00 0.00 0.00 0.00 54.91 54.12 2vuy h ALA 665 Cb 1.07 0.00 0.06 0.00 0.00 0.00 0.00 17.79 18.92 2vuy h ALA 665 CO 0.89 0.00 0.79 -1.71 0.00 0.00 0.00 179.25 179.21 2vuy n ASN 666 N -2.32 3.04 0.29 0.00 2.85 -0.93 -4.28 115.26 113.92 2vuy n ASN 666 Ca 0.04 1.08 0.17 0.00 -0.11 0.00 0.00 54.58 55.76 2vuy n ASN 666 Cb 0.46 -1.42 0.89 0.00 1.24 0.00 0.00 39.78 40.95 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 5.90 0.00 -6.79 1.20 0.13 -1.91 -2.02 132.00 128.50 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 1.26 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.42 2vuy h PRO 667 CO 0.88 0.05 -0.04 -0.80 -0.23 0.00 0.00 178.00 177.87 2vuy s ASN 668 N -5.80 5.73 0.81 1.44 0.02 -1.26 -4.07 114.94 111.82 2vuy s ASN 668 Ca -0.03 0.33 -0.12 0.00 -1.02 0.00 0.00 52.86 52.03 2vuy s ASN 668 Cb 0.13 -1.49 0.08 0.00 0.02 0.00 0.00 41.25 39.98 2vuy s ASN 668 CO 0.52 -0.82 1.11 0.20 0.02 0.00 0.00 177.10 178.14 2vuy s ASN 669 N -4.26 4.37 -0.01 -1.22 0.02 -1.26 -2.92 114.94 109.66 2vuy s ASN 669 Ca 0.50 1.20 -0.19 0.00 -1.02 0.00 0.00 52.86 53.35 2vuy s ASN 669 Cb -0.10 -1.89 0.04 0.00 0.02 0.00 0.00 41.25 39.31 2vuy s ASN 669 CO 0.39 -2.03 0.41 0.68 0.02 0.00 0.00 177.10 176.57 2vuy s VAL 670 N -3.22 0.04 -0.46 1.60 -7.23 -0.55 -4.87 120.40 105.72 2vuy s VAL 670 Ca 0.61 -0.36 -0.04 0.00 -1.81 0.00 0.00 61.98 60.38 2vuy s VAL 670 Cb -0.14 -0.76 0.12 0.00 0.56 0.00 0.00 36.38 36.16 2vuy s VAL 670 CO 0.54 -0.20 0.27 -0.54 -0.31 0.00 0.00 175.10 174.86 2vuy s LYS 671 N -1.49 2.17 0.08 4.82 1.02 -1.26 -0.00 119.74 125.09 2vuy s LYS 671 Ca -0.12 -1.95 -0.19 0.00 0.02 0.00 0.00 55.97 53.74 2vuy s LYS 671 Cb -0.03 -3.66 -0.07 0.00 -0.52 0.00 0.00 37.83 33.55 2vuy s LYS 671 CO 0.05 -1.11 0.58 0.14 -0.92 0.00 0.00 175.35 174.08 2vuy s VAL 672 N 0.95 4.73 -0.47 3.17 -7.23 -1.00 -4.72 120.40 115.83 2vuy s VAL 672 Ca 0.10 1.20 -0.17 0.00 -1.81 0.00 0.00 61.98 61.30 2vuy s VAL 672 Cb -0.23 -3.89 0.06 0.00 0.56 0.00 0.00 36.38 32.88 2vuy s VAL 672 CO -0.04 0.52 0.45 -0.75 -0.31 0.00 0.00 175.10 174.98 2vuy s LYS 673 N -1.20 3.03 0.45 4.82 2.20 -0.55 -1.77 119.74 126.73 2vuy s LYS 673 Ca 0.30 -1.13 -0.23 0.00 -0.36 0.00 0.00 55.97 54.55 2vuy s LYS 673 Cb -0.19 -4.09 -0.10 0.00 -1.51 0.00 0.00 37.83 31.94 2vuy s LYS 673 CO 0.19 -1.03 0.97 1.19 -0.36 0.00 0.00 175.35 176.31 2vuy n PHE 674 N 5.50 1.01 -1.50 4.03 3.01 -0.82 -4.16 117.46 124.52 2vuy n PHE 674 Ca -0.10 0.54 -0.29 0.00 1.01 0.00 0.00 57.45 58.60 2vuy n PHE 674 Cb 0.45 -2.20 0.12 0.00 -0.01 0.00 0.00 39.48 37.84 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 -2.11 1.54 0.34 -1.08 0.04 -1.26 -4.26 135.00 128.21 2vuy s PRO 675 Ca 0.65 0.51 -0.26 0.00 0.04 0.00 0.00 61.00 61.94 2vuy s PRO 675 Cb -0.53 -1.87 -0.14 0.00 0.04 0.00 0.00 34.50 32.01 2vuy s PRO 675 CO 0.55 -1.97 0.79 1.63 0.04 0.00 0.00 177.00 178.04 2vuy n LYS 676 N -3.65 0.90 0.00 4.56 5.02 -1.26 -4.42 118.16 119.32 2vuy n LYS 676 Ca 0.07 0.32 0.00 0.00 -2.02 0.00 0.00 58.31 56.68 2vuy n LYS 676 Cb 0.57 -1.64 0.00 0.00 -0.02 0.00 0.00 35.03 33.95 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 0.48 3.23 0.72 0.00 -1.26 -4.98 105.19 104.88 2vuy n GLY 677 Ca 0.11 -2.31 -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 -0.96 2.85 -0.01 1.61 2.20 0.78 -3.46 119.74 122.75 2vuy s LYS 678 Ca 0.00 -0.98 0.00 0.00 -0.36 0.00 0.00 55.97 54.63 2vuy s LYS 678 Cb 0.00 -3.08 -0.04 0.00 -1.51 0.00 0.00 37.83 33.21 2vuy s LYS 678 CO 0.00 -0.43 0.04 -1.58 -0.36 0.00 0.00 175.35 173.03 2vuy s TRP 679 N 1.35 3.20 -0.13 4.03 0.52 0.20 -0.79 118.94 127.32 2vuy s TRP 679 Ca 0.00 0.17 0.02 0.00 0.02 0.00 0.00 56.10 56.30 2vuy s TRP 679 Cb -0.17 -1.72 -0.00 0.00 -1.15 0.00 0.00 33.47 30.43 2vuy s TRP 679 CO -0.03 0.52 -0.19 -2.00 0.02 0.00 0.00 176.95 175.27 2vuy s GLU 680 N -1.58 3.15 0.37 4.98 2.12 -0.29 -1.14 118.70 126.31 2vuy s GLU 680 Ca 0.21 -0.80 -0.27 0.00 0.36 0.00 0.00 54.97 54.46 2vuy s GLU 680 Cb -0.12 -2.49 -0.09 0.00 0.26 0.00 0.00 34.13 31.69 2vuy s GLU 680 CO 0.11 0.08 1.27 -1.17 -0.54 0.00 0.00 175.26 175.01 2vuy s LEU 681 N 0.63 4.31 0.00 2.70 1.98 0.76 -0.66 118.68 128.40 2vuy s LEU 681 Ca -0.10 2.60 0.00 0.00 -2.89 0.00 0.00 54.13 53.74 2vuy s LEU 681 Cb -0.16 -3.82 0.00 0.00 0.66 0.00 0.00 46.19 42.87 2vuy s LEU 681 CO 0.03 -0.67 0.00 0.55 -1.89 0.00 0.00 176.35 174.37 2vuy n VAL 682 N 0.42 0.00 -3.75 1.68 3.14 -0.53 -4.88 118.33 114.40 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 -0.10 -0.10 0.00 -1.06 0.00 0.00 33.84 33.01 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 -0.94 0.02 0.14 1.55 1.01 -1.11 -4.99 121.20 116.88 2vuy s ILE 683 Ca 0.00 -0.15 -0.24 0.00 0.00 0.00 0.00 60.65 60.26 2vuy s ILE 683 Cb 0.00 -0.54 0.07 0.00 0.01 0.00 0.00 42.46 42.00 2vuy s ILE 683 CO 0.00 -0.08 0.70 -0.94 0.00 0.00 0.00 174.94 174.62 2vuy s SER 684 N -0.32 -0.45 0.00 3.58 1.04 -1.26 -0.96 113.70 115.34 2vuy s SER 684 Ca -0.05 -0.12 0.27 0.00 0.48 0.00 0.00 55.95 56.53 2vuy s SER 684 Cb -0.03 0.57 0.80 0.00 0.10 0.00 0.00 66.02 67.45 2vuy s SER 684 CO 0.02 -0.95 1.59 -1.54 0.98 0.00 0.00 173.24 173.34 2vuy n SER 685 N -0.37 1.08 -4.69 7.02 3.41 -0.87 -4.93 113.62 114.27 2vuy n SER 685 Ca -0.13 -0.96 -0.44 0.00 -0.26 0.00 0.00 58.87 57.08 2vuy n SER 685 Cb 0.63 0.12 -0.02 0.00 -0.26 0.00 0.00 64.21 64.68 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 -0.55 2.30 -0.09 7.33 0.53 -1.26 -4.59 117.16 120.84 2vuy n TYR 686 Ca 0.13 0.42 -0.13 0.00 -1.02 0.00 0.00 57.90 57.30 2vuy n TYR 686 Cb 0.35 -2.48 -0.14 0.00 -1.03 0.00 0.00 39.34 36.04 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 1.94 1.22 -4.60 7.72 4.77 -1.26 -4.94 117.00 121.84 2vuy n LEU 687 Ca 0.10 0.04 -0.29 0.00 -0.03 0.00 0.00 56.01 55.82 2vuy n LEU 687 Cb 0.33 -0.09 0.22 0.00 -2.33 0.00 0.00 43.42 41.54 2vuy n LEU 687 CO 0.63 0.64 0.60 0.00 -1.33 0.00 0.00 177.39 177.93 2vuy s ARG 688 N -2.52 -0.54 0.15 3.23 1.70 -1.26 -4.97 118.95 114.74 2vuy s ARG 688 Ca -0.18 0.32 -0.29 0.00 -0.47 0.00 0.00 55.73 55.11 2vuy s ARG 688 Cb 0.07 -1.64 -0.07 0.00 -0.57 0.00 0.00 34.95 32.74 2vuy s ARG 688 CO 0.76 -3.34 0.93 -2.00 -1.08 0.00 0.00 175.30 170.57 2vuy s GLU 689 N -5.05 4.73 0.18 3.89 2.12 -1.26 -5.00 118.70 118.30 2vuy s GLU 689 Ca 0.68 1.42 -0.30 0.00 0.36 0.00 0.00 54.97 57.13 2vuy s GLU 689 Cb -0.16 -3.34 -0.08 0.00 0.26 0.00 0.00 34.13 30.81 2vuy s GLU 689 CO 0.58 0.33 1.29 0.96 -0.54 0.00 0.00 175.26 177.89 2vuy s ILE 690 N -0.44 3.33 0.38 -3.70 -0.00 -1.26 -5.01 121.20 114.51 2vuy s ILE 690 Ca 0.44 1.07 -0.24 0.00 -0.00 0.00 0.00 60.65 61.92 2vuy s ILE 690 Cb -0.24 -3.69 -0.09 0.00 -0.00 0.00 0.00 42.46 38.44 2vuy s ILE 690 CO 0.30 0.15 1.03 -0.54 -0.00 0.00 0.00 174.94 175.88 2vuy s LYS 691 N 0.08 4.26 0.40 0.37 1.02 -1.26 -4.95 119.74 119.65 2vuy s LYS 691 Ca 0.57 1.48 0.20 0.00 0.02 0.00 0.00 55.97 58.24 2vuy s LYS 691 Cb -0.35 -2.60 1.14 0.00 -0.52 0.00 0.00 37.83 35.50 2vuy s LYS 691 CO 0.36 -0.05 1.74 -1.35 -0.92 0.00 0.00 175.35 175.14 2vuy h PRO 692 N 2.64 0.34 0.00 -1.68 0.11 -2.02 0.26 132.00 131.65 2vuy h PRO 692 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2vuy h PRO 692 Cb 1.21 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2vuy h PRO 692 CO 0.63 0.23 0.00 -0.85 -0.21 0.00 0.00 178.00 177.80 2vuy n GLU 693 N -4.66 0.93 -0.03 1.05 0.00 -1.26 -3.12 120.64 113.54 2vuy n GLU 693 Ca 0.27 0.00 0.04 0.00 0.00 0.00 0.00 57.16 57.47 2vuy n GLU 693 Cb 0.95 -1.46 -0.15 0.00 0.00 0.00 0.00 31.44 30.78 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 -0.96 0.73 0.01 3.44 1.02 0.90 -4.52 120.64 121.25 2vuy n GLU 694 Ca 0.21 -0.13 -0.02 0.00 -0.02 0.00 0.00 57.16 57.20 2vuy n GLU 694 Cb 0.09 -1.47 0.24 0.00 -0.02 0.00 0.00 31.44 30.28 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 0.50 -3.43 3.49 3.08 -1.51 -3.41 114.38 113.10 2vuy h ARG 695 Ca -0.16 -0.16 -0.33 0.00 0.07 0.00 0.00 59.98 59.41 2vuy h ARG 695 Cb 1.29 -0.05 -0.36 0.00 0.08 0.00 0.00 29.97 30.93 2vuy h ARG 695 CO 0.01 0.65 -0.73 0.42 -1.07 0.00 0.00 179.97 179.24 2vuy s ILE 696 N -4.67 -0.08 -0.16 2.04 1.01 -1.26 -0.17 121.20 117.91 2vuy s ILE 696 Ca -0.07 0.31 0.00 0.00 0.00 0.00 0.00 60.65 60.89 2vuy s ILE 696 Cb 0.14 -0.11 0.00 0.00 0.01 0.00 0.00 42.46 42.50 2vuy s ILE 696 CO 0.78 0.13 -0.16 -0.63 0.00 0.00 0.00 174.94 175.06 2vuy s ILE 697 N 1.56 2.59 0.29 2.92 -1.09 -0.30 -4.90 121.20 122.27 2vuy s ILE 697 Ca -0.03 -0.79 0.07 0.00 -2.23 0.00 0.00 60.65 57.68 2vuy s ILE 697 Cb -0.13 -2.09 -0.06 0.00 -1.58 0.00 0.00 42.46 38.60 2vuy s ILE 697 CO -0.03 0.51 -0.07 -0.70 -1.23 0.00 0.00 174.94 173.42 2vuy s GLU 698 N 0.90 1.61 -1.22 2.79 2.12 -1.26 -0.63 118.70 123.01 2vuy s GLU 698 Ca -0.04 -1.81 -0.26 0.00 0.36 0.00 0.00 54.97 53.22 2vuy s GLU 698 Cb -0.15 -1.29 0.02 0.00 0.26 0.00 0.00 34.13 32.97 2vuy s GLU 698 CO -0.02 0.07 0.67 0.41 -0.54 0.00 0.00 175.26 175.86 2vuy n GLY 699 N -0.62 -0.82 3.02 -1.50 0.00 -1.22 -2.89 105.19 101.16 2vuy n GLY 699 Ca -0.05 0.36 -0.12 0.00 0.00 0.00 0.00 46.02 46.21 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 -4.68 -0.96 -1.93 1.61 0.28 -1.26 -4.90 120.64 108.80 2vuy n GLU 700 Ca -0.13 0.04 -0.30 0.00 -0.16 0.00 0.00 57.16 56.61 2vuy n GLU 700 Cb 0.59 -1.37 0.17 0.00 1.43 0.00 0.00 31.44 32.25 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 -4.27 0.92 -0.00 3.44 1.02 -1.14 -4.48 119.74 115.23 2vuy s LYS 701 Ca 0.07 -0.31 -0.01 0.00 0.02 0.00 0.00 55.97 55.74 2vuy s LYS 701 Cb -0.04 -1.87 -0.04 0.00 -0.52 0.00 0.00 37.83 35.36 2vuy s LYS 701 CO 0.36 -2.24 0.11 -1.21 -0.92 0.00 0.00 175.35 171.45 2vuy s GLU 702 N -5.82 3.18 -0.03 1.68 2.02 -1.26 -1.94 118.70 116.52 2vuy s GLU 702 Ca 0.71 -0.44 0.04 0.00 0.02 0.00 0.00 54.97 55.30 2vuy s GLU 702 Cb -0.05 -2.93 -0.00 0.00 0.10 0.00 0.00 34.13 31.24 2vuy s GLU 702 CO 0.52 0.65 -0.13 -1.17 0.02 0.00 0.00 175.26 175.15 2vuy s LEU 703 N -1.81 1.88 0.09 1.80 2.96 -0.73 -4.98 118.68 117.90 2vuy s LEU 703 Ca 0.24 -0.27 -0.26 0.00 -0.22 0.00 0.00 54.13 53.63 2vuy s LEU 703 Cb -0.12 -0.75 -0.06 0.00 0.50 0.00 0.00 46.19 45.75 2vuy s LEU 703 CO 0.15 0.12 0.81 -0.70 -1.32 0.00 0.00 176.35 175.41 2vuy s GLU 704 N 0.04 4.56 -0.20 1.98 2.12 -1.26 -2.37 118.70 123.57 2vuy s GLU 704 Ca -0.02 1.17 0.00 0.00 0.36 0.00 0.00 54.97 56.48 2vuy s GLU 704 Cb -0.09 -3.34 0.05 0.00 0.26 0.00 0.00 34.13 31.01 2vuy s GLU 704 CO 0.01 0.36 -0.08 0.42 -0.54 0.00 0.00 175.26 175.43 2vuy s ILE 705 N -0.38 1.45 0.70 -3.70 1.01 1.00 -4.96 121.20 116.33 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 -0.22 -1.60 -0.01 0.00 0.01 0.00 0.00 42.46 40.64 2vuy s ILE 705 CO 0.25 0.10 0.90 -0.62 0.00 0.00 0.00 174.94 175.57 2vuy n GLU 706 N 4.74 0.53 -1.64 2.79 1.02 -1.26 -1.48 120.64 125.34 2vuy n GLU 706 Ca -0.13 0.23 -0.36 0.00 -0.02 0.00 0.00 57.16 56.88 2vuy n GLU 706 Cb 0.46 -2.15 0.08 0.00 -0.02 0.00 0.00 31.44 29.81 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 -1.56 2.69 -0.85 0.62 0.00 -1.15 -3.73 107.32 103.35 2vuy s GLY 707 Ca 0.73 1.11 -0.04 0.00 0.00 0.00 0.00 44.72 46.52 2vuy s GLY 707 CO 0.51 1.53 0.73 0.54 0.00 0.00 0.00 173.10 176.41 2vuy n ARG 708 N -2.17 -1.49 -3.81 2.90 1.74 -0.57 -4.93 116.66 108.32 2vuy n ARG 708 Ca 0.15 1.15 -0.13 0.00 -0.77 0.00 0.00 57.85 58.25 2vuy n ARG 708 Cb 0.49 -5.00 -0.13 0.00 -1.02 0.00 0.00 32.46 26.80 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 -3.12 -0.01 -0.10 0.55 2.01 -0.49 -4.87 115.64 109.61 2vuy s THR 709 Ca 0.13 0.04 0.03 0.00 0.31 0.00 0.00 61.69 62.21 2vuy s THR 709 Cb -0.03 -0.17 -0.01 0.00 0.01 0.00 0.00 72.50 72.30 2vuy s THR 709 CO 0.79 0.02 -0.21 0.00 -0.69 0.00 0.00 174.62 174.53 2vuy s ALA 710 N 0.32 2.31 0.00 7.40 0.00 -1.26 -1.26 121.76 129.27 2vuy s ALA 710 Ca -0.02 -0.97 0.01 0.00 0.00 0.00 0.00 51.96 50.98 2vuy s ALA 710 Cb -0.03 -0.89 -0.01 0.00 0.00 0.00 0.00 23.12 22.19 2vuy s ALA 710 CO -0.01 0.32 -0.04 -0.51 0.00 0.00 0.00 175.76 175.52 2vuy s LEU 711 N 0.17 2.05 -0.19 0.00 1.02 -0.17 -2.06 118.68 119.51 2vuy s LEU 711 Ca -0.12 -0.16 0.01 0.00 0.02 0.00 0.00 54.13 53.88 2vuy s LEU 711 Cb -0.16 -0.17 0.04 0.00 0.02 0.00 0.00 46.19 45.92 2vuy s LEU 711 CO 0.07 -0.01 -0.12 -0.69 0.02 0.00 0.00 176.35 175.61 2vuy s VAL 712 N -0.34 1.71 0.12 -1.59 1.01 -0.13 -0.89 120.40 120.27 2vuy s VAL 712 Ca -0.01 -0.94 0.06 0.00 0.00 0.00 0.00 61.98 61.09 2vuy s VAL 712 Cb -0.03 -1.70 -0.04 0.00 0.00 0.00 0.00 36.38 34.60 2vuy s VAL 712 CO -0.00 0.28 -0.01 -0.31 0.00 0.00 0.00 175.10 175.05 2vuy s TYR 713 N 1.39 2.92 -0.14 5.22 1.51 0.44 -1.45 117.35 127.24 2vuy s TYR 713 Ca 0.01 -0.07 0.02 0.00 -1.01 0.00 0.00 57.07 56.02 2vuy s TYR 713 Cb -0.15 -1.48 0.01 0.00 -0.11 0.00 0.00 41.96 40.23 2vuy s TYR 713 CO -0.09 0.48 -0.21 0.50 -1.11 0.00 0.00 175.55 175.12 2vuy s ARG 714 N -2.48 2.94 0.06 -0.62 3.52 0.17 -0.23 118.95 122.31 2vuy s ARG 714 Ca 0.26 -0.83 -0.31 0.00 -0.13 0.00 0.00 55.73 54.72 2vuy s ARG 714 Cb -0.11 -2.39 -0.07 0.00 -1.56 0.00 0.00 34.95 30.83 2vuy s ARG 714 CO 0.18 -0.03 1.40 0.50 -0.81 0.00 0.00 175.30 176.54 2vuy s ARG 715 N 0.85 4.30 0.00 5.12 3.52 -0.52 -1.13 118.95 131.08 2vuy s ARG 715 Ca -0.07 2.02 0.04 0.00 -0.13 0.00 0.00 55.73 57.60 2vuy s ARG 715 Cb -0.15 -3.42 0.05 0.00 -1.56 0.00 0.00 34.95 29.86 2vuy s ARG 715 CO -0.02 -0.51 0.73 0.44 -0.81 0.00 0.00 175.30 175.12 2vuy n ILE 716 N 4.32 0.18 -3.64 4.11 -5.35 0.03 -4.69 119.36 114.32 2vuy n ILE 716 Ca 0.12 -0.59 -0.07 0.00 -0.27 0.00 0.00 62.75 61.94 2vuy n ILE 716 Cb 0.43 0.99 -0.07 0.00 -1.74 0.00 0.00 39.64 39.25 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 -0.49 0.36 0.00 6.28 2.12 -1.20 -4.97 118.70 120.80 2vuy s GLU 717 Ca 0.06 0.40 0.00 0.00 0.36 0.00 0.00 54.97 55.79 2vuy s GLU 717 Cb 0.04 0.18 0.00 0.00 0.26 0.00 0.00 34.13 34.61 2vuy s GLU 717 CO 0.06 -0.05 0.00 -0.11 -0.54 0.00 0.00 175.26 174.62