#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vvm s THR 2 N 0.00 5.14 0.45 2.03 2.01 -1.26 -0.95 115.64 123.06 2vvm s THR 2 Ca 0.00 1.10 -0.08 0.00 0.31 0.00 0.00 61.69 63.02 2vvm s THR 2 Cb 0.00 -3.89 -0.05 0.00 0.01 0.00 0.00 72.50 68.57 2vvm s THR 2 CO 0.00 0.30 0.79 -0.55 -0.69 0.00 0.00 174.62 174.47 2vvm s SER 3 N 0.70 6.39 0.37 3.53 0.15 0.58 -4.92 113.70 120.50 2vvm s SER 3 Ca 0.29 1.06 0.19 0.00 0.70 0.00 0.00 55.95 58.19 2vvm s SER 3 Cb -0.16 -2.30 0.64 0.00 -1.71 0.00 0.00 66.02 62.50 2vvm s SER 3 CO 0.13 -0.51 1.71 0.03 1.20 0.00 0.00 173.24 175.80 2vvm h ARG 4 N 0.69 0.00 -7.31 5.44 3.08 -1.95 -2.95 114.38 111.38 2vvm h ARG 4 Ca -0.47 0.00 -0.51 0.00 0.07 0.00 0.00 59.98 59.07 2vvm h ARG 4 Cb 1.20 0.00 0.09 0.00 0.08 0.00 0.00 29.97 31.34 2vvm h ARG 4 CO 0.63 0.37 0.37 -0.51 -1.07 0.00 0.00 179.97 179.76 2vvm s ASP 5 N -6.41 5.38 0.00 7.04 1.01 -1.26 -3.66 116.67 118.76 2vvm s ASP 5 Ca 0.01 1.66 0.00 0.00 0.71 0.00 0.00 52.55 54.93 2vvm s ASP 5 Cb 0.11 -2.50 0.00 0.00 1.01 0.00 0.00 42.92 41.53 2vvm s ASP 5 CO 0.69 -1.44 0.00 0.61 0.21 0.00 0.00 175.17 175.23 2vvm n GLY 6 N -1.78 0.07 3.05 0.21 0.00 -1.26 -2.28 105.19 103.20 2vvm n GLY 6 Ca 0.08 -1.70 -0.10 0.00 0.00 0.00 0.00 46.02 44.29 2vvm n GLY 6 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2vvm s TYR 7 N -2.96 0.54 0.01 1.61 2.02 0.82 -0.28 117.35 119.11 2vvm s TYR 7 Ca 0.00 -0.65 0.01 0.00 -0.37 0.00 0.00 57.07 56.06 2vvm s TYR 7 Cb 0.00 -0.34 -0.01 0.00 -0.40 0.00 0.00 41.96 41.21 2vvm s TYR 7 CO 0.00 -0.17 -0.03 -1.14 -1.57 0.00 0.00 175.55 172.64 2vvm s GLN 8 N -2.20 0.24 -0.04 -0.62 0.74 -0.38 -2.10 119.66 115.31 2vvm s GLN 8 Ca -0.06 -0.28 0.04 0.00 0.05 0.00 0.00 55.36 55.11 2vvm s GLN 8 Cb -0.05 -0.11 -0.00 0.00 1.10 0.00 0.00 33.01 33.94 2vvm s GLN 8 CO -0.02 0.02 -0.17 -0.46 -0.55 0.00 0.00 175.29 174.11 2vvm s TRP 9 N -0.54 1.69 0.08 1.67 -0.00 0.33 -0.40 118.94 121.77 2vvm s TRP 9 Ca -0.04 -0.46 0.01 0.00 -0.00 0.00 0.00 56.10 55.61 2vvm s TRP 9 Cb -0.04 -1.13 -0.04 0.00 -0.00 0.00 0.00 33.47 32.26 2vvm s TRP 9 CO -0.00 -0.14 -0.06 0.95 -0.00 0.00 0.00 176.95 177.70 2vvm s THR 10 N -0.04 0.57 0.44 5.86 -4.23 -1.14 -1.05 115.64 116.06 2vvm s THR 10 Ca -0.02 -1.74 0.21 0.00 -1.18 0.00 0.00 61.69 58.96 2vvm s THR 10 Cb -0.11 -1.43 0.40 0.00 1.34 0.00 0.00 72.50 72.70 2vvm s THR 10 CO 0.02 -0.80 1.85 -0.65 -0.54 0.00 0.00 174.62 174.50 2vvm h PRO 11 N 3.30 0.31 0.00 3.99 0.11 -1.88 0.07 132.00 137.90 2vvm h PRO 11 Ca -0.35 -0.02 -0.21 0.00 0.11 0.00 0.00 66.00 65.53 2vvm h PRO 11 Cb 1.17 -0.07 -0.04 0.00 0.11 0.00 0.00 31.00 32.17 2vvm h PRO 11 CO 0.60 0.20 -1.46 1.49 -0.21 0.00 0.00 178.00 178.62 2vvm h GLU 12 N 0.31 0.00 0.00 1.05 4.22 -1.96 -3.30 114.58 114.90 2vvm h GLU 12 Ca 0.47 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.91 2vvm h GLU 12 Cb 1.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.57 2vvm h GLU 12 CO -0.15 0.41 -1.39 0.25 -2.18 0.00 0.00 179.01 175.95 2vvm n THR 13 N -2.99 0.00 -4.94 0.32 -2.24 -1.11 -5.10 114.28 98.23 2vvm n THR 13 Ca -0.11 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.43 2vvm n THR 13 Cb 0.92 0.56 0.00 0.00 -2.10 0.00 0.00 70.33 69.71 2vvm n THR 13 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2vvm n GLY 14 N 1.41 0.85 3.67 3.38 0.00 -0.01 -4.67 105.19 109.83 2vvm n GLY 14 Ca 0.00 -0.78 -0.41 0.00 0.00 0.00 0.00 46.02 44.83 2vvm n GLY 14 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2vvm s LEU 15 N 0.00 4.19 0.11 0.99 2.96 -1.26 -2.90 118.68 122.77 2vvm s LEU 15 Ca 0.00 1.15 0.09 0.00 -0.22 0.00 0.00 54.13 55.16 2vvm s LEU 15 Cb 0.00 -3.20 -0.04 0.00 0.50 0.00 0.00 46.19 43.46 2vvm s LEU 15 CO 0.00 -0.36 -0.23 0.42 -1.32 0.00 0.00 176.35 174.86 2vvm s THR 16 N 1.98 1.92 -0.08 3.68 -4.23 0.47 -5.00 115.64 114.38 2vvm s THR 16 Ca 0.38 -1.62 -0.01 0.00 -1.18 0.00 0.00 61.69 59.26 2vvm s THR 16 Cb -0.17 -1.72 -0.03 0.00 1.34 0.00 0.00 72.50 71.92 2vvm s THR 16 CO 0.13 0.00 -0.02 -1.58 -0.54 0.00 0.00 174.62 172.62 2vvm s GLN 17 N -1.94 2.95 0.00 3.99 0.74 -1.26 -1.25 119.66 122.88 2vvm s GLN 17 Ca 0.09 -0.44 0.00 0.00 0.05 0.00 0.00 55.36 55.06 2vvm s GLN 17 Cb -0.10 -2.75 0.00 0.00 1.10 0.00 0.00 33.01 31.26 2vvm s GLN 17 CO 0.05 0.68 0.00 0.41 -0.55 0.00 0.00 175.29 175.88 2vvm n GLY 18 N 2.20 -0.11 3.20 2.59 0.00 0.62 -4.97 105.19 108.71 2vvm n GLY 18 Ca -0.18 -1.15 -0.13 0.00 0.00 0.00 0.00 46.02 44.56 2vvm n GLY 18 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2vvm s VAL 19 N -0.15 0.93 0.63 1.61 -7.23 -0.97 -4.82 120.40 110.41 2vvm s VAL 19 Ca 0.00 -1.91 -0.18 0.00 -1.81 0.00 0.00 61.98 58.09 2vvm s VAL 19 Cb 0.00 -1.66 -0.02 0.00 0.56 0.00 0.00 36.38 35.26 2vvm s VAL 19 CO 0.00 -0.75 1.20 -2.16 -0.31 0.00 0.00 175.10 173.08 2vvm s PRO 20 N -3.54 2.76 -0.25 4.82 0.04 -1.26 -0.31 135.00 137.27 2vvm s PRO 20 Ca 0.12 1.77 -0.19 0.00 0.04 0.00 0.00 61.00 62.74 2vvm s PRO 20 Cb 0.02 -1.91 0.07 0.00 0.04 0.00 0.00 34.50 32.72 2vvm s PRO 20 CO -0.02 -1.36 0.63 0.45 0.04 0.00 0.00 177.00 176.75 2vvm s SER 21 N -1.79 -0.74 0.43 6.66 0.15 -0.13 -4.17 113.70 114.11 2vvm s SER 21 Ca 0.76 1.33 0.27 0.00 0.70 0.00 0.00 55.95 59.00 2vvm s SER 21 Cb -0.29 1.28 1.47 0.00 -1.71 0.00 0.00 66.02 66.77 2vvm s SER 21 CO 0.37 -0.23 1.82 -0.07 1.20 0.00 0.00 173.24 176.33 2vvm h LEU 22 N 5.91 0.00 -0.60 3.45 4.07 -1.84 -2.33 115.31 123.98 2vvm h LEU 22 Ca -0.30 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.66 2vvm h LEU 22 Cb 1.19 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.93 2vvm h LEU 22 CO 0.14 0.00 0.00 1.23 -1.08 0.00 0.00 178.44 178.73 2vvm h GLY 23 N 0.00 0.00 -4.70 0.83 0.00 -1.85 -3.45 103.07 93.91 2vvm h GLY 23 Ca 0.00 0.00 -0.54 0.00 0.00 0.00 0.00 47.33 46.79 2vvm h GLY 23 CO 0.00 0.00 0.77 0.14 0.00 0.00 0.00 176.54 177.45 2vvm s VAL 24 N -3.36 3.53 -0.23 4.60 1.01 -0.88 -1.03 120.40 124.04 2vvm s VAL 24 Ca 0.05 1.03 -0.09 0.00 0.00 0.00 0.00 61.98 62.97 2vvm s VAL 24 Cb 0.08 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.76 2vvm s VAL 24 CO 0.58 0.04 0.12 -0.63 0.00 0.00 0.00 175.10 175.20 2vvm s ILE 25 N 1.74 4.96 -0.05 2.22 -1.09 -1.09 -4.97 121.20 122.92 2vvm s ILE 25 Ca 0.64 0.04 0.01 0.00 -2.23 0.00 0.00 60.65 59.11 2vvm s ILE 25 Cb -0.34 -3.30 0.02 0.00 -1.58 0.00 0.00 42.46 37.26 2vvm s ILE 25 CO 0.29 0.36 -0.05 -0.55 -1.23 0.00 0.00 174.94 173.75 2vvm s SER 26 N 1.13 1.17 0.74 3.58 0.15 -1.26 -3.48 113.70 115.73 2vvm s SER 26 Ca 0.06 -0.16 -0.11 0.00 0.70 0.00 0.00 55.95 56.45 2vvm s SER 26 Cb -0.14 -0.52 0.04 0.00 -1.71 0.00 0.00 66.02 63.69 2vvm s SER 26 CO 0.04 -0.06 1.08 -2.16 1.20 0.00 0.00 173.24 173.35 2vvm s PRO 27 N 1.00 2.52 0.00 5.44 0.04 -1.26 -5.06 135.00 137.68 2vvm s PRO 27 Ca -0.10 1.09 0.13 0.00 0.04 0.00 0.00 61.00 62.16 2vvm s PRO 27 Cb -0.14 -1.93 0.56 0.00 0.04 0.00 0.00 34.50 33.03 2vvm s PRO 27 CO -0.00 -1.43 1.42 -0.35 0.04 0.00 0.00 177.00 176.67 2vvm n PRO 28 N -3.36 0.01 -3.76 0.56 -0.04 -1.23 -4.74 135.00 122.44 2vvm n PRO 28 Ca 0.08 0.27 -0.12 0.00 -0.04 0.00 0.00 63.50 63.70 2vvm n PRO 28 Cb 0.53 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.42 2vvm n PRO 28 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 2vvm s THR 29 N -2.98 0.08 -0.01 0.52 -1.32 -1.26 -0.58 115.64 110.08 2vvm s THR 29 Ca 0.07 -0.63 0.01 0.00 -1.21 0.00 0.00 61.69 59.92 2vvm s THR 29 Cb 0.09 -0.86 0.01 0.00 -1.51 0.00 0.00 72.50 70.23 2vvm s THR 29 CO 0.24 -0.35 0.95 -0.46 -2.21 0.00 0.00 174.62 172.79 2vvm n ASN 30 N 0.74 1.77 0.00 8.08 6.94 -1.10 -5.02 115.26 126.67 2vvm n ASN 30 Ca -0.19 -1.94 0.00 0.00 -0.02 0.00 0.00 54.58 52.43 2vvm n ASN 30 Cb 0.59 -0.02 0.00 0.00 -2.36 0.00 0.00 39.78 37.98 2vvm n ASN 30 CO 0.00 0.00 0.00 2.30 -1.03 0.00 0.00 177.26 178.53 2vvm n ILE 31 N -0.49 0.00 0.00 1.53 -5.35 -1.26 -4.91 119.36 108.88 2vvm n ILE 31 Ca 0.01 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.49 2vvm n ILE 31 Cb 0.30 -0.01 0.00 0.00 -1.74 0.00 0.00 39.64 38.20 2vvm n ILE 31 CO 0.00 0.00 0.00 0.79 -1.76 0.00 0.00 176.55 175.58 2vvm n TRP 40 N 0.00 0.00 -0.03 4.28 7.02 -1.25 -5.15 117.44 122.30 2vvm n TRP 40 Ca 0.00 0.00 -0.15 0.00 -1.02 0.00 0.00 57.50 56.33 2vvm n TRP 40 Cb 0.00 0.00 -0.09 0.00 -2.42 0.00 0.00 31.31 28.80 2vvm n TRP 40 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 2vvm h ASP 41 N 0.00 0.44 -3.91 -0.99 3.32 -1.52 -2.96 116.42 110.80 2vvm h ASP 41 Ca 0.00 -0.63 -0.23 0.00 0.02 0.00 0.00 57.03 56.18 2vvm h ASP 41 Cb 0.00 -0.13 -0.27 0.00 0.22 0.00 0.00 39.33 39.15 2vvm h ASP 41 CO 0.00 1.00 -0.72 -0.69 -1.72 0.00 0.00 179.24 177.11 2vvm s VAL 42 N -3.70 0.06 -0.19 -1.35 1.01 -0.96 -2.30 120.40 112.97 2vvm s VAL 42 Ca -0.14 -0.15 -0.05 0.00 0.00 0.00 0.00 61.98 61.64 2vvm s VAL 42 Cb 0.04 -0.08 -0.03 0.00 0.00 0.00 0.00 36.38 36.31 2vvm s VAL 42 CO 0.78 -0.05 0.01 -0.63 0.00 0.00 0.00 175.10 175.21 2vvm s ILE 43 N -0.20 4.16 -0.26 2.22 1.01 -0.66 -0.73 121.20 126.73 2vvm s ILE 43 Ca -0.02 -0.25 -0.08 0.00 0.00 0.00 0.00 60.65 60.30 2vvm s ILE 43 Cb -0.02 -2.87 -0.02 0.00 0.01 0.00 0.00 42.46 39.56 2vvm s ILE 43 CO -0.00 0.44 0.09 -0.69 0.00 0.00 0.00 174.94 174.78 2vvm s VAL 44 N 0.74 4.40 -0.37 2.92 1.01 0.58 -0.39 120.40 129.31 2vvm s VAL 44 Ca 0.01 -0.22 -0.18 0.00 0.00 0.00 0.00 61.98 61.59 2vvm s VAL 44 Cb -0.14 -3.10 0.00 0.00 0.00 0.00 0.00 36.38 33.14 2vvm s VAL 44 CO 0.02 0.28 0.50 -0.63 0.00 0.00 0.00 175.10 175.26 2vvm s ILE 45 N 1.62 5.03 0.00 2.22 1.01 0.26 -1.13 121.20 130.20 2vvm s ILE 45 Ca 0.06 0.19 0.00 0.00 0.00 0.00 0.00 60.65 60.90 2vvm s ILE 45 Cb -0.16 -3.98 0.00 0.00 0.01 0.00 0.00 42.46 38.33 2vvm s ILE 45 CO 0.04 -0.27 0.00 0.61 0.00 0.00 0.00 174.94 175.33 2vvm n GLY 46 N 4.88 2.51 1.74 6.18 0.00 0.02 -0.86 105.19 119.66 2vvm n GLY 46 Ca -0.05 -1.33 -0.18 0.00 0.00 0.00 0.00 46.02 44.46 2vvm n GLY 46 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vvm n GLY 47 N 1.86 5.53 1.31 -0.02 0.00 -1.26 -4.02 105.19 108.59 2vvm n GLY 47 Ca 0.00 -1.87 -0.10 0.00 0.00 0.00 0.00 46.02 44.05 2vvm n GLY 47 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vvm n GLY 48 N -0.97 -1.47 0.31 -0.02 0.00 -1.26 -0.32 105.19 101.47 2vvm n GLY 48 Ca 0.45 -1.65 0.10 0.00 0.00 0.00 0.00 46.02 44.91 2vvm n GLY 48 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2vvm h TYR 49 N -1.37 0.26 0.37 1.61 0.05 -1.94 0.17 116.97 116.12 2vvm h TYR 49 Ca -0.15 0.01 -0.02 0.00 0.05 0.00 0.00 58.73 58.62 2vvm h TYR 49 Cb 0.41 -0.09 0.00 0.00 1.01 0.00 0.00 36.73 38.07 2vvm h TYR 49 CO 0.00 0.15 -0.18 0.00 -1.05 0.00 0.00 178.16 177.08 2vvm h GLY 51 N -0.75 1.25 1.01 0.00 0.00 -1.62 -1.69 103.07 101.26 2vvm h GLY 51 Ca -0.05 -0.52 0.00 0.00 0.00 0.00 0.00 47.33 46.76 2vvm h GLY 51 CO 0.08 0.50 0.45 1.41 0.00 0.00 0.00 176.54 178.99 2vvm h LEU 52 N 1.18 0.85 -0.08 3.11 3.38 -0.97 0.16 115.31 122.94 2vvm h LEU 52 Ca 0.31 -0.05 -0.01 0.00 0.09 0.00 0.00 57.88 58.22 2vvm h LEU 52 Cb -0.05 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.49 2vvm h LEU 52 CO -0.06 0.64 0.01 0.74 0.09 0.00 0.00 178.44 179.86 2vvm h THR 53 N 0.98 1.21 -0.27 0.22 2.02 -1.00 -0.39 112.91 115.67 2vvm h THR 53 Ca 0.26 -0.66 0.00 0.00 0.77 0.00 0.00 66.41 66.79 2vvm h THR 53 Cb -0.07 1.51 -0.01 0.00 -1.74 0.00 0.00 68.15 67.83 2vvm h THR 53 CO -0.05 0.18 0.18 0.00 0.37 0.00 0.00 175.52 176.20 2vvm h ALA 54 N 0.78 0.35 -0.50 6.16 0.00 -1.21 -0.75 119.26 124.08 2vvm h ALA 54 Ca 0.02 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 2vvm h ALA 54 Cb 0.28 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2vvm h ALA 54 CO 0.00 -0.18 0.25 1.15 0.00 0.00 0.00 179.25 180.47 2vvm h THR 55 N 0.37 1.19 0.18 0.00 2.02 -0.94 -0.20 112.91 115.53 2vvm h THR 55 Ca 0.10 -0.52 -0.01 0.00 0.77 0.00 0.00 66.41 66.76 2vvm h THR 55 Cb -0.04 0.61 -0.00 0.00 -1.74 0.00 0.00 68.15 66.98 2vvm h THR 55 CO -0.02 0.21 -0.10 -0.09 0.37 0.00 0.00 175.52 175.88 2vvm h ARG 56 N 0.66 -0.26 -0.28 6.66 1.12 -0.87 -0.68 114.38 120.73 2vvm h ARG 56 Ca 0.17 0.02 0.02 0.00 -1.11 0.00 0.00 59.98 59.08 2vvm h ARG 56 Cb 0.10 0.06 -0.03 0.00 -0.01 0.00 0.00 29.97 30.09 2vvm h ARG 56 CO -0.02 -0.17 0.12 -0.44 -3.11 0.00 0.00 179.97 176.35 2vvm h ASP 57 N -0.27 0.17 -0.15 -3.80 5.19 -0.99 -1.83 116.42 114.73 2vvm h ASP 57 Ca -0.02 0.02 -0.02 0.00 -0.62 0.00 0.00 57.03 56.39 2vvm h ASP 57 Cb 0.22 -0.01 -0.01 0.00 0.18 0.00 0.00 39.33 39.72 2vvm h ASP 57 CO 0.02 0.13 0.01 -0.07 -3.12 0.00 0.00 179.24 176.21 2vvm h LEU 58 N 0.27 0.25 -0.65 1.55 3.38 -0.90 -1.33 115.31 117.88 2vvm h LEU 58 Ca 0.12 -0.30 -0.04 0.00 0.09 0.00 0.00 57.88 57.75 2vvm h LEU 58 Cb 0.06 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 40.71 2vvm h LEU 58 CO -0.10 0.49 0.25 0.71 0.09 0.00 0.00 178.44 179.88 2vvm h THR 59 N 0.01 1.24 -0.63 0.22 1.35 -1.13 -0.53 112.91 113.43 2vvm h THR 59 Ca 0.04 -0.75 -0.01 0.00 -0.55 0.00 0.00 66.41 65.14 2vvm h THR 59 Cb 0.36 0.52 -0.03 0.00 -1.73 0.00 0.00 68.15 67.26 2vvm h THR 59 CO 0.01 0.30 0.34 0.58 -0.25 0.00 0.00 175.52 176.49 2vvm h VAL 60 N 0.91 1.19 0.00 6.82 2.07 -1.25 -2.10 116.25 123.89 2vvm h VAL 60 Ca 0.22 -0.49 0.00 0.00 0.82 0.00 0.00 66.70 67.25 2vvm h VAL 60 Cb 0.21 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 30.33 2vvm h VAL 60 CO -0.02 0.22 0.00 0.00 0.02 0.00 0.00 177.57 177.79 2vvm n ALA 61 N -2.44 2.59 0.00 1.67 0.00 -0.51 -4.89 120.51 116.94 2vvm n ALA 61 Ca 0.06 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.32 2vvm n ALA 61 Cb 0.10 -1.49 0.00 0.00 0.00 0.00 0.00 19.45 18.06 2vvm n ALA 61 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2vvm n GLY 62 N 0.99 0.90 3.74 0.00 0.00 -0.79 -5.06 105.19 104.98 2vvm n GLY 62 Ca 0.21 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.84 2vvm n GLY 62 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2vvm s PHE 63 N -2.00 3.63 -0.26 1.61 0.08 -0.26 -4.99 117.98 115.79 2vvm s PHE 63 Ca 0.00 1.18 -0.29 0.00 0.12 0.00 0.00 56.93 57.94 2vvm s PHE 63 Cb 0.00 -2.66 -0.01 0.00 -0.57 0.00 0.00 43.02 39.77 2vvm s PHE 63 CO 0.00 0.25 1.47 0.21 -0.10 0.00 0.00 175.22 177.04 2vvm s LYS 64 N 0.22 3.84 -0.09 0.44 2.20 -1.26 -3.93 119.74 121.15 2vvm s LYS 64 Ca 0.32 1.44 0.03 0.00 -0.36 0.00 0.00 55.97 57.41 2vvm s LYS 64 Cb -0.18 -3.97 0.01 0.00 -1.51 0.00 0.00 37.83 32.18 2vvm s LYS 64 CO 0.17 -1.23 -0.19 0.99 -0.36 0.00 0.00 175.35 174.73 2vvm s THR 65 N 4.86 1.66 -0.28 3.43 2.01 -0.26 -1.27 115.64 125.78 2vvm s THR 65 Ca 0.64 -0.78 -0.08 0.00 0.31 0.00 0.00 61.69 61.79 2vvm s THR 65 Cb -0.21 -1.47 -0.01 0.00 0.01 0.00 0.00 72.50 70.83 2vvm s THR 65 CO 0.27 0.47 0.09 -0.22 -0.69 0.00 0.00 174.62 174.54 2vvm s LEU 66 N 0.57 3.72 -0.27 4.42 2.96 0.09 -0.40 118.68 129.76 2vvm s LEU 66 Ca -0.15 -0.47 -0.13 0.00 -0.22 0.00 0.00 54.13 53.16 2vvm s LEU 66 Cb -0.17 -1.92 -0.04 0.00 0.50 0.00 0.00 46.19 44.56 2vvm s LEU 66 CO 0.05 -0.13 0.28 -0.22 -1.32 0.00 0.00 176.35 175.01 2vvm s LEU 67 N 1.57 4.04 -0.19 -0.68 0.20 0.35 -0.30 118.68 123.66 2vvm s LEU 67 Ca 0.05 0.15 -0.04 0.00 0.69 0.00 0.00 54.13 54.97 2vvm s LEU 67 Cb -0.16 -2.27 -0.02 0.00 -0.43 0.00 0.00 46.19 43.31 2vvm s LEU 67 CO 0.03 -0.10 -0.03 -0.76 -0.29 0.00 0.00 176.35 175.20 2vvm s LEU 68 N 1.85 3.14 -0.04 -0.68 1.43 -0.29 -1.05 118.68 123.05 2vvm s LEU 68 Ca 0.11 -0.23 0.03 0.00 -1.03 0.00 0.00 54.13 53.01 2vvm s LEU 68 Cb -0.16 -1.78 0.01 0.00 0.03 0.00 0.00 46.19 44.29 2vvm s LEU 68 CO 0.10 0.08 -0.11 -0.70 0.23 0.00 0.00 176.35 175.96 2vvm s GLU 69 N 0.88 1.24 0.20 1.70 2.56 -0.21 -0.80 118.70 124.26 2vvm s GLU 69 Ca -0.00 -0.36 -0.06 0.00 0.00 0.00 0.00 54.97 54.56 2vvm s GLU 69 Cb -0.14 -1.11 0.13 0.00 2.00 0.00 0.00 34.13 35.01 2vvm s GLU 69 CO 0.02 0.10 1.59 0.00 -0.56 0.00 0.00 175.26 176.41 2vvm h ALA 70 N 6.57 0.81 -1.95 6.30 0.00 -1.86 0.14 119.26 129.26 2vvm h ALA 70 Ca -0.33 -0.39 -0.45 0.00 0.00 0.00 0.00 54.91 53.74 2vvm h ALA 70 Cb 1.17 -0.15 0.16 0.00 0.00 0.00 0.00 17.79 18.98 2vvm h ALA 70 CO 0.48 0.65 0.40 1.03 0.00 0.00 0.00 179.25 181.81 2vvm s ARG 71 N -4.55 0.66 0.00 0.00 0.52 -1.26 -3.53 118.95 110.78 2vvm s ARG 71 Ca -0.10 -0.48 0.15 0.00 -0.52 0.00 0.00 55.73 54.78 2vvm s ARG 71 Cb 0.13 -1.88 0.46 0.00 0.52 0.00 0.00 34.95 34.18 2vvm s ARG 71 CO 0.85 -2.38 1.36 -0.40 0.02 0.00 0.00 175.30 174.74 2vvm n ASP 72 N -3.72 1.99 -4.01 0.23 5.68 -1.26 -1.08 116.55 114.38 2vvm n ASP 72 Ca 0.15 -1.92 -0.10 0.00 -0.50 0.00 0.00 54.79 52.43 2vvm n ASP 72 Cb 0.59 -0.22 -0.08 0.00 -1.14 0.00 0.00 41.12 40.28 2vvm n ASP 72 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2vvm s ARG 73 N -1.57 1.09 0.56 0.11 1.70 -1.26 -2.67 118.95 116.92 2vvm s ARG 73 Ca 0.28 -1.25 0.03 0.00 -0.47 0.00 0.00 55.73 54.33 2vvm s ARG 73 Cb 0.15 0.34 0.06 0.00 -0.57 0.00 0.00 34.95 34.92 2vvm s ARG 73 CO 0.20 -0.38 0.78 0.96 -1.08 0.00 0.00 175.30 175.79 2vvm s ILE 74 N -3.99 2.55 0.00 4.99 -4.36 -0.20 -4.68 121.20 115.52 2vvm s ILE 74 Ca 0.19 -0.76 0.00 0.00 -0.26 0.00 0.00 60.65 59.82 2vvm s ILE 74 Cb 0.04 -2.79 0.00 0.00 1.25 0.00 0.00 42.46 40.96 2vvm s ILE 74 CO 0.01 0.00 0.00 0.61 0.24 0.00 0.00 174.94 175.80 2vvm n GLY 75 N -2.34 2.44 7.00 6.27 0.00 0.56 -4.79 105.19 114.32 2vvm n GLY 75 Ca 0.10 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2vvm n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vvm n GLY 76 N 0.00 3.52 0.00 -0.02 0.00 -1.26 -1.69 105.19 105.75 2vvm n GLY 76 Ca 0.00 0.21 0.04 0.00 0.00 0.00 0.00 46.02 46.28 2vvm n GLY 76 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vvm n ARG 77 N 10.11 0.95 -3.73 1.61 1.74 -1.26 -4.59 116.66 121.49 2vvm n ARG 77 Ca 0.00 0.00 -0.21 0.00 -0.77 0.00 0.00 57.85 56.87 2vvm n ARG 77 Cb 0.00 -1.14 -0.18 0.00 -1.02 0.00 0.00 32.46 30.12 2vvm n ARG 77 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 2vvm s SER 78 N -1.32 1.34 -0.05 0.55 0.15 -0.68 -0.93 113.70 112.76 2vvm s SER 78 Ca 0.13 -0.01 -0.29 0.00 0.70 0.00 0.00 55.95 56.48 2vvm s SER 78 Cb 0.06 -0.29 0.09 0.00 -1.71 0.00 0.00 66.02 64.17 2vvm s SER 78 CO 0.10 -0.22 0.80 -1.66 1.20 0.00 0.00 173.24 173.47 2vvm s TRP 79 N 2.03 -0.50 0.12 3.44 1.48 -1.26 -4.39 118.94 119.86 2vvm s TRP 79 Ca 0.05 0.73 0.11 0.00 -1.06 0.00 0.00 56.10 55.92 2vvm s TRP 79 Cb -0.12 0.46 -0.04 0.00 -1.16 0.00 0.00 33.47 32.61 2vvm s TRP 79 CO -0.04 -0.55 -0.26 -1.54 -4.06 0.00 0.00 176.95 170.50 2vvm s SER 80 N -1.57 3.22 -0.15 -2.66 1.04 -1.26 -0.68 113.70 111.64 2vvm s SER 80 Ca -0.04 -0.73 0.01 0.00 0.48 0.00 0.00 55.95 55.66 2vvm s SER 80 Cb -0.00 -0.21 0.02 0.00 0.10 0.00 0.00 66.02 65.92 2vvm s SER 80 CO 0.01 0.17 -0.16 -0.55 0.98 0.00 0.00 173.24 173.69 2vvm s SER 81 N -2.00 2.76 -0.34 7.02 0.15 -0.10 -4.29 113.70 116.90 2vvm s SER 81 Ca 0.13 -0.51 -0.23 0.00 0.70 0.00 0.00 55.95 56.03 2vvm s SER 81 Cb -0.10 -1.24 0.00 0.00 -1.71 0.00 0.00 66.02 62.98 2vvm s SER 81 CO 0.06 -0.02 0.78 0.20 1.20 0.00 0.00 173.24 175.45 2vvm s ASN 82 N 1.32 6.60 -0.08 5.45 0.01 -1.26 -0.44 114.94 126.54 2vvm s ASN 82 Ca 0.02 0.49 -0.00 0.00 -0.71 0.00 0.00 52.86 52.66 2vvm s ASN 82 Cb -0.13 -2.40 0.02 0.00 0.41 0.00 0.00 41.25 39.15 2vvm s ASN 82 CO -0.09 -0.67 -0.06 -0.63 -1.51 0.00 0.00 177.10 174.14 2vvm s ILE 83 N 3.02 0.78 -1.66 0.60 1.01 -0.59 -4.77 121.20 119.59 2vvm s ILE 83 Ca 0.32 -0.17 -0.14 0.00 0.00 0.00 0.00 60.65 60.65 2vvm s ILE 83 Cb -0.14 -0.82 0.13 0.00 0.01 0.00 0.00 42.46 41.64 2vvm s ILE 83 CO 0.15 0.31 0.64 0.47 0.00 0.00 0.00 174.94 176.51 2vvm n ASP 84 N 4.70 -2.24 0.00 3.58 8.00 -1.26 -2.10 116.55 127.23 2vvm n ASP 84 Ca -0.14 -1.06 0.00 0.00 0.71 0.00 0.00 54.79 54.30 2vvm n ASP 84 Cb 0.50 -2.58 0.00 0.00 -0.02 0.00 0.00 41.12 39.02 2vvm n ASP 84 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2vvm n GLY 85 N -1.56 0.56 3.06 0.44 0.00 -1.26 -4.51 105.19 101.92 2vvm n GLY 85 Ca -0.02 -0.18 -0.25 0.00 0.00 0.00 0.00 46.02 45.57 2vvm n GLY 85 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2vvm s TYR 86 N -2.00 1.53 -0.23 1.61 5.04 -0.89 -4.75 117.35 117.67 2vvm s TYR 86 Ca 0.00 -0.53 -0.25 0.00 -2.44 0.00 0.00 57.07 53.85 2vvm s TYR 86 Cb 0.00 -1.09 -0.00 0.00 0.35 0.00 0.00 41.96 41.21 2vvm s TYR 86 CO 0.00 -0.24 0.85 -1.25 -1.34 0.00 0.00 175.55 173.57 2vvm s PRO 87 N 0.46 4.21 -0.27 4.97 0.04 -1.26 -1.54 135.00 141.60 2vvm s PRO 87 Ca -0.11 1.00 -0.14 0.00 0.04 0.00 0.00 61.00 61.79 2vvm s PRO 87 Cb -0.14 -3.63 -0.04 0.00 0.04 0.00 0.00 34.50 30.72 2vvm s PRO 87 CO 0.03 -0.50 0.33 0.71 0.04 0.00 0.00 177.00 177.61 2vvm s TYR 88 N 2.78 3.24 -0.56 0.56 2.02 0.42 -4.89 117.35 120.92 2vvm s TYR 88 Ca 0.36 0.35 -0.22 0.00 -0.37 0.00 0.00 57.07 57.19 2vvm s TYR 88 Cb -0.15 -2.53 0.05 0.00 -0.40 0.00 0.00 41.96 38.93 2vvm s TYR 88 CO 0.08 -0.21 0.85 -1.21 -1.57 0.00 0.00 175.55 173.49 2vvm s GLU 89 N 1.99 3.23 0.30 -0.62 0.41 -1.26 -0.92 118.70 121.82 2vvm s GLU 89 Ca 0.13 -0.57 0.11 0.00 -0.41 0.00 0.00 54.97 54.24 2vvm s GLU 89 Cb -0.16 -4.10 0.47 0.00 -1.78 0.00 0.00 34.13 28.56 2vvm s GLU 89 CO 0.10 -1.48 1.68 0.52 -0.49 0.00 0.00 175.26 175.59 2vvm h MET 90 N 9.27 0.00 0.00 1.61 2.86 -1.28 -3.46 114.93 123.93 2vvm h MET 90 Ca -0.27 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.37 2vvm h MET 90 Cb 1.08 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.74 2vvm h MET 90 CO 1.07 0.54 0.00 0.41 1.06 0.00 0.00 176.91 179.99 2vvm n GLY 91 N 0.03 4.29 3.62 8.32 0.00 -1.25 -4.45 105.19 115.76 2vvm n GLY 91 Ca -0.01 -0.55 -0.50 0.00 0.00 0.00 0.00 46.02 44.96 2vvm n GLY 91 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vvm n GLY 92 N 0.81 0.69 1.38 -0.02 0.00 -0.11 -4.85 105.19 103.08 2vvm n GLY 92 Ca 0.00 0.67 0.00 0.00 0.00 0.00 0.00 46.02 46.69 2vvm n GLY 92 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2vvm n THR 93 N 2.77 0.75 -3.48 2.61 -1.04 -1.26 -4.46 114.28 110.16 2vvm n THR 93 Ca 0.18 0.25 -0.34 0.00 -2.04 0.00 0.00 64.05 62.09 2vvm n THR 93 Cb 0.23 -1.21 -0.05 0.00 -1.82 0.00 0.00 70.33 67.48 2vvm n THR 93 CO 0.00 0.00 0.00 0.26 -0.64 0.00 0.00 175.07 174.69 2vvm s TRP 94 N -2.00 3.55 0.16 -1.42 0.51 -1.26 -4.53 118.94 113.95 2vvm s TRP 94 Ca 0.00 0.87 -0.02 0.00 -2.12 0.00 0.00 56.10 54.84 2vvm s TRP 94 Cb 0.00 -2.23 -0.04 0.00 -0.81 0.00 0.00 33.47 30.39 2vvm s TRP 94 CO 0.00 0.43 0.10 0.14 -0.51 0.00 0.00 176.95 177.11 2vvm s VAL 95 N -1.52 0.06 0.05 4.03 -7.23 -0.55 -4.91 120.40 110.32 2vvm s VAL 95 Ca 0.38 -1.91 -0.25 0.00 -1.81 0.00 0.00 61.98 58.38 2vvm s VAL 95 Cb -0.14 -2.20 0.06 0.00 0.56 0.00 0.00 36.38 34.67 2vvm s VAL 95 CO 0.20 -0.29 0.60 -2.28 -0.31 0.00 0.00 175.10 173.02 2vvm s HIS 96 N -4.08 -0.54 -1.18 2.82 2.46 -1.26 -4.16 115.29 109.35 2vvm s HIS 96 Ca 0.29 0.64 0.16 0.00 0.47 0.00 0.00 55.06 56.62 2vvm s HIS 96 Cb 0.07 0.43 0.73 0.00 -0.13 0.00 0.00 32.58 33.68 2vvm s HIS 96 CO 0.05 -0.70 1.48 -2.67 -2.47 0.00 0.00 174.74 170.44 2vvm n TRP 97 N 0.32 0.00 1.66 3.88 2.14 -1.26 -1.51 117.44 122.67 2vvm n TRP 97 Ca -0.18 0.00 0.09 0.00 2.07 0.00 0.00 57.50 59.48 2vvm n TRP 97 Cb 0.61 -0.41 0.45 0.00 -0.81 0.00 0.00 31.31 31.15 2vvm n TRP 97 CO 0.00 0.00 0.00 0.72 2.07 0.00 0.00 177.69 180.48 2vvm n HIS 98 N -1.41 0.10 -3.68 -2.67 8.25 -1.26 -4.60 115.22 109.95 2vvm n HIS 98 Ca 0.05 -0.05 -0.38 0.00 -0.26 0.00 0.00 57.72 57.08 2vvm n HIS 98 Cb 0.16 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.17 2vvm n HIS 98 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 2vvm s GLN 99 N -1.90 2.25 0.14 -0.41 -0.21 -0.57 -5.00 119.66 113.96 2vvm s GLN 99 Ca 0.28 -1.74 -0.18 0.00 0.02 0.00 0.00 55.36 53.74 2vvm s GLN 99 Cb 0.14 -3.71 0.02 0.00 1.00 0.00 0.00 33.01 30.46 2vvm s GLN 99 CO 0.22 -1.09 1.71 1.03 -2.12 0.00 0.00 175.29 175.05 2vvm h SER 100 N 8.23 -0.11 0.03 5.90 0.87 -1.84 -1.09 113.55 125.54 2vvm h SER 100 Ca -0.17 0.06 -0.09 0.00 -1.23 0.00 0.00 61.79 60.36 2vvm h SER 100 Cb 1.06 0.11 0.01 0.00 -0.44 0.00 0.00 62.40 63.14 2vvm h SER 100 CO 0.76 -0.02 -0.36 0.45 -0.53 0.00 0.00 176.83 177.13 2vvm h HIS 101 N 0.09 0.31 -0.68 2.24 3.86 -1.95 -1.56 115.15 117.46 2vvm h HIS 101 Ca 0.13 -0.19 -0.07 0.00 -1.16 0.00 0.00 60.37 59.08 2vvm h HIS 101 Cb 0.18 -0.03 -0.03 0.00 1.06 0.00 0.00 27.41 28.59 2vvm h HIS 101 CO -0.21 1.05 0.13 -0.24 0.86 0.00 0.00 177.93 179.52 2vvm h VAL 102 N -0.53 1.26 -0.41 2.45 3.04 -1.79 -2.75 116.25 117.53 2vvm h VAL 102 Ca -0.05 -1.01 -0.09 0.00 -1.01 0.00 0.00 66.70 64.54 2vvm h VAL 102 Cb 1.18 0.60 -0.02 0.00 -2.01 0.00 0.00 31.29 31.04 2vvm h VAL 102 CO 0.07 0.38 -0.11 -0.25 -1.01 0.00 0.00 177.57 176.66 2vvm h TRP 103 N 1.04 0.78 -0.61 3.17 2.91 -1.21 -0.74 115.95 121.29 2vvm h TRP 103 Ca 0.21 -0.14 0.01 0.00 1.13 0.00 0.00 58.89 60.10 2vvm h TRP 103 Cb 0.41 -0.20 -0.03 0.00 -0.51 0.00 0.00 29.16 28.83 2vvm h TRP 103 CO 0.03 0.79 0.40 -0.09 -1.03 0.00 0.00 178.44 178.54 2vvm h ARG 104 N 0.65 0.80 -0.23 2.65 1.12 -1.13 -0.53 114.38 117.72 2vvm h ARG 104 Ca 0.11 -0.05 -0.04 0.00 -1.11 0.00 0.00 59.98 58.90 2vvm h ARG 104 Cb 0.56 -0.18 -0.01 0.00 -0.01 0.00 0.00 29.97 30.33 2vvm h ARG 104 CO 0.03 0.53 -0.02 0.93 -3.11 0.00 0.00 179.97 178.33 2vvm h GLU 105 N 0.82 0.41 -0.50 0.20 4.39 -1.20 -1.56 114.58 117.14 2vvm h GLU 105 Ca 0.22 -0.14 0.08 0.00 0.34 0.00 0.00 59.36 59.87 2vvm h GLU 105 Cb -0.09 -0.03 -0.07 0.00 -0.10 0.00 0.00 28.75 28.46 2vvm h GLU 105 CO -0.05 0.61 0.12 0.82 -1.16 0.00 0.00 179.01 179.35 2vvm h ILE 106 N 0.16 0.75 -0.27 3.13 2.04 -0.88 0.72 117.51 123.16 2vvm h ILE 106 Ca 0.06 -0.09 -0.08 0.00 1.00 0.00 0.00 64.86 65.75 2vvm h ILE 106 Cb 0.44 0.46 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 2vvm h ILE 106 CO 0.02 0.05 -0.14 0.74 0.00 0.00 0.00 178.15 178.81 2vvm h THR 107 N 0.27 1.30 -0.59 -0.27 2.02 -1.07 0.15 112.91 114.71 2vvm h THR 107 Ca 0.25 -1.23 -0.06 0.00 0.77 0.00 0.00 66.41 66.13 2vvm h THR 107 Cb 0.32 1.52 -0.03 0.00 -1.74 0.00 0.00 68.15 68.23 2vvm h THR 107 CO -0.31 0.39 0.11 -0.09 0.37 0.00 0.00 175.52 175.99 2vvm h ARG 108 N 0.31 0.94 -0.06 6.66 2.43 -1.05 -0.94 114.38 122.68 2vvm h ARG 108 Ca 0.06 -0.22 0.00 0.00 -0.81 0.00 0.00 59.98 59.01 2vvm h ARG 108 Cb 0.65 -0.13 0.00 0.00 -0.42 0.00 0.00 29.97 30.08 2vvm h ARG 108 CO 0.04 0.86 0.00 0.66 -1.51 0.00 0.00 179.97 180.02 2vvm n TYR 109 N -4.24 0.07 -3.78 2.20 4.01 0.22 -4.93 117.16 110.71 2vvm n TYR 109 Ca 0.04 -0.04 -0.26 0.00 -0.16 0.00 0.00 57.90 57.48 2vvm n TYR 109 Cb 0.26 0.00 0.04 0.00 -0.31 0.00 0.00 39.34 39.33 2vvm n TYR 109 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2vvm n LYS 110 N -0.43 -5.85 -0.19 -0.72 5.02 -0.36 -4.90 118.16 110.73 2vvm n LYS 110 Ca 0.11 0.66 0.06 0.00 -2.02 0.00 0.00 58.31 57.12 2vvm n LYS 110 Cb 0.12 -5.50 0.17 0.00 -0.02 0.00 0.00 35.03 29.80 2vvm n LYS 110 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 2vvm n MET 111 N -4.61 2.87 0.28 1.97 2.81 0.45 -4.61 117.12 116.28 2vvm n MET 111 Ca -0.07 -2.10 0.11 0.00 -1.81 0.00 0.00 57.70 53.83 2vvm n MET 111 Cb 0.58 -1.30 0.77 0.00 -0.71 0.00 0.00 33.22 32.56 2vvm n MET 111 CO 0.00 0.00 0.00 1.12 1.51 0.00 0.00 175.97 178.60 2vvm h HIS 112 N 2.16 0.00 -0.34 2.03 2.07 -1.88 -0.08 115.15 119.11 2vvm h HIS 112 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 2vvm h HIS 112 Cb 0.76 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.74 2vvm h HIS 112 CO 0.25 0.01 0.00 0.27 -3.07 0.00 0.00 177.93 175.39 2vvm n ASN 113 N -4.19 2.39 -1.63 3.10 6.94 -1.26 -4.43 115.26 116.18 2vvm n ASN 113 Ca -0.03 -1.89 -0.15 0.00 -0.02 0.00 0.00 54.58 52.49 2vvm n ASN 113 Cb 0.10 -0.22 0.15 0.00 -2.36 0.00 0.00 39.78 37.44 2vvm n ASN 113 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2vvm n ALA 114 N 0.80 4.94 -2.72 -2.53 0.00 -0.04 -5.01 120.51 115.95 2vvm n ALA 114 Ca 0.17 -3.30 -0.25 0.00 0.00 0.00 0.00 53.44 50.06 2vvm n ALA 114 Cb 0.42 -0.91 -0.06 0.00 0.00 0.00 0.00 19.45 18.89 2vvm n ALA 114 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2vvm s LEU 115 N -3.42 3.49 0.00 0.00 1.43 -1.26 -0.63 118.68 118.29 2vvm s LEU 115 Ca 0.50 -0.37 0.06 0.00 -1.03 0.00 0.00 54.13 53.29 2vvm s LEU 115 Cb 0.43 -2.08 -0.02 0.00 0.03 0.00 0.00 46.19 44.56 2vvm s LEU 115 CO 0.01 0.04 -0.17 -0.44 0.23 0.00 0.00 176.35 176.02 2vvm s SER 116 N -3.34 2.06 0.01 2.29 0.01 0.56 -4.71 113.70 110.57 2vvm s SER 116 Ca 0.30 -0.36 -0.28 0.00 1.31 0.00 0.00 55.95 56.92 2vvm s SER 116 Cb -0.08 -0.21 -0.04 0.00 0.21 0.00 0.00 66.02 65.90 2vvm s SER 116 CO 0.21 0.18 0.88 -2.16 0.41 0.00 0.00 173.24 172.76 2vvm s PRO 117 N -0.62 4.54 0.15 12.44 0.04 -1.26 -1.72 135.00 148.57 2vvm s PRO 117 Ca 0.06 1.24 -0.12 0.00 0.04 0.00 0.00 61.00 62.22 2vvm s PRO 117 Cb -0.07 -3.43 0.02 0.00 0.04 0.00 0.00 34.50 31.05 2vvm s PRO 117 CO -0.00 0.06 1.60 0.77 0.04 0.00 0.00 177.00 179.47 2vvm h SER 118 N 6.46 0.86 -3.39 6.66 0.02 -1.06 -3.44 113.55 119.66 2vvm h SER 118 Ca -0.42 -0.31 -0.55 0.00 -0.84 0.00 0.00 61.79 59.67 2vvm h SER 118 Cb 1.21 -0.23 -0.04 0.00 0.14 0.00 0.00 62.40 63.48 2vvm h SER 118 CO 0.74 0.96 0.13 -0.36 -1.14 0.00 0.00 176.83 177.16 2vvm s PHE 119 N -4.99 3.67 -0.26 3.45 0.08 -1.26 -4.26 117.98 114.40 2vvm s PHE 119 Ca -0.12 1.37 -0.02 0.00 0.12 0.00 0.00 56.93 58.28 2vvm s PHE 119 Cb 0.12 -2.81 0.12 0.00 -0.57 0.00 0.00 43.02 39.88 2vvm s PHE 119 CO 0.82 0.20 0.29 1.21 -0.10 0.00 0.00 175.22 177.64 2vvm s ASN 120 N 0.31 1.42 -0.29 1.36 3.84 -1.26 -5.02 114.94 115.30 2vvm s ASN 120 Ca 0.38 -0.50 0.11 0.00 0.21 0.00 0.00 52.86 53.07 2vvm s ASN 120 Cb -0.19 0.55 0.75 0.00 -0.55 0.00 0.00 41.25 41.81 2vvm s ASN 120 CO 0.21 -0.36 1.76 0.49 -2.79 0.00 0.00 177.10 176.41 2vvm n PHE 121 N 5.32 2.23 0.25 0.43 3.72 -1.26 -3.93 117.46 124.22 2vvm n PHE 121 Ca -0.03 -1.06 0.14 0.00 -0.05 0.00 0.00 57.45 56.45 2vvm n PHE 121 Cb 0.48 -0.61 0.49 0.00 -0.94 0.00 0.00 39.48 38.90 2vvm n PHE 121 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2vvm h SER 122 N 2.95 0.00 -5.11 4.37 4.64 -1.97 -3.47 113.55 114.96 2vvm h SER 122 Ca 0.17 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.48 2vvm h SER 122 Cb 2.17 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 64.17 2vvm h SER 122 CO 0.63 0.05 0.03 0.00 -0.87 0.00 0.00 176.83 176.67 2vvm s ARG 123 N -3.52 1.52 0.56 4.77 1.70 -1.26 -5.15 118.95 117.57 2vvm s ARG 123 Ca 0.03 -1.01 0.00 0.00 -0.47 0.00 0.00 55.73 54.28 2vvm s ARG 123 Cb 0.08 0.53 0.00 0.00 -0.57 0.00 0.00 34.95 34.99 2vvm s ARG 123 CO 0.60 -0.65 0.00 0.41 -1.08 0.00 0.00 175.30 174.57 2vvm n GLY 124 N -0.38 -1.65 0.24 3.88 0.00 -1.26 -4.19 105.19 101.83 2vvm n GLY 124 Ca -0.06 -1.80 0.06 0.00 0.00 0.00 0.00 46.02 44.21 2vvm n GLY 124 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2vvm h VAL 125 N 0.00 1.10 -6.56 1.61 -1.51 -1.21 -3.47 116.25 106.20 2vvm h VAL 125 Ca 0.00 -0.44 -0.51 0.00 -1.23 0.00 0.00 66.70 64.52 2vvm h VAL 125 Cb 0.00 1.17 -0.07 0.00 -2.13 0.00 0.00 31.29 30.25 2vvm h VAL 125 CO 0.00 0.13 -0.90 -3.20 -1.23 0.00 0.00 177.57 172.37 2vvm n ASN 126 N -4.39 -0.17 -3.94 4.19 5.15 -1.22 -4.96 115.26 109.92 2vvm n ASN 126 Ca -0.02 -1.04 -0.08 0.00 -0.60 0.00 0.00 54.58 52.84 2vvm n ASN 126 Cb 0.19 -2.89 -0.08 0.00 -0.53 0.00 0.00 39.78 36.47 2vvm n ASN 126 CO 0.00 0.00 0.00 -1.38 1.40 0.00 0.00 177.26 177.28 2vvm s HIS 127 N -4.01 0.30 -0.21 1.20 -3.43 -1.19 -4.47 115.29 103.47 2vvm s HIS 127 Ca 0.01 -0.76 -0.09 0.00 -0.80 0.00 0.00 55.06 53.42 2vvm s HIS 127 Cb -0.00 -0.16 -0.05 0.00 -1.43 0.00 0.00 32.58 30.94 2vvm s HIS 127 CO 0.90 -0.52 0.11 0.12 -2.00 0.00 0.00 174.74 173.36 2vvm s PHE 128 N -3.89 3.29 -0.36 0.38 5.36 0.18 -2.24 117.98 120.70 2vvm s PHE 128 Ca 0.08 0.14 -0.08 0.00 -0.96 0.00 0.00 56.93 56.11 2vvm s PHE 128 Cb 0.06 -2.19 0.04 0.00 -0.34 0.00 0.00 43.02 40.59 2vvm s PHE 128 CO -0.09 0.10 0.15 -1.14 -1.46 0.00 0.00 175.22 172.77 2vvm s GLN 129 N 0.76 2.65 -0.24 10.12 0.74 -0.04 -1.25 119.66 132.40 2vvm s GLN 129 Ca 0.06 -1.20 -0.09 0.00 0.05 0.00 0.00 55.36 54.18 2vvm s GLN 129 Cb -0.13 -3.56 -0.04 0.00 1.10 0.00 0.00 33.01 30.39 2vvm s GLN 129 CO 0.02 -0.71 0.11 -1.17 -0.55 0.00 0.00 175.29 172.99 2vvm s LEU 130 N 1.43 3.76 -0.19 3.68 2.96 0.13 -1.83 118.68 128.60 2vvm s LEU 130 Ca -0.00 -0.05 0.01 0.00 -0.22 0.00 0.00 54.13 53.87 2vvm s LEU 130 Cb -0.20 -2.00 0.03 0.00 0.50 0.00 0.00 46.19 44.51 2vvm s LEU 130 CO 0.03 0.02 -0.18 -0.13 -1.32 0.00 0.00 176.35 174.78 2vvm s ARG 131 N 1.29 2.86 0.00 1.98 0.52 0.38 -0.01 118.95 125.96 2vvm s ARG 131 Ca 0.06 -0.92 0.12 0.00 -0.52 0.00 0.00 55.73 54.46 2vvm s ARG 131 Cb -0.15 -2.63 -0.06 0.00 0.52 0.00 0.00 34.95 32.64 2vvm s ARG 131 CO 0.05 -0.27 0.60 0.25 0.02 0.00 0.00 175.30 175.94 2vvm n THR 132 N 4.59 0.00 -3.83 0.02 -2.24 -1.26 -1.23 114.28 110.33 2vvm n THR 132 Ca -0.20 -0.31 -0.09 0.00 -2.27 0.00 0.00 64.05 61.17 2vvm n THR 132 Cb 0.49 1.08 -0.06 0.00 -2.10 0.00 0.00 70.33 69.73 2vvm n THR 132 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2vvm s ASN 133 N -1.76 -0.04 0.24 3.42 2.20 -1.26 -4.46 114.94 113.29 2vvm s ASN 133 Ca 0.07 -0.63 0.21 0.00 -0.94 0.00 0.00 52.86 51.57 2vvm s ASN 133 Cb 0.09 0.44 0.96 0.00 -2.00 0.00 0.00 41.25 40.73 2vvm s ASN 133 CO 0.37 -0.86 1.63 -2.65 -2.94 0.00 0.00 177.10 172.65 2vvm n PRO 134 N -0.19 0.15 0.00 3.55 -0.02 -1.26 -3.29 135.00 133.94 2vvm n PRO 134 Ca -0.12 0.49 0.07 0.00 -2.02 0.00 0.00 63.50 61.92 2vvm n PRO 134 Cb 0.63 -1.85 -0.06 0.00 -0.02 0.00 0.00 33.50 32.20 2vvm n PRO 134 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2vvm n THR 135 N -2.14 0.00 -4.32 3.45 -2.24 -1.26 -5.02 114.28 102.74 2vvm n THR 135 Ca 0.01 -0.20 -0.17 0.00 -2.27 0.00 0.00 64.05 61.42 2vvm n THR 135 Cb 0.14 1.04 -0.10 0.00 -2.10 0.00 0.00 70.33 69.31 2vvm n THR 135 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2vvm s THR 136 N -2.22 0.54 -0.00 4.28 -4.23 -1.21 -5.17 115.64 107.64 2vvm s THR 136 Ca 0.07 -2.00 -0.04 0.00 -1.18 0.00 0.00 61.69 58.54 2vvm s THR 136 Cb 0.11 -2.62 -0.00 0.00 1.34 0.00 0.00 72.50 71.32 2vvm s THR 136 CO 0.54 0.00 0.08 -0.44 -0.54 0.00 0.00 174.62 174.25 2vvm s SER 137 N -3.33 0.06 -0.16 3.99 0.01 -1.26 -4.58 113.70 108.44 2vvm s SER 137 Ca 0.37 -0.21 -0.01 0.00 1.31 0.00 0.00 55.95 57.41 2vvm s SER 137 Cb 0.07 0.17 -0.01 0.00 0.21 0.00 0.00 66.02 66.46 2vvm s SER 137 CO 0.14 -0.27 -0.10 -0.89 0.41 0.00 0.00 173.24 172.52 2vvm s THR 138 N -1.09 3.18 -0.09 1.44 2.01 0.98 -4.98 115.64 117.10 2vvm s THR 138 Ca -0.12 -0.60 -0.01 0.00 0.31 0.00 0.00 61.69 61.27 2vvm s THR 138 Cb -0.07 -2.37 -0.03 0.00 0.01 0.00 0.00 72.50 70.04 2vvm s THR 138 CO 0.00 0.50 -0.02 -0.31 -0.69 0.00 0.00 174.62 174.10 2vvm s TYR 139 N 0.65 3.08 0.16 4.92 2.02 -1.26 0.17 117.35 127.09 2vvm s TYR 139 Ca -0.06 0.10 -0.07 0.00 -0.37 0.00 0.00 57.07 56.67 2vvm s TYR 139 Cb -0.15 -1.78 -0.01 0.00 -0.40 0.00 0.00 41.96 39.61 2vvm s TYR 139 CO 0.02 0.38 0.25 0.00 -1.57 0.00 0.00 175.55 174.64 2vvm s MET 140 N -0.75 1.14 0.87 -0.62 0.23 -0.38 -4.99 119.30 114.80 2vvm s MET 140 Ca 0.12 -1.24 -0.11 0.00 -1.03 0.00 0.00 55.69 53.43 2vvm s MET 140 Cb -0.11 0.35 0.12 0.00 -1.53 0.00 0.00 34.83 33.66 2vvm s MET 140 CO 0.02 -0.40 1.10 0.95 -2.03 0.00 0.00 175.02 174.65 2vvm s THR 141 N -3.99 2.76 0.33 3.16 -4.23 -1.26 -0.65 115.64 111.76 2vvm s THR 141 Ca 0.19 0.25 0.19 0.00 -1.18 0.00 0.00 61.69 61.14 2vvm s THR 141 Cb 0.04 -2.62 0.18 0.00 1.34 0.00 0.00 72.50 71.43 2vvm s THR 141 CO 0.01 -0.32 1.89 0.45 -0.54 0.00 0.00 174.62 176.11 2vvm h HIS 142 N -1.53 0.00 -0.35 3.99 3.86 -1.92 -1.05 115.15 118.16 2vvm h HIS 142 Ca -0.47 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 58.72 2vvm h HIS 142 Cb 1.27 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 29.72 2vvm h HIS 142 CO 0.48 0.28 0.14 1.49 0.86 0.00 0.00 177.93 181.18 2vvm h GLU 143 N 0.00 0.52 -0.62 2.45 4.81 -1.97 -0.12 114.58 119.66 2vvm h GLU 143 Ca -0.00 -0.09 -0.08 0.00 -0.13 0.00 0.00 59.36 59.06 2vvm h GLU 143 Cb 0.60 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 29.87 2vvm h GLU 143 CO 0.04 0.50 0.07 0.00 -0.73 0.00 0.00 179.01 178.89 2vvm h ALA 144 N 0.99 0.96 0.05 2.92 0.00 -1.81 -1.52 119.26 120.84 2vvm h ALA 144 Ca 0.12 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.77 2vvm h ALA 144 Cb 0.18 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 2vvm h ALA 144 CO -0.01 0.64 -0.12 1.49 0.00 0.00 0.00 179.25 181.25 2vvm h GLU 145 N 0.96 -0.22 -0.55 0.00 4.81 -1.06 -0.04 114.58 118.48 2vvm h GLU 145 Ca 0.19 0.02 0.09 0.00 -0.13 0.00 0.00 59.36 59.52 2vvm h GLU 145 Cb 0.45 0.05 -0.07 0.00 0.63 0.00 0.00 28.75 29.81 2vvm h GLU 145 CO 0.02 -0.15 0.13 -0.44 -0.73 0.00 0.00 179.01 177.84 2vvm h ASP 146 N -0.23 0.05 -0.61 1.04 3.32 -0.78 -1.14 116.42 118.07 2vvm h ASP 146 Ca 0.03 0.09 -0.05 0.00 0.02 0.00 0.00 57.03 57.12 2vvm h ASP 146 Cb 0.26 0.11 -0.03 0.00 0.22 0.00 0.00 39.33 39.90 2vvm h ASP 146 CO -0.09 0.05 0.19 -0.08 -1.72 0.00 0.00 179.24 177.59 2vvm h GLU 147 N 0.28 0.95 0.16 3.56 4.57 -0.97 -0.44 114.58 122.69 2vvm h GLU 147 Ca 0.28 -0.21 -0.01 0.00 -1.18 0.00 0.00 59.36 58.24 2vvm h GLU 147 Cb 0.38 -0.14 0.00 0.00 -0.16 0.00 0.00 28.75 28.83 2vvm h GLU 147 CO -0.34 0.85 -0.08 1.25 -1.18 0.00 0.00 179.01 179.51 2vvm h LEU 148 N 0.87 -0.19 -0.84 1.64 5.85 -0.52 -0.61 115.31 121.52 2vvm h LEU 148 Ca 0.20 -0.06 -0.05 0.00 0.84 0.00 0.00 57.88 58.81 2vvm h LEU 148 Cb 0.29 0.05 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 2vvm h LEU 148 CO -0.01 -0.06 0.28 -0.07 -0.34 0.00 0.00 178.44 178.24 2vvm h LEU 149 N -0.30 1.05 -0.22 2.25 -0.00 -1.18 -1.86 115.31 115.05 2vvm h LEU 149 Ca -0.02 -0.17 0.00 0.00 -0.00 0.00 0.00 57.88 57.69 2vvm h LEU 149 Cb 0.23 -0.27 -0.01 0.00 -0.00 0.00 0.00 40.66 40.61 2vvm h LEU 149 CO 0.04 0.95 0.15 -0.09 -0.00 0.00 0.00 178.44 179.48 2vvm h ARG 150 N 1.10 0.30 0.08 1.13 2.43 -0.94 0.43 114.38 118.90 2vvm h ARG 150 Ca 0.25 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.41 2vvm h ARG 150 Cb 0.24 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.71 2vvm h ARG 150 CO -0.02 0.20 -0.11 1.03 -1.51 0.00 0.00 179.97 179.56 2vvm h SER 151 N 0.30 -0.31 -0.31 -3.80 0.87 -0.93 0.46 113.55 109.83 2vvm h SER 151 Ca 0.08 0.04 -0.05 0.00 -1.23 0.00 0.00 61.79 60.63 2vvm h SER 151 Cb -0.03 0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.04 2vvm h SER 151 CO -0.02 -0.17 -0.00 0.00 -0.53 0.00 0.00 176.83 176.11 2vvm h ALA 152 N 0.66 0.41 -0.04 6.23 0.00 -1.22 -2.56 119.26 122.74 2vvm h ALA 152 Ca 0.02 -0.24 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 2vvm h ALA 152 Cb 0.25 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2vvm h ALA 152 CO -0.06 0.17 -0.36 -0.07 0.00 0.00 0.00 179.25 178.93 2vvm h LEU 153 N 0.34 0.08 0.10 0.00 3.38 -0.89 -1.10 115.31 117.21 2vvm h LEU 153 Ca 0.09 -0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 2vvm h LEU 153 Cb 0.45 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.17 2vvm h LEU 153 CO 0.02 0.43 -0.06 -0.74 0.09 0.00 0.00 178.44 178.18 2vvm h HIS 154 N 0.07 -0.17 -0.55 1.13 2.76 -0.71 -1.07 115.15 116.61 2vvm h HIS 154 Ca 0.01 -0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.14 2vvm h HIS 154 Cb 0.67 0.06 -0.02 0.00 1.55 0.00 0.00 27.41 29.66 2vvm h HIS 154 CO 0.00 -0.10 0.22 0.87 -1.30 0.00 0.00 177.93 177.63 2vvm h LYS 155 N -0.16 0.81 -0.32 5.26 1.57 -1.21 -1.50 116.57 121.03 2vvm h LYS 155 Ca -0.01 -0.14 0.01 0.00 -1.87 0.00 0.00 60.65 58.64 2vvm h LYS 155 Cb 0.14 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.30 2vvm h LYS 155 CO 0.00 0.70 0.19 0.35 -0.57 0.00 0.00 179.45 180.13 2vvm h PHE 156 N 0.74 0.37 0.00 -1.35 3.57 -1.10 -3.22 116.94 115.94 2vvm h PHE 156 Ca 0.18 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.69 2vvm h PHE 156 Cb 0.19 -0.12 0.00 0.00 2.79 0.00 0.00 35.95 38.81 2vvm h PHE 156 CO 0.01 0.22 -0.56 0.25 -2.23 0.00 0.00 178.31 176.00 2vvm n THR 157 N -4.89 0.13 -1.29 4.41 -2.24 -0.42 -4.56 114.28 105.42 2vvm n THR 157 Ca -0.01 -0.11 -0.30 0.00 -2.27 0.00 0.00 64.05 61.36 2vvm n THR 157 Cb 0.04 0.09 -0.07 0.00 -2.10 0.00 0.00 70.33 68.29 2vvm n THR 157 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2vvm n ASN 158 N -1.74 7.52 0.23 3.42 5.15 -0.58 -3.68 115.26 125.59 2vvm n ASN 158 Ca 0.05 -2.62 0.13 0.00 -0.60 0.00 0.00 54.58 51.53 2vvm n ASN 158 Cb 0.38 -1.48 0.35 0.00 -0.53 0.00 0.00 39.78 38.50 2vvm n ASN 158 CO 0.00 0.00 0.00 -0.37 1.40 0.00 0.00 177.26 178.29 2vvm h VAL 159 N 2.61 0.12 0.00 3.44 -1.51 -1.85 -3.34 116.25 115.71 2vvm h VAL 159 Ca 0.63 -0.95 0.00 0.00 -1.23 0.00 0.00 66.70 65.15 2vvm h VAL 159 Cb 0.68 1.86 0.00 0.00 -2.13 0.00 0.00 31.29 31.70 2vvm h VAL 159 CO 1.24 0.06 0.00 -0.90 -1.23 0.00 0.00 177.57 176.74 2vvm n ASP 160 N -3.13 1.38 0.00 4.19 5.75 -1.26 -5.00 116.55 118.48 2vvm n ASP 160 Ca 0.02 -1.64 0.00 0.00 -0.01 0.00 0.00 54.79 53.16 2vvm n ASP 160 Cb 0.47 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.56 2vvm n ASP 160 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2vvm n GLY 161 N -0.32 2.19 0.89 6.12 0.00 -1.26 -4.82 105.19 108.00 2vvm n GLY 161 Ca 0.00 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.06 2vvm n GLY 161 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2vvm n THR 162 N -2.00 0.77 -3.93 2.61 -2.24 -1.26 -5.00 114.28 103.23 2vvm n THR 162 Ca 0.00 -1.49 -0.30 0.00 -2.27 0.00 0.00 64.05 59.98 2vvm n THR 162 Cb 0.00 0.44 0.02 0.00 -2.10 0.00 0.00 70.33 68.69 2vvm n THR 162 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2vvm n ASN 163 N -0.24 -4.50 0.00 3.42 3.02 -1.26 -2.49 115.26 113.21 2vvm n ASN 163 Ca 0.09 -0.80 0.00 0.00 -0.03 0.00 0.00 54.58 53.84 2vvm n ASN 163 Cb 0.88 -3.79 0.00 0.00 -0.61 0.00 0.00 39.78 36.26 2vvm n ASN 163 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2vvm n GLY 164 N -1.67 0.91 0.25 7.41 0.00 -1.24 -4.87 105.19 105.98 2vvm n GLY 164 Ca 0.03 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.16 2vvm n GLY 164 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2vvm h ARG 165 N 3.57 0.00 0.08 1.61 3.08 -1.74 0.80 114.38 121.78 2vvm h ARG 165 Ca 0.00 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.79 2vvm h ARG 165 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 2vvm h ARG 165 CO 0.00 0.14 -1.37 1.15 -1.07 0.00 0.00 179.97 178.82 2vvm h THR 166 N 0.00 0.99 0.00 2.04 2.02 -1.89 -3.20 112.91 112.87 2vvm h THR 166 Ca -0.00 -2.33 -0.04 0.00 0.77 0.00 0.00 66.41 64.80 2vvm h THR 166 Cb 0.35 2.59 -0.01 0.00 -1.74 0.00 0.00 68.15 69.35 2vvm h THR 166 CO 0.02 0.62 -0.44 -0.37 0.37 0.00 0.00 175.52 175.72 2vvm h VAL 167 N -0.48 0.29 -2.04 3.16 -1.51 -1.91 -3.39 116.25 110.38 2vvm h VAL 167 Ca -0.31 -1.43 -0.54 0.00 -1.23 0.00 0.00 66.70 63.18 2vvm h VAL 167 Cb 1.63 2.04 -0.40 0.00 -2.13 0.00 0.00 31.29 32.43 2vvm h VAL 167 CO -0.01 0.16 -1.06 -0.11 -1.23 0.00 0.00 177.57 175.32 2vvm n LEU 168 N -3.04 0.98 0.16 4.19 7.94 0.27 -4.38 117.00 123.11 2vvm n LEU 168 Ca 0.02 -4.92 0.02 0.00 -1.11 0.00 0.00 56.01 50.01 2vvm n LEU 168 Cb 0.62 0.46 0.23 0.00 0.53 0.00 0.00 43.42 45.27 2vvm n LEU 168 CO 0.38 2.15 0.57 1.55 -1.11 0.00 0.00 177.39 180.92 2vvm h PRO 169 N 3.66 0.00 -3.04 1.96 0.13 -1.71 -3.38 132.00 129.62 2vvm h PRO 169 Ca 0.10 0.00 -0.62 0.00 -0.87 0.00 0.00 66.00 64.61 2vvm h PRO 169 Cb 0.86 0.00 -0.41 0.00 0.13 0.00 0.00 31.00 31.59 2vvm h PRO 169 CO 0.53 0.52 -0.69 -0.06 -0.23 0.00 0.00 178.00 178.07 2vvm s PHE 170 N -3.59 2.58 0.62 1.56 0.08 -1.26 -4.99 117.98 112.99 2vvm s PHE 170 Ca -0.01 -2.83 0.44 0.00 0.12 0.00 0.00 56.93 54.66 2vvm s PHE 170 Cb 0.12 -2.22 2.37 0.00 -0.57 0.00 0.00 43.02 42.72 2vvm s PHE 170 CO 0.73 -0.72 2.35 -1.00 -0.10 0.00 0.00 175.22 176.48 2vvm h PRO 171 N 6.22 0.00 0.00 0.24 0.13 -1.95 0.69 132.00 137.33 2vvm h PRO 171 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.17 2vvm h PRO 171 Cb 0.87 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.00 2vvm h PRO 171 CO 0.58 0.00 0.00 0.72 -0.23 0.00 0.00 178.00 179.07 2vvm n HIS 172 N -3.06 0.04 -3.46 1.56 8.25 -1.26 -4.21 115.22 113.08 2vvm n HIS 172 Ca -0.03 0.01 -0.27 0.00 -0.26 0.00 0.00 57.72 57.17 2vvm n HIS 172 Cb 0.08 -0.52 -0.11 0.00 1.12 0.00 0.00 29.99 30.56 2vvm n HIS 172 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2vvm s ASP 173 N -3.07 1.99 0.53 0.41 -1.08 0.23 -4.90 116.67 110.78 2vvm s ASP 173 Ca 0.10 -3.03 0.22 0.00 -0.52 0.00 0.00 52.55 49.31 2vvm s ASP 173 Cb 0.13 -0.57 1.41 0.00 -1.46 0.00 0.00 42.92 42.44 2vvm s ASP 173 CO 0.37 -0.18 2.14 0.00 0.52 0.00 0.00 175.17 178.02 2vvm h MET 174 N 5.80 0.00 -0.33 4.34 -0.00 -1.73 -2.22 114.93 120.78 2vvm h MET 174 Ca 0.22 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.92 2vvm h MET 174 Cb 0.90 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.50 2vvm h MET 174 CO 0.40 0.06 0.00 1.19 -0.00 0.00 0.00 176.91 178.56 2vvm n PHE 175 N -4.14 0.43 -0.31 -0.10 3.72 -1.26 -4.30 117.46 111.50 2vvm n PHE 175 Ca -0.03 -0.22 0.09 0.00 -0.05 0.00 0.00 57.45 57.25 2vvm n PHE 175 Cb 0.14 0.00 0.26 0.00 -0.94 0.00 0.00 39.48 38.94 2vvm n PHE 175 CO 0.00 0.00 0.00 -0.92 -0.05 0.00 0.00 176.76 175.79 2vvm h TYR 176 N 3.16 0.85 -3.58 1.38 3.20 -1.73 -3.26 116.97 116.99 2vvm h TYR 176 Ca 0.00 0.03 -0.67 0.00 3.14 0.00 0.00 58.73 61.23 2vvm h TYR 176 Cb 0.70 -0.24 -0.28 0.00 1.54 0.00 0.00 36.73 38.45 2vvm h TYR 176 CO 0.22 0.18 -0.67 0.08 -1.64 0.00 0.00 178.16 176.33 2vvm s VAL 177 N -5.93 3.56 0.29 1.81 1.01 -1.26 -5.02 120.40 114.86 2vvm s VAL 177 Ca -0.12 -0.82 0.04 0.00 0.00 0.00 0.00 61.98 61.08 2vvm s VAL 177 Cb 0.23 -2.83 0.28 0.00 0.00 0.00 0.00 36.38 34.06 2vvm s VAL 177 CO 0.79 0.12 1.76 -0.65 0.00 0.00 0.00 175.10 177.11 2vvm h PRO 178 N 8.15 0.63 0.00 2.72 0.11 -1.88 -2.15 132.00 139.58 2vvm h PRO 178 Ca -0.32 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.76 2vvm h PRO 178 Cb 1.12 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.09 2vvm h PRO 178 CO 0.59 0.42 0.00 -0.85 -0.21 0.00 0.00 178.00 177.95 2vvm n GLU 179 N -4.85 0.11 -0.04 1.05 0.00 -1.26 -2.52 120.64 113.13 2vvm n GLU 179 Ca 0.21 0.45 0.07 0.00 0.00 0.00 0.00 57.16 57.90 2vvm n GLU 179 Cb 0.55 -1.76 0.45 0.00 0.00 0.00 0.00 31.44 30.68 2vvm n GLU 179 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.13 177.48 2vvm h PHE 180 N 0.00 0.49 -0.94 -1.84 3.57 -1.59 -2.90 116.94 113.73 2vvm h PHE 180 Ca 0.00 0.01 0.21 0.00 3.53 0.00 0.00 57.97 61.72 2vvm h PHE 180 Cb 0.20 -0.16 -0.12 0.00 2.79 0.00 0.00 35.95 38.66 2vvm h PHE 180 CO 0.00 0.28 0.49 -0.09 -2.23 0.00 0.00 178.31 176.76 2vvm h ARG 181 N 0.50 0.53 -0.18 1.11 2.43 -1.72 0.03 114.38 117.08 2vvm h ARG 181 Ca 0.21 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.32 2vvm h ARG 181 Cb 0.20 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 2vvm h ARG 181 CO -0.05 0.35 -0.01 1.57 -1.51 0.00 0.00 179.97 180.31 2vvm h LYS 182 N 0.54 0.26 -0.10 0.20 2.10 -1.76 -1.18 116.57 116.64 2vvm h LYS 182 Ca 0.57 -0.04 -0.22 0.00 -2.00 0.00 0.00 60.65 58.97 2vvm h LYS 182 Cb 1.03 -0.05 0.01 0.00 -0.90 0.00 0.00 32.23 32.32 2vvm h LYS 182 CO -0.47 0.30 -0.80 1.88 -2.00 0.00 0.00 179.45 178.36 2vvm h TYR 183 N 0.26 0.87 -0.73 0.07 0.05 -1.17 -2.73 116.97 113.59 2vvm h TYR 183 Ca 0.06 -0.40 0.10 0.00 0.05 0.00 0.00 58.73 58.54 2vvm h TYR 183 Cb 0.20 -0.13 -0.05 0.00 1.01 0.00 0.00 36.73 37.76 2vvm h TYR 183 CO 0.00 1.21 0.48 0.22 -1.05 0.00 0.00 178.16 179.02 2vvm h ASP 184 N 0.42 0.56 0.37 3.88 3.58 -0.76 0.07 116.42 124.54 2vvm h ASP 184 Ca -0.05 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.41 2vvm h ASP 184 Cb 1.42 -0.10 0.00 0.00 1.72 0.00 0.00 39.33 42.36 2vvm h ASP 184 CO 0.15 0.33 -0.04 -0.62 -2.88 0.00 0.00 179.24 176.19 2vvm n GLU 185 N -4.49 0.66 -3.63 0.28 1.02 -0.52 -0.74 120.64 113.22 2vvm n GLU 185 Ca 0.12 -0.11 -0.36 0.00 -0.02 0.00 0.00 57.16 56.79 2vvm n GLU 185 Cb 0.35 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 30.21 2vvm n GLU 185 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 2vvm s MET 186 N -2.41 3.74 0.55 3.49 -1.94 -0.75 -4.38 119.30 117.60 2vvm s MET 186 Ca 0.33 0.18 -0.06 0.00 -1.71 0.00 0.00 55.69 54.42 2vvm s MET 186 Cb 0.21 -3.14 -0.01 0.00 2.01 0.00 0.00 34.83 33.90 2vvm s MET 186 CO 0.45 0.67 0.87 -1.54 -0.01 0.00 0.00 175.02 175.45 2vvm s SER 187 N -1.34 5.89 0.19 3.03 1.04 -1.26 0.34 113.70 121.58 2vvm s SER 187 Ca 0.25 0.86 -0.14 0.00 0.48 0.00 0.00 55.95 57.39 2vvm s SER 187 Cb -0.15 -1.97 0.18 0.00 0.10 0.00 0.00 66.02 64.18 2vvm s SER 187 CO 0.13 -0.87 1.67 1.88 0.98 0.00 0.00 173.24 177.03 2vvm h TYR 188 N -0.04 -0.12 -0.95 5.02 -1.99 -0.98 -2.37 116.97 115.54 2vvm h TYR 188 Ca -0.46 0.04 0.00 0.00 2.00 0.00 0.00 58.73 60.32 2vvm h TYR 188 Cb 1.23 0.13 -0.05 0.00 2.00 0.00 0.00 36.73 40.05 2vvm h TYR 188 CO 0.53 -0.16 0.61 0.66 -0.00 0.00 0.00 178.16 179.80 2vvm h SER 189 N 0.07 1.11 -0.67 3.88 4.64 -1.40 -0.45 113.55 120.73 2vvm h SER 189 Ca 0.25 -0.04 -0.05 0.00 -0.47 0.00 0.00 61.79 61.47 2vvm h SER 189 Cb 0.38 -0.28 -0.03 0.00 -0.31 0.00 0.00 62.40 62.16 2vvm h SER 189 CO -0.46 0.82 0.23 -0.33 -0.87 0.00 0.00 176.83 176.23 2vvm h GLU 190 N 1.30 1.05 -0.25 4.77 5.08 -1.76 -1.35 114.58 123.43 2vvm h GLU 190 Ca 0.35 -0.21 -0.10 0.00 -1.00 0.00 0.00 59.36 58.40 2vvm h GLU 190 Cb -0.12 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 28.97 2vvm h GLU 190 CO -0.07 0.89 -0.22 -0.09 -1.00 0.00 0.00 179.01 178.51 2vvm h ARG 191 N 1.02 0.59 -0.58 2.33 9.65 -0.86 -3.11 114.38 123.42 2vvm h ARG 191 Ca 0.23 -0.30 0.06 0.00 -1.10 0.00 0.00 59.98 58.86 2vvm h ARG 191 Cb 0.26 0.01 -0.05 0.00 -1.39 0.00 0.00 29.97 28.80 2vvm h ARG 191 CO -0.01 0.89 0.29 0.82 2.80 0.00 0.00 179.97 184.77 2vvm h ILE 192 N 0.30 0.93 -0.37 1.20 1.08 -0.96 -1.62 117.51 118.08 2vvm h ILE 192 Ca 0.04 -0.19 0.10 0.00 -0.39 0.00 0.00 64.86 64.42 2vvm h ILE 192 Cb 0.77 0.33 -0.02 0.00 -3.07 0.00 0.00 36.82 34.84 2vvm h ILE 192 CO 0.06 0.10 0.26 0.44 -0.69 0.00 0.00 178.15 178.32 2vvm h ASP 193 N 0.55 0.04 1.27 1.72 3.32 -1.24 0.20 116.42 122.28 2vvm h ASP 193 Ca 0.26 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.29 2vvm h ASP 193 Cb 0.19 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 39.73 2vvm h ASP 193 CO -0.19 0.02 -0.12 1.56 -1.72 0.00 0.00 179.24 178.79 2vvm h GLN 194 N 0.04 0.00 0.00 3.56 4.20 -1.22 -3.33 115.11 118.36 2vvm h GLN 194 Ca 0.17 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.88 2vvm h GLN 194 Cb 0.64 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.42 2vvm h GLN 194 CO -0.01 0.12 0.00 0.44 -0.67 0.00 0.00 178.83 178.72 2vvm n ILE 195 N -3.20 0.47 -0.25 2.54 -5.35 -0.29 -4.86 119.36 108.41 2vvm n ILE 195 Ca 0.01 -0.63 0.04 0.00 -0.27 0.00 0.00 62.75 61.91 2vvm n ILE 195 Cb 0.44 0.85 0.17 0.00 -1.74 0.00 0.00 39.64 39.37 2vvm n ILE 195 CO 0.00 0.00 0.00 -0.09 -1.76 0.00 0.00 176.55 174.70 2vvm h ARG 196 N 0.00 0.46 0.00 6.28 2.43 -0.78 -0.53 114.38 122.23 2vvm h ARG 196 Ca 0.00 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2vvm h ARG 196 Cb 0.40 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 29.85 2vvm h ARG 196 CO 0.00 0.30 0.00 -0.25 -1.51 0.00 0.00 179.97 178.51 2vvm n ASP 197 N -4.97 0.47 -0.94 -3.80 8.00 -1.26 -2.36 116.55 111.69 2vvm n ASP 197 Ca 0.13 0.60 0.12 0.00 0.71 0.00 0.00 54.79 56.36 2vvm n ASP 197 Cb 0.38 -0.71 0.16 0.00 -0.02 0.00 0.00 41.12 40.94 2vvm n ASP 197 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2vvm n GLU 198 N -2.01 2.28 -4.44 -1.24 -0.58 -0.21 -4.92 120.64 109.52 2vvm n GLU 198 Ca 0.03 -1.88 -0.34 0.00 -0.42 0.00 0.00 57.16 54.56 2vvm n GLU 198 Cb 0.25 -1.47 -0.13 0.00 -0.57 0.00 0.00 31.44 29.51 2vvm n GLU 198 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2vvm s LEU 199 N -1.91 3.00 0.89 -4.62 1.43 -0.99 -5.09 118.68 111.39 2vvm s LEU 199 Ca 0.31 -0.25 -0.11 0.00 -1.03 0.00 0.00 54.13 53.05 2vvm s LEU 199 Cb 0.20 -1.72 0.13 0.00 0.03 0.00 0.00 46.19 44.83 2vvm s LEU 199 CO 0.31 0.13 1.09 -0.94 0.23 0.00 0.00 176.35 177.17 2vvm s SER 200 N 0.57 3.46 0.23 2.29 1.04 -1.26 -4.77 113.70 115.27 2vvm s SER 200 Ca -0.05 1.57 -0.06 0.00 0.48 0.00 0.00 55.95 57.89 2vvm s SER 200 Cb -0.15 -2.24 0.35 0.00 0.10 0.00 0.00 66.02 64.08 2vvm s SER 200 CO 0.03 -2.66 1.81 0.25 0.98 0.00 0.00 173.24 173.65 2vvm h LEU 201 N -1.56 0.63 -0.69 2.42 5.85 -1.98 0.15 115.31 120.13 2vvm h LEU 201 Ca -0.49 0.04 -0.05 0.00 0.84 0.00 0.00 57.88 58.22 2vvm h LEU 201 Cb 1.28 -0.08 -0.03 0.00 0.37 0.00 0.00 40.66 42.20 2vvm h LEU 201 CO 0.53 0.37 0.22 0.78 -0.34 0.00 0.00 178.44 180.01 2vvm h ASN 202 N 0.76 1.00 0.06 1.25 2.35 -1.99 0.10 115.58 119.11 2vvm h ASN 202 Ca 0.37 -0.21 -0.00 0.00 -0.55 0.00 0.00 56.30 55.91 2vvm h ASN 202 Cb 0.31 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 38.41 2vvm h ASN 202 CO -0.23 0.94 -0.03 -0.33 -1.65 0.00 0.00 177.43 176.14 2vvm h GLU 203 N 1.01 -0.07 -0.56 0.81 5.08 -1.80 -2.26 114.58 116.79 2vvm h GLU 203 Ca 0.22 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.51 2vvm h GLU 203 Cb 0.30 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 2vvm h GLU 203 CO -0.01 0.19 0.03 -0.09 -1.00 0.00 0.00 179.01 178.14 2vvm h ARG 204 N -0.33 0.96 -0.17 2.33 2.43 -0.84 -0.14 114.38 118.61 2vvm h ARG 204 Ca -0.01 -0.29 -0.01 0.00 -0.81 0.00 0.00 59.98 58.87 2vvm h ARG 204 Cb 0.30 -0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.74 2vvm h ARG 204 CO 0.01 0.95 0.08 0.77 -1.51 0.00 0.00 179.97 180.27 2vvm h SER 205 N 0.84 0.22 -0.38 -3.80 0.02 -0.83 0.71 113.55 110.33 2vvm h SER 205 Ca 0.16 -0.13 -0.11 0.00 -0.84 0.00 0.00 61.79 60.87 2vvm h SER 205 Cb 0.49 -0.06 -0.02 0.00 0.14 0.00 0.00 62.40 62.96 2vvm h SER 205 CO 0.02 0.29 -0.16 0.77 -1.14 0.00 0.00 176.83 176.61 2vvm h SER 206 N 0.14 0.86 0.33 3.07 4.64 -1.33 -1.55 113.55 119.70 2vvm h SER 206 Ca 0.06 -0.29 -0.02 0.00 -0.47 0.00 0.00 61.79 61.07 2vvm h SER 206 Cb 0.13 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 61.99 2vvm h SER 206 CO -0.01 1.01 -0.16 0.25 -0.87 0.00 0.00 176.83 177.06 2vvm h LEU 207 N 0.76 -0.38 -0.75 5.97 5.85 -0.83 -0.95 115.31 124.98 2vvm h LEU 207 Ca 0.12 -0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.79 2vvm h LEU 207 Cb 0.68 0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.77 2vvm h LEU 207 CO 0.05 -0.18 0.50 -0.33 -0.34 0.00 0.00 178.44 178.13 2vvm h GLU 208 N -0.55 0.98 -0.84 1.25 5.08 -0.84 -0.17 114.58 119.49 2vvm h GLU 208 Ca -0.05 -0.06 0.01 0.00 -1.00 0.00 0.00 59.36 58.27 2vvm h GLU 208 Cb 0.41 -0.22 -0.04 0.00 0.50 0.00 0.00 28.75 29.39 2vvm h GLU 208 CO 0.07 0.65 0.56 0.00 -1.00 0.00 0.00 179.01 179.29 2vvm h ALA 209 N 1.28 1.07 -0.12 3.43 0.00 -1.20 -0.63 119.26 123.09 2vvm h ALA 209 Ca 0.28 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.08 2vvm h ALA 209 Cb -0.11 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.34 2vvm h ALA 209 CO -0.06 0.47 -0.12 0.35 0.00 0.00 0.00 179.25 179.88 2vvm h PHE 210 N 1.13 0.35 -0.08 0.00 3.57 -0.61 0.43 116.94 121.72 2vvm h PHE 210 Ca 0.31 -0.11 -0.11 0.00 3.53 0.00 0.00 57.97 61.59 2vvm h PHE 210 Cb -0.13 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.53 2vvm h PHE 210 CO -0.01 0.71 -0.45 -0.84 -2.23 0.00 0.00 178.31 175.49 2vvm h ILE 211 N -0.11 1.32 0.00 1.41 3.07 -0.95 -2.30 117.51 119.95 2vvm h ILE 211 Ca 0.02 -1.60 -0.15 0.00 1.55 0.00 0.00 64.86 64.68 2vvm h ILE 211 Cb 0.65 1.76 -0.02 0.00 -0.27 0.00 0.00 36.82 38.94 2vvm h ILE 211 CO 0.03 0.47 -0.72 -0.07 -1.05 0.00 0.00 178.15 176.82 2vvm h LEU 212 N 0.16 0.00 -0.30 0.16 3.38 -1.10 -1.36 115.31 116.25 2vvm h LEU 212 Ca 0.01 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.03 2vvm h LEU 212 Cb 0.86 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.56 2vvm h LEU 212 CO 0.07 0.72 -0.02 0.25 0.09 0.00 0.00 178.44 179.55 2vvm h LEU 213 N 0.00 -0.16 -0.53 1.67 5.85 -0.56 0.13 115.31 121.71 2vvm h LEU 213 Ca -0.01 0.07 -0.09 0.00 0.84 0.00 0.00 57.88 58.70 2vvm h LEU 213 Cb 1.39 0.13 -0.02 0.00 0.37 0.00 0.00 40.66 42.53 2vvm h LEU 213 CO 0.09 -0.04 -0.01 0.00 -0.34 0.00 0.00 178.44 178.14 2vvm h SER 215 N 0.81 0.00 0.00 0.00 4.64 -1.19 -3.48 113.55 114.33 2vvm h SER 215 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 2vvm h SER 215 Cb 0.55 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.64 2vvm h SER 215 CO 0.03 0.70 0.00 0.61 -0.87 0.00 0.00 176.83 177.30 2vvm n GLY 216 N 1.37 0.12 0.00 -0.77 0.00 0.43 -3.31 105.19 103.04 2vvm n GLY 216 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 2vvm n GLY 216 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vvm n GLY 217 N -0.20 3.39 3.53 -0.02 0.00 -1.24 -1.65 105.19 109.00 2vvm n GLY 217 Ca 0.00 -1.49 -0.25 0.00 0.00 0.00 0.00 46.02 44.28 2vvm n GLY 217 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2vvm s THR 218 N 4.43 1.73 0.35 2.61 -4.23 -1.26 -2.48 115.64 116.79 2vvm s THR 218 Ca 0.00 -2.05 0.06 0.00 -1.18 0.00 0.00 61.69 58.52 2vvm s THR 218 Cb 0.00 -2.80 0.16 0.00 1.34 0.00 0.00 72.50 71.20 2vvm s THR 218 CO 0.00 -0.08 1.89 -0.07 -0.54 0.00 0.00 174.62 175.82 2vvm h LEU 219 N 1.99 0.43 -0.01 4.79 3.38 -1.98 -2.46 115.31 121.45 2vvm h LEU 219 Ca -0.42 -0.08 -0.23 0.00 0.09 0.00 0.00 57.88 57.24 2vvm h LEU 219 Cb 1.24 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.87 2vvm h LEU 219 CO 0.74 0.51 -1.07 -0.33 0.09 0.00 0.00 178.44 178.38 2vvm h GLU 220 N 0.44 0.14 -0.02 1.13 3.07 -1.96 -0.49 114.58 116.88 2vvm h GLU 220 Ca 0.09 -0.21 0.00 0.00 -0.50 0.00 0.00 59.36 58.74 2vvm h GLU 220 Cb 0.33 0.08 0.00 0.00 -0.84 0.00 0.00 28.75 28.31 2vvm h GLU 220 CO 0.01 1.07 -0.38 0.27 -1.40 0.00 0.00 179.01 178.58 2vvm n ASN 221 N -3.48 2.20 -4.78 1.42 0.23 -1.16 -4.80 115.26 104.89 2vvm n ASN 221 Ca -0.04 -1.60 -0.37 0.00 -0.53 0.00 0.00 54.58 52.04 2vvm n ASN 221 Cb 0.95 0.39 -0.06 0.00 -2.08 0.00 0.00 39.78 38.97 2vvm n ASN 221 CO 0.00 0.00 0.00 -0.44 -0.93 0.00 0.00 177.26 175.89 2vvm s SER 222 N -2.36 6.56 -0.08 0.53 0.01 -0.94 -4.00 113.70 113.43 2vvm s SER 222 Ca 0.20 0.66 -0.30 0.00 1.31 0.00 0.00 55.95 57.83 2vvm s SER 222 Cb 0.18 -2.19 -0.03 0.00 0.21 0.00 0.00 66.02 64.19 2vvm s SER 222 CO 0.51 0.21 1.21 -0.55 0.41 0.00 0.00 173.24 175.03 2vvm s SER 223 N -0.21 7.03 0.17 2.44 0.15 -0.65 -1.51 113.70 121.12 2vvm s SER 223 Ca 0.19 1.79 -0.14 0.00 0.70 0.00 0.00 55.95 58.49 2vvm s SER 223 Cb -0.14 -2.55 0.06 0.00 -1.71 0.00 0.00 66.02 61.67 2vvm s SER 223 CO 0.07 -0.62 1.80 0.15 1.20 0.00 0.00 173.24 175.84 2vvm h PHE 224 N 7.61 0.69 -0.54 3.44 3.57 -0.27 -2.94 116.94 128.49 2vvm h PHE 224 Ca -0.33 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.18 2vvm h PHE 224 Cb 1.15 -0.23 -0.03 0.00 2.79 0.00 0.00 35.95 39.64 2vvm h PHE 224 CO 0.75 0.48 0.36 0.78 -2.23 0.00 0.00 178.31 178.44 2vvm h GLY 225 N 0.70 0.76 1.12 2.40 0.00 -1.18 -1.23 103.07 105.64 2vvm h GLY 225 Ca 0.19 -0.28 -0.09 0.00 0.00 0.00 0.00 47.33 47.14 2vvm h GLY 225 CO -0.03 0.28 0.02 -2.09 0.00 0.00 0.00 176.54 174.71 2vvm h GLU 226 N 0.73 1.06 -0.55 4.80 4.57 -1.80 0.01 114.58 123.40 2vvm h GLU 226 Ca 0.20 -0.32 -0.02 0.00 -1.18 0.00 0.00 59.36 58.04 2vvm h GLU 226 Cb -0.08 -0.10 -0.03 0.00 -0.16 0.00 0.00 28.75 28.38 2vvm h GLU 226 CO -0.04 1.02 0.26 0.35 -1.18 0.00 0.00 179.01 179.42 2vvm h PHE 227 N 0.97 0.80 -0.67 0.92 3.57 -1.21 -1.93 116.94 119.38 2vvm h PHE 227 Ca 0.18 -0.04 0.08 0.00 3.53 0.00 0.00 57.97 61.72 2vvm h PHE 227 Cb 0.53 -0.25 -0.04 0.00 2.79 0.00 0.00 35.95 38.98 2vvm h PHE 227 CO 0.04 0.62 0.44 1.25 -2.23 0.00 0.00 178.31 178.43 2vvm h LEU 228 N 0.75 0.53 -0.07 0.59 5.85 -0.84 0.06 115.31 122.18 2vvm h LEU 228 Ca 0.19 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.91 2vvm h LEU 228 Cb 0.12 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 41.04 2vvm h LEU 228 CO -0.02 0.33 0.03 -0.74 -0.34 0.00 0.00 178.44 177.70 2vvm h HIS 229 N 0.60 0.10 -0.46 1.25 2.76 -0.41 0.28 115.15 119.27 2vvm h HIS 229 Ca 0.30 -0.00 0.05 0.00 -2.20 0.00 0.00 60.37 58.52 2vvm h HIS 229 Cb 0.39 -0.03 -0.05 0.00 1.55 0.00 0.00 27.41 29.27 2vvm h HIS 229 CO -0.00 0.18 0.19 -1.49 -1.30 0.00 0.00 177.93 175.51 2vvm h TRP 230 N -0.01 0.34 -0.20 5.26 4.06 -0.63 -0.83 115.95 123.94 2vvm h TRP 230 Ca 0.02 0.02 0.03 0.00 2.06 0.00 0.00 58.89 61.02 2vvm h TRP 230 Cb 0.12 -0.08 -0.03 0.00 -1.00 0.00 0.00 29.16 28.17 2vvm h TRP 230 CO -0.03 0.14 0.04 2.35 -3.56 0.00 0.00 178.44 177.37 2vvm h TRP 231 N 0.38 0.06 -0.28 0.49 2.91 -0.88 -1.42 115.95 117.21 2vvm h TRP 231 Ca 0.21 0.01 -0.01 0.00 1.13 0.00 0.00 58.89 60.24 2vvm h TRP 231 Cb 0.18 0.00 -0.01 0.00 -0.51 0.00 0.00 29.16 28.82 2vvm h TRP 231 CO -0.14 0.02 0.15 0.00 -1.03 0.00 0.00 178.44 177.44 2vvm h ALA 232 N 1.15 0.37 -0.91 2.65 0.00 -0.68 0.60 119.26 122.43 2vvm h ALA 232 Ca 0.09 -0.08 0.07 0.00 0.00 0.00 0.00 54.91 54.99 2vvm h ALA 232 Cb 0.09 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 17.71 2vvm h ALA 232 CO -0.12 -0.09 0.59 0.52 0.00 0.00 0.00 179.25 180.15 2vvm h MET 233 N 0.33 1.00 0.00 0.00 2.86 -0.92 -2.10 114.93 116.11 2vvm h MET 233 Ca 0.10 -0.06 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 2vvm h MET 233 Cb 0.09 -0.23 0.00 0.00 0.06 0.00 0.00 31.60 31.53 2vvm h MET 233 CO -0.01 0.66 0.00 0.43 1.06 0.00 0.00 176.91 179.05 2vvm n SER 234 N -4.49 0.00 0.00 1.22 7.64 -0.55 -4.89 113.62 112.54 2vvm n SER 234 Ca 0.14 0.19 0.00 0.00 1.01 0.00 0.00 58.87 60.21 2vvm n SER 234 Cb 0.20 -0.39 0.00 0.00 -1.01 0.00 0.00 64.21 63.01 2vvm n SER 234 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2vvm n GLY 235 N 1.17 1.28 2.45 0.23 0.00 -0.79 -4.18 105.19 105.35 2vvm n GLY 235 Ca 0.10 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.91 2vvm n GLY 235 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2vvm n TYR 236 N -1.26 -1.07 -4.00 1.61 4.01 0.17 -4.94 117.16 111.68 2vvm n TYR 236 Ca 0.00 0.04 -0.08 0.00 -0.16 0.00 0.00 57.90 57.70 2vvm n TYR 236 Cb 0.00 -4.02 -0.10 0.00 -0.31 0.00 0.00 39.34 34.92 2vvm n TYR 236 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 2vvm s THR 237 N -3.05 0.17 0.16 -0.72 -4.23 -1.26 -4.98 115.64 101.73 2vvm s THR 237 Ca 0.02 -1.42 -0.12 0.00 -1.18 0.00 0.00 61.69 58.99 2vvm s THR 237 Cb -0.01 -1.18 0.06 0.00 1.34 0.00 0.00 72.50 72.71 2vvm s THR 237 CO 0.03 -0.79 1.70 0.22 -0.54 0.00 0.00 174.62 175.24 2vvm h TYR 238 N 3.41 0.89 -0.45 3.99 3.20 -1.95 -1.63 116.97 124.44 2vvm h TYR 238 Ca -0.33 -0.09 -0.07 0.00 3.14 0.00 0.00 58.73 61.38 2vvm h TYR 238 Cb 1.17 -0.26 -0.02 0.00 1.54 0.00 0.00 36.73 39.16 2vvm h TYR 238 CO 0.53 0.75 -0.01 0.37 -1.64 0.00 0.00 178.16 178.16 2vvm h GLN 239 N 0.78 0.73 -0.33 1.82 5.75 -1.97 -0.95 115.11 120.95 2vvm h GLN 239 Ca 0.18 -0.19 0.04 0.00 -0.15 0.00 0.00 58.65 58.53 2vvm h GLN 239 Cb 0.26 -0.09 -0.04 0.00 1.07 0.00 0.00 27.48 28.69 2vvm h GLN 239 CO -0.01 0.75 0.11 0.78 -2.65 0.00 0.00 178.83 177.81 2vvm h GLY 240 N 0.96 0.41 0.82 2.39 0.00 -1.70 -0.13 103.07 105.81 2vvm h GLY 240 Ca 0.14 -0.06 0.02 0.00 0.00 0.00 0.00 47.33 47.42 2vvm h GLY 240 CO 0.02 0.02 -0.02 0.00 0.00 0.00 0.00 176.54 176.56 2vvm h MET 242 N -0.00 1.18 -0.22 0.00 2.07 -0.97 0.25 114.93 117.24 2vvm h MET 242 Ca 0.04 -0.15 0.02 0.00 -2.07 0.00 0.00 59.70 57.54 2vvm h MET 242 Cb 0.07 -0.23 -0.02 0.00 -1.87 0.00 0.00 31.60 29.56 2vvm h MET 242 CO -0.09 0.88 0.10 -0.44 1.07 0.00 0.00 176.91 178.42 2vvm h ASP 243 N 1.18 0.14 0.83 1.22 5.19 -0.86 -2.42 116.42 121.70 2vvm h ASP 243 Ca 0.29 0.01 -0.24 0.00 -0.62 0.00 0.00 57.03 56.48 2vvm h ASP 243 Cb 0.05 -0.01 -0.02 0.00 0.18 0.00 0.00 39.33 39.53 2vvm h ASP 243 CO -0.04 0.11 -1.15 0.00 -3.12 0.00 0.00 179.24 175.04 2vvm n LEU 245 N -3.39 0.64 -0.27 0.00 4.77 0.84 -4.44 117.00 115.16 2vvm n LEU 245 Ca -0.04 0.29 0.00 0.00 -0.03 0.00 0.00 56.01 56.23 2vvm n LEU 245 Cb 0.98 0.20 0.00 0.00 -2.33 0.00 0.00 43.42 42.27 2vvm n LEU 245 CO 0.49 0.31 0.19 0.80 -1.33 0.00 0.00 177.39 177.86 2vvm n MET 246 N -2.89 0.00 -0.12 3.23 1.56 -0.92 -4.65 117.12 113.33 2vvm n MET 246 Ca -0.17 -0.39 -0.21 0.00 -0.27 0.00 0.00 57.70 56.66 2vvm n MET 246 Cb 0.98 -0.25 -0.12 0.00 2.15 0.00 0.00 33.22 35.98 2vvm n MET 246 CO 0.00 0.00 0.00 0.43 -0.73 0.00 0.00 175.97 175.67 2vvm n SER 247 N 0.00 1.98 -4.01 6.12 7.64 -1.15 -4.62 113.62 119.58 2vvm n SER 247 Ca 0.00 -0.01 -0.26 0.00 1.01 0.00 0.00 58.87 59.61 2vvm n SER 247 Cb 0.56 -0.54 -0.17 0.00 -1.01 0.00 0.00 64.21 63.05 2vvm n SER 247 CO 0.00 0.00 0.00 -0.31 -3.01 0.00 0.00 175.04 171.72 2vvm s TYR 248 N -2.52 1.56 0.25 1.43 2.02 -1.26 -0.52 117.35 118.31 2vvm s TYR 248 Ca -0.35 -0.65 0.05 0.00 -0.37 0.00 0.00 57.07 55.76 2vvm s TYR 248 Cb 0.10 -1.17 -0.05 0.00 -0.40 0.00 0.00 41.96 40.44 2vvm s TYR 248 CO 0.59 -0.36 -0.04 -1.59 -1.57 0.00 0.00 175.55 172.58 2vvm s LYS 249 N 0.92 1.42 0.13 -0.62 -2.85 -0.70 -1.49 119.74 116.56 2vvm s LYS 249 Ca -0.09 -1.71 -0.30 0.00 -1.00 0.00 0.00 55.97 52.87 2vvm s LYS 249 Cb -0.15 -0.89 -0.07 0.00 -2.06 0.00 0.00 37.83 34.66 2vvm s LYS 249 CO 0.00 -0.01 1.24 -0.06 0.10 0.00 0.00 175.35 176.62 2vvm s PHE 250 N -3.20 3.39 0.21 1.78 0.08 -1.26 -0.33 117.98 118.64 2vvm s PHE 250 Ca 0.28 1.29 -0.10 0.00 0.12 0.00 0.00 56.93 58.52 2vvm s PHE 250 Cb 0.04 -3.48 0.28 0.00 -0.57 0.00 0.00 43.02 39.29 2vvm s PHE 250 CO 0.09 -1.48 1.74 0.87 -0.10 0.00 0.00 175.22 176.35 2vvm h LYS 251 N 6.01 0.38 -0.57 0.44 1.57 -1.16 -2.62 116.57 120.63 2vvm h LYS 251 Ca -0.43 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 2vvm h LYS 251 Cb 1.21 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.44 2vvm h LYS 251 CO 0.79 0.25 0.00 -0.25 -0.57 0.00 0.00 179.45 179.67 2vvm n ASP 252 N -5.01 3.54 0.00 0.86 8.00 -1.26 -4.78 116.55 117.90 2vvm n ASP 252 Ca 0.09 -1.99 0.00 0.00 0.71 0.00 0.00 54.79 53.60 2vvm n ASP 252 Cb 0.28 -0.38 0.00 0.00 -0.02 0.00 0.00 41.12 41.00 2vvm n ASP 252 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2vvm n GLY 253 N 1.55 -0.99 0.33 0.44 0.00 -0.99 -4.34 105.19 101.19 2vvm n GLY 253 Ca 0.22 -1.54 0.09 0.00 0.00 0.00 0.00 46.02 44.78 2vvm n GLY 253 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2vvm h GLN 254 N 0.00 0.36 -0.11 1.61 1.08 -1.90 -2.33 115.11 113.83 2vvm h GLN 254 Ca 0.00 -0.02 -0.03 0.00 -1.45 0.00 0.00 58.65 57.15 2vvm h GLN 254 Cb 0.00 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 27.34 2vvm h GLN 254 CO 0.00 0.24 -0.09 0.77 -0.95 0.00 0.00 178.83 178.80 2vvm h SER 255 N 0.37 0.15 -0.87 1.46 0.02 -1.84 -0.70 113.55 112.13 2vvm h SER 255 Ca 0.19 -0.02 -0.01 0.00 -0.84 0.00 0.00 61.79 61.11 2vvm h SER 255 Cb 0.28 -0.04 -0.04 0.00 0.14 0.00 0.00 62.40 62.74 2vvm h SER 255 CO -0.04 0.26 0.51 0.00 -1.14 0.00 0.00 176.83 176.41 2vvm h ALA 256 N 1.76 1.24 0.10 3.77 0.00 -1.61 -1.65 119.26 122.88 2vvm h ALA 256 Ca 0.03 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 2vvm h ALA 256 Cb 0.26 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2vvm h ALA 256 CO 0.01 0.63 -0.05 0.35 0.00 0.00 0.00 179.25 180.20 2vvm h PHE 257 N 1.22 -0.13 -0.99 0.00 3.57 -1.27 -3.16 116.94 116.18 2vvm h PHE 257 Ca 0.31 -0.00 0.12 0.00 3.53 0.00 0.00 57.97 61.93 2vvm h PHE 257 Cb -0.02 0.04 -0.08 0.00 2.79 0.00 0.00 35.95 38.68 2vvm h PHE 257 CO 0.01 0.18 0.63 0.00 -2.23 0.00 0.00 178.31 176.90 2vvm h ALA 258 N 0.40 1.54 -1.01 2.41 0.00 -1.09 -1.42 119.26 120.10 2vvm h ALA 258 Ca -0.01 0.02 0.10 0.00 0.00 0.00 0.00 54.91 55.02 2vvm h ALA 258 Cb 0.37 -0.21 -0.08 0.00 0.00 0.00 0.00 17.79 17.87 2vvm h ALA 258 CO 0.02 0.22 0.64 0.00 0.00 0.00 0.00 179.25 180.13 2vvm h ARG 259 N 0.98 1.02 -0.74 0.00 2.47 -1.27 -2.20 114.38 114.64 2vvm h ARG 259 Ca 0.49 -0.06 0.06 0.00 -1.26 0.00 0.00 59.98 59.21 2vvm h ARG 259 Cb 0.48 -0.23 -0.06 0.00 -1.65 0.00 0.00 29.97 28.52 2vvm h ARG 259 CO -0.25 0.67 0.43 0.00 0.56 0.00 0.00 179.97 181.38 2vvm h ARG 260 N 1.05 0.77 -0.32 0.04 2.47 -1.23 0.54 114.38 117.70 2vvm h ARG 260 Ca 0.48 -0.05 -0.00 0.00 -1.26 0.00 0.00 59.98 59.15 2vvm h ARG 260 Cb 0.40 -0.17 -0.02 0.00 -1.65 0.00 0.00 29.97 28.53 2vvm h ARG 260 CO -0.24 0.51 0.18 0.74 0.56 0.00 0.00 179.97 181.72 2vvm h PHE 261 N 0.79 0.43 0.36 3.04 0.04 -1.48 -2.07 116.94 118.05 2vvm h PHE 261 Ca 0.33 -0.01 -0.02 0.00 2.80 0.00 0.00 57.97 61.07 2vvm h PHE 261 Cb 0.18 -0.14 0.00 0.00 2.20 0.00 0.00 35.95 38.19 2vvm h PHE 261 CO -0.06 0.33 -0.17 2.35 -0.60 0.00 0.00 178.31 180.16 2vvm h TRP 262 N 0.40 -0.45 -0.86 -0.55 2.91 -0.63 -1.77 115.95 115.01 2vvm h TRP 262 Ca 0.11 -0.01 0.02 0.00 1.13 0.00 0.00 58.89 60.14 2vvm h TRP 262 Cb 0.04 0.15 -0.05 0.00 -0.51 0.00 0.00 29.16 28.79 2vvm h TRP 262 CO -0.03 -0.28 0.57 0.93 -1.03 0.00 0.00 178.44 178.60 2vvm h GLU 263 N -0.48 1.09 0.00 2.65 4.39 0.03 0.57 114.58 122.83 2vvm h GLU 263 Ca -0.05 -0.07 -0.00 0.00 0.34 0.00 0.00 59.36 59.59 2vvm h GLU 263 Cb 0.37 -0.24 0.00 0.00 -0.10 0.00 0.00 28.75 28.78 2vvm h GLU 263 CO 0.08 0.72 -0.00 1.49 -1.16 0.00 0.00 179.01 180.14 2vvm h GLU 264 N 1.12 -0.00 -0.43 2.33 4.81 -1.24 -1.02 114.58 120.15 2vvm h GLU 264 Ca 0.33 0.00 0.03 0.00 -0.13 0.00 0.00 59.36 59.59 2vvm h GLU 264 Cb -0.05 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.30 2vvm h GLU 264 CO -0.09 0.23 0.24 0.00 -0.73 0.00 0.00 179.01 178.66 2vvm h ALA 265 N 0.77 0.54 -0.51 2.92 0.00 -0.89 -2.50 119.26 119.59 2vvm h ALA 265 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2vvm h ALA 265 Cb 0.23 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 2vvm h ALA 265 CO 0.00 -0.10 0.26 0.00 0.00 0.00 0.00 179.25 179.41 2vvm h ALA 266 N 1.21 1.50 0.00 0.00 0.00 -0.85 -2.57 119.26 118.54 2vvm h ALA 266 Ca 0.18 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2vvm h ALA 266 Cb 0.05 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.63 2vvm h ALA 266 CO -0.10 0.41 0.00 0.78 0.00 0.00 0.00 179.25 180.34 2vvm h GLY 267 N 0.81 0.00 2.00 0.00 0.00 -0.71 -2.90 103.07 102.27 2vvm h GLY 267 Ca 0.18 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.47 2vvm h GLY 267 CO -0.03 0.00 -0.18 -0.91 0.00 0.00 0.00 176.54 175.42 2vvm h THR 268 N 0.00 0.43 0.00 4.70 1.35 -1.39 -3.47 112.91 114.53 2vvm h THR 268 Ca 0.00 -1.07 0.00 0.00 -0.55 0.00 0.00 66.41 64.79 2vvm h THR 268 Cb 0.36 1.78 0.00 0.00 -1.73 0.00 0.00 68.15 68.56 2vvm h THR 268 CO 0.00 0.18 0.00 0.61 -0.25 0.00 0.00 175.52 176.06 2vvm n GLY 269 N 0.27 0.61 0.63 5.82 0.00 -1.09 -4.89 105.19 106.54 2vvm n GLY 269 Ca 0.01 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.08 2vvm n GLY 269 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vvm n ARG 270 N -2.29 2.82 -3.61 1.61 1.74 -1.26 -4.97 116.66 110.69 2vvm n ARG 270 Ca 0.00 -2.03 -0.38 0.00 -0.77 0.00 0.00 57.85 54.68 2vvm n ARG 270 Cb 0.04 -1.27 -0.11 0.00 -1.02 0.00 0.00 32.46 30.11 2vvm n ARG 270 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2vvm s LEU 271 N -1.00 4.03 0.08 0.55 2.96 -1.26 -1.11 118.68 122.94 2vvm s LEU 271 Ca 0.23 0.02 0.04 0.00 -0.22 0.00 0.00 54.13 54.20 2vvm s LEU 271 Cb 0.12 -2.11 -0.04 0.00 0.50 0.00 0.00 46.19 44.66 2vvm s LEU 271 CO 0.16 -0.02 0.03 -0.83 -1.32 0.00 0.00 176.35 174.36 2vvm s GLY 272 N 1.57 1.95 -0.03 7.98 0.00 0.46 -5.00 107.32 114.27 2vvm s GLY 272 Ca 0.07 -1.08 -0.17 0.00 0.00 0.00 0.00 44.72 43.55 2vvm s GLY 272 CO 0.09 -1.05 0.37 -2.52 0.00 0.00 0.00 173.10 169.99 2vvm s TYR 273 N -1.33 -0.26 -0.11 1.90 -0.85 -1.26 -0.49 117.35 114.95 2vvm s TYR 273 Ca 0.27 0.44 -0.03 0.00 -0.52 0.00 0.00 57.07 57.23 2vvm s TYR 273 Cb -0.12 0.14 0.04 0.00 0.38 0.00 0.00 41.96 42.41 2vvm s TYR 273 CO 0.19 -0.41 0.05 0.08 -1.52 0.00 0.00 175.55 173.95 2vvm s VAL 274 N -1.19 0.10 0.42 -3.49 1.01 -0.21 -2.72 120.40 114.31 2vvm s VAL 274 Ca -0.12 0.05 0.02 0.00 0.00 0.00 0.00 61.98 61.93 2vvm s VAL 274 Cb -0.04 -0.49 -0.00 0.00 0.00 0.00 0.00 36.38 35.85 2vvm s VAL 274 CO 0.05 0.01 0.61 -0.36 0.00 0.00 0.00 175.10 175.41 2vvm s PHE 275 N 2.07 3.16 -1.47 5.22 0.08 0.25 -1.04 117.98 126.25 2vvm s PHE 275 Ca 0.03 0.06 -0.07 0.00 0.12 0.00 0.00 56.93 57.08 2vvm s PHE 275 Cb -0.14 -2.24 0.01 0.00 -0.57 0.00 0.00 43.02 40.08 2vvm s PHE 275 CO -0.06 -0.28 0.90 0.41 -0.10 0.00 0.00 175.22 176.09 2vvm n GLY 276 N -1.95 -0.54 2.53 4.36 0.00 -0.24 -4.89 105.19 104.46 2vvm n GLY 276 Ca 0.01 0.20 -0.27 0.00 0.00 0.00 0.00 46.02 45.96 2vvm n GLY 276 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vvm s PRO 278 N -1.15 4.52 0.15 0.00 0.05 -1.26 -3.75 135.00 133.55 2vvm s PRO 278 Ca 0.32 1.58 -0.28 0.00 0.05 0.00 0.00 61.00 62.67 2vvm s PRO 278 Cb 0.06 -3.40 -0.07 0.00 0.05 0.00 0.00 34.50 31.14 2vvm s PRO 278 CO -0.14 -0.11 0.87 0.08 0.05 0.00 0.00 177.00 177.75 2vvm s VAL 279 N 0.90 4.40 -0.09 -0.36 1.01 -1.26 0.33 120.40 125.33 2vvm s VAL 279 Ca 0.54 1.90 0.08 0.00 0.00 0.00 0.00 61.98 64.50 2vvm s VAL 279 Cb -0.25 -4.24 -0.11 0.00 0.00 0.00 0.00 36.38 31.78 2vvm s VAL 279 CO 0.29 0.43 0.04 -2.11 0.00 0.00 0.00 175.10 173.74 2vvm n ARG 280 N 2.14 2.47 -3.77 2.72 1.85 0.61 -4.72 116.66 117.96 2vvm n ARG 280 Ca -0.02 -0.01 -0.12 0.00 -1.00 0.00 0.00 57.85 56.70 2vvm n ARG 280 Cb 0.49 -1.23 -0.08 0.00 -1.05 0.00 0.00 32.46 30.59 2vvm n ARG 280 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 2vvm s SER 281 N -4.07 -0.13 -0.12 2.89 1.04 -0.75 -1.87 113.70 110.69 2vvm s SER 281 Ca -0.04 -0.08 -0.01 0.00 0.48 0.00 0.00 55.95 56.29 2vvm s SER 281 Cb 0.03 0.32 0.04 0.00 0.10 0.00 0.00 66.02 66.51 2vvm s SER 281 CO 0.37 -0.53 -0.01 -0.69 0.98 0.00 0.00 173.24 173.36 2vvm s VAL 282 N -1.97 0.64 -0.15 5.02 1.01 0.76 -0.82 120.40 124.89 2vvm s VAL 282 Ca -0.09 -0.20 0.02 0.00 0.00 0.00 0.00 61.98 61.71 2vvm s VAL 282 Cb -0.03 -0.84 0.01 0.00 0.00 0.00 0.00 36.38 35.52 2vvm s VAL 282 CO 0.00 0.17 -0.20 -0.69 0.00 0.00 0.00 175.10 174.38 2vvm s VAL 283 N 1.85 2.15 -0.24 2.92 1.01 -0.02 -2.38 120.40 125.69 2vvm s VAL 283 Ca 0.03 -0.94 -0.29 0.00 0.00 0.00 0.00 61.98 60.78 2vvm s VAL 283 Cb -0.14 -1.88 0.00 0.00 0.00 0.00 0.00 36.38 34.37 2vvm s VAL 283 CO -0.07 0.54 1.15 0.20 0.00 0.00 0.00 175.10 176.92 2vvm s ASN 284 N 0.97 6.96 0.32 3.32 0.02 -0.10 -0.45 114.94 125.97 2vvm s ASN 284 Ca -0.03 1.38 0.03 0.00 -1.02 0.00 0.00 52.86 53.22 2vvm s ASN 284 Cb -0.15 -2.54 0.03 0.00 0.02 0.00 0.00 41.25 38.61 2vvm s ASN 284 CO -0.05 -0.80 0.22 -0.62 0.02 0.00 0.00 177.10 175.87 2vvm n GLU 285 N 6.65 1.04 -2.26 -0.60 1.02 0.34 -4.78 120.64 122.05 2vvm n GLU 285 Ca 0.13 -2.02 -0.43 0.00 -0.02 0.00 0.00 57.16 54.83 2vvm n GLU 285 Cb 0.46 0.24 -0.02 0.00 -0.02 0.00 0.00 31.44 32.10 2vvm n GLU 285 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 2vvm s ARG 286 N -3.30 3.98 0.00 3.49 0.52 -1.26 -3.27 118.95 119.11 2vvm s ARG 286 Ca 0.17 1.61 0.00 0.00 -0.52 0.00 0.00 55.73 56.99 2vvm s ARG 286 Cb -0.01 -3.92 0.00 0.00 0.52 0.00 0.00 34.95 31.53 2vvm s ARG 286 CO 0.11 -1.05 0.00 -0.25 0.02 0.00 0.00 175.30 174.12 2vvm n ASP 287 N 7.62 0.00 -3.90 0.23 8.00 -1.26 -4.93 116.55 122.31 2vvm n ASP 287 Ca 0.16 0.00 -0.09 0.00 0.71 0.00 0.00 54.79 55.58 2vvm n ASP 287 Cb 0.45 -0.86 -0.04 0.00 -0.02 0.00 0.00 41.12 40.65 2vvm n ASP 287 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2vvm s ALA 288 N -2.72 -0.68 0.03 2.24 0.00 -1.20 -4.57 121.76 114.85 2vvm s ALA 288 Ca 0.00 -0.57 0.06 0.00 0.00 0.00 0.00 51.96 51.45 2vvm s ALA 288 Cb 0.00 0.96 -0.02 0.00 0.00 0.00 0.00 23.12 24.06 2vvm s ALA 288 CO 0.00 -0.90 -0.18 0.00 0.00 0.00 0.00 175.76 174.68 2vvm s ALA 289 N -3.96 1.53 -0.19 0.00 0.00 0.67 -0.50 121.76 119.30 2vvm s ALA 289 Ca 0.16 -0.91 -0.04 0.00 0.00 0.00 0.00 51.96 51.17 2vvm s ALA 289 Cb -0.02 -0.31 -0.02 0.00 0.00 0.00 0.00 23.12 22.76 2vvm s ALA 289 CO 0.06 0.34 -0.02 0.50 0.00 0.00 0.00 175.76 176.64 2vvm s ARG 290 N -0.95 3.56 -0.18 0.00 3.52 0.40 -2.18 118.95 123.12 2vvm s ARG 290 Ca 0.06 -0.55 -0.03 0.00 -0.13 0.00 0.00 55.73 55.07 2vvm s ARG 290 Cb -0.08 -3.01 -0.02 0.00 -1.56 0.00 0.00 34.95 30.29 2vvm s ARG 290 CO 0.01 0.02 -0.04 0.08 -0.81 0.00 0.00 175.30 174.55 2vvm s VAL 291 N 0.96 3.60 -0.15 7.11 1.01 0.85 -0.84 120.40 132.94 2vvm s VAL 291 Ca 0.01 -0.44 -0.00 0.00 0.00 0.00 0.00 61.98 61.54 2vvm s VAL 291 Cb -0.14 -2.60 -0.01 0.00 0.00 0.00 0.00 36.38 33.63 2vvm s VAL 291 CO 0.01 0.46 -0.14 -0.89 0.00 0.00 0.00 175.10 174.54 2vvm s THR 292 N 0.88 2.84 0.82 3.92 2.01 0.00 -0.64 115.64 125.47 2vvm s THR 292 Ca -0.01 -0.72 -0.11 0.00 0.31 0.00 0.00 61.69 61.16 2vvm s THR 292 Cb -0.15 -2.20 0.08 0.00 0.01 0.00 0.00 72.50 70.25 2vvm s THR 292 CO 0.01 0.51 1.09 0.00 -0.69 0.00 0.00 174.62 175.55 2vvm s ALA 293 N 0.67 2.05 0.37 7.40 0.00 0.23 -0.28 121.76 132.19 2vvm s ALA 293 Ca -0.07 -0.07 0.09 0.00 0.00 0.00 0.00 51.96 51.91 2vvm s ALA 293 Cb -0.16 -3.16 0.83 0.00 0.00 0.00 0.00 23.12 20.63 2vvm s ALA 293 CO 0.02 -1.90 1.91 0.00 0.00 0.00 0.00 175.76 175.79 2vvm h ARG 294 N -1.22 0.65 -0.20 0.00 3.08 -0.41 -1.67 114.38 114.61 2vvm h ARG 294 Ca -0.47 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.54 2vvm h ARG 294 Cb 1.26 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 31.17 2vvm h ARG 294 CO 0.56 0.43 0.00 -0.40 -1.07 0.00 0.00 179.97 179.49 2vvm n ASP 295 N -4.52 1.24 0.00 7.04 5.75 -1.26 -4.90 116.55 119.90 2vvm n ASP 295 Ca 0.15 -1.87 0.00 0.00 -0.01 0.00 0.00 54.79 53.05 2vvm n ASP 295 Cb 0.40 -0.13 0.00 0.00 -1.03 0.00 0.00 41.12 40.36 2vvm n ASP 295 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2vvm n GLY 296 N 0.93 1.47 3.67 6.12 0.00 -0.63 -5.05 105.19 111.70 2vvm n GLY 296 Ca 0.11 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.68 2vvm n GLY 296 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vvm n ARG 297 N -2.00 2.01 -5.00 1.61 1.74 -1.26 -4.68 116.66 109.08 2vvm n ARG 297 Ca 0.00 0.71 -0.32 0.00 -0.77 0.00 0.00 57.85 57.47 2vvm n ARG 297 Cb 0.00 -2.33 -0.14 0.00 -1.02 0.00 0.00 32.46 28.97 2vvm n ARG 297 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2vvm s GLU 298 N -0.82 2.33 0.00 5.56 2.02 -1.26 -0.60 118.70 125.93 2vvm s GLU 298 Ca 0.65 -0.80 0.02 0.00 0.02 0.00 0.00 54.97 54.86 2vvm s GLU 298 Cb -0.63 -2.25 -0.01 0.00 0.10 0.00 0.00 34.13 31.34 2vvm s GLU 298 CO 0.53 0.60 -0.08 -0.06 0.02 0.00 0.00 175.26 176.27 2vvm s PHE 299 N -0.71 0.68 -0.02 1.61 0.08 0.18 -4.98 117.98 114.82 2vvm s PHE 299 Ca 0.11 -0.16 0.05 0.00 0.12 0.00 0.00 56.93 57.05 2vvm s PHE 299 Cb -0.10 -0.43 -0.01 0.00 -0.57 0.00 0.00 43.02 41.90 2vvm s PHE 299 CO 0.00 -0.01 -0.17 0.08 -0.10 0.00 0.00 175.22 175.03 2vvm s VAL 300 N -0.30 1.32 0.12 -0.44 1.01 -1.26 -0.11 120.40 120.75 2vvm s VAL 300 Ca 0.02 -0.70 -0.13 0.00 0.00 0.00 0.00 61.98 61.17 2vvm s VAL 300 Cb -0.04 -1.11 0.02 0.00 0.00 0.00 0.00 36.38 35.25 2vvm s VAL 300 CO -0.00 0.38 0.32 0.00 0.00 0.00 0.00 175.10 175.80 2vvm s ALA 301 N -0.26 -0.60 0.18 5.51 0.00 -0.93 -3.83 121.76 121.83 2vvm s ALA 301 Ca 0.04 -0.33 -0.12 0.00 0.00 0.00 0.00 51.96 51.55 2vvm s ALA 301 Cb -0.08 0.63 0.09 0.00 0.00 0.00 0.00 23.12 23.77 2vvm s ALA 301 CO 0.00 -0.60 1.78 0.87 0.00 0.00 0.00 175.76 177.81 2vvm h LYS 302 N 2.51 0.88 -4.78 0.00 1.57 -1.30 0.19 116.57 115.64 2vvm h LYS 302 Ca -0.34 -0.11 -0.28 0.00 -1.87 0.00 0.00 60.65 58.05 2vvm h LYS 302 Cb 1.23 -0.17 -0.18 0.00 0.08 0.00 0.00 32.23 33.20 2vvm h LYS 302 CO 0.50 0.68 -0.72 1.03 -0.57 0.00 0.00 179.45 180.37 2vvm s ARG 303 N -5.79 0.77 -0.07 3.15 1.81 -0.97 -4.22 118.95 113.62 2vvm s ARG 303 Ca -0.13 -1.12 0.04 0.00 -1.72 0.00 0.00 55.73 52.80 2vvm s ARG 303 Cb 0.13 -0.38 0.00 0.00 -0.45 0.00 0.00 34.95 34.25 2vvm s ARG 303 CO 0.78 0.04 -0.20 0.08 -0.68 0.00 0.00 175.30 175.33 2vvm s VAL 304 N -2.57 1.70 -0.40 3.52 1.01 0.02 -1.65 120.40 122.03 2vvm s VAL 304 Ca 0.04 -0.83 -0.12 0.00 0.00 0.00 0.00 61.98 61.07 2vvm s VAL 304 Cb -0.02 -1.48 0.04 0.00 0.00 0.00 0.00 36.38 34.92 2vvm s VAL 304 CO -0.01 0.48 0.25 -0.69 0.00 0.00 0.00 175.10 175.13 2vvm s VAL 305 N 0.29 4.71 -0.34 2.92 1.01 0.48 0.02 120.40 129.48 2vvm s VAL 305 Ca -0.13 -0.94 -0.16 0.00 0.00 0.00 0.00 61.98 60.75 2vvm s VAL 305 Cb -0.16 -3.69 -0.01 0.00 0.00 0.00 0.00 36.38 32.53 2vvm s VAL 305 CO 0.06 -0.33 0.42 0.00 0.00 0.00 0.00 175.10 175.24 2vvm n THR 307 N 5.31 1.03 -1.66 0.00 -2.24 -0.03 -1.49 114.28 115.20 2vvm n THR 307 Ca -0.08 -1.02 -0.46 0.00 -2.27 0.00 0.00 64.05 60.23 2vvm n THR 307 Cb 0.49 0.48 -0.03 0.00 -2.10 0.00 0.00 70.33 69.17 2vvm n THR 307 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 2vvm n ILE 308 N 0.81 0.80 -1.46 2.28 5.41 -1.25 -4.78 119.36 121.17 2vvm n ILE 308 Ca 0.15 -0.20 -0.34 0.00 1.00 0.00 0.00 62.75 63.36 2vvm n ILE 308 Cb 0.49 -1.40 0.09 0.00 -0.71 0.00 0.00 39.64 38.11 2vvm n ILE 308 CO 0.00 0.00 0.00 -2.84 0.00 0.00 0.00 176.55 173.71 2vvm s PRO 309 N -0.22 2.20 0.23 0.38 0.02 -1.26 -4.79 135.00 131.56 2vvm s PRO 309 Ca 0.70 1.70 -0.09 0.00 0.02 0.00 0.00 61.00 63.33 2vvm s PRO 309 Cb -0.68 -1.85 0.35 0.00 0.02 0.00 0.00 34.50 32.34 2vvm s PRO 309 CO 0.48 -1.78 1.65 1.25 -0.33 0.00 0.00 177.00 178.28 2vvm h LEU 310 N -0.30 -0.29 0.00 -5.54 5.85 -1.92 -1.21 115.31 111.91 2vvm h LEU 310 Ca -0.47 0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.41 2vvm h LEU 310 Cb 1.29 0.29 0.00 0.00 0.37 0.00 0.00 40.66 42.61 2vvm h LEU 310 CO 0.50 -0.13 0.00 0.59 -0.34 0.00 0.00 178.44 179.06 2vvm n ASN 311 N -5.30 0.00 -0.00 1.25 4.13 -1.26 -2.47 115.26 111.61 2vvm n ASN 311 Ca 0.11 -0.33 0.04 0.00 1.68 0.00 0.00 54.58 56.08 2vvm n ASN 311 Cb 0.40 -0.14 -0.06 0.00 -1.54 0.00 0.00 39.78 38.44 2vvm n ASN 311 CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06 2vvm n VAL 312 N -1.14 0.00 0.28 2.41 0.31 -0.52 -4.72 118.33 114.96 2vvm n VAL 312 Ca 0.13 -0.23 0.13 0.00 -0.01 0.00 0.00 64.34 64.36 2vvm n VAL 312 Cb 0.12 0.50 0.83 0.00 -0.91 0.00 0.00 33.84 34.38 2vvm n VAL 312 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2vvm h LEU 313 N 0.00 0.00 -0.23 7.52 3.38 -1.06 -1.95 115.31 122.97 2vvm h LEU 313 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2vvm h LEU 313 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 2vvm h LEU 313 CO 0.00 0.02 0.00 -1.54 0.09 0.00 0.00 178.44 177.01 2vvm n SER 314 N -3.98 0.19 -0.08 -0.43 3.41 -1.26 -2.03 113.62 109.44 2vvm n SER 314 Ca -0.03 0.55 0.14 0.00 -0.26 0.00 0.00 58.87 59.27 2vvm n SER 314 Cb 0.11 -0.59 0.51 0.00 -0.26 0.00 0.00 64.21 63.98 2vvm n SER 314 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 2vvm n THR 315 N -1.71 0.00 -4.17 6.66 -2.24 -0.73 -4.91 114.28 107.18 2vvm n THR 315 Ca 0.03 -0.04 -0.33 0.00 -2.27 0.00 0.00 64.05 61.44 2vvm n THR 315 Cb 0.16 -0.06 -0.08 0.00 -2.10 0.00 0.00 70.33 68.25 2vvm n THR 315 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2vvm s ILE 316 N -2.70 4.51 -0.32 2.28 -1.09 -0.86 -4.91 121.20 118.10 2vvm s ILE 316 Ca 0.21 -0.47 -0.12 0.00 -2.23 0.00 0.00 60.65 58.05 2vvm s ILE 316 Cb 0.19 -3.04 -0.02 0.00 -1.58 0.00 0.00 42.46 38.01 2vvm s ILE 316 CO 0.54 0.37 0.21 -1.10 -1.23 0.00 0.00 174.94 173.73 2vvm s GLN 317 N -1.64 3.58 -0.06 2.79 -0.21 -0.78 -5.01 119.66 118.33 2vvm s GLN 317 Ca 0.21 -0.57 0.02 0.00 0.02 0.00 0.00 55.36 55.04 2vvm s GLN 317 Cb -0.12 -3.73 -0.03 0.00 1.00 0.00 0.00 33.01 30.14 2vvm s GLN 317 CO 0.12 -0.37 -0.11 -0.06 -2.12 0.00 0.00 175.29 172.75 2vvm s PHE 318 N 1.71 2.81 -0.08 0.91 0.08 -1.26 -0.17 117.98 121.99 2vvm s PHE 318 Ca 0.06 -0.09 -0.03 0.00 0.12 0.00 0.00 56.93 56.99 2vvm s PHE 318 Cb -0.17 -1.67 0.04 0.00 -0.57 0.00 0.00 43.02 40.65 2vvm s PHE 318 CO 0.10 0.24 0.16 -1.54 -0.10 0.00 0.00 175.22 174.09 2vvm s SER 319 N -0.74 0.13 0.79 1.36 1.04 -1.00 -3.93 113.70 111.36 2vvm s SER 319 Ca 0.11 0.34 -0.11 0.00 0.48 0.00 0.00 55.95 56.78 2vvm s SER 319 Cb -0.11 0.26 0.07 0.00 0.10 0.00 0.00 66.02 66.34 2vvm s SER 319 CO 0.01 -0.18 1.09 -2.16 0.98 0.00 0.00 173.24 172.98 2vvm s PRO 320 N 1.54 2.10 0.33 4.02 0.04 -1.26 -0.93 135.00 140.84 2vvm s PRO 320 Ca -0.05 0.92 -0.28 0.00 0.04 0.00 0.00 61.00 61.62 2vvm s PRO 320 Cb -0.12 -1.90 -0.13 0.00 0.04 0.00 0.00 34.50 32.40 2vvm s PRO 320 CO -0.06 -1.68 1.26 0.00 0.04 0.00 0.00 177.00 176.56 2vvm n ALA 321 N -3.52 1.09 -1.26 8.56 0.00 -1.25 -4.97 120.51 119.15 2vvm n ALA 321 Ca 0.08 0.37 -0.31 0.00 0.00 0.00 0.00 53.44 53.57 2vvm n ALA 321 Cb 0.54 -2.23 0.09 0.00 0.00 0.00 0.00 19.45 17.86 2vvm n ALA 321 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2vvm s LEU 322 N -0.74 3.05 0.92 0.00 1.43 -1.26 -5.02 118.68 117.05 2vvm s LEU 322 Ca 0.57 1.85 -0.12 0.00 -1.03 0.00 0.00 54.13 55.40 2vvm s LEU 322 Cb -0.59 -4.52 0.14 0.00 0.03 0.00 0.00 46.19 41.24 2vvm s LEU 322 CO 0.61 -2.04 1.09 -0.94 0.23 0.00 0.00 176.35 175.30 2vvm s SER 323 N -3.31 3.25 0.21 2.29 1.04 -1.26 -4.81 113.70 111.11 2vvm s SER 323 Ca 0.62 1.53 -0.10 0.00 0.48 0.00 0.00 55.95 58.47 2vvm s SER 323 Cb -0.18 -2.20 0.16 0.00 0.10 0.00 0.00 66.02 63.91 2vvm s SER 323 CO 0.55 -2.79 1.86 0.74 0.98 0.00 0.00 173.24 174.59 2vvm h THR 324 N -1.65 1.15 -0.44 2.02 2.02 -1.99 -1.33 112.91 112.69 2vvm h THR 324 Ca -0.50 -0.32 -0.12 0.00 0.77 0.00 0.00 66.41 66.24 2vvm h THR 324 Cb 1.29 0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 67.83 2vvm h THR 324 CO 0.54 0.17 -0.21 -0.33 0.37 0.00 0.00 175.52 176.05 2vvm h GLU 325 N 0.93 0.92 -0.32 6.66 3.07 -1.94 -0.92 114.58 122.96 2vvm h GLU 325 Ca 0.27 -0.40 -0.01 0.00 -0.50 0.00 0.00 59.36 58.72 2vvm h GLU 325 Cb -0.06 -0.03 -0.02 0.00 -0.84 0.00 0.00 28.75 27.81 2vvm h GLU 325 CO -0.08 1.06 0.18 -0.09 -1.40 0.00 0.00 179.01 178.68 2vvm h ARG 326 N 0.75 0.45 -0.49 2.33 2.43 -1.76 -1.85 114.38 116.24 2vvm h ARG 326 Ca 0.10 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.19 2vvm h ARG 326 Cb 0.79 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.23 2vvm h ARG 326 CO 0.06 0.38 0.21 0.82 -1.51 0.00 0.00 179.97 179.94 2vvm h ILE 327 N 0.40 1.20 -0.61 1.20 2.04 -1.10 -1.68 117.51 118.97 2vvm h ILE 327 Ca 0.11 -0.60 -0.07 0.00 1.00 0.00 0.00 64.86 65.30 2vvm h ILE 327 Cb 0.06 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 2vvm h ILE 327 CO -0.02 0.23 0.12 0.77 0.00 0.00 0.00 178.15 179.25 2vvm h SER 328 N 0.65 0.95 -0.61 1.72 4.64 -1.07 -0.65 113.55 119.18 2vvm h SER 328 Ca 0.17 -0.25 -0.01 0.00 -0.47 0.00 0.00 61.79 61.23 2vvm h SER 328 Cb 0.16 -0.25 -0.03 0.00 -0.31 0.00 0.00 62.40 61.97 2vvm h SER 328 CO -0.02 0.96 0.35 0.00 -0.87 0.00 0.00 176.83 177.25 2vvm h ALA 329 N 1.03 0.79 -0.61 5.18 0.00 -1.26 -1.50 119.26 122.88 2vvm h ALA 329 Ca 0.19 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 2vvm h ALA 329 Cb 0.40 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 2vvm h ALA 329 CO 0.01 0.28 0.05 0.52 0.00 0.00 0.00 179.25 180.11 2vvm h MET 330 N 0.83 1.04 0.14 0.00 2.07 -0.98 0.95 114.93 118.99 2vvm h MET 330 Ca 0.22 -0.30 -0.30 0.00 -2.07 0.00 0.00 59.70 57.26 2vvm h MET 330 Cb 0.01 -0.11 0.02 0.00 -1.87 0.00 0.00 31.60 29.65 2vvm h MET 330 CO -0.04 0.99 -1.27 1.96 1.07 0.00 0.00 176.91 179.61 2vvm h GLN 331 N 0.96 0.50 0.06 1.72 4.20 -1.02 -3.29 115.11 118.25 2vvm h GLN 331 Ca 0.18 -0.73 -0.00 0.00 0.06 0.00 0.00 58.65 58.16 2vvm h GLN 331 Cb 0.49 0.25 0.00 0.00 0.30 0.00 0.00 27.48 28.52 2vvm h GLN 331 CO 0.02 1.33 -0.03 0.00 -0.67 0.00 0.00 178.83 179.48 2vvm h ALA 332 N 0.38 -0.09 -0.24 3.87 0.00 -1.27 -3.50 119.26 118.41 2vvm h ALA 332 Ca -0.18 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.56 2vvm h ALA 332 Cb 1.96 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.78 2vvm h ALA 332 CO 0.23 -0.37 -0.07 0.41 0.00 0.00 0.00 179.25 179.45 2vvm n GLY 333 N -0.15 -2.80 3.85 0.00 0.00 0.33 -4.98 105.19 101.44 2vvm n GLY 333 Ca -0.08 -1.33 -0.30 0.00 0.00 0.00 0.00 46.02 44.31 2vvm n GLY 333 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 2vvm s HIS 334 N -3.71 3.02 -1.80 1.61 -3.43 -1.26 -4.78 115.29 104.94 2vvm s HIS 334 Ca 0.00 1.03 0.21 0.00 -0.80 0.00 0.00 55.06 55.50 2vvm s HIS 334 Cb 0.00 -3.17 -0.03 0.00 -1.43 0.00 0.00 32.58 27.95 2vvm s HIS 334 CO 0.00 -1.58 1.01 1.33 -2.00 0.00 0.00 174.74 173.50 2vvm n VAL 335 N -3.27 0.00 -2.34 -5.38 0.24 0.43 -4.91 118.33 103.10 2vvm n VAL 335 Ca 0.07 -0.25 -0.42 0.00 -2.04 0.00 0.00 64.34 61.70 2vvm n VAL 335 Cb 0.57 1.22 -0.02 0.00 -1.47 0.00 0.00 33.84 34.14 2vvm n VAL 335 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2vvm s SER 336 N -2.40 6.20 -0.35 -1.34 0.15 -1.21 -3.61 113.70 111.13 2vvm s SER 336 Ca 0.16 0.63 0.06 0.00 0.70 0.00 0.00 55.95 57.50 2vvm s SER 336 Cb 0.17 -2.54 0.46 0.00 -1.71 0.00 0.00 66.02 62.40 2vvm s SER 336 CO 0.56 -1.59 1.40 0.23 1.20 0.00 0.00 173.24 175.05 2vvm n MET 337 N 8.35 2.93 -1.64 5.44 0.00 -0.66 -0.85 117.12 130.69 2vvm n MET 337 Ca 0.15 -3.75 -0.48 0.00 0.00 0.00 0.00 57.70 53.62 2vvm n MET 337 Cb 0.49 -2.14 -0.05 0.00 0.00 0.00 0.00 33.22 31.52 2vvm n MET 337 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2vvm s THR 339 N 0.73 5.32 -0.24 0.00 2.01 -0.26 -4.71 115.64 118.49 2vvm s THR 339 Ca 0.81 0.18 0.02 0.00 0.31 0.00 0.00 61.69 63.01 2vvm s THR 339 Cb -0.79 -3.53 0.05 0.00 0.01 0.00 0.00 72.50 68.25 2vvm s THR 339 CO 0.41 0.27 -0.13 -0.75 -0.69 0.00 0.00 174.62 173.74 2vvm s LYS 340 N 1.58 2.44 -0.15 4.92 2.20 -1.26 -0.17 119.74 129.29 2vvm s LYS 340 Ca 0.07 -1.21 0.02 0.00 -0.36 0.00 0.00 55.97 54.49 2vvm s LYS 340 Cb -0.15 -2.82 0.01 0.00 -1.51 0.00 0.00 37.83 33.36 2vvm s LYS 340 CO 0.09 -0.48 -0.21 0.08 -0.36 0.00 0.00 175.35 174.47 2vvm s VAL 341 N 1.15 2.04 -0.07 4.02 1.01 -0.00 -4.41 120.40 124.14 2vvm s VAL 341 Ca -0.05 -0.96 -0.19 0.00 0.00 0.00 0.00 61.98 60.78 2vvm s VAL 341 Cb -0.18 -1.82 -0.05 0.00 0.00 0.00 0.00 36.38 34.33 2vvm s VAL 341 CO -0.07 0.54 0.51 -1.00 0.00 0.00 0.00 175.10 175.09 2vvm s HIS 342 N 0.96 3.59 -0.11 5.22 3.76 -0.12 -0.57 115.29 128.02 2vvm s HIS 342 Ca -0.04 1.01 0.01 0.00 -0.15 0.00 0.00 55.06 55.90 2vvm s HIS 342 Cb -0.15 -2.55 0.02 0.00 1.11 0.00 0.00 32.58 31.01 2vvm s HIS 342 CO -0.05 0.28 -0.14 0.00 -0.85 0.00 0.00 174.74 173.97 2vvm s ALA 343 N 0.19 1.63 -0.32 -1.40 0.00 0.20 -1.50 121.76 120.57 2vvm s ALA 343 Ca 0.28 -0.70 -0.20 0.00 0.00 0.00 0.00 51.96 51.33 2vvm s ALA 343 Cb -0.16 -0.83 -0.01 0.00 0.00 0.00 0.00 23.12 22.12 2vvm s ALA 343 CO 0.13 -0.11 0.63 -2.00 0.00 0.00 0.00 175.76 174.41 2vvm s GLU 344 N 1.06 3.85 0.21 0.00 2.12 -0.08 -0.21 118.70 125.64 2vvm s GLU 344 Ca -0.05 0.25 0.11 0.00 0.36 0.00 0.00 54.97 55.63 2vvm s GLU 344 Cb -0.15 -3.75 -0.04 0.00 0.26 0.00 0.00 34.13 30.45 2vvm s GLU 344 CO -0.02 -0.61 -0.22 0.14 -0.54 0.00 0.00 175.26 174.00 2vvm s VAL 345 N 2.64 2.44 -2.12 3.70 -7.23 -0.08 0.18 120.40 119.93 2vvm s VAL 345 Ca 0.25 -2.06 0.15 0.00 -1.81 0.00 0.00 61.98 58.51 2vvm s VAL 345 Cb -0.15 -2.19 0.37 0.00 0.56 0.00 0.00 36.38 34.98 2vvm s VAL 345 CO 0.13 -0.16 1.39 -0.90 -0.31 0.00 0.00 175.10 175.24 2vvm n ASP 346 N 0.11 1.71 -4.41 4.85 5.68 -0.63 -2.25 116.55 121.60 2vvm n ASP 346 Ca -0.11 -1.86 -0.44 0.00 -0.50 0.00 0.00 54.79 51.87 2vvm n ASP 346 Cb 0.57 -0.17 -0.06 0.00 -1.14 0.00 0.00 41.12 40.32 2vvm n ASP 346 CO 0.00 0.00 0.00 0.21 -1.33 0.00 0.00 177.20 176.08 2vvm s ASN 347 N -1.25 6.20 0.41 -1.12 3.84 -1.26 -4.94 114.94 116.82 2vvm s ASN 347 Ca 0.27 -1.17 0.10 0.00 0.21 0.00 0.00 52.86 52.27 2vvm s ASN 347 Cb 0.14 -2.28 0.86 0.00 -0.55 0.00 0.00 41.25 39.42 2vvm s ASN 347 CO 0.20 -0.94 1.97 0.11 -2.79 0.00 0.00 177.10 175.65 2vvm h LYS 348 N 9.03 0.26 0.00 0.43 1.57 -1.85 -2.91 116.57 123.10 2vvm h LYS 348 Ca -0.28 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.45 2vvm h LYS 348 Cb 1.09 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.36 2vvm h LYS 348 CO 1.00 0.32 0.00 -0.25 -0.57 0.00 0.00 179.45 179.96 2vvm n ASP 349 N -4.34 0.10 -0.12 0.86 8.00 -1.26 -3.08 116.55 116.71 2vvm n ASP 349 Ca -0.00 0.52 0.08 0.00 0.71 0.00 0.00 54.79 56.10 2vvm n ASP 349 Cb 0.21 -0.54 0.45 0.00 -0.02 0.00 0.00 41.12 41.22 2vvm n ASP 349 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 2vvm n MET 350 N -1.60 1.16 -0.26 -1.24 2.81 -1.10 -0.69 117.12 116.20 2vvm n MET 350 Ca 0.05 -0.24 0.13 0.00 -1.81 0.00 0.00 57.70 55.83 2vvm n MET 350 Cb 0.26 -1.28 0.40 0.00 -0.71 0.00 0.00 33.22 31.89 2vvm n MET 350 CO 0.00 0.00 0.00 -0.09 1.51 0.00 0.00 175.97 177.39 2vvm h ARG 351 N 0.46 0.63 -0.53 0.03 9.65 -1.77 -1.88 114.38 120.97 2vvm h ARG 351 Ca 0.00 -0.04 -0.06 0.00 -1.10 0.00 0.00 59.98 58.78 2vvm h ARG 351 Cb 0.10 -0.14 -0.04 0.00 -1.39 0.00 0.00 29.97 28.50 2vvm h ARG 351 CO 0.00 0.41 0.06 -1.13 2.80 0.00 0.00 179.97 182.12 2vvm n SER 352 N -4.55 4.96 -4.88 -3.80 3.41 -1.24 -4.39 113.62 103.12 2vvm n SER 352 Ca 0.17 -3.06 -0.35 0.00 -0.26 0.00 0.00 58.87 55.37 2vvm n SER 352 Cb 0.49 -0.67 -0.05 0.00 -0.26 0.00 0.00 64.21 63.72 2vvm n SER 352 CO 0.00 0.00 0.00 0.86 -0.16 0.00 0.00 175.04 175.74 2vvm s TRP 353 N -2.87 3.59 0.10 7.33 -0.00 -0.71 -3.19 118.94 123.20 2vvm s TRP 353 Ca 0.52 0.59 0.04 0.00 -0.00 0.00 0.00 56.10 57.24 2vvm s TRP 353 Cb 0.41 -1.99 -0.04 0.00 -0.00 0.00 0.00 33.47 31.84 2vvm s TRP 353 CO 0.13 0.64 -0.10 0.95 -0.00 0.00 0.00 176.95 178.58 2vvm s THR 354 N -1.23 0.94 -0.05 5.86 -4.23 -0.95 -0.87 115.64 115.11 2vvm s THR 354 Ca 0.25 -1.69 -0.12 0.00 -1.18 0.00 0.00 61.69 58.94 2vvm s THR 354 Cb -0.13 -1.42 0.02 0.00 1.34 0.00 0.00 72.50 72.31 2vvm s THR 354 CO 0.14 -0.59 0.29 -0.83 -0.54 0.00 0.00 174.62 173.08 2vvm s GLY 355 N -2.54 -0.16 -0.10 3.99 0.00 -0.05 -0.86 107.32 107.60 2vvm s GLY 355 Ca 0.07 0.49 0.00 0.00 0.00 0.00 0.00 44.72 45.28 2vvm s GLY 355 CO -0.00 0.32 -0.09 -0.42 0.00 0.00 0.00 173.10 172.91 2vvm s ILE 356 N -0.75 1.06 -0.23 0.90 1.01 -0.76 -1.10 121.20 121.32 2vvm s ILE 356 Ca -0.08 -0.36 0.01 0.00 0.00 0.00 0.00 60.65 60.23 2vvm s ILE 356 Cb -0.04 -1.04 0.06 0.00 0.01 0.00 0.00 42.46 41.44 2vvm s ILE 356 CO 0.02 0.36 -0.09 0.00 0.00 0.00 0.00 174.94 175.24 2vvm s ALA 357 N 1.34 2.17 -0.23 9.38 0.00 -0.05 -0.47 121.76 133.90 2vvm s ALA 357 Ca -0.02 -1.45 -0.18 0.00 0.00 0.00 0.00 51.96 50.31 2vvm s ALA 357 Cb -0.14 -1.44 0.06 0.00 0.00 0.00 0.00 23.12 21.60 2vvm s ALA 357 CO -0.04 -1.10 0.60 -0.47 0.00 0.00 0.00 175.76 174.75 2vvm s TYR 358 N 1.30 -0.74 -1.96 0.00 5.04 -0.37 -4.18 117.35 116.44 2vvm s TYR 358 Ca -0.06 1.69 0.21 0.00 -2.44 0.00 0.00 57.07 56.47 2vvm s TYR 358 Cb -0.19 0.32 0.53 0.00 0.35 0.00 0.00 41.96 42.97 2vvm s TYR 358 CO -0.06 -0.37 1.45 -0.35 -1.34 0.00 0.00 175.55 174.88 2vvm n PRO 359 N 3.29 2.63 0.05 4.97 -0.04 -1.26 -4.19 135.00 140.46 2vvm n PRO 359 Ca -0.16 -2.45 0.13 0.00 -0.04 0.00 0.00 63.50 60.97 2vvm n PRO 359 Cb 0.56 -1.51 0.50 0.00 -0.04 0.00 0.00 33.50 33.01 2vvm n PRO 359 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 2vvm n PHE 360 N 1.44 0.40 -4.29 0.54 1.16 -1.26 -4.85 117.46 110.60 2vvm n PHE 360 Ca 0.21 0.12 -0.31 0.00 -1.87 0.00 0.00 57.45 55.60 2vvm n PHE 360 Cb 0.59 -0.70 -0.09 0.00 -1.61 0.00 0.00 39.48 37.66 2vvm n PHE 360 CO 0.00 0.00 0.00 1.21 -1.87 0.00 0.00 176.76 176.10 2vvm s ASN 361 N -3.64 4.71 0.00 5.98 2.47 -1.26 -5.02 114.94 118.17 2vvm s ASN 361 Ca 0.11 -0.21 0.29 0.00 0.42 0.00 0.00 52.86 53.46 2vvm s ASN 361 Cb 0.15 -1.06 1.26 0.00 -1.45 0.00 0.00 41.25 40.14 2vvm s ASN 361 CO 0.51 0.22 1.93 0.29 -3.72 0.00 0.00 177.10 176.33 2vvm n LYS 362 N 1.02 0.07 -4.38 0.43 5.02 -1.26 -4.40 118.16 114.66 2vvm n LYS 362 Ca -0.13 0.01 -0.30 0.00 -2.02 0.00 0.00 58.31 55.86 2vvm n LYS 362 Cb 0.52 -1.50 -0.17 0.00 -0.02 0.00 0.00 35.03 33.87 2vvm n LYS 362 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2vvm s LEU 363 N -2.93 1.84 -0.01 -0.35 1.43 -1.26 -4.38 118.68 113.01 2vvm s LEU 363 Ca 0.16 -0.50 0.11 0.00 -1.03 0.00 0.00 54.13 52.87 2vvm s LEU 363 Cb 0.19 -1.23 -0.17 0.00 0.03 0.00 0.00 46.19 45.01 2vvm s LEU 363 CO 0.51 0.01 0.27 0.00 0.23 0.00 0.00 176.35 177.37 2vvm s TYR 365 N -2.74 0.34 0.01 0.00 6.14 -1.07 -0.87 117.35 119.16 2vvm s TYR 365 Ca -0.04 -0.02 -0.13 0.00 0.64 0.00 0.00 57.07 57.53 2vvm s TYR 365 Cb 0.07 -0.40 0.02 0.00 0.42 0.00 0.00 41.96 42.07 2vvm s TYR 365 CO 0.48 -0.12 0.28 0.00 0.64 0.00 0.00 175.55 176.82 2vvm s ALA 366 N 0.89 -0.65 0.04 3.97 0.00 -0.26 -0.25 121.76 125.49 2vvm s ALA 366 Ca -0.09 0.11 0.02 0.00 0.00 0.00 0.00 51.96 51.99 2vvm s ALA 366 Cb -0.12 0.18 -0.02 0.00 0.00 0.00 0.00 23.12 23.15 2vvm s ALA 366 CO -0.01 -0.31 -0.07 0.96 0.00 0.00 0.00 175.76 176.32 2vvm s ILE 367 N -1.87 0.47 0.04 0.00 -4.36 -0.83 -0.88 121.20 113.78 2vvm s ILE 367 Ca -0.10 -1.08 -0.30 0.00 -0.26 0.00 0.00 60.65 58.90 2vvm s ILE 367 Cb -0.04 -0.59 -0.07 0.00 1.25 0.00 0.00 42.46 43.02 2vvm s ILE 367 CO 0.01 -0.42 1.53 -0.83 0.24 0.00 0.00 174.94 175.47 2vvm s GLY 368 N -1.61 1.70 0.00 6.27 0.00 -0.05 -1.51 107.32 112.12 2vvm s GLY 368 Ca -0.10 1.06 0.00 0.00 0.00 0.00 0.00 44.72 45.67 2vvm s GLY 368 CO -0.00 2.70 0.00 1.34 0.00 0.00 0.00 173.10 177.14 2vvm n ASP 369 N 5.45 1.72 0.00 1.64 2.03 0.80 -4.61 116.55 123.58 2vvm n ASP 369 Ca 0.14 -0.30 0.00 0.00 0.52 0.00 0.00 54.79 55.16 2vvm n ASP 369 Cb 0.42 0.94 0.00 0.00 -0.72 0.00 0.00 41.12 41.76 2vvm n ASP 369 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2vvm n GLY 370 N 1.46 -1.67 3.02 0.27 0.00 -1.19 -4.62 105.19 102.45 2vvm n GLY 370 Ca 0.00 -1.11 -0.24 0.00 0.00 0.00 0.00 46.02 44.67 2vvm n GLY 370 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2vvm s THR 371 N -2.05 1.10 0.74 2.61 2.01 -1.26 -0.75 115.64 118.03 2vvm s THR 371 Ca 0.00 -0.46 -0.12 0.00 0.31 0.00 0.00 61.69 61.42 2vvm s THR 371 Cb 0.00 -1.00 0.04 0.00 0.01 0.00 0.00 72.50 71.54 2vvm s THR 371 CO 0.00 0.34 1.11 0.42 -0.69 0.00 0.00 174.62 175.80 2vvm s THR 372 N 0.63 3.23 0.54 -0.82 -4.23 -0.12 -4.90 115.64 109.97 2vvm s THR 372 Ca -0.13 0.40 0.21 0.00 -1.18 0.00 0.00 61.69 60.98 2vvm s THR 372 Cb -0.15 -3.33 0.31 0.00 1.34 0.00 0.00 72.50 70.67 2vvm s THR 372 CO 0.03 -0.52 2.17 -0.65 -0.54 0.00 0.00 174.62 175.11 2vvm h PRO 373 N -0.81 0.00 0.00 3.99 0.11 -1.85 0.60 132.00 134.03 2vvm h PRO 373 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2vvm h PRO 373 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2vvm h PRO 373 CO 0.63 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.42 2vvm n ALA 374 N -2.47 2.30 -0.83 -0.75 0.00 -1.26 -4.87 120.51 112.63 2vvm n ALA 374 Ca -0.02 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.30 2vvm n ALA 374 Cb 0.13 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.28 2vvm n ALA 374 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2vvm n GLY 375 N 0.35 0.57 3.88 0.00 0.00 0.20 -5.04 105.19 105.14 2vvm n GLY 375 Ca 0.14 -0.18 -0.32 0.00 0.00 0.00 0.00 46.02 45.67 2vvm n GLY 375 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2vvm s ASN 376 N -2.16 6.61 0.11 1.61 0.01 -1.26 -4.74 114.94 115.13 2vvm s ASN 376 Ca 0.00 0.91 -0.30 0.00 -0.71 0.00 0.00 52.86 52.76 2vvm s ASN 376 Cb 0.00 -2.22 -0.06 0.00 0.41 0.00 0.00 41.25 39.38 2vvm s ASN 376 CO 0.00 -0.09 1.06 -0.89 -1.51 0.00 0.00 177.10 175.68 2vvm s THR 377 N -1.85 4.22 -0.28 1.60 2.01 -0.96 -0.94 115.64 119.45 2vvm s THR 377 Ca 0.47 1.78 -0.15 0.00 0.31 0.00 0.00 61.69 64.10 2vvm s THR 377 Cb -0.11 -4.14 -0.03 0.00 0.01 0.00 0.00 72.50 68.23 2vvm s THR 377 CO 0.22 0.24 0.37 -2.28 -0.69 0.00 0.00 174.62 172.47 2vvm s HIS 378 N 0.26 3.24 -0.14 4.92 2.46 0.07 -0.90 115.29 125.20 2vvm s HIS 378 Ca 0.51 0.35 -0.06 0.00 0.47 0.00 0.00 55.06 56.33 2vvm s HIS 378 Cb -0.26 -2.58 -0.04 0.00 -0.13 0.00 0.00 32.58 29.57 2vvm s HIS 378 CO 0.31 -0.25 0.08 -0.51 -2.47 0.00 0.00 174.74 171.91 2vvm s LEU 379 N 2.06 4.01 -0.18 8.88 1.43 0.70 -0.14 118.68 135.45 2vvm s LEU 379 Ca 0.14 0.26 -0.03 0.00 -1.03 0.00 0.00 54.13 53.47 2vvm s LEU 379 Cb -0.16 -1.98 -0.02 0.00 0.03 0.00 0.00 46.19 44.06 2vvm s LEU 379 CO 0.10 0.32 -0.05 0.54 0.23 0.00 0.00 176.35 177.49 2vvm s VAL 380 N -0.47 3.58 -0.03 -1.59 0.11 -0.57 -0.62 120.40 120.80 2vvm s VAL 380 Ca 0.11 -0.45 0.07 0.00 -2.93 0.00 0.00 61.98 58.77 2vvm s VAL 380 Cb -0.12 -2.58 -0.01 0.00 -1.53 0.00 0.00 36.38 32.14 2vvm s VAL 380 CO 0.02 0.47 -0.23 0.00 -3.33 0.00 0.00 175.10 172.03 2vvm s PHE 382 N -0.37 1.80 0.14 0.00 0.08 0.65 -0.82 117.98 119.46 2vvm s PHE 382 Ca 0.04 -0.46 0.05 0.00 0.12 0.00 0.00 56.93 56.69 2vvm s PHE 382 Cb -0.11 -1.19 -0.04 0.00 -0.57 0.00 0.00 43.02 41.11 2vvm s PHE 382 CO 0.01 -0.12 -0.12 0.20 -0.10 0.00 0.00 175.22 175.08 2vvm s GLY 383 N -0.16 1.11 0.29 4.36 0.00 0.75 -0.20 107.32 113.48 2vvm s GLY 383 Ca 0.00 -1.41 0.02 0.00 0.00 0.00 0.00 44.72 43.33 2vvm s GLY 383 CO 0.01 -1.50 0.08 1.16 0.00 0.00 0.00 173.10 172.86 2vvm n ASN 384 N 0.12 1.45 0.25 1.64 0.23 -1.26 -1.10 115.26 116.59 2vvm n ASN 384 Ca -0.12 -2.49 0.13 0.00 -0.53 0.00 0.00 54.58 51.56 2vvm n ASN 384 Cb 0.59 0.63 0.57 0.00 -2.08 0.00 0.00 39.78 39.49 2vvm n ASN 384 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 2vvm h SER 385 N 1.07 0.00 -0.19 0.53 0.02 -1.08 -3.12 113.55 110.78 2vvm h SER 385 Ca -0.23 0.00 -0.04 0.00 -0.84 0.00 0.00 61.79 60.68 2vvm h SER 385 Cb 0.84 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.36 2vvm h SER 385 CO 0.37 0.12 0.01 0.00 -1.14 0.00 0.00 176.83 176.19 2vvm h ALA 386 N 1.88 1.47 -1.95 3.77 0.00 -1.80 -3.35 119.26 119.28 2vvm h ALA 386 Ca -0.00 -0.17 -0.39 0.00 0.00 0.00 0.00 54.91 54.34 2vvm h ALA 386 Cb 0.62 -0.13 -0.31 0.00 0.00 0.00 0.00 17.79 17.97 2vvm h ALA 386 CO 0.02 0.38 -0.72 1.21 0.00 0.00 0.00 179.25 180.13 2vvm s ASN 387 N -6.77 1.01 -0.01 0.00 3.84 -1.20 -5.11 114.94 106.70 2vvm s ASN 387 Ca -0.07 -1.89 -0.07 0.00 0.21 0.00 0.00 52.86 51.03 2vvm s ASN 387 Cb 0.16 0.49 -0.05 0.00 -0.55 0.00 0.00 41.25 41.30 2vvm s ASN 387 CO 0.75 -0.22 0.26 -2.28 -2.79 0.00 0.00 177.10 172.81 2vvm s HIS 388 N 1.11 3.59 -0.02 0.43 5.65 -1.18 -4.29 115.29 120.58 2vvm s HIS 388 Ca 0.21 0.59 0.04 0.00 0.25 0.00 0.00 55.06 56.15 2vvm s HIS 388 Cb -0.11 -2.00 -0.01 0.00 -1.18 0.00 0.00 32.58 29.29 2vvm s HIS 388 CO -0.05 0.64 -0.13 -1.50 -0.65 0.00 0.00 174.74 173.05 2vvm s ILE 389 N -1.24 1.02 -0.50 0.89 2.07 -1.26 -4.98 121.20 117.20 2vvm s ILE 389 Ca 0.25 -0.53 -0.21 0.00 -1.41 0.00 0.00 60.65 58.75 2vvm s ILE 389 Cb -0.13 -0.87 0.04 0.00 0.13 0.00 0.00 42.46 41.63 2vvm s ILE 389 CO 0.14 0.30 0.73 -1.10 -1.91 0.00 0.00 174.94 173.10 2vvm s GLN 390 N -0.10 3.23 0.56 3.50 -1.52 -1.26 -4.82 119.66 119.25 2vvm s GLN 390 Ca 0.01 -0.57 0.27 0.00 -1.95 0.00 0.00 55.36 53.13 2vvm s GLN 390 Cb -0.07 -4.05 1.66 0.00 -0.22 0.00 0.00 33.01 30.33 2vvm s GLN 390 CO 0.00 -1.25 2.20 -1.00 -0.25 0.00 0.00 175.29 174.99 2vvm h PRO 391 N 9.06 0.00 0.00 2.91 0.13 -1.98 -2.43 132.00 139.70 2vvm h PRO 391 Ca -0.27 0.00 -0.08 0.00 -0.87 0.00 0.00 66.00 64.79 2vvm h PRO 391 Cb 1.09 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.21 2vvm h PRO 391 CO 0.99 0.04 -0.36 0.38 -0.23 0.00 0.00 178.00 178.81 2vvm h ASP 392 N 0.00 0.00 -0.18 1.44 2.03 -1.99 -3.39 116.42 114.33 2vvm h ASP 392 Ca -0.00 0.00 -0.20 0.00 -0.73 0.00 0.00 57.03 56.10 2vvm h ASP 392 Cb 0.09 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.59 2vvm h ASP 392 CO 0.00 0.36 -0.65 -0.33 -1.03 0.00 0.00 179.24 177.60 2vvm h GLU 393 N 0.00 0.80 -1.97 4.15 5.08 -1.86 -3.41 114.58 117.36 2vvm h GLU 393 Ca -0.00 -0.57 -0.28 0.00 -1.00 0.00 0.00 59.36 57.51 2vvm h GLU 393 Cb 1.17 0.09 -0.31 0.00 0.50 0.00 0.00 28.75 30.20 2vvm h GLU 393 CO 0.05 1.19 -0.60 0.34 -1.00 0.00 0.00 179.01 178.99 2vvm s ASP 394 N -7.01 1.18 0.43 1.42 -1.08 -1.26 -5.03 116.67 105.32 2vvm s ASP 394 Ca -0.10 -0.66 0.09 0.00 -0.52 0.00 0.00 52.55 51.37 2vvm s ASP 394 Cb 0.10 0.73 0.94 0.00 -1.46 0.00 0.00 42.92 43.23 2vvm s ASP 394 CO 0.89 -0.37 2.06 0.58 0.52 0.00 0.00 175.17 178.85 2vvm h VAL 395 N 6.17 1.05 -0.72 1.11 2.07 -1.80 -0.44 116.25 123.69 2vvm h VAL 395 Ca -0.11 -0.16 0.05 0.00 0.82 0.00 0.00 66.70 67.31 2vvm h VAL 395 Cb 1.09 0.55 -0.05 0.00 -1.52 0.00 0.00 31.29 31.36 2vvm h VAL 395 CO 0.30 0.08 0.42 0.03 0.02 0.00 0.00 177.57 178.43 2vvm h ARG 396 N 0.46 0.77 -0.33 1.57 3.08 -1.95 0.23 114.38 118.21 2vvm h ARG 396 Ca 0.16 -0.05 -0.15 0.00 0.07 0.00 0.00 59.98 60.01 2vvm h ARG 396 Cb 0.05 -0.17 -0.01 0.00 0.08 0.00 0.00 29.97 29.92 2vvm h ARG 396 CO -0.04 0.51 -0.38 0.93 -1.07 0.00 0.00 179.97 179.93 2vvm h GLU 397 N 0.79 0.78 -0.38 0.04 4.39 -1.54 -1.72 114.58 116.93 2vvm h GLU 397 Ca 0.31 -0.39 -0.03 0.00 0.34 0.00 0.00 59.36 59.59 2vvm h GLU 397 Cb 0.14 0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.78 2vvm h GLU 397 CO -0.16 1.02 0.12 1.15 -1.16 0.00 0.00 179.01 179.98 2vvm h THR 398 N 0.64 1.21 -0.69 1.13 2.02 -0.70 -1.63 112.91 114.90 2vvm h THR 398 Ca 0.06 -0.70 -0.03 0.00 0.77 0.00 0.00 66.41 66.51 2vvm h THR 398 Cb 0.93 0.95 -0.03 0.00 -1.74 0.00 0.00 68.15 68.26 2vvm h THR 398 CO 0.08 0.25 0.32 -0.07 0.37 0.00 0.00 175.52 176.48 2vvm h LEU 399 N 0.47 0.89 -0.32 2.58 3.38 -0.52 -1.55 115.31 120.25 2vvm h LEU 399 Ca 0.12 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 2vvm h LEU 399 Cb 0.26 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 2vvm h LEU 399 CO -0.00 0.76 0.20 0.50 0.09 0.00 0.00 178.44 179.98 2vvm h LYS 400 N 0.98 0.43 -0.78 1.13 3.64 -1.04 0.45 116.57 121.37 2vvm h LYS 400 Ca 0.24 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.56 2vvm h LYS 400 Cb 0.11 -0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 31.80 2vvm h LYS 400 CO -0.03 0.31 0.38 0.00 -2.27 0.00 0.00 179.45 177.84 2vvm h ALA 401 N 1.09 1.01 0.05 5.00 0.00 -0.90 -0.46 119.26 125.04 2vvm h ALA 401 Ca 0.11 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 2vvm h ALA 401 Cb -0.01 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.47 2vvm h ALA 401 CO -0.02 0.58 -0.02 0.28 0.00 0.00 0.00 179.25 180.06 2vvm h VAL 402 N 1.11 1.06 -0.93 0.00 2.07 -1.09 -3.18 116.25 115.29 2vvm h VAL 402 Ca 0.27 -0.36 0.02 0.00 0.82 0.00 0.00 66.70 67.45 2vvm h VAL 402 Cb 0.12 1.30 -0.05 0.00 -1.52 0.00 0.00 31.29 31.14 2vvm h VAL 402 CO -0.03 0.09 0.61 1.23 0.02 0.00 0.00 177.57 179.49 2vvm h GLY 403 N -0.22 1.33 2.00 2.17 0.00 -0.60 -2.48 103.07 105.27 2vvm h GLY 403 Ca -0.01 -0.47 0.00 0.00 0.00 0.00 0.00 47.33 46.85 2vvm h GLY 403 CO 0.01 0.43 0.00 -1.06 0.00 0.00 0.00 176.54 175.92 2vvm n GLN 404 N -4.42 0.07 0.13 4.80 6.02 -0.21 -1.42 117.38 122.36 2vvm n GLN 404 Ca 0.12 0.37 0.02 0.00 -0.01 0.00 0.00 57.00 57.50 2vvm n GLN 404 Cb 0.07 -1.65 0.38 0.00 1.02 0.00 0.00 30.24 30.05 2vvm n GLN 404 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 2vvm h LEU 405 N 0.00 0.18 -5.31 1.08 3.38 -1.49 -3.39 115.31 109.77 2vvm h LEU 405 Ca 0.00 -0.04 -0.28 0.00 0.09 0.00 0.00 57.88 57.65 2vvm h LEU 405 Cb 0.23 -0.05 -0.21 0.00 0.09 0.00 0.00 40.66 40.73 2vvm h LEU 405 CO 0.00 0.39 -0.63 0.00 0.09 0.00 0.00 178.44 178.29 2vvm n ALA 406 N -2.49 -0.58 -1.73 1.53 0.00 -0.50 -4.88 120.51 111.86 2vvm n ALA 406 Ca -0.01 -1.71 -0.42 0.00 0.00 0.00 0.00 53.44 51.30 2vvm n ALA 406 Cb 0.31 -1.26 -0.02 0.00 0.00 0.00 0.00 19.45 18.48 2vvm n ALA 406 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2vvm n PRO 407 N 2.33 2.49 -1.20 0.00 -0.02 -0.89 -2.83 135.00 134.89 2vvm n PRO 407 Ca 0.17 0.88 -0.07 0.00 -2.02 0.00 0.00 63.50 62.47 2vvm n PRO 407 Cb 0.57 -2.62 -0.03 0.00 -0.02 0.00 0.00 33.50 31.40 2vvm n PRO 407 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2vvm n GLY 408 N 1.88 0.88 0.00 -1.23 0.00 -1.26 -4.89 105.19 100.57 2vvm n GLY 408 Ca 0.08 -0.49 0.05 0.00 0.00 0.00 0.00 46.02 45.66 2vvm n GLY 408 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2vvm n THR 409 N -2.71 0.00 -3.62 2.61 -2.24 -1.13 -5.06 114.28 102.14 2vvm n THR 409 Ca -0.07 -0.23 -0.13 0.00 -2.27 0.00 0.00 64.05 61.35 2vvm n THR 409 Cb 0.27 0.42 -0.05 0.00 -2.10 0.00 0.00 70.33 68.87 2vvm n THR 409 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 2vvm s PHE 410 N -2.52 -0.32 0.04 4.78 -0.12 -1.26 -4.67 117.98 113.91 2vvm s PHE 410 Ca -0.02 0.24 0.02 0.00 -0.05 0.00 0.00 56.93 57.12 2vvm s PHE 410 Cb 0.06 0.29 -0.04 0.00 -0.63 0.00 0.00 43.02 42.70 2vvm s PHE 410 CO 0.40 -0.64 0.07 0.20 -0.05 0.00 0.00 175.22 175.20 2vvm s GLY 411 N -2.20 2.00 -0.23 1.99 0.00 -1.26 -4.97 107.32 102.65 2vvm s GLY 411 Ca -0.03 -0.95 -0.18 0.00 0.00 0.00 0.00 44.72 43.56 2vvm s GLY 411 CO -0.05 -0.88 0.50 0.14 0.00 0.00 0.00 173.10 172.81 2vvm s VAL 412 N -1.27 5.10 -0.11 1.40 1.01 -1.26 -1.61 120.40 123.66 2vvm s VAL 412 Ca 0.25 0.88 0.16 0.00 0.00 0.00 0.00 61.98 63.27 2vvm s VAL 412 Cb -0.12 -3.82 -0.15 0.00 0.00 0.00 0.00 36.38 32.29 2vvm s VAL 412 CO 0.17 0.15 0.78 0.29 0.00 0.00 0.00 175.10 176.49 2vvm n LYS 413 N 5.09 0.62 -3.62 2.72 5.02 0.13 -4.82 118.16 123.30 2vvm n LYS 413 Ca -0.05 0.23 -0.14 0.00 -2.02 0.00 0.00 58.31 56.33 2vvm n LYS 413 Cb 0.50 -1.80 -0.07 0.00 -0.02 0.00 0.00 35.03 33.64 2vvm n LYS 413 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 2vvm s ARG 414 N -2.87 0.85 0.00 1.97 3.52 -1.10 -4.36 118.95 116.96 2vvm s ARG 414 Ca -0.03 0.90 0.07 0.00 -0.13 0.00 0.00 55.73 56.53 2vvm s ARG 414 Cb 0.09 0.41 -0.03 0.00 -1.56 0.00 0.00 34.95 33.86 2vvm s ARG 414 CO 0.81 -0.12 -0.22 -0.51 -0.81 0.00 0.00 175.30 174.45 2vvm s LEU 415 N 0.20 2.35 -0.02 -0.88 1.43 -0.21 -0.90 118.68 120.65 2vvm s LEU 415 Ca -0.01 -0.42 0.00 0.00 -1.03 0.00 0.00 54.13 52.66 2vvm s LEU 415 Cb -0.04 -1.42 0.03 0.00 0.03 0.00 0.00 46.19 44.78 2vvm s LEU 415 CO 0.02 0.30 0.02 -0.69 0.23 0.00 0.00 176.35 176.23 2vvm s VAL 416 N -0.75 -0.02 -0.01 -1.59 1.01 -0.57 -0.52 120.40 117.96 2vvm s VAL 416 Ca 0.12 0.17 -0.29 0.00 0.00 0.00 0.00 61.98 61.98 2vvm s VAL 416 Cb -0.10 -0.09 0.10 0.00 0.00 0.00 0.00 36.38 36.29 2vvm s VAL 416 CO 0.01 0.08 0.87 0.72 0.00 0.00 0.00 175.10 176.78 2vvm s PHE 417 N 0.92 -0.38 -0.06 5.22 -0.12 -0.89 -0.95 117.98 121.72 2vvm s PHE 417 Ca -0.08 0.31 0.04 0.00 -0.05 0.00 0.00 56.93 57.15 2vvm s PHE 417 Cb -0.11 0.52 -0.00 0.00 -0.63 0.00 0.00 43.02 42.80 2vvm s PHE 417 CO -0.02 -0.55 -0.19 -1.58 -0.05 0.00 0.00 175.22 172.83 2vvm s HIS 418 N -2.86 1.97 -0.67 3.49 2.46 -1.26 -0.13 115.29 118.28 2vvm s HIS 418 Ca 0.03 -0.65 -0.23 0.00 0.47 0.00 0.00 55.06 54.68 2vvm s HIS 418 Cb -0.01 -1.33 0.07 0.00 -0.13 0.00 0.00 32.58 31.18 2vvm s HIS 418 CO -0.07 -0.25 0.98 1.21 -2.47 0.00 0.00 174.74 174.14 2vvm s ASN 419 N 0.18 6.19 0.26 9.88 3.84 -1.26 -4.75 114.94 129.28 2vvm s ASN 419 Ca -0.09 -1.02 0.05 0.00 0.21 0.00 0.00 52.86 52.02 2vvm s ASN 419 Cb -0.14 -2.42 0.33 0.00 -0.55 0.00 0.00 41.25 38.47 2vvm s ASN 419 CO 0.04 -1.44 1.62 -0.50 -2.79 0.00 0.00 177.10 174.03 2vvm h TRP 420 N 9.56 0.28 -0.40 0.43 4.06 -1.87 -2.87 115.95 125.13 2vvm h TRP 420 Ca -0.27 -0.10 -0.04 0.00 2.06 0.00 0.00 58.89 60.55 2vvm h TRP 420 Cb 1.07 -0.06 -0.02 0.00 -1.00 0.00 0.00 29.16 29.16 2vvm h TRP 420 CO 0.98 0.71 0.09 0.28 -3.56 0.00 0.00 178.44 176.95 2vvm h VAL 421 N 0.18 1.23 -0.01 1.49 2.07 -1.85 -1.56 116.25 117.80 2vvm h VAL 421 Ca 0.00 -0.80 0.00 0.00 0.82 0.00 0.00 66.70 66.73 2vvm h VAL 421 Cb 0.99 0.98 0.00 0.00 -1.52 0.00 0.00 31.29 31.74 2vvm h VAL 421 CO 0.08 0.28 -0.24 0.29 0.02 0.00 0.00 177.57 178.00 2vvm n LYS 422 N -4.55 0.83 -2.13 1.57 5.02 -1.24 -4.00 118.16 113.66 2vvm n LYS 422 Ca -0.00 -0.47 -0.43 0.00 -2.02 0.00 0.00 58.31 55.38 2vvm n LYS 422 Cb 0.21 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.70 2vvm n LYS 422 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2vvm s ASP 423 N -2.49 6.43 0.61 4.39 -1.08 -1.08 -4.89 116.67 118.55 2vvm s ASP 423 Ca 0.25 1.65 0.36 0.00 -0.52 0.00 0.00 52.55 54.29 2vvm s ASP 423 Cb 0.19 -2.53 1.99 0.00 -1.46 0.00 0.00 42.92 41.11 2vvm s ASP 423 CO 0.51 -1.21 2.25 1.05 0.52 0.00 0.00 175.17 178.30 2vvm h GLU 424 N 10.50 0.00 -0.69 4.34 4.11 -1.88 0.45 114.58 131.41 2vvm h GLU 424 Ca -0.33 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.10 2vvm h GLU 424 Cb 1.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.40 2vvm h GLU 424 CO 1.00 0.02 0.00 1.19 0.07 0.00 0.00 179.01 181.29 2vvm n PHE 425 N -3.41 0.92 0.00 2.06 3.72 -1.26 -4.55 117.46 114.93 2vvm n PHE 425 Ca -0.02 -0.46 0.00 0.00 -0.05 0.00 0.00 57.45 56.92 2vvm n PHE 425 Cb 0.12 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.66 2vvm n PHE 425 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2vvm n ALA 426 N 1.66 2.78 -3.85 4.37 0.00 -0.75 -4.73 120.51 119.98 2vvm n ALA 426 Ca 0.24 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 53.42 2vvm n ALA 426 Cb 0.63 0.16 0.01 0.00 0.00 0.00 0.00 19.45 20.25 2vvm n ALA 426 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2vvm n LYS 427 N -2.47 -4.61 0.00 0.00 5.02 0.15 -4.49 118.16 111.75 2vvm n LYS 427 Ca 0.00 0.55 0.00 0.00 -2.02 0.00 0.00 58.31 56.84 2vvm n LYS 427 Cb 0.16 -5.12 0.00 0.00 -0.02 0.00 0.00 35.03 30.06 2vvm n LYS 427 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2vvm n GLY 428 N -1.69 2.33 0.00 0.72 0.00 -0.60 -4.84 105.19 101.11 2vvm n GLY 428 Ca -0.18 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 43.98 2vvm n GLY 428 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vvm n ALA 429 N -1.55 0.00 -1.42 4.61 0.00 -0.03 -4.50 120.51 117.62 2vvm n ALA 429 Ca 0.00 0.00 -0.39 0.00 0.00 0.00 0.00 53.44 53.05 2vvm n ALA 429 Cb 0.00 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.48 2vvm n ALA 429 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 177.50 174.83 2vvm n TRP 430 N 0.00 -1.16 -1.68 0.00 2.14 -1.26 -4.85 117.44 110.63 2vvm n TRP 430 Ca 0.00 0.46 -0.46 0.00 2.07 0.00 0.00 57.50 59.57 2vvm n TRP 430 Cb 0.00 -1.90 -0.04 0.00 -0.81 0.00 0.00 31.31 28.56 2vvm n TRP 430 CO 0.00 0.00 0.00 0.34 2.07 0.00 0.00 177.69 180.10 2vvm n PHE 431 N -1.55 2.39 -3.78 -2.67 7.35 -1.26 -4.41 117.46 113.52 2vvm n PHE 431 Ca 0.11 0.01 -0.14 0.00 -0.76 0.00 0.00 57.45 56.67 2vvm n PHE 431 Cb 0.46 -2.66 -0.15 0.00 0.35 0.00 0.00 39.48 37.49 2vvm n PHE 431 CO 0.00 0.00 0.00 0.12 -0.76 0.00 0.00 176.76 176.12 2vvm s PHE 432 N 2.91 -0.05 0.43 -5.13 2.19 -1.26 -4.65 117.98 112.42 2vvm s PHE 432 Ca 0.86 0.24 -0.06 0.00 0.33 0.00 0.00 56.93 58.30 2vvm s PHE 432 Cb -0.62 -0.13 -0.04 0.00 -1.31 0.00 0.00 43.02 40.91 2vvm s PHE 432 CO 0.44 -0.10 0.74 -1.54 1.83 0.00 0.00 175.22 176.59 2vvm s SER 433 N 0.87 6.35 0.56 6.13 1.04 -1.26 -0.43 113.70 126.95 2vvm s SER 433 Ca -0.07 0.92 -0.12 0.00 0.48 0.00 0.00 55.95 57.16 2vvm s SER 433 Cb -0.10 -2.24 -0.05 0.00 0.10 0.00 0.00 66.02 63.73 2vvm s SER 433 CO -0.03 -0.48 0.98 -0.13 0.98 0.00 0.00 173.24 174.56 2vvm s ARG 434 N -4.38 3.73 0.17 4.02 0.52 -1.26 -1.63 118.95 120.13 2vvm s ARG 434 Ca 0.47 0.75 -0.33 0.00 -0.52 0.00 0.00 55.73 56.10 2vvm s ARG 434 Cb -0.10 -2.15 -0.15 0.00 0.52 0.00 0.00 34.95 33.07 2vvm s ARG 434 CO 0.39 -0.40 1.40 -2.30 0.02 0.00 0.00 175.30 174.42 2vvm n PRO 435 N -2.20 1.73 0.00 3.54 -0.02 -1.26 -1.50 135.00 135.29 2vvm n PRO 435 Ca 0.05 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 62.16 2vvm n PRO 435 Cb 0.54 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.74 2vvm n PRO 435 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2vvm n GLY 436 N 2.59 2.99 0.05 -1.23 0.00 0.08 -4.87 105.19 104.79 2vvm n GLY 436 Ca 0.15 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.05 2vvm n GLY 436 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2vvm h MET 437 N 1.39 0.03 -0.11 1.61 -1.53 -1.54 -1.28 114.93 113.51 2vvm h MET 437 Ca 0.00 -0.00 -0.01 0.00 -3.44 0.00 0.00 59.70 56.25 2vvm h MET 437 Cb 0.00 -0.01 -0.00 0.00 -0.55 0.00 0.00 31.60 31.04 2vvm h MET 437 CO 0.00 0.02 0.03 0.28 0.14 0.00 0.00 176.91 177.38 2vvm h VAL 438 N 0.03 1.19 -0.87 -5.77 2.07 -1.91 0.13 116.25 111.13 2vvm h VAL 438 Ca 0.01 -0.59 -0.00 0.00 0.82 0.00 0.00 66.70 66.94 2vvm h VAL 438 Cb -0.00 1.38 -0.04 0.00 -1.52 0.00 0.00 31.29 31.11 2vvm h VAL 438 CO -0.00 0.17 0.53 0.77 0.02 0.00 0.00 177.57 179.06 2vvm h SER 439 N -0.03 1.03 -0.16 0.57 4.64 -1.92 -0.97 113.55 116.72 2vvm h SER 439 Ca 0.03 -0.05 -0.22 0.00 -0.47 0.00 0.00 61.79 61.08 2vvm h SER 439 Cb 0.24 -0.26 0.01 0.00 -0.31 0.00 0.00 62.40 62.08 2vvm h SER 439 CO 0.00 0.78 -0.78 -0.08 -0.87 0.00 0.00 176.83 175.88 2vvm h GLU 440 N 1.19 0.81 0.00 4.77 4.81 -1.12 -3.41 114.58 121.63 2vvm h GLU 440 Ca 0.31 -0.65 0.00 0.00 -0.13 0.00 0.00 59.36 58.89 2vvm h GLU 440 Cb -0.07 0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.45 2vvm h GLU 440 CO -0.06 1.26 -0.70 0.00 -0.73 0.00 0.00 179.01 178.78 2vvm h LEU 442 N 0.00 0.28 -0.14 0.00 5.85 -1.32 0.39 115.31 120.38 2vvm h LEU 442 Ca 0.00 0.04 0.04 0.00 0.84 0.00 0.00 57.88 58.79 2vvm h LEU 442 Cb 0.18 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.16 2vvm h LEU 442 CO 0.00 0.20 -0.10 -0.61 -0.34 0.00 0.00 178.44 177.59 2vvm h GLN 443 N 0.42 -0.11 -0.83 1.25 4.15 -1.85 -2.30 115.11 115.84 2vvm h GLN 443 Ca 0.21 0.01 0.04 0.00 0.77 0.00 0.00 58.65 59.68 2vvm h GLN 443 Cb 0.16 0.02 -0.05 0.00 0.21 0.00 0.00 27.48 27.82 2vvm h GLN 443 CO -0.17 -0.07 0.55 0.78 -1.93 0.00 0.00 178.83 177.98 2vvm h GLY 444 N -0.11 1.18 2.00 2.39 0.00 -1.66 -1.90 103.07 104.97 2vvm h GLY 444 Ca 0.09 -0.40 -0.02 0.00 0.00 0.00 0.00 47.33 47.00 2vvm h GLY 444 CO -0.21 0.33 -0.10 1.41 0.00 0.00 0.00 176.54 177.98 2vvm h LEU 445 N 1.00 0.00 -0.25 3.11 3.38 -0.49 -3.13 115.31 118.93 2vvm h LEU 445 Ca 0.34 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.31 2vvm h LEU 445 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 2vvm h LEU 445 CO -0.11 0.10 -0.75 0.54 0.09 0.00 0.00 178.44 178.31 2vvm n ARG 446 N -3.31 1.06 -1.82 1.13 1.74 -0.78 -4.88 116.66 109.79 2vvm n ARG 446 Ca -0.00 -0.24 -0.33 0.00 -0.77 0.00 0.00 57.85 56.50 2vvm n ARG 446 Cb 0.30 -1.37 0.04 0.00 -1.02 0.00 0.00 32.46 30.41 2vvm n ARG 446 CO 0.00 0.00 0.00 -1.83 -1.52 0.00 0.00 177.63 174.28 2vvm s GLU 447 N -2.60 2.93 0.71 5.56 -1.05 -0.80 -4.93 118.70 118.53 2vvm s GLU 447 Ca 0.09 1.34 -0.16 0.00 -0.15 0.00 0.00 54.97 56.09 2vvm s GLU 447 Cb 0.14 -1.97 0.00 0.00 -0.44 0.00 0.00 34.13 31.87 2vvm s GLU 447 CO 0.69 -1.14 0.99 1.63 0.95 0.00 0.00 175.26 178.38 2vvm n LYS 448 N -2.34 0.56 -3.04 -4.83 5.02 -1.26 -4.73 118.16 107.55 2vvm n LYS 448 Ca 0.10 0.25 -0.17 0.00 -2.02 0.00 0.00 58.31 56.46 2vvm n LYS 448 Cb 0.52 -2.24 -0.02 0.00 -0.02 0.00 0.00 35.03 33.27 2vvm n LYS 448 CO 0.00 0.00 0.00 1.58 -0.52 0.00 0.00 177.40 178.46 2vvm n HIS 449 N -2.44 -1.22 0.00 2.13 -0.00 -1.18 -5.07 115.22 107.43 2vvm n HIS 449 Ca 0.13 -3.04 0.00 0.00 0.46 0.00 0.00 57.72 55.27 2vvm n HIS 449 Cb 0.49 0.29 0.00 0.00 -0.12 0.00 0.00 29.99 30.65 2vvm n HIS 449 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2vvm n GLY 450 N 1.12 3.07 1.05 1.57 0.00 -1.26 -1.31 105.19 109.44 2vvm n GLY 450 Ca 0.17 0.18 0.07 0.00 0.00 0.00 0.00 46.02 46.44 2vvm n GLY 450 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vvm n GLY 451 N 0.00 1.63 3.34 -0.02 0.00 -1.26 -4.86 105.19 104.01 2vvm n GLY 451 Ca 0.00 -0.57 -0.34 0.00 0.00 0.00 0.00 46.02 45.12 2vvm n GLY 451 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vvm s VAL 452 N -1.52 3.15 -0.36 1.61 1.01 -0.43 -0.80 120.40 123.07 2vvm s VAL 452 Ca 0.35 -0.60 -0.12 0.00 0.00 0.00 0.00 61.98 61.60 2vvm s VAL 452 Cb 0.20 -2.37 0.00 0.00 0.00 0.00 0.00 36.38 34.21 2vvm s VAL 452 CO 0.20 0.49 0.23 -0.69 0.00 0.00 0.00 175.10 175.32 2vvm s VAL 453 N 0.83 4.96 -0.24 2.92 1.01 0.10 -3.12 120.40 126.86 2vvm s VAL 453 Ca -0.03 -0.51 -0.22 0.00 0.00 0.00 0.00 61.98 61.22 2vvm s VAL 453 Cb -0.15 -3.64 -0.01 0.00 0.00 0.00 0.00 36.38 32.58 2vvm s VAL 453 CO 0.01 -0.11 0.72 -0.36 0.00 0.00 0.00 175.10 175.35 2vvm s PHE 454 N 1.65 3.31 -0.08 5.22 0.08 -1.26 -0.43 117.98 126.47 2vvm s PHE 454 Ca 0.05 0.98 -0.03 0.00 0.12 0.00 0.00 56.93 58.04 2vvm s PHE 454 Cb -0.18 -2.93 0.04 0.00 -0.57 0.00 0.00 43.02 39.38 2vvm s PHE 454 CO 0.09 -0.34 0.15 0.00 -0.10 0.00 0.00 175.22 175.02 2vvm s ALA 455 N 2.57 -0.19 -0.12 5.36 0.00 -0.55 -4.86 121.76 123.96 2vvm s ALA 455 Ca 0.30 0.60 -0.30 0.00 0.00 0.00 0.00 51.96 52.56 2vvm s ALA 455 Cb -0.15 -0.67 0.10 0.00 0.00 0.00 0.00 23.12 22.39 2vvm s ALA 455 CO 0.08 -0.41 0.83 1.21 0.00 0.00 0.00 175.76 177.48 2vvm s ASN 456 N 1.86 -0.54 0.53 0.00 3.84 -1.26 -3.85 114.94 115.52 2vvm s ASN 456 Ca -0.02 0.65 0.33 0.00 0.21 0.00 0.00 52.86 54.04 2vvm s ASN 456 Cb -0.12 0.53 1.48 0.00 -0.55 0.00 0.00 41.25 42.59 2vvm s ASN 456 CO -0.06 -0.45 1.83 -1.28 -2.79 0.00 0.00 177.10 174.35 2vvm h SER 457 N 3.04 0.05 -0.70 -4.21 0.87 -1.83 -2.03 113.55 108.73 2vvm h SER 457 Ca -0.24 0.01 0.20 0.00 -1.23 0.00 0.00 61.79 60.54 2vvm h SER 457 Cb 1.15 0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 63.09 2vvm h SER 457 CO 0.32 0.01 0.52 0.44 -0.53 0.00 0.00 176.83 177.59 2vvm h ASP 458 N 0.04 0.00 -0.00 6.23 3.32 -1.93 -1.64 116.42 122.45 2vvm h ASP 458 Ca 0.52 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.49 2vvm h ASP 458 Cb 1.99 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 41.38 2vvm h ASP 458 CO -0.04 0.00 -0.73 -2.67 -1.72 0.00 0.00 179.24 174.08 2vvm n TRP 459 N -4.25 0.00 -1.02 4.55 2.14 -0.77 -4.75 117.44 113.34 2vvm n TRP 459 Ca 0.14 -1.08 -0.28 0.00 2.07 0.00 0.00 57.50 58.35 2vvm n TRP 459 Cb 0.79 -0.21 0.20 0.00 -0.81 0.00 0.00 31.31 31.28 2vvm n TRP 459 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 2vvm s ALA 460 N -1.87 0.53 -0.15 -1.67 0.00 -0.96 -4.85 121.76 112.79 2vvm s ALA 460 Ca 0.36 -0.35 -0.03 0.00 0.00 0.00 0.00 51.96 51.94 2vvm s ALA 460 Cb 0.38 -3.13 -0.24 0.00 0.00 0.00 0.00 23.12 20.13 2vvm s ALA 460 CO -0.11 -3.15 0.24 1.28 0.00 0.00 0.00 175.76 174.02 2vvm n LEU 461 N -4.40 2.60 0.00 0.00 4.32 -1.26 -4.54 117.00 113.73 2vvm n LEU 461 Ca 0.04 0.14 0.00 0.00 -0.02 0.00 0.00 56.01 56.17 2vvm n LEU 461 Cb 0.57 -0.99 0.00 0.00 -1.62 0.00 0.00 43.42 41.38 2vvm n LEU 461 CO 0.58 0.85 0.00 0.61 -1.22 0.00 0.00 177.39 178.20 2vvm n GLY 462 N 2.03 0.47 2.28 -0.72 0.00 -1.26 -4.40 105.19 103.60 2vvm n GLY 462 Ca -0.34 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.32 2vvm n GLY 462 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2vvm n TRP 463 N 0.00 2.13 -1.69 1.61 7.02 -1.26 -4.93 117.44 120.31 2vvm n TRP 463 Ca 0.00 -2.90 -0.44 0.00 -1.02 0.00 0.00 57.50 53.14 2vvm n TRP 463 Cb 0.00 -2.39 -0.04 0.00 -2.42 0.00 0.00 31.31 26.47 2vvm n TRP 463 CO 0.00 0.00 0.00 -2.13 -2.02 0.00 0.00 177.69 173.54 2vvm n ARG 464 N 3.46 2.41 -0.63 -0.99 0.63 -1.26 -1.90 116.66 118.38 2vvm n ARG 464 Ca 0.74 0.87 0.00 0.00 -0.92 0.00 0.00 57.85 58.54 2vvm n ARG 464 Cb 0.31 -2.66 0.00 0.00 0.45 0.00 0.00 32.46 30.56 2vvm n ARG 464 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 2vvm n SER 465 N 3.48 -0.56 -4.79 6.15 3.41 -0.66 -4.96 113.62 115.70 2vvm n SER 465 Ca 0.16 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.55 2vvm n SER 465 Cb 0.32 -0.09 -0.05 0.00 -0.26 0.00 0.00 64.21 64.12 2vvm n SER 465 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 2vvm s PHE 466 N -2.89 2.87 0.30 7.33 0.08 -0.80 -4.45 117.98 120.42 2vvm s PHE 466 Ca 0.00 -0.27 0.05 0.00 0.12 0.00 0.00 56.93 56.82 2vvm s PHE 466 Cb 0.00 -1.60 0.69 0.00 -0.57 0.00 0.00 43.02 41.54 2vvm s PHE 466 CO 0.00 0.35 1.79 0.82 -0.10 0.00 0.00 175.22 178.08 2vvm h ILE 467 N 1.45 0.77 -0.53 0.64 2.04 -1.91 -1.62 117.51 118.35 2vvm h ILE 467 Ca -0.45 -0.29 0.04 0.00 1.00 0.00 0.00 64.86 65.16 2vvm h ILE 467 Cb 1.25 -0.14 -0.04 0.00 -0.74 0.00 0.00 36.82 37.15 2vvm h ILE 467 CO 0.60 0.15 0.29 -0.78 0.00 0.00 0.00 178.15 178.41 2vvm h ASP 468 N 0.83 0.43 -0.34 1.72 3.58 -1.95 -1.85 116.42 118.84 2vvm h ASP 468 Ca 0.56 0.02 -0.02 0.00 0.42 0.00 0.00 57.03 58.01 2vvm h ASP 468 Cb 0.78 -0.06 -0.02 0.00 1.72 0.00 0.00 39.33 41.75 2vvm h ASP 468 CO -0.35 0.29 0.15 1.23 -2.88 0.00 0.00 179.24 177.69 2vvm h GLY 469 N 0.55 0.59 0.99 -0.78 0.00 -0.74 0.07 103.07 103.75 2vvm h GLY 469 Ca 0.23 -0.28 -0.01 0.00 0.00 0.00 0.00 47.33 47.28 2vvm h GLY 469 CO -0.14 0.26 0.31 0.00 0.00 0.00 0.00 176.54 176.97 2vvm h ALA 470 N 1.62 0.68 -0.24 3.60 0.00 -0.62 -1.55 119.26 122.75 2vvm h ALA 470 Ca 0.14 -0.08 -0.20 0.00 0.00 0.00 0.00 54.91 54.77 2vvm h ALA 470 Cb 0.12 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2vvm h ALA 470 CO -0.01 0.18 -0.63 0.82 0.00 0.00 0.00 179.25 179.60 2vvm h ILE 471 N 0.71 1.28 -0.63 0.00 2.04 -0.89 -0.41 117.51 119.60 2vvm h ILE 471 Ca 0.19 -1.82 0.12 0.00 1.00 0.00 0.00 64.86 64.35 2vvm h ILE 471 Cb 0.01 1.76 -0.09 0.00 -0.74 0.00 0.00 36.82 37.76 2vvm h ILE 471 CO -0.03 0.59 0.15 -0.08 0.00 0.00 0.00 178.15 178.78 2vvm h GLU 472 N 0.62 0.28 -0.05 2.37 4.81 -0.90 -1.25 114.58 120.45 2vvm h GLU 472 Ca -0.01 -0.02 -0.25 0.00 -0.13 0.00 0.00 59.36 58.95 2vvm h GLU 472 Cb 1.25 -0.06 0.02 0.00 0.63 0.00 0.00 28.75 30.58 2vvm h GLU 472 CO 0.14 0.18 -0.95 0.93 -0.73 0.00 0.00 179.01 178.58 2vvm h GLU 473 N 0.28 0.71 -0.87 1.92 4.39 -1.01 -1.89 114.58 118.11 2vvm h GLU 473 Ca 0.33 -0.69 -0.02 0.00 0.34 0.00 0.00 59.36 59.32 2vvm h GLU 473 Cb 0.50 0.18 -0.04 0.00 -0.10 0.00 0.00 28.75 29.29 2vvm h GLU 473 CO -0.41 1.28 0.48 0.78 -1.16 0.00 0.00 179.01 179.98 2vvm h GLY 474 N 0.54 1.31 0.99 -3.84 0.00 -0.95 0.26 103.07 101.38 2vvm h GLY 474 Ca -0.10 -0.59 -0.03 0.00 0.00 0.00 0.00 47.33 46.61 2vvm h GLY 474 CO 0.19 0.57 0.26 -0.84 0.00 0.00 0.00 176.54 176.71 2vvm h THR 475 N 1.22 1.22 -0.20 4.70 2.02 -1.18 -1.83 112.91 118.87 2vvm h THR 475 Ca 0.31 -0.66 -0.01 0.00 0.77 0.00 0.00 66.41 66.81 2vvm h THR 475 Cb 0.03 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 66.98 2vvm h THR 475 CO -0.05 0.26 0.07 -0.09 0.37 0.00 0.00 175.52 176.09 2vvm h ARG 476 N 0.82 0.30 -0.43 6.66 2.43 -0.95 -2.29 114.38 120.92 2vvm h ARG 476 Ca 0.20 -0.06 0.06 0.00 -0.81 0.00 0.00 59.98 59.37 2vvm h ARG 476 Cb 0.17 -0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 29.62 2vvm h ARG 476 CO -0.02 0.37 0.14 0.00 -1.51 0.00 0.00 179.97 178.95 2vvm h ALA 477 N 0.91 0.50 -0.86 2.80 0.00 -0.76 -0.21 119.26 121.65 2vvm h ALA 477 Ca 0.07 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.01 2vvm h ALA 477 Cb 0.19 0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 2vvm h ALA 477 CO -0.00 -0.26 0.43 0.00 0.00 0.00 0.00 179.25 179.42 2vvm h ALA 478 N 1.29 1.15 -0.42 0.00 0.00 -1.29 -1.53 119.26 118.46 2vvm h ALA 478 Ca 0.20 -0.15 -0.02 0.00 0.00 0.00 0.00 54.91 54.95 2vvm h ALA 478 Cb 0.21 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 2vvm h ALA 478 CO -0.22 0.66 0.20 -0.09 0.00 0.00 0.00 179.25 179.79 2vvm h ARG 479 N 1.21 0.61 0.04 0.00 9.65 -0.76 -0.83 114.38 124.31 2vvm h ARG 479 Ca 0.30 -0.09 -0.00 0.00 -1.10 0.00 0.00 59.98 59.08 2vvm h ARG 479 Cb 0.08 -0.11 0.00 0.00 -1.39 0.00 0.00 29.97 28.55 2vvm h ARG 479 CO -0.04 0.54 -0.02 0.28 2.80 0.00 0.00 179.97 183.53 2vvm h VAL 480 N 0.54 0.96 -0.11 0.20 2.07 -0.71 -1.59 116.25 117.61 2vvm h VAL 480 Ca 0.14 -0.01 -0.00 0.00 0.82 0.00 0.00 66.70 67.66 2vvm h VAL 480 Cb 0.13 0.97 -0.01 0.00 -1.52 0.00 0.00 31.29 30.86 2vvm h VAL 480 CO -0.02 0.00 0.07 0.58 0.02 0.00 0.00 177.57 178.22 2vvm h VAL 481 N -0.06 1.06 -0.65 2.57 2.07 -1.21 -0.71 116.25 119.31 2vvm h VAL 481 Ca -0.01 -0.14 0.05 0.00 0.82 0.00 0.00 66.70 67.43 2vvm h VAL 481 Cb 0.05 0.94 -0.05 0.00 -1.52 0.00 0.00 31.29 30.71 2vvm h VAL 481 CO 0.01 0.05 0.37 0.25 0.02 0.00 0.00 177.57 178.27 2vvm h LEU 482 N 0.13 0.56 -0.50 2.57 6.46 -1.09 0.82 115.31 124.26 2vvm h LEU 482 Ca 0.04 0.02 -0.05 0.00 -0.12 0.00 0.00 57.88 57.77 2vvm h LEU 482 Cb 0.02 -0.09 -0.02 0.00 -0.73 0.00 0.00 40.66 39.84 2vvm h LEU 482 CO -0.01 0.37 0.11 -0.33 -0.62 0.00 0.00 178.44 177.96 2vvm h GLU 483 N 0.69 0.81 -0.24 1.25 5.08 -1.07 0.59 114.58 121.70 2vvm h GLU 483 Ca 0.28 -0.20 -0.15 0.00 -1.00 0.00 0.00 59.36 58.29 2vvm h GLU 483 Cb 0.14 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 2vvm h GLU 483 CO -0.16 0.79 -0.48 0.93 -1.00 0.00 0.00 179.01 179.09 2vvm h GLU 484 N 0.70 0.64 -0.00 2.33 5.08 -0.69 -3.21 114.58 119.43 2vvm h GLU 484 Ca 0.16 -0.37 0.00 0.00 -1.00 0.00 0.00 59.36 58.15 2vvm h GLU 484 Cb 0.35 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.63 2vvm h GLU 484 CO 0.00 0.98 -0.52 1.28 -1.00 0.00 0.00 179.01 179.75 2vvm n LEU 485 N -4.00 0.80 0.00 1.33 4.77 0.24 -5.10 117.00 115.05 2vvm n LEU 485 Ca -0.03 -0.19 0.00 0.00 -0.03 0.00 0.00 56.01 55.76 2vvm n LEU 485 Cb 0.57 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.50 2vvm n LEU 485 CO 0.47 0.18 0.00 0.61 -1.33 0.00 0.00 177.39 177.32