#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vlr s LEU 4 N 0.00 0.35 -0.11 1.08 1.43 -1.26 -5.06 118.68 115.12 2vlr s LEU 4 Ca 0.00 0.53 -0.01 0.00 -1.03 0.00 0.00 54.13 53.63 2vlr s LEU 4 Cb 0.00 0.74 -0.02 0.00 0.03 0.00 0.00 46.19 46.94 2vlr s LEU 4 CO 0.00 -0.17 -0.08 -0.76 0.23 0.00 0.00 176.35 175.57 2vlr s LEU 5 N 1.35 3.04 -0.09 1.79 1.43 -1.26 -4.45 118.68 120.48 2vlr s LEU 5 Ca -0.09 -0.15 0.04 0.00 -1.03 0.00 0.00 54.13 52.91 2vlr s LEU 5 Cb -0.10 -1.68 0.00 0.00 0.03 0.00 0.00 46.19 44.43 2vlr s LEU 5 CO -0.09 0.25 -0.23 -0.70 0.23 0.00 0.00 176.35 175.82 2vlr s GLU 6 N -0.16 2.89 -0.08 1.70 2.12 -0.36 -4.49 118.70 120.32 2vlr s GLU 6 Ca 0.01 -0.84 -0.01 0.00 0.36 0.00 0.00 54.97 54.49 2vlr s GLU 6 Cb -0.13 -2.21 -0.03 0.00 0.26 0.00 0.00 34.13 32.01 2vlr s GLU 6 CO 0.03 0.18 -0.02 -0.65 -0.54 0.00 0.00 175.26 174.27 2vlr s GLN 7 N 0.32 2.94 -0.07 4.30 -0.21 -1.26 -0.36 119.66 125.31 2vlr s GLN 7 Ca -0.17 -0.44 -0.06 0.00 0.02 0.00 0.00 55.36 54.70 2vlr s GLN 7 Cb -0.17 -2.74 0.02 0.00 1.00 0.00 0.00 33.01 31.11 2vlr s GLN 7 CO 0.08 0.69 0.19 0.45 -2.12 0.00 0.00 175.29 174.58 2vlr s SER 8 N -0.84 -0.20 0.79 5.90 0.15 -0.86 -4.55 113.70 114.10 2vlr s SER 8 Ca 0.13 0.39 -0.12 0.00 0.70 0.00 0.00 55.95 57.05 2vlr s SER 8 Cb -0.11 0.37 0.07 0.00 -1.71 0.00 0.00 66.02 64.64 2vlr s SER 8 CO 0.02 -0.08 1.11 -2.16 1.20 0.00 0.00 173.24 173.33 2vlr s PRO 9 N 0.26 2.14 0.24 5.44 0.04 -1.26 -1.29 135.00 140.57 2vlr s PRO 9 Ca -0.01 0.54 0.04 0.00 0.04 0.00 0.00 61.00 61.61 2vlr s PRO 9 Cb -0.03 -1.93 0.26 0.00 0.04 0.00 0.00 34.50 32.84 2vlr s PRO 9 CO -0.01 -1.56 1.57 1.96 0.04 0.00 0.00 177.00 179.00 2vlr h GLN 10 N -1.04 0.26 -3.83 4.56 4.20 -1.82 -3.41 115.11 114.02 2vlr h GLN 10 Ca -0.47 -0.17 -0.27 0.00 0.06 0.00 0.00 58.65 57.80 2vlr h GLN 10 Cb 1.27 0.02 -0.30 0.00 0.30 0.00 0.00 27.48 28.78 2vlr h GLN 10 CO 0.61 0.76 -0.73 -0.06 -0.67 0.00 0.00 178.83 178.74 2vlr s PHE 11 N -3.81 0.14 -0.08 2.96 0.40 -1.26 -1.83 117.98 114.51 2vlr s PHE 11 Ca -0.04 -0.00 -0.03 0.00 -0.60 0.00 0.00 56.93 56.25 2vlr s PHE 11 Cb 0.12 -0.14 0.04 0.00 0.51 0.00 0.00 43.02 43.55 2vlr s PHE 11 CO 0.80 -0.03 0.16 -1.17 0.70 0.00 0.00 175.22 175.68 2vlr s LEU 12 N 0.22 0.50 -0.23 -0.37 2.96 -0.90 -4.97 118.68 115.90 2vlr s LEU 12 Ca -0.02 0.34 0.00 0.00 -0.22 0.00 0.00 54.13 54.23 2vlr s LEU 12 Cb -0.04 0.40 0.06 0.00 0.50 0.00 0.00 46.19 47.12 2vlr s LEU 12 CO -0.01 -0.17 -0.03 -0.55 -1.32 0.00 0.00 176.35 174.28 2vlr s SER 13 N 1.43 3.71 0.23 3.68 0.15 -1.26 -1.48 113.70 120.16 2vlr s SER 13 Ca -0.07 -1.16 0.02 0.00 0.70 0.00 0.00 55.95 55.44 2vlr s SER 13 Cb -0.12 -1.07 -0.01 0.00 -1.71 0.00 0.00 66.02 63.12 2vlr s SER 13 CO -0.06 -0.26 0.08 2.30 1.20 0.00 0.00 173.24 176.49 2vlr n ILE 14 N 4.74 0.00 -3.99 6.45 -6.64 -0.78 -5.00 119.36 114.14 2vlr n ILE 14 Ca -0.10 -1.35 -0.34 0.00 -1.77 0.00 0.00 62.75 59.18 2vlr n ILE 14 Cb 0.44 0.48 -0.06 0.00 -1.44 0.00 0.00 39.64 39.06 2vlr n ILE 14 CO 0.00 0.00 0.00 -1.10 -1.77 0.00 0.00 176.55 173.68 2vlr s GLN 15 N -2.89 3.28 -0.02 6.28 -1.52 -1.26 -0.77 119.66 122.75 2vlr s GLN 15 Ca 0.11 -0.36 -0.38 0.00 -1.95 0.00 0.00 55.36 52.78 2vlr s GLN 15 Cb 0.01 -3.01 -0.16 0.00 -0.22 0.00 0.00 33.01 29.63 2vlr s GLN 15 CO 0.08 0.68 1.47 -1.91 -0.25 0.00 0.00 175.29 175.36 2vlr n GLU 16 N 1.22 1.17 -0.08 2.91 2.13 0.16 -1.68 120.64 126.46 2vlr n GLU 16 Ca -0.13 0.42 0.00 0.00 0.66 0.00 0.00 57.16 58.11 2vlr n GLU 16 Cb 0.53 -2.08 0.00 0.00 0.27 0.00 0.00 31.44 30.16 2vlr n GLU 16 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2vlr n GLY 17 N 3.05 0.84 3.78 8.31 0.00 0.15 -4.87 105.19 116.44 2vlr n GLY 17 Ca 0.21 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 2vlr n GLY 17 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2vlr s GLU 18 N -0.70 3.32 -0.09 1.61 2.02 -0.68 -4.28 118.70 119.90 2vlr s GLU 18 Ca 0.00 1.48 -0.04 0.00 0.02 0.00 0.00 54.97 56.42 2vlr s GLU 18 Cb 0.00 -2.01 -0.04 0.00 0.10 0.00 0.00 34.13 32.18 2vlr s GLU 18 CO 0.00 -0.85 0.08 -0.80 0.02 0.00 0.00 175.26 173.71 2vlr s ASN 19 N -2.09 5.87 0.08 -0.19 0.01 -1.26 -1.42 114.94 115.95 2vlr s ASN 19 Ca 0.70 0.31 -0.14 0.00 -0.71 0.00 0.00 52.86 53.01 2vlr s ASN 19 Cb -0.21 -1.79 0.02 0.00 0.41 0.00 0.00 41.25 39.68 2vlr s ASN 19 CO 0.30 0.38 0.34 -1.48 -1.51 0.00 0.00 177.10 175.12 2vlr s LEU 20 N -1.09 0.72 -0.01 0.60 0.05 -0.94 -5.02 118.68 112.99 2vlr s LEU 20 Ca 0.16 -0.29 0.01 0.00 0.05 0.00 0.00 54.13 54.06 2vlr s LEU 20 Cb -0.12 1.55 0.00 0.00 -2.05 0.00 0.00 46.19 45.57 2vlr s LEU 20 CO 0.05 -0.73 -0.04 -0.89 -0.55 0.00 0.00 176.35 174.19 2vlr s THR 21 N -3.25 0.32 0.13 5.48 2.01 -1.26 -1.67 115.64 117.39 2vlr s THR 21 Ca -0.00 -0.14 0.09 0.00 0.31 0.00 0.00 61.69 61.95 2vlr s THR 21 Cb 0.01 -0.29 -0.04 0.00 0.01 0.00 0.00 72.50 72.19 2vlr s THR 21 CO -0.08 0.11 -0.21 0.68 -0.69 0.00 0.00 174.62 174.43 2vlr s VAL 22 N 0.10 1.86 0.15 3.82 -7.23 -0.52 -4.92 120.40 113.65 2vlr s VAL 22 Ca -0.01 -1.70 0.11 0.00 -1.81 0.00 0.00 61.98 58.57 2vlr s VAL 22 Cb -0.04 -1.73 -0.04 0.00 0.56 0.00 0.00 36.38 35.13 2vlr s VAL 22 CO -0.00 -0.11 -0.25 -0.31 -0.31 0.00 0.00 175.10 174.12 2vlr s TYR 23 N -1.40 2.34 -0.06 2.82 1.51 -0.41 -2.07 117.35 120.08 2vlr s TYR 23 Ca 0.11 -0.36 -0.03 0.00 -1.01 0.00 0.00 57.07 55.78 2vlr s TYR 23 Cb -0.09 -1.24 0.04 0.00 -0.11 0.00 0.00 41.96 40.57 2vlr s TYR 23 CO 0.05 0.39 0.12 0.00 -1.11 0.00 0.00 175.55 175.00 2vlr s ASN 25 N 2.19 1.46 0.13 0.00 -0.87 0.51 -2.22 114.94 116.14 2vlr s ASN 25 Ca 0.03 -0.57 -0.03 0.00 -1.57 0.00 0.00 52.86 50.72 2vlr s ASN 25 Cb -0.12 -0.04 -0.03 0.00 -0.02 0.00 0.00 41.25 41.04 2vlr s ASN 25 CO -0.05 -0.09 0.11 -0.55 -2.57 0.00 0.00 177.10 173.95 2vlr s SER 26 N -1.60 0.25 0.35 -1.22 0.15 0.05 -1.23 113.70 110.45 2vlr s SER 26 Ca -0.03 -1.10 0.22 0.00 0.70 0.00 0.00 55.95 55.74 2vlr s SER 26 Cb -0.10 0.32 0.21 0.00 -1.71 0.00 0.00 66.02 64.75 2vlr s SER 26 CO 0.02 -0.76 1.41 0.28 1.20 0.00 0.00 173.24 175.38 2vlr h SER 27 N 2.80 0.00 -2.03 5.45 0.02 -1.83 -3.45 113.55 114.51 2vlr h SER 27 Ca -0.34 0.00 -0.61 0.00 -0.84 0.00 0.00 61.79 59.99 2vlr h SER 27 Cb 1.20 0.00 -0.14 0.00 0.14 0.00 0.00 62.40 63.61 2vlr h SER 27 CO 0.57 0.04 -0.70 -0.94 -1.14 0.00 0.00 176.83 174.66 2vlr s SER 28 N -5.95 3.67 0.02 3.07 1.04 -1.26 -5.07 113.70 109.21 2vlr s SER 28 Ca 0.04 -1.16 -0.20 0.00 0.48 0.00 0.00 55.95 55.12 2vlr s SER 28 Cb 0.07 -0.33 -0.06 0.00 0.10 0.00 0.00 66.02 65.80 2vlr s SER 28 CO 0.71 -0.15 0.57 -0.69 0.98 0.00 0.00 173.24 174.66 2vlr s VAL 29 N -2.60 4.86 -0.12 5.02 1.01 -1.26 -4.46 120.40 122.85 2vlr s VAL 29 Ca 0.32 1.21 -0.02 0.00 0.00 0.00 0.00 61.98 63.49 2vlr s VAL 29 Cb 0.01 -3.91 -0.03 0.00 0.00 0.00 0.00 36.38 32.46 2vlr s VAL 29 CO 0.16 0.47 -0.06 -0.36 0.00 0.00 0.00 175.10 175.31 2vlr s PHE 30 N -0.52 2.98 0.11 5.22 0.40 -0.61 -5.01 117.98 120.56 2vlr s PHE 30 Ca 0.30 -0.21 0.10 0.00 -0.60 0.00 0.00 56.93 56.52 2vlr s PHE 30 Cb -0.18 -1.86 0.05 0.00 0.51 0.00 0.00 43.02 41.54 2vlr s PHE 30 CO 0.17 0.09 1.43 0.66 0.70 0.00 0.00 175.22 178.27 2vlr h SER 31 N 6.15 0.00 -4.70 1.36 4.64 -1.89 -3.46 113.55 115.65 2vlr h SER 31 Ca -0.37 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 60.82 2vlr h SER 31 Cb 1.19 0.00 -0.21 0.00 -0.31 0.00 0.00 62.40 63.06 2vlr h SER 31 CO 0.58 0.77 -0.33 -0.94 -0.87 0.00 0.00 176.83 176.05 2vlr s SER 32 N -6.67 -0.19 0.02 4.97 1.04 -1.26 -4.72 113.70 106.88 2vlr s SER 32 Ca 0.01 0.18 0.03 0.00 0.48 0.00 0.00 55.95 56.64 2vlr s SER 32 Cb 0.10 0.38 -0.02 0.00 0.10 0.00 0.00 66.02 66.58 2vlr s SER 32 CO 0.78 -0.35 -0.09 -0.22 0.98 0.00 0.00 173.24 174.34 2vlr s LEU 33 N -0.97 2.14 0.20 2.42 0.20 -0.58 -2.13 118.68 119.96 2vlr s LEU 33 Ca -0.10 -0.35 0.10 0.00 0.69 0.00 0.00 54.13 54.47 2vlr s LEU 33 Cb -0.05 -0.34 -0.04 0.00 -0.43 0.00 0.00 46.19 45.33 2vlr s LEU 33 CO 0.03 -0.03 -0.19 -1.10 -0.29 0.00 0.00 176.35 174.77 2vlr s GLN 34 N -0.88 1.42 0.08 1.98 1.11 -0.50 -1.01 119.66 121.86 2vlr s GLN 34 Ca -0.02 -1.55 0.08 0.00 0.01 0.00 0.00 55.36 53.88 2vlr s GLN 34 Cb -0.06 -1.48 -0.03 0.00 -1.01 0.00 0.00 33.01 30.43 2vlr s GLN 34 CO 0.00 0.29 -0.21 -1.58 0.01 0.00 0.00 175.29 173.81 2vlr s TRP 35 N -2.27 1.78 0.09 0.91 0.52 -1.02 -2.57 118.94 116.39 2vlr s TRP 35 Ca 0.21 -0.40 0.04 0.00 0.02 0.00 0.00 56.10 55.97 2vlr s TRP 35 Cb -0.05 -1.01 -0.03 0.00 -1.15 0.00 0.00 33.47 31.23 2vlr s TRP 35 CO 0.09 0.16 -0.10 0.71 0.02 0.00 0.00 176.95 177.83 2vlr s TYR 36 N -1.03 1.03 -0.08 -1.98 1.51 -0.53 -1.44 117.35 114.84 2vlr s TYR 36 Ca 0.07 -0.63 0.05 0.00 -1.01 0.00 0.00 57.07 55.55 2vlr s TYR 36 Cb -0.10 -0.57 -0.00 0.00 -0.11 0.00 0.00 41.96 41.18 2vlr s TYR 36 CO 0.03 -0.01 -0.24 0.50 -1.11 0.00 0.00 175.55 174.73 2vlr s ARG 37 N -2.59 2.78 -0.07 -0.62 3.52 -0.82 -1.81 118.95 119.33 2vlr s ARG 37 Ca 0.03 -0.86 0.02 0.00 -0.13 0.00 0.00 55.73 54.80 2vlr s ARG 37 Cb -0.04 -2.18 0.01 0.00 -1.56 0.00 0.00 34.95 31.18 2vlr s ARG 37 CO 0.00 0.24 -0.13 -1.14 -0.81 0.00 0.00 175.30 173.46 2vlr s GLN 38 N 0.18 1.76 0.20 5.12 0.74 -0.34 -1.59 119.66 125.73 2vlr s GLN 38 Ca -0.13 -0.43 -0.18 0.00 0.05 0.00 0.00 55.36 54.66 2vlr s GLN 38 Cb -0.16 -1.45 -0.08 0.00 1.10 0.00 0.00 33.01 32.42 2vlr s GLN 38 CO 0.07 0.03 0.68 -1.21 -0.55 0.00 0.00 175.29 174.31 2vlr s GLU 39 N 0.67 4.18 0.34 1.67 0.41 -1.26 -1.93 118.70 122.77 2vlr s GLU 39 Ca -0.14 0.77 -0.29 0.00 -0.41 0.00 0.00 54.97 54.90 2vlr s GLU 39 Cb -0.16 -2.88 -0.11 0.00 -1.78 0.00 0.00 34.13 29.19 2vlr s GLU 39 CO 0.04 0.41 1.55 -1.25 -0.49 0.00 0.00 175.26 175.51 2vlr s PRO 40 N -1.99 4.11 -0.42 0.39 0.04 -1.26 -2.82 135.00 133.05 2vlr s PRO 40 Ca 0.42 2.59 0.00 0.00 0.04 0.00 0.00 61.00 64.05 2vlr s PRO 40 Cb -0.16 -2.99 0.00 0.00 0.04 0.00 0.00 34.50 31.39 2vlr s PRO 40 CO 0.20 -0.59 0.00 0.41 0.04 0.00 0.00 177.00 177.06 2vlr n GLY 41 N 1.26 0.64 3.07 0.56 0.00 -1.26 -5.03 105.19 104.43 2vlr n GLY 41 Ca 0.04 -0.87 -0.08 0.00 0.00 0.00 0.00 46.02 45.12 2vlr n GLY 41 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2vlr s GLU 42 N -2.53 0.55 0.10 1.61 2.56 -1.13 -5.14 118.70 114.73 2vlr s GLU 42 Ca 0.00 -1.04 -0.31 0.00 0.00 0.00 0.00 54.97 53.62 2vlr s GLU 42 Cb 0.00 0.19 -0.08 0.00 2.00 0.00 0.00 34.13 36.25 2vlr s GLU 42 CO 0.00 -0.10 1.39 0.20 -0.56 0.00 0.00 175.26 176.18 2vlr s GLY 43 N -2.53 1.98 0.50 -1.50 0.00 -1.26 -4.76 107.32 99.74 2vlr s GLY 43 Ca 0.01 1.09 -0.22 0.00 0.00 0.00 0.00 44.72 45.60 2vlr s GLY 43 CO -0.08 2.35 1.08 -1.05 0.00 0.00 0.00 173.10 175.40 2vlr n PRO 44 N 4.06 1.35 -4.16 2.90 -0.02 -1.26 -4.79 135.00 133.08 2vlr n PRO 44 Ca 0.12 0.49 -0.34 0.00 -2.02 0.00 0.00 63.50 61.74 2vlr n PRO 44 Cb 0.43 -2.21 -0.13 0.00 -0.02 0.00 0.00 33.50 31.57 2vlr n PRO 44 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2vlr s VAL 45 N -1.35 3.55 0.15 -1.45 1.01 -0.62 -4.97 120.40 116.72 2vlr s VAL 45 Ca 0.68 -0.45 -0.30 0.00 0.00 0.00 0.00 61.98 61.90 2vlr s VAL 45 Cb -0.48 -2.59 -0.07 0.00 0.00 0.00 0.00 36.38 33.24 2vlr s VAL 45 CO 0.53 0.45 1.16 -0.22 0.00 0.00 0.00 175.10 177.02 2vlr s LEU 46 N 1.02 4.44 -0.11 3.92 2.96 -1.26 -1.95 118.68 127.70 2vlr s LEU 46 Ca 0.01 2.11 0.05 0.00 -0.22 0.00 0.00 54.13 56.08 2vlr s LEU 46 Cb -0.15 -3.60 -0.10 0.00 0.50 0.00 0.00 46.19 42.84 2vlr s LEU 46 CO 0.00 -0.34 -0.03 0.18 -1.32 0.00 0.00 176.35 174.85 2vlr n LEU 47 N 2.83 1.35 -3.56 -0.68 4.77 -0.52 -4.96 117.00 116.24 2vlr n LEU 47 Ca 0.05 -0.03 -0.14 0.00 -0.03 0.00 0.00 56.01 55.86 2vlr n LEU 47 Cb 0.46 -0.07 -0.06 0.00 -2.33 0.00 0.00 43.42 41.42 2vlr n LEU 47 CO 0.55 0.45 0.60 0.54 -1.33 0.00 0.00 177.39 178.20 2vlr s VAL 48 N -2.24 0.00 -0.11 4.08 0.11 -1.23 -5.00 120.40 116.01 2vlr s VAL 48 Ca -0.10 0.00 0.03 0.00 -2.93 0.00 0.00 61.98 58.98 2vlr s VAL 48 Cb 0.04 -1.00 -0.00 0.00 -1.53 0.00 0.00 36.38 33.88 2vlr s VAL 48 CO 0.35 0.00 -0.22 -0.89 -3.33 0.00 0.00 175.10 171.01 2vlr s THR 49 N -1.01 2.21 0.09 5.04 2.01 -1.26 -2.42 115.64 120.30 2vlr s THR 49 Ca -0.06 -0.96 0.08 0.00 0.31 0.00 0.00 61.69 61.07 2vlr s THR 49 Cb -0.01 -1.86 -0.04 0.00 0.01 0.00 0.00 72.50 70.60 2vlr s THR 49 CO 0.05 0.55 -0.17 0.68 -0.69 0.00 0.00 174.62 175.04 2vlr s VAL 50 N 0.40 2.88 0.00 3.82 -7.23 -0.18 -5.00 120.40 115.10 2vlr s VAL 50 Ca -0.16 -1.38 0.00 0.00 -1.81 0.00 0.00 61.98 58.63 2vlr s VAL 50 Cb -0.17 -2.29 0.00 0.00 0.56 0.00 0.00 36.38 34.47 2vlr s VAL 50 CO 0.07 0.17 0.00 0.52 -0.31 0.00 0.00 175.10 175.56 2vlr n VAL 51 N 1.02 0.00 -3.55 1.32 0.31 -1.26 -1.52 118.33 114.65 2vlr n VAL 51 Ca -0.16 0.00 -0.36 0.00 -0.01 0.00 0.00 64.34 63.81 2vlr n VAL 51 Cb 0.52 -0.15 -0.07 0.00 -0.91 0.00 0.00 33.84 33.23 2vlr n VAL 51 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 2vlr s THR 52 N -1.28 5.31 0.10 2.52 2.01 -1.26 -4.85 115.64 118.20 2vlr s THR 52 Ca 0.00 0.52 -0.32 0.00 0.31 0.00 0.00 61.69 62.20 2vlr s THR 52 Cb 0.00 -3.62 -0.11 0.00 0.01 0.00 0.00 72.50 68.78 2vlr s THR 52 CO 0.00 0.38 1.84 0.61 -0.69 0.00 0.00 174.62 176.77 2vlr n GLY 53 N 3.45 1.65 1.24 4.40 0.00 -1.26 -1.30 105.19 113.37 2vlr n GLY 53 Ca -0.12 0.74 0.00 0.00 0.00 0.00 0.00 46.02 46.63 2vlr n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vlr n GLY 54 N 4.23 1.01 3.77 -0.02 0.00 0.78 -4.77 105.19 110.18 2vlr n GLY 54 Ca 0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.82 2vlr n GLY 54 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2vlr s GLU 55 N -0.59 3.88 -0.07 1.61 -1.05 -0.42 -4.74 118.70 117.31 2vlr s GLU 55 Ca 0.00 1.99 0.04 0.00 -0.15 0.00 0.00 54.97 56.85 2vlr s GLU 55 Cb 0.00 -2.62 -0.02 0.00 -0.44 0.00 0.00 34.13 31.05 2vlr s GLU 55 CO 0.00 -0.51 -0.19 0.08 0.95 0.00 0.00 175.26 175.59 2vlr s VAL 56 N -1.36 2.62 0.06 1.83 1.01 -1.26 -2.12 120.40 121.18 2vlr s VAL 56 Ca 0.59 -0.86 0.04 0.00 0.00 0.00 0.00 61.98 61.76 2vlr s VAL 56 Cb -0.34 -2.02 -0.03 0.00 0.00 0.00 0.00 36.38 33.99 2vlr s VAL 56 CO 0.43 0.57 -0.12 -0.54 0.00 0.00 0.00 175.10 175.43 2vlr s LYS 57 N -0.22 0.74 -0.05 2.72 1.02 -0.77 -5.01 119.74 118.17 2vlr s LYS 57 Ca -0.01 -0.85 0.04 0.00 0.02 0.00 0.00 55.97 55.18 2vlr s LYS 57 Cb -0.13 -0.68 -0.00 0.00 -0.52 0.00 0.00 37.83 36.50 2vlr s LYS 57 CO 0.03 0.15 -0.18 0.15 -0.92 0.00 0.00 175.35 174.58 2vlr s LYS 58 N -1.56 1.92 -0.03 1.68 1.02 -1.26 -1.10 119.74 120.41 2vlr s LYS 58 Ca -0.04 -0.63 -0.01 0.00 0.02 0.00 0.00 55.97 55.31 2vlr s LYS 58 Cb -0.09 -1.63 0.03 0.00 -0.52 0.00 0.00 37.83 35.61 2vlr s LYS 58 CO 0.02 0.23 0.05 -0.51 -0.92 0.00 0.00 175.35 174.21 2vlr s LEU 59 N 0.10 0.69 0.00 3.17 2.01 -0.09 -5.00 118.68 119.58 2vlr s LEU 59 Ca -0.06 0.07 0.00 0.00 0.01 0.00 0.00 54.13 54.15 2vlr s LEU 59 Cb -0.13 -0.07 0.00 0.00 0.01 0.00 0.00 46.19 46.00 2vlr s LEU 59 CO 0.03 -0.18 0.00 0.29 1.01 0.00 0.00 176.35 177.50 2vlr n LYS 60 N 4.62 0.00 -0.16 1.70 5.02 -1.26 -0.70 118.16 127.37 2vlr n LYS 60 Ca -0.18 0.00 0.06 0.00 -2.02 0.00 0.00 58.31 56.16 2vlr n LYS 60 Cb 0.50 0.00 0.17 0.00 -0.02 0.00 0.00 35.03 35.68 2vlr n LYS 60 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2vlr n ARG 61 N 14.00 1.76 -4.18 1.97 1.74 -1.26 -4.94 116.66 125.75 2vlr n ARG 61 Ca 0.00 -1.19 -0.34 0.00 -0.77 0.00 0.00 57.85 55.55 2vlr n ARG 61 Cb 0.00 -1.27 -0.08 0.00 -1.02 0.00 0.00 32.46 30.09 2vlr n ARG 61 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2vlr s LEU 62 N -1.05 3.80 -0.09 0.55 1.02 0.12 -2.55 118.68 120.49 2vlr s LEU 62 Ca 0.23 0.16 -0.02 0.00 0.02 0.00 0.00 54.13 54.53 2vlr s LEU 62 Cb 0.12 -2.07 0.03 0.00 0.02 0.00 0.00 46.19 44.29 2vlr s LEU 62 CO 0.16 0.32 0.02 -0.89 0.02 0.00 0.00 176.35 175.98 2vlr s THR 63 N -1.06 0.30 -0.12 5.49 2.01 -0.55 -0.91 115.64 120.80 2vlr s THR 63 Ca 0.19 0.05 -0.04 0.00 0.31 0.00 0.00 61.69 62.20 2vlr s THR 63 Cb -0.12 -0.56 -0.03 0.00 0.01 0.00 0.00 72.50 71.80 2vlr s THR 63 CO 0.09 0.15 0.03 -0.36 -0.69 0.00 0.00 174.62 173.83 2vlr s PHE 64 N 1.99 3.21 -0.07 4.92 0.08 -0.26 -0.55 117.98 127.30 2vlr s PHE 64 Ca 0.04 0.14 0.02 0.00 0.12 0.00 0.00 56.93 57.25 2vlr s PHE 64 Cb -0.13 -1.89 0.01 0.00 -0.57 0.00 0.00 43.02 40.44 2vlr s PHE 64 CO -0.06 0.36 -0.14 -0.65 -0.10 0.00 0.00 175.22 174.64 2vlr s GLN 65 N -0.45 1.87 -0.26 0.44 -1.52 -0.82 -1.85 119.66 117.06 2vlr s GLN 65 Ca 0.09 -0.47 -0.10 0.00 -1.95 0.00 0.00 55.36 52.93 2vlr s GLN 65 Cb -0.12 -1.53 -0.04 0.00 -0.22 0.00 0.00 33.01 31.09 2vlr s GLN 65 CO 0.02 0.03 0.15 0.12 -0.25 0.00 0.00 175.29 175.36 2vlr s PHE 66 N 0.67 3.20 0.62 0.91 5.36 -0.90 -1.26 117.98 126.58 2vlr s PHE 66 Ca -0.14 -0.01 -0.18 0.00 -0.96 0.00 0.00 56.93 55.64 2vlr s PHE 66 Cb -0.16 -2.31 -0.04 0.00 -0.34 0.00 0.00 43.02 40.17 2vlr s PHE 66 CO 0.04 -0.16 1.04 0.41 -1.46 0.00 0.00 175.22 175.08 2vlr n GLY 67 N 4.84 -0.13 0.35 13.12 0.00 0.01 -0.15 105.19 123.23 2vlr n GLY 67 Ca -0.15 -0.15 0.01 0.00 0.00 0.00 0.00 46.02 45.73 2vlr n GLY 67 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2vlr h ASP 68 N 0.44 0.86 0.32 1.61 3.32 -1.89 -1.02 116.42 120.06 2vlr h ASP 68 Ca -0.49 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.54 2vlr h ASP 68 Cb 1.36 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.70 2vlr h ASP 68 CO 0.51 0.62 -0.02 0.00 -1.72 0.00 0.00 179.24 178.62 2vlr n ALA 69 N -2.42 2.61 -1.97 3.45 0.00 -1.26 -4.61 120.51 116.31 2vlr n ALA 69 Ca 0.08 -0.20 -0.11 0.00 0.00 0.00 0.00 53.44 53.21 2vlr n ALA 69 Cb 0.04 -1.46 -0.02 0.00 0.00 0.00 0.00 19.45 18.01 2vlr n ALA 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2vlr n ARG 70 N -1.07 -0.88 0.00 0.00 1.74 -0.39 -4.84 116.66 111.23 2vlr n ARG 70 Ca 0.18 0.65 0.07 0.00 -0.77 0.00 0.00 57.85 57.98 2vlr n ARG 70 Cb 0.21 -4.74 -0.06 0.00 -1.02 0.00 0.00 32.46 26.84 2vlr n ARG 70 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 2vlr n LYS 71 N -2.26 2.20 -3.89 5.56 5.02 -1.26 -1.57 118.16 121.96 2vlr n LYS 71 Ca -0.13 -0.18 -0.09 0.00 -2.02 0.00 0.00 58.31 55.89 2vlr n LYS 71 Cb 0.54 -1.18 -0.05 0.00 -0.02 0.00 0.00 35.03 34.31 2vlr n LYS 71 CO 0.00 0.00 0.00 0.16 -0.52 0.00 0.00 177.40 177.04 2vlr s ASP 72 N -2.21 -0.10 0.01 4.39 -4.77 -1.26 -0.77 116.67 111.96 2vlr s ASP 72 Ca 0.07 -0.75 -0.13 0.00 -3.30 0.00 0.00 52.55 48.45 2vlr s ASP 72 Cb 0.11 0.52 0.02 0.00 -1.09 0.00 0.00 42.92 42.48 2vlr s ASP 72 CO 0.53 -1.01 0.26 -0.55 0.70 0.00 0.00 175.17 175.11 2vlr s SER 73 N -2.95 -0.11 0.10 2.11 0.15 -0.94 -0.81 113.70 111.25 2vlr s SER 73 Ca 0.16 -0.08 0.08 0.00 0.70 0.00 0.00 55.95 56.81 2vlr s SER 73 Cb 0.01 0.29 -0.03 0.00 -1.71 0.00 0.00 66.02 64.58 2vlr s SER 73 CO 0.01 -0.48 -0.20 -0.94 1.20 0.00 0.00 173.24 172.83 2vlr s SER 74 N -1.56 2.47 -0.19 5.45 1.04 -0.39 -2.15 113.70 118.37 2vlr s SER 74 Ca -0.11 -0.68 -0.00 0.00 0.48 0.00 0.00 55.95 55.64 2vlr s SER 74 Cb -0.04 -0.13 0.01 0.00 0.10 0.00 0.00 66.02 65.96 2vlr s SER 74 CO 0.01 0.05 -0.16 -0.22 0.98 0.00 0.00 173.24 173.90 2vlr s LEU 75 N -1.88 2.31 -0.18 2.42 2.96 -0.88 -1.95 118.68 121.49 2vlr s LEU 75 Ca 0.06 -0.58 -0.04 0.00 -0.22 0.00 0.00 54.13 53.34 2vlr s LEU 75 Cb -0.10 -1.54 -0.02 0.00 0.50 0.00 0.00 46.19 45.03 2vlr s LEU 75 CO 0.04 0.00 -0.03 -2.28 -1.32 0.00 0.00 176.35 172.77 2vlr s HIS 76 N 1.28 3.01 -0.18 5.38 5.65 0.28 -1.43 115.29 129.28 2vlr s HIS 76 Ca 0.04 -0.46 -0.06 0.00 0.25 0.00 0.00 55.06 54.83 2vlr s HIS 76 Cb -0.14 -2.02 -0.04 0.00 -1.18 0.00 0.00 32.58 29.21 2vlr s HIS 76 CO -0.10 -0.19 0.03 0.42 -0.65 0.00 0.00 174.74 174.26 2vlr s ILE 77 N 0.76 4.45 -0.22 0.89 1.01 -0.67 -1.48 121.20 125.94 2vlr s ILE 77 Ca -0.01 -0.15 -0.10 0.00 0.00 0.00 0.00 60.65 60.39 2vlr s ILE 77 Cb -0.14 -3.00 -0.05 0.00 0.01 0.00 0.00 42.46 39.28 2vlr s ILE 77 CO 0.02 0.46 0.14 -0.89 0.00 0.00 0.00 174.94 174.66 2vlr s THR 78 N 0.52 5.31 -1.24 2.92 2.01 -1.06 -2.21 115.64 121.90 2vlr s THR 78 Ca 0.01 0.16 -0.08 0.00 0.31 0.00 0.00 61.69 62.09 2vlr s THR 78 Cb -0.13 -3.45 -0.01 0.00 0.01 0.00 0.00 72.50 68.92 2vlr s THR 78 CO 0.02 0.39 0.71 0.00 -0.69 0.00 0.00 174.62 175.05 2vlr n ALA 79 N 3.92 -2.25 -1.50 7.40 0.00 -1.23 -4.86 120.51 121.99 2vlr n ALA 79 Ca -0.16 -0.18 -0.44 0.00 0.00 0.00 0.00 53.44 52.67 2vlr n ALA 79 Cb 0.52 -3.04 -0.01 0.00 0.00 0.00 0.00 19.45 16.92 2vlr n ALA 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2vlr n ALA 80 N -4.15 -1.29 -2.60 0.00 0.00 -0.51 -4.47 120.51 107.49 2vlr n ALA 80 Ca -0.21 0.31 -0.14 0.00 0.00 0.00 0.00 53.44 53.40 2vlr n ALA 80 Cb 0.64 -1.84 -0.11 0.00 0.00 0.00 0.00 19.45 18.15 2vlr n ALA 80 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 2vlr s GLN 81 N -1.45 0.74 0.12 0.00 -0.21 -1.26 -0.68 119.66 116.92 2vlr s GLN 81 Ca 0.62 -1.03 0.06 0.00 0.02 0.00 0.00 55.36 55.03 2vlr s GLN 81 Cb -0.71 -0.47 0.33 0.00 1.00 0.00 0.00 33.01 33.16 2vlr s GLN 81 CO 0.58 0.08 1.09 -2.30 -2.12 0.00 0.00 175.29 172.62 2vlr n PRO 82 N 0.88 0.04 0.00 2.91 -0.02 -1.26 0.76 135.00 138.31 2vlr n PRO 82 Ca -0.18 0.47 0.15 0.00 -2.02 0.00 0.00 63.50 61.91 2vlr n PRO 82 Cb 0.57 -1.76 0.91 0.00 -0.02 0.00 0.00 33.50 33.20 2vlr n PRO 82 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2vlr n GLY 83 N -1.35 -0.98 0.00 -1.23 0.00 -1.26 -3.34 105.19 97.02 2vlr n GLY 83 Ca -0.00 -0.19 0.10 0.00 0.00 0.00 0.00 46.02 45.93 2vlr n GLY 83 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2vlr n ASP 84 N -0.99 0.88 -4.67 1.61 8.00 0.23 -4.98 116.55 116.64 2vlr n ASP 84 Ca 0.23 -0.83 -0.46 0.00 0.71 0.00 0.00 54.79 54.44 2vlr n ASP 84 Cb 0.11 0.85 -0.04 0.00 -0.02 0.00 0.00 41.12 42.02 2vlr n ASP 84 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 2vlr n THR 85 N -1.51 0.00 0.00 -3.53 -1.04 -1.21 -4.92 114.28 102.07 2vlr n THR 85 Ca 0.04 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.05 2vlr n THR 85 Cb 0.33 -1.56 0.00 0.00 -1.82 0.00 0.00 70.33 67.29 2vlr n THR 85 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2vlr n GLY 86 N 3.43 0.05 3.66 3.41 0.00 -0.79 -4.88 105.19 110.07 2vlr n GLY 86 Ca 0.17 -1.45 -0.41 0.00 0.00 0.00 0.00 46.02 44.33 2vlr n GLY 86 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2vlr s LEU 87 N 0.00 4.14 -0.23 0.99 2.96 -0.81 -1.82 118.68 123.91 2vlr s LEU 87 Ca 0.00 1.01 -0.07 0.00 -0.22 0.00 0.00 54.13 54.85 2vlr s LEU 87 Cb 0.00 -3.09 -0.03 0.00 0.50 0.00 0.00 46.19 43.56 2vlr s LEU 87 CO 0.00 -0.38 0.07 -0.31 -1.32 0.00 0.00 176.35 174.41 2vlr s TYR 88 N 2.25 3.14 -0.09 5.38 1.51 -0.59 -1.20 117.35 127.74 2vlr s TYR 88 Ca 0.34 -0.21 0.04 0.00 -1.01 0.00 0.00 57.07 56.22 2vlr s TYR 88 Cb -0.16 -2.19 0.00 0.00 -0.11 0.00 0.00 41.96 39.51 2vlr s TYR 88 CO 0.10 -0.17 -0.21 -0.51 -1.11 0.00 0.00 175.55 173.65 2vlr s LEU 89 N 1.18 1.99 0.12 -1.29 1.43 -0.75 -1.91 118.68 119.44 2vlr s LEU 89 Ca 0.05 -0.50 0.03 0.00 -1.03 0.00 0.00 54.13 52.67 2vlr s LEU 89 Cb -0.14 -1.28 -0.04 0.00 0.03 0.00 0.00 46.19 44.76 2vlr s LEU 89 CO 0.03 0.13 0.17 0.00 0.23 0.00 0.00 176.35 176.91 2vlr s ALA 91 N -1.60 -0.94 0.06 0.00 0.00 -1.06 -1.77 121.76 116.45 2vlr s ALA 91 Ca 0.32 0.49 -0.05 0.00 0.00 0.00 0.00 51.96 52.73 2vlr s ALA 91 Cb -0.11 0.05 -0.02 0.00 0.00 0.00 0.00 23.12 23.04 2vlr s ALA 91 CO 0.25 -0.28 0.07 0.20 0.00 0.00 0.00 175.76 176.01 2vlr s GLY 92 N -1.28 0.27 -0.10 0.00 0.00 -0.04 -1.41 107.32 104.76 2vlr s GLY 92 Ca -0.13 -0.87 -0.36 0.00 0.00 0.00 0.00 44.72 43.36 2vlr s GLY 92 CO 0.05 -1.01 1.75 0.00 0.00 0.00 0.00 173.10 173.89 2vlr n ALA 93 N 0.18 0.40 -2.76 3.20 0.00 -0.91 -0.73 120.51 119.90 2vlr n ALA 93 Ca -0.15 0.36 -0.34 0.00 0.00 0.00 0.00 53.44 53.31 2vlr n ALA 93 Cb 0.61 -2.35 -0.05 0.00 0.00 0.00 0.00 19.45 17.66 2vlr n ALA 93 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2vlr s GLY 94 N 3.17 2.24 0.52 0.00 0.00 -0.05 -4.77 107.32 108.44 2vlr s GLY 94 Ca 0.92 -0.60 0.30 0.00 0.00 0.00 0.00 44.72 45.34 2vlr s GLY 94 CO 0.54 -0.44 2.01 1.48 0.00 0.00 0.00 173.10 176.68 2vlr h SER 95 N 3.68 0.00 -0.59 1.64 4.64 -1.94 -2.61 113.55 118.37 2vlr h SER 95 Ca -0.49 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 60.78 2vlr h SER 95 Cb 1.19 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.24 2vlr h SER 95 CO 0.68 0.11 0.07 0.00 -0.87 0.00 0.00 176.83 176.82 2vlr n GLN 96 N -3.36 4.41 -0.84 4.77 1.13 -1.26 -4.95 117.38 117.28 2vlr n GLN 96 Ca -0.01 -3.13 0.00 0.00 -1.94 0.00 0.00 57.00 51.93 2vlr n GLN 96 Cb 0.30 -2.22 0.00 0.00 0.11 0.00 0.00 30.24 28.43 2vlr n GLN 96 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2vlr n GLY 97 N 0.30 0.98 0.86 1.08 0.00 -0.98 -5.06 105.19 102.36 2vlr n GLY 97 Ca 0.31 -0.50 -0.06 0.00 0.00 0.00 0.00 46.02 45.77 2vlr n GLY 97 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2vlr n ASN 98 N 1.03 0.79 -4.67 1.61 2.04 -1.26 -5.00 115.26 109.81 2vlr n ASN 98 Ca 0.00 -1.56 -0.35 0.00 -0.44 0.00 0.00 54.58 52.23 2vlr n ASN 98 Cb 0.16 0.30 -0.09 0.00 -2.53 0.00 0.00 39.78 37.62 2vlr n ASN 98 CO 0.00 0.00 0.00 -0.76 -0.44 0.00 0.00 177.26 176.06 2vlr s LEU 99 N 0.00 3.86 -0.14 -4.53 1.43 -1.26 -0.87 118.68 117.16 2vlr s LEU 99 Ca 0.06 0.13 -0.29 0.00 -1.03 0.00 0.00 54.13 53.01 2vlr s LEU 99 Cb 0.00 -1.96 -0.01 0.00 0.03 0.00 0.00 46.19 44.25 2vlr s LEU 99 CO 0.04 0.22 0.98 -0.63 0.23 0.00 0.00 176.35 177.19 2vlr s ILE 100 N 0.10 4.78 0.00 -0.59 -1.09 0.09 -4.88 121.20 119.61 2vlr s ILE 100 Ca 0.05 1.96 0.02 0.00 -2.23 0.00 0.00 60.65 60.46 2vlr s ILE 100 Cb -0.12 -4.28 -0.04 0.00 -1.58 0.00 0.00 42.46 36.44 2vlr s ILE 100 CO 0.01 -0.03 -0.02 -0.36 -1.23 0.00 0.00 174.94 173.30 2vlr s PHE 101 N 2.29 3.02 0.67 3.97 0.40 -1.26 -0.86 117.98 126.21 2vlr s PHE 101 Ca 0.45 0.04 -0.07 0.00 -0.60 0.00 0.00 56.93 56.76 2vlr s PHE 101 Cb -0.17 -1.65 0.04 0.00 0.51 0.00 0.00 43.02 41.75 2vlr s PHE 101 CO 0.14 0.43 0.99 0.20 0.70 0.00 0.00 175.22 177.68 2vlr s GLY 102 N -1.52 1.65 0.04 4.36 0.00 -0.73 -4.62 107.32 106.51 2vlr s GLY 102 Ca 0.19 -0.80 0.25 0.00 0.00 0.00 0.00 44.72 44.36 2vlr s GLY 102 CO 0.09 -0.44 1.42 0.28 0.00 0.00 0.00 173.10 174.46 2vlr n LYS 103 N -2.82 0.11 0.00 2.90 4.76 -1.26 -4.76 118.16 117.09 2vlr n LYS 103 Ca 0.07 0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.54 2vlr n LYS 103 Cb 0.59 -1.57 0.00 0.00 -1.84 0.00 0.00 35.03 32.22 2vlr n LYS 103 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2vlr n GLY 104 N 1.44 2.13 3.03 0.72 0.00 -1.26 -4.99 105.19 106.25 2vlr n GLY 104 Ca 0.05 -1.99 -0.31 0.00 0.00 0.00 0.00 46.02 43.77 2vlr n GLY 104 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2vlr s THR 105 N -2.46 1.73 -0.37 2.61 2.01 -0.80 -4.65 115.64 113.71 2vlr s THR 105 Ca 0.00 -0.96 -0.20 0.00 0.31 0.00 0.00 61.69 60.84 2vlr s THR 105 Cb 0.00 -1.73 0.01 0.00 0.01 0.00 0.00 72.50 70.78 2vlr s THR 105 CO 0.00 0.28 0.60 -0.75 -0.69 0.00 0.00 174.62 174.06 2vlr s LYS 106 N 1.38 3.56 -0.17 4.92 2.20 -0.76 -1.54 119.74 129.34 2vlr s LYS 106 Ca 0.01 -0.11 -0.07 0.00 -0.36 0.00 0.00 55.97 55.43 2vlr s LYS 106 Cb -0.15 -3.84 -0.04 0.00 -1.51 0.00 0.00 37.83 32.28 2vlr s LYS 106 CO -0.09 -0.77 0.08 -1.17 -0.36 0.00 0.00 175.35 173.03 2vlr s LEU 107 N 2.64 3.94 -0.08 5.43 2.96 -0.75 -2.11 118.68 130.71 2vlr s LEU 107 Ca 0.22 0.17 0.05 0.00 -0.22 0.00 0.00 54.13 54.35 2vlr s LEU 107 Cb -0.15 -1.99 -0.01 0.00 0.50 0.00 0.00 46.19 44.55 2vlr s LEU 107 CO 0.15 0.23 -0.23 -0.44 -1.32 0.00 0.00 176.35 174.74 2vlr s SER 108 N 0.05 3.23 -0.18 3.68 0.01 -0.55 -1.89 113.70 118.05 2vlr s SER 108 Ca 0.07 -0.49 -0.03 0.00 1.31 0.00 0.00 55.95 56.81 2vlr s SER 108 Cb -0.12 -1.10 -0.02 0.00 0.21 0.00 0.00 66.02 64.99 2vlr s SER 108 CO 0.00 0.22 -0.06 -0.69 0.41 0.00 0.00 173.24 173.12 2vlr s VAL 109 N 0.01 3.53 -0.06 3.43 1.01 -1.26 -1.86 120.40 125.20 2vlr s VAL 109 Ca -0.08 -0.47 -0.01 0.00 0.00 0.00 0.00 61.98 61.42 2vlr s VAL 109 Cb -0.15 -2.56 -0.03 0.00 0.00 0.00 0.00 36.38 33.64 2vlr s VAL 109 CO 0.05 0.47 0.00 -0.54 0.00 0.00 0.00 175.10 175.09 2vlr s LYS 110 N 0.81 2.94 0.50 2.72 1.02 0.05 -4.67 119.74 123.12 2vlr s LYS 110 Ca -0.02 -0.45 -0.21 0.00 0.02 0.00 0.00 55.97 55.31 2vlr s LYS 110 Cb -0.15 -2.77 -0.07 0.00 -0.52 0.00 0.00 37.83 34.32 2vlr s LYS 110 CO 0.02 0.68 1.10 -1.25 -0.92 0.00 0.00 175.35 174.98 2vlr s PRO 111 N -1.06 3.62 -0.24 -1.68 0.04 -1.26 0.37 135.00 134.78 2vlr s PRO 111 Ca 0.15 1.57 -0.26 0.00 0.04 0.00 0.00 61.00 62.50 2vlr s PRO 111 Cb -0.11 -2.15 0.00 0.00 0.04 0.00 0.00 34.50 32.28 2vlr s PRO 111 CO 0.04 -0.62 0.90 -0.80 0.04 0.00 0.00 177.00 176.56 2vlr s ASN 112 N -1.74 6.91 -0.59 6.66 0.01 -1.26 -4.72 114.94 120.21 2vlr s ASN 112 Ca 0.68 1.13 -0.18 0.00 -0.71 0.00 0.00 52.86 53.78 2vlr s ASN 112 Cb -0.23 -2.47 0.11 0.00 0.41 0.00 0.00 41.25 39.08 2vlr s ASN 112 CO 0.26 -0.57 0.66 -0.63 -1.51 0.00 0.00 177.10 175.31 2vlr s ILE 113 N 2.97 4.95 0.26 0.60 -1.09 -1.26 -4.93 121.20 122.70 2vlr s ILE 113 Ca 0.38 -1.18 0.01 0.00 -2.23 0.00 0.00 60.65 57.62 2vlr s ILE 113 Cb -0.15 -4.45 0.06 0.00 -1.58 0.00 0.00 42.46 36.34 2vlr s ILE 113 CO 0.07 -1.06 1.71 1.56 -1.23 0.00 0.00 174.94 175.99 2vlr h GLN 114 N 9.07 0.57 -2.57 2.79 4.20 -1.95 -3.36 115.11 123.86 2vlr h GLN 114 Ca -0.28 -0.21 -0.60 0.00 0.06 0.00 0.00 58.65 57.62 2vlr h GLN 114 Cb 1.09 -0.04 -0.39 0.00 0.30 0.00 0.00 27.48 28.44 2vlr h GLN 114 CO 1.08 0.75 -0.87 -0.80 -0.67 0.00 0.00 178.83 178.32 2vlr s ASN 115 N -6.78 2.39 0.39 1.46 0.01 -1.26 -5.12 114.94 106.02 2vlr s ASN 115 Ca -0.08 -3.07 -0.27 0.00 -0.71 0.00 0.00 52.86 48.74 2vlr s ASN 115 Cb 0.14 -0.69 -0.09 0.00 0.41 0.00 0.00 41.25 41.01 2vlr s ASN 115 CO 0.80 -0.18 1.36 -2.84 -1.51 0.00 0.00 177.10 174.74 2vlr s PRO 116 N -0.07 4.04 -0.36 -0.60 0.02 -1.26 -4.97 135.00 131.80 2vlr s PRO 116 Ca 0.28 2.30 0.13 0.00 0.02 0.00 0.00 61.00 63.74 2vlr s PRO 116 Cb -0.03 -2.86 0.38 0.00 0.02 0.00 0.00 34.50 32.02 2vlr s PRO 116 CO -0.15 -0.49 0.84 -3.47 -0.33 0.00 0.00 177.00 173.40 2vlr n ASP 117 N 0.29 0.75 -4.67 2.53 -0.08 0.01 -5.02 116.55 110.36 2vlr n ASP 117 Ca 0.02 -2.94 -0.52 0.00 -1.51 0.00 0.00 54.79 49.85 2vlr n ASP 117 Cb 0.42 -0.39 -0.06 0.00 2.34 0.00 0.00 41.12 43.43 2vlr n ASP 117 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 2vlr n PRO 118 N 0.15 1.63 -3.73 -0.67 -0.04 -1.24 -4.63 135.00 126.48 2vlr n PRO 118 Ca 0.18 0.60 -0.14 0.00 -0.04 0.00 0.00 63.50 64.10 2vlr n PRO 118 Cb 0.72 -2.34 -0.09 0.00 -0.04 0.00 0.00 33.50 31.75 2vlr n PRO 118 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2vlr s ALA 119 N 2.78 -0.94 -0.14 0.55 0.00 -1.01 -0.18 121.76 122.81 2vlr s ALA 119 Ca 0.91 0.64 0.02 0.00 0.00 0.00 0.00 51.96 53.54 2vlr s ALA 119 Cb -0.87 -0.13 0.00 0.00 0.00 0.00 0.00 23.12 22.13 2vlr s ALA 119 CO 0.54 -0.25 -0.20 0.08 0.00 0.00 0.00 175.76 175.92 2vlr s VAL 120 N -0.90 2.26 0.24 0.00 1.01 -0.47 -1.16 120.40 121.37 2vlr s VAL 120 Ca -0.10 -0.92 0.11 0.00 0.00 0.00 0.00 61.98 61.07 2vlr s VAL 120 Cb -0.04 -1.91 -0.05 0.00 0.00 0.00 0.00 36.38 34.38 2vlr s VAL 120 CO 0.04 0.54 -0.19 -0.31 0.00 0.00 0.00 175.10 175.18 2vlr s TYR 121 N 0.70 2.12 -0.14 5.22 2.02 -0.29 -4.29 117.35 122.70 2vlr s TYR 121 Ca -0.09 -0.40 -0.02 0.00 -0.37 0.00 0.00 57.07 56.19 2vlr s TYR 121 Cb -0.16 -0.97 -0.02 0.00 -0.40 0.00 0.00 41.96 40.41 2vlr s TYR 121 CO 0.01 0.57 -0.08 -1.14 -1.57 0.00 0.00 175.55 173.34 2vlr s GLN 122 N -3.31 3.47 -0.07 -0.62 0.74 -1.26 -0.91 119.66 117.69 2vlr s GLN 122 Ca 0.25 -0.59 0.03 0.00 0.05 0.00 0.00 55.36 55.10 2vlr s GLN 122 Cb -0.05 -2.77 -0.02 0.00 1.10 0.00 0.00 33.01 31.27 2vlr s GLN 122 CO 0.12 0.27 -0.15 -0.51 -0.55 0.00 0.00 175.29 174.47 2vlr s LEU 123 N 0.24 2.69 0.08 3.68 1.02 -0.61 -5.01 118.68 120.76 2vlr s LEU 123 Ca -0.05 -0.26 -0.05 0.00 0.02 0.00 0.00 54.13 53.79 2vlr s LEU 123 Cb -0.15 -1.56 -0.05 0.00 0.02 0.00 0.00 46.19 44.45 2vlr s LEU 123 CO 0.04 0.28 0.32 0.00 0.02 0.00 0.00 176.35 177.01 2vlr s ARG 124 N -0.37 3.60 0.24 1.70 3.03 -1.26 -2.18 118.95 123.71 2vlr s ARG 124 Ca 0.04 -0.11 -0.31 0.00 2.03 0.00 0.00 55.73 57.39 2vlr s ARG 124 Cb -0.12 -2.97 -0.11 0.00 -1.03 0.00 0.00 34.95 30.72 2vlr s ARG 124 CO 0.02 0.56 1.54 0.34 -1.13 0.00 0.00 175.30 176.63 2vlr s ASP 125 N -2.14 6.53 -0.03 -2.89 -1.08 -0.70 -4.96 116.67 111.40 2vlr s ASP 125 Ca 0.35 2.76 -0.25 0.00 -0.52 0.00 0.00 52.55 54.89 2vlr s ASP 125 Cb -0.13 -2.62 -0.19 0.00 -1.46 0.00 0.00 42.92 38.52 2vlr s ASP 125 CO 0.22 -0.82 1.14 0.77 0.52 0.00 0.00 175.17 177.00 2vlr h SER 126 N 5.53 -0.08 -2.03 -0.34 4.64 -1.95 -3.35 113.55 115.98 2vlr h SER 126 Ca -0.45 -0.46 -0.72 0.00 -0.47 0.00 0.00 61.79 59.69 2vlr h SER 126 Cb 1.21 0.02 -0.32 0.00 -0.31 0.00 0.00 62.40 63.00 2vlr h SER 126 CO 0.83 0.45 0.44 1.17 -0.87 0.00 0.00 176.83 178.85 2vlr n LYS 127 N -4.88 3.76 -3.59 4.77 4.81 -1.26 -4.95 118.16 116.82 2vlr n LYS 127 Ca -0.09 -4.26 -0.08 0.00 -0.87 0.00 0.00 58.31 53.01 2vlr n LYS 127 Cb 0.27 -2.32 -0.05 0.00 0.02 0.00 0.00 35.03 32.95 2vlr n LYS 127 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2vlr s SER 128 N -2.01 -0.28 0.43 3.14 0.15 -1.26 -5.15 113.70 108.72 2vlr s SER 128 Ca 0.47 0.28 -0.10 0.00 0.70 0.00 0.00 55.95 57.30 2vlr s SER 128 Cb 0.33 0.23 -0.06 0.00 -1.71 0.00 0.00 66.02 64.82 2vlr s SER 128 CO -0.25 -0.28 0.79 -0.55 1.20 0.00 0.00 173.24 174.16 2vlr s SER 129 N -1.21 6.48 0.46 5.45 0.15 -1.26 -4.72 113.70 119.04 2vlr s SER 129 Ca 0.02 1.13 0.00 0.00 0.70 0.00 0.00 55.95 57.80 2vlr s SER 129 Cb -0.01 -2.33 0.00 0.00 -1.71 0.00 0.00 66.02 61.98 2vlr s SER 129 CO -0.01 -0.45 0.00 -0.67 1.20 0.00 0.00 173.24 173.30 2vlr n ASP 130 N -1.51 -0.69 -2.06 5.45 -0.08 -1.26 -5.01 116.55 111.39 2vlr n ASP 130 Ca 0.02 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.30 2vlr n ASP 130 Cb 0.54 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.00 2vlr n ASP 130 CO 0.00 0.00 0.00 1.17 0.12 0.00 0.00 177.20 178.49 2vlr n LYS 131 N 0.00 -5.14 -3.45 -0.67 4.81 -1.26 -4.17 118.16 108.28 2vlr n LYS 131 Ca 0.00 3.62 -0.11 0.00 -0.87 0.00 0.00 58.31 60.95 2vlr n LYS 131 Cb 0.00 -3.97 -0.02 0.00 0.02 0.00 0.00 35.03 31.06 2vlr n LYS 131 CO 0.00 0.00 0.00 -1.54 1.17 0.00 0.00 177.40 177.03 2vlr s SER 132 N -0.48 -0.51 0.31 3.14 1.04 -1.26 -1.72 113.70 114.22 2vlr s SER 132 Ca 0.00 -0.02 0.10 0.00 0.48 0.00 0.00 55.95 56.52 2vlr s SER 132 Cb 0.00 0.55 -0.06 0.00 0.10 0.00 0.00 66.02 66.62 2vlr s SER 132 CO 0.00 -0.90 -0.11 0.68 0.98 0.00 0.00 173.24 173.89 2vlr s VAL 133 N -3.61 2.52 -0.09 5.02 -7.23 -0.93 -4.69 120.40 111.40 2vlr s VAL 133 Ca 0.02 -2.21 0.02 0.00 -1.81 0.00 0.00 61.98 58.00 2vlr s VAL 133 Cb -0.01 -2.56 -0.02 0.00 0.56 0.00 0.00 36.38 34.35 2vlr s VAL 133 CO -0.12 -0.29 -0.14 0.00 -0.31 0.00 0.00 175.10 174.24 2vlr s LEU 135 N -0.18 2.33 -0.38 0.00 2.96 -0.09 -1.88 118.68 121.44 2vlr s LEU 135 Ca 0.00 -0.99 -0.20 0.00 -0.22 0.00 0.00 54.13 52.73 2vlr s LEU 135 Cb -0.13 -1.18 0.01 0.00 0.50 0.00 0.00 46.19 45.39 2vlr s LEU 135 CO 0.03 -0.19 0.60 0.12 -1.32 0.00 0.00 176.35 175.59 2vlr s PHE 136 N 1.42 3.13 0.13 5.38 5.36 -0.85 -1.13 117.98 131.42 2vlr s PHE 136 Ca -0.03 0.15 0.01 0.00 -0.96 0.00 0.00 56.93 56.10 2vlr s PHE 136 Cb -0.17 -3.14 -0.04 0.00 -0.34 0.00 0.00 43.02 39.32 2vlr s PHE 136 CO -0.07 -0.68 -0.01 -0.08 -1.46 0.00 0.00 175.22 172.92 2vlr s THR 137 N 2.64 0.52 -0.35 0.12 -1.32 -0.31 -0.55 115.64 116.40 2vlr s THR 137 Ca 0.22 -1.94 0.00 0.00 -1.21 0.00 0.00 61.69 58.76 2vlr s THR 137 Cb -0.15 -1.94 0.00 0.00 -1.51 0.00 0.00 72.50 68.91 2vlr s THR 137 CO 0.16 -0.62 0.00 0.47 -2.21 0.00 0.00 174.62 172.41 2vlr n ASP 138 N -0.13 -4.37 -4.86 8.08 8.00 -0.46 -2.41 116.55 120.41 2vlr n ASP 138 Ca -0.08 0.08 -0.31 0.00 0.71 0.00 0.00 54.79 55.19 2vlr n ASP 138 Cb 0.62 -2.16 0.04 0.00 -0.02 0.00 0.00 41.12 39.60 2vlr n ASP 138 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2vlr s PHE 139 N -1.80 3.36 0.87 1.24 -0.71 -1.26 -0.81 117.98 118.87 2vlr s PHE 139 Ca 0.00 1.22 -0.12 0.00 -1.04 0.00 0.00 56.93 57.00 2vlr s PHE 139 Cb 0.00 -2.90 0.11 0.00 -1.21 0.00 0.00 43.02 39.02 2vlr s PHE 139 CO 0.00 -1.05 1.10 0.16 -1.34 0.00 0.00 175.22 174.08 2vlr s ASP 140 N -4.13 3.82 0.00 1.98 3.84 -1.26 -4.50 116.67 116.41 2vlr s ASP 140 Ca 0.57 1.37 0.18 0.00 -0.00 0.00 0.00 52.55 54.67 2vlr s ASP 140 Cb -0.12 -2.06 1.05 0.00 -1.38 0.00 0.00 42.92 40.41 2vlr s ASP 140 CO 0.54 -2.41 1.52 -1.20 -0.00 0.00 0.00 175.17 173.62 2vlr n SER 141 N -3.72 0.00 -0.16 2.11 7.64 -1.26 -3.11 113.62 115.11 2vlr n SER 141 Ca 0.07 -0.95 0.08 0.00 1.01 0.00 0.00 58.87 59.08 2vlr n SER 141 Cb 0.56 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.70 2vlr n SER 141 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2vlr n GLN 142 N -0.87 1.53 -2.33 1.43 3.00 -1.26 -4.99 117.38 113.89 2vlr n GLN 142 Ca 0.13 -0.35 -0.42 0.00 -0.01 0.00 0.00 57.00 56.35 2vlr n GLN 142 Cb 0.06 -1.30 -0.03 0.00 0.00 0.00 0.00 30.24 28.97 2vlr n GLN 142 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.06 178.05 2vlr s THR 143 N -2.35 3.84 -0.12 5.09 2.01 -1.18 -5.03 115.64 117.90 2vlr s THR 143 Ca 0.10 1.28 -0.17 0.00 0.31 0.00 0.00 61.69 63.21 2vlr s THR 143 Cb 0.13 -3.82 -0.04 0.00 0.01 0.00 0.00 72.50 68.78 2vlr s THR 143 CO 0.59 0.06 0.45 0.20 -0.69 0.00 0.00 174.62 175.23 2vlr s ASN 144 N 1.33 6.66 -0.34 3.53 0.01 -1.26 -5.03 114.94 119.84 2vlr s ASN 144 Ca 0.61 0.79 -0.11 0.00 -0.71 0.00 0.00 52.86 53.43 2vlr s ASN 144 Cb -0.31 -2.27 -0.00 0.00 0.41 0.00 0.00 41.25 39.08 2vlr s ASN 144 CO 0.28 0.03 0.20 -0.69 -1.51 0.00 0.00 177.10 175.41 2vlr s VAL 145 N 0.50 4.88 0.71 1.60 1.01 -1.26 -4.40 120.40 123.44 2vlr s VAL 145 Ca 0.25 -0.43 -0.10 0.00 0.00 0.00 0.00 61.98 61.70 2vlr s VAL 145 Cb -0.15 -3.55 0.04 0.00 0.00 0.00 0.00 36.38 32.72 2vlr s VAL 145 CO 0.10 -0.03 1.08 -0.44 0.00 0.00 0.00 175.10 175.80 2vlr s SER 146 N 1.65 5.16 0.47 3.32 0.01 -1.26 -4.98 113.70 118.07 2vlr s SER 146 Ca 0.05 0.90 0.03 0.00 1.31 0.00 0.00 55.95 58.24 2vlr s SER 146 Cb -0.18 -1.64 0.01 0.00 0.21 0.00 0.00 66.02 64.43 2vlr s SER 146 CO 0.08 -1.47 0.66 -1.10 0.41 0.00 0.00 173.24 171.82 2vlr s GLN 147 N -5.34 2.81 0.55 12.44 -0.21 -1.26 -4.84 119.66 123.81 2vlr s GLN 147 Ca 0.59 -0.84 -0.16 0.00 0.02 0.00 0.00 55.36 54.96 2vlr s GLN 147 Cb -0.11 -2.61 -0.06 0.00 1.00 0.00 0.00 33.01 31.23 2vlr s GLN 147 CO 0.49 -0.40 1.03 -1.54 -2.12 0.00 0.00 175.29 172.75 2vlr s SER 148 N -4.32 6.16 0.11 5.90 1.04 -1.26 -4.91 113.70 116.42 2vlr s SER 148 Ca 0.53 1.73 0.26 0.00 0.48 0.00 0.00 55.95 58.95 2vlr s SER 148 Cb -0.10 -2.53 0.76 0.00 0.10 0.00 0.00 66.02 64.25 2vlr s SER 148 CO 0.36 -0.90 1.65 2.29 0.98 0.00 0.00 173.24 177.62 2vlr n LYS 149 N -1.75 0.17 -3.88 4.02 -0.00 -1.26 -4.85 118.16 110.61 2vlr n LYS 149 Ca 0.08 0.10 -0.37 0.00 -0.00 0.00 0.00 58.31 58.12 2vlr n LYS 149 Cb 0.53 -1.66 -0.06 0.00 -0.00 0.00 0.00 35.03 33.84 2vlr n LYS 149 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 2vlr s ASP 150 N -3.87 6.33 0.00 -5.58 1.01 -1.26 -4.98 116.67 108.31 2vlr s ASP 150 Ca 0.10 0.43 0.28 0.00 0.71 0.00 0.00 52.55 54.08 2vlr s ASP 150 Cb 0.15 -2.05 1.11 0.00 1.01 0.00 0.00 42.92 43.13 2vlr s ASP 150 CO 0.62 0.38 1.83 -0.24 0.21 0.00 0.00 175.17 177.97 2vlr n SER 151 N 2.18 0.14 -0.65 0.27 2.88 -1.26 -3.61 113.62 113.56 2vlr n SER 151 Ca -0.19 0.21 0.12 0.00 -1.33 0.00 0.00 58.87 57.68 2vlr n SER 151 Cb 0.55 -0.29 0.21 0.00 -0.75 0.00 0.00 64.21 63.92 2vlr n SER 151 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 2vlr n ASP 152 N -1.44 2.19 -4.23 -3.46 5.68 -1.26 -4.91 116.55 109.12 2vlr n ASP 152 Ca 0.08 -1.64 -0.31 0.00 -0.50 0.00 0.00 54.79 52.43 2vlr n ASP 152 Cb 0.33 0.13 -0.17 0.00 -1.14 0.00 0.00 41.12 40.27 2vlr n ASP 152 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 2vlr s VAL 153 N -2.17 1.93 -0.23 2.12 1.01 -1.24 -4.41 120.40 117.41 2vlr s VAL 153 Ca 0.28 -0.98 -0.04 0.00 0.00 0.00 0.00 61.98 61.23 2vlr s VAL 153 Cb 0.20 -1.65 -0.01 0.00 0.00 0.00 0.00 36.38 34.92 2vlr s VAL 153 CO 0.40 0.54 -0.03 -0.31 0.00 0.00 0.00 175.10 175.70 2vlr s TYR 154 N 0.01 2.99 -0.16 5.22 2.02 -0.57 -4.77 117.35 122.08 2vlr s TYR 154 Ca -0.08 -0.96 0.01 0.00 -0.37 0.00 0.00 57.07 55.67 2vlr s TYR 154 Cb -0.15 -2.12 0.02 0.00 -0.40 0.00 0.00 41.96 39.31 2vlr s TYR 154 CO 0.05 -0.55 -0.20 0.42 -1.57 0.00 0.00 175.55 173.70 2vlr s ILE 155 N 1.48 1.97 0.68 2.71 1.01 -1.26 -1.86 121.20 125.93 2vlr s ILE 155 Ca 0.05 -0.90 -0.11 0.00 0.00 0.00 0.00 60.65 59.69 2vlr s ILE 155 Cb -0.15 -1.78 -0.00 0.00 0.01 0.00 0.00 42.46 40.54 2vlr s ILE 155 CO -0.03 0.53 1.08 0.42 0.00 0.00 0.00 174.94 176.94 2vlr s THR 156 N 1.18 3.86 0.89 2.92 -4.23 -0.42 -4.89 115.64 114.94 2vlr s THR 156 Ca 0.01 0.60 -0.12 0.00 -1.18 0.00 0.00 61.69 61.01 2vlr s THR 156 Cb -0.14 -3.59 0.12 0.00 1.34 0.00 0.00 72.50 70.24 2vlr s THR 156 CO -0.09 -0.79 1.10 -1.81 -0.54 0.00 0.00 174.62 172.49 2vlr s ASP 157 N -4.29 3.65 0.41 3.99 1.01 -1.26 -4.59 116.67 115.58 2vlr s ASP 157 Ca 0.57 1.31 -0.24 0.00 0.71 0.00 0.00 52.55 54.90 2vlr s ASP 157 Cb -0.11 -1.99 -0.09 0.00 1.01 0.00 0.00 42.92 41.74 2vlr s ASP 157 CO 0.53 -2.51 1.06 -1.59 0.21 0.00 0.00 175.17 172.86 2vlr s LYS 158 N -5.06 4.12 0.18 8.23 -2.85 -1.26 -4.65 119.74 118.46 2vlr s LYS 158 Ca 0.63 1.52 0.08 0.00 -1.00 0.00 0.00 55.97 57.19 2vlr s LYS 158 Cb -0.17 -2.50 -0.04 0.00 -2.06 0.00 0.00 37.83 33.06 2vlr s LYS 158 CO 0.56 -0.18 -0.16 0.95 0.10 0.00 0.00 175.35 176.62 2vlr s THR 159 N -1.68 1.71 -0.15 3.79 -4.23 -0.64 -4.95 115.64 109.50 2vlr s THR 159 Ca 0.59 -2.03 -0.07 0.00 -1.18 0.00 0.00 61.69 59.00 2vlr s THR 159 Cb -0.22 -1.89 -0.04 0.00 1.34 0.00 0.00 72.50 71.69 2vlr s THR 159 CO 0.27 -0.46 0.09 -0.69 -0.54 0.00 0.00 174.62 173.29 2vlr s VAL 160 N -2.49 5.08 0.06 2.29 1.01 -1.26 -2.64 120.40 122.44 2vlr s VAL 160 Ca 0.18 0.06 0.09 0.00 0.00 0.00 0.00 61.98 62.31 2vlr s VAL 160 Cb -0.03 -3.24 -0.03 0.00 0.00 0.00 0.00 36.38 33.08 2vlr s VAL 160 CO 0.06 0.54 -0.25 -0.22 0.00 0.00 0.00 175.10 175.23 2vlr s LEU 161 N -0.36 2.27 -0.26 3.92 0.20 -0.80 -5.00 118.68 118.65 2vlr s LEU 161 Ca 0.10 -0.58 0.01 0.00 0.69 0.00 0.00 54.13 54.35 2vlr s LEU 161 Cb -0.12 -1.32 0.07 0.00 -0.43 0.00 0.00 46.19 44.39 2vlr s LEU 161 CO 0.01 0.25 -0.02 -0.62 -0.29 0.00 0.00 176.35 175.69 2vlr s ASP 162 N -1.38 4.02 -0.84 3.68 2.15 -1.26 -2.60 116.67 120.44 2vlr s ASP 162 Ca 0.13 -1.40 -0.23 0.00 0.43 0.00 0.00 52.55 51.48 2vlr s ASP 162 Cb -0.10 -1.20 0.06 0.00 -0.30 0.00 0.00 42.92 41.38 2vlr s ASP 162 CO 0.03 -0.28 1.23 -0.04 -0.17 0.00 0.00 175.17 175.94 2vlr s MET 163 N 1.35 3.36 0.18 4.34 -1.94 -0.11 -4.91 119.30 121.56 2vlr s MET 163 Ca -0.01 -0.90 -0.08 0.00 -1.71 0.00 0.00 55.69 52.99 2vlr s MET 163 Cb -0.19 -4.66 0.06 0.00 2.01 0.00 0.00 34.83 32.05 2vlr s MET 163 CO -0.09 -2.03 1.57 0.00 -0.01 0.00 0.00 175.02 174.46 2vlr h ARG 164 N 9.65 0.92 0.00 2.03 3.08 -1.98 -0.49 114.38 127.60 2vlr h ARG 164 Ca -0.07 -0.40 -0.07 0.00 0.07 0.00 0.00 59.98 59.52 2vlr h ARG 164 Cb 1.04 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 31.05 2vlr h ARG 164 CO 1.27 1.06 -0.32 0.66 -1.07 0.00 0.00 179.97 181.57 2vlr h SER 165 N 0.79 0.00 0.26 7.04 4.64 -1.97 -3.12 113.55 121.19 2vlr h SER 165 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 2vlr h SER 165 Cb 0.80 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.89 2vlr h SER 165 CO 0.07 0.32 -0.74 0.23 -0.87 0.00 0.00 176.83 175.84 2vlr n MET 166 N -3.26 0.02 -3.30 4.77 2.81 -1.16 -5.02 117.12 111.99 2vlr n MET 166 Ca 0.02 -0.01 -0.17 0.00 -1.81 0.00 0.00 57.70 55.73 2vlr n MET 166 Cb 0.59 -1.50 0.06 0.00 -0.71 0.00 0.00 33.22 31.67 2vlr n MET 166 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 2vlr n ASP 167 N -1.48 -6.53 -3.75 7.83 4.64 -0.22 -5.03 116.55 112.01 2vlr n ASP 167 Ca 0.05 -0.73 -0.13 0.00 -1.38 0.00 0.00 54.79 52.61 2vlr n ASP 167 Cb 0.33 -4.98 -0.11 0.00 -1.04 0.00 0.00 41.12 35.33 2vlr n ASP 167 CO 0.00 0.00 0.00 0.12 -0.82 0.00 0.00 177.20 176.50 2vlr s PHE 168 N -3.38 -0.39 0.11 -0.67 5.36 -1.04 -5.04 117.98 112.92 2vlr s PHE 168 Ca 0.44 0.93 0.07 0.00 -0.96 0.00 0.00 56.93 57.41 2vlr s PHE 168 Cb -0.07 0.13 -0.03 0.00 -0.34 0.00 0.00 43.02 42.71 2vlr s PHE 168 CO 0.76 -0.21 -0.17 0.15 -1.46 0.00 0.00 175.22 174.29 2vlr s LYS 169 N 0.48 1.03 -0.18 10.12 1.02 -1.26 -0.93 119.74 130.02 2vlr s LYS 169 Ca -0.02 -1.16 -0.15 0.00 0.02 0.00 0.00 55.97 54.65 2vlr s LYS 169 Cb -0.04 -1.09 0.05 0.00 -0.52 0.00 0.00 37.83 36.23 2vlr s LYS 169 CO -0.02 0.23 0.46 -1.54 -0.92 0.00 0.00 175.35 173.56 2vlr s SER 170 N -2.11 -0.49 0.38 2.83 1.04 -1.07 -4.97 113.70 109.30 2vlr s SER 170 Ca 0.06 0.94 -0.20 0.00 0.48 0.00 0.00 55.95 57.23 2vlr s SER 170 Cb -0.08 0.94 -0.10 0.00 0.10 0.00 0.00 66.02 66.88 2vlr s SER 170 CO 0.04 -0.17 0.89 0.20 0.98 0.00 0.00 173.24 175.18 2vlr s ASN 171 N 0.37 6.95 -0.03 7.02 0.01 -1.26 -1.90 114.94 126.10 2vlr s ASN 171 Ca -0.01 1.60 -0.18 0.00 -0.71 0.00 0.00 52.86 53.56 2vlr s ASN 171 Cb -0.04 -2.50 0.03 0.00 0.41 0.00 0.00 41.25 39.16 2vlr s ASN 171 CO -0.01 -0.27 0.38 -0.94 -1.51 0.00 0.00 177.10 174.75 2vlr s SER 172 N -2.12 -0.28 0.23 -1.22 1.04 -1.08 -1.35 113.70 108.91 2vlr s SER 172 Ca 0.58 0.23 0.11 0.00 0.48 0.00 0.00 55.95 57.34 2vlr s SER 172 Cb -0.11 0.37 -0.05 0.00 0.10 0.00 0.00 66.02 66.34 2vlr s SER 172 CO 0.16 -0.46 -0.20 0.00 0.98 0.00 0.00 173.24 173.71 2vlr s ALA 173 N -1.24 2.44 -0.03 5.32 0.00 0.29 -1.62 121.76 126.92 2vlr s ALA 173 Ca -0.13 -1.71 0.06 0.00 0.00 0.00 0.00 51.96 50.18 2vlr s ALA 173 Cb -0.04 -0.24 -0.01 0.00 0.00 0.00 0.00 23.12 22.83 2vlr s ALA 173 CO 0.05 0.28 -0.21 0.08 0.00 0.00 0.00 175.76 175.95 2vlr s VAL 174 N -2.29 1.70 0.02 0.00 1.01 -1.26 -2.01 120.40 117.57 2vlr s VAL 174 Ca 0.24 -0.90 0.04 0.00 0.00 0.00 0.00 61.98 61.36 2vlr s VAL 174 Cb -0.05 -1.43 -0.02 0.00 0.00 0.00 0.00 36.38 34.88 2vlr s VAL 174 CO 0.11 0.48 -0.12 0.00 0.00 0.00 0.00 175.10 175.57 2vlr s ALA 175 N -0.31 1.01 0.18 5.51 0.00 -0.79 -1.30 121.76 126.07 2vlr s ALA 175 Ca 0.03 -0.68 -0.11 0.00 0.00 0.00 0.00 51.96 51.20 2vlr s ALA 175 Cb -0.10 -0.18 0.00 0.00 0.00 0.00 0.00 23.12 22.84 2vlr s ALA 175 CO 0.01 0.20 0.36 1.67 0.00 0.00 0.00 175.76 178.00 2vlr s TRP 176 N -0.66 0.27 -0.06 0.00 -2.14 -0.78 -1.22 118.94 114.35 2vlr s TRP 176 Ca 0.02 -0.63 -0.29 0.00 2.66 0.00 0.00 56.10 57.86 2vlr s TRP 176 Cb -0.07 0.08 0.10 0.00 -3.10 0.00 0.00 33.47 30.49 2vlr s TRP 176 CO 0.01 -0.80 0.86 0.45 -2.66 0.00 0.00 176.95 174.81 2vlr s SER 177 N -2.95 -0.45 -0.00 -2.66 0.15 -1.26 -1.52 113.70 105.01 2vlr s SER 177 Ca 0.16 0.32 0.09 0.00 0.70 0.00 0.00 55.95 57.22 2vlr s SER 177 Cb 0.02 0.40 -0.23 0.00 -1.71 0.00 0.00 66.02 64.50 2vlr s SER 177 CO 0.00 -0.54 0.82 0.78 1.20 0.00 0.00 173.24 175.51 2vlr h ASN 178 N 2.44 0.04 -0.70 5.45 2.35 -1.98 -3.48 115.58 119.71 2vlr h ASN 178 Ca -0.23 -0.08 -0.47 0.00 -0.55 0.00 0.00 56.30 54.98 2vlr h ASN 178 Cb 1.19 -0.01 0.07 0.00 0.05 0.00 0.00 38.32 39.62 2vlr h ASN 178 CO 0.33 1.07 -0.35 0.29 -1.65 0.00 0.00 177.43 177.12 2vlr n LYS 179 N -3.17 0.00 0.05 0.81 4.76 -1.26 -4.87 118.16 114.48 2vlr n LYS 179 Ca -0.13 0.00 0.12 0.00 -2.87 0.00 0.00 58.31 55.43 2vlr n LYS 179 Cb 1.02 -0.71 0.26 0.00 -1.84 0.00 0.00 35.03 33.76 2vlr n LYS 179 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 2vlr n SER 180 N 1.37 0.61 -0.46 4.39 2.88 -1.26 -3.37 113.62 117.78 2vlr n SER 180 Ca 0.13 0.15 0.09 0.00 -1.33 0.00 0.00 58.87 57.91 2vlr n SER 180 Cb 0.17 -0.03 0.01 0.00 -0.75 0.00 0.00 64.21 63.61 2vlr n SER 180 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 2vlr n ASP 181 N -1.96 1.89 -4.68 -3.46 5.75 -1.26 -5.02 116.55 107.81 2vlr n ASP 181 Ca 0.04 -1.44 -0.46 0.00 -0.01 0.00 0.00 54.79 52.92 2vlr n ASP 181 Cb 0.41 0.39 -0.04 0.00 -1.03 0.00 0.00 41.12 40.85 2vlr n ASP 181 CO 0.00 0.00 0.00 0.33 -0.11 0.00 0.00 177.20 177.42 2vlr n PHE 182 N 0.11 2.41 -4.53 2.11 -0.00 -1.22 -4.99 117.46 111.35 2vlr n PHE 182 Ca 0.08 -0.04 -0.22 0.00 -0.00 0.00 0.00 57.45 57.27 2vlr n PHE 182 Cb 0.39 -2.68 -0.15 0.00 -0.00 0.00 0.00 39.48 37.04 2vlr n PHE 182 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2vlr s ALA 183 N 3.22 1.05 0.58 3.13 0.00 -1.26 -5.02 121.76 123.46 2vlr s ALA 183 Ca 0.87 -0.46 0.28 0.00 0.00 0.00 0.00 51.96 52.65 2vlr s ALA 183 Cb -0.61 -0.35 1.52 0.00 0.00 0.00 0.00 23.12 23.68 2vlr s ALA 183 CO 0.44 0.20 1.98 0.00 0.00 0.00 0.00 175.76 178.39 2vlr h ALA 185 N 1.62 1.53 -0.19 0.00 0.00 -1.96 -3.12 119.26 117.14 2vlr h ALA 185 Ca 0.18 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.08 2vlr h ALA 185 Cb 0.92 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.46 2vlr h ALA 185 CO -0.00 0.32 0.00 0.27 0.00 0.00 0.00 179.25 179.83 2vlr n ASN 186 N -4.50 2.62 -0.23 0.00 0.23 0.21 -4.72 115.26 108.87 2vlr n ASN 186 Ca 0.14 -1.77 -0.07 0.00 -0.53 0.00 0.00 54.58 52.36 2vlr n ASN 186 Cb 0.23 -0.12 0.04 0.00 -2.08 0.00 0.00 39.78 37.84 2vlr n ASN 186 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2vlr h ALA 187 N 2.80 0.84 -0.53 -2.53 0.00 -1.34 -3.17 119.26 115.33 2vlr h ALA 187 Ca 0.00 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 2vlr h ALA 187 Cb 0.69 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 2vlr h ALA 187 CO 0.00 0.43 0.05 1.19 0.00 0.00 0.00 179.25 180.92 2vlr n PHE 188 N -4.45 1.88 0.32 0.00 3.01 -1.26 -4.66 117.46 112.29 2vlr n PHE 188 Ca 0.04 -0.86 0.20 0.00 1.01 0.00 0.00 57.45 57.84 2vlr n PHE 188 Cb 0.15 -0.50 1.06 0.00 -0.01 0.00 0.00 39.48 40.18 2vlr n PHE 188 CO 0.00 0.00 0.00 -0.91 1.01 0.00 0.00 176.76 176.86 2vlr h ASN 189 N 3.21 0.00 1.24 4.37 4.21 -1.87 -2.91 115.58 123.84 2vlr h ASN 189 Ca 0.05 0.00 -0.07 0.00 1.21 0.00 0.00 56.30 57.49 2vlr h ASN 189 Cb 1.92 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 39.11 2vlr h ASN 189 CO 0.47 0.00 -0.79 -1.13 -1.29 0.00 0.00 177.43 174.69 2vlr h ASN 190 N 0.00 0.00 -2.87 5.81 -0.00 -1.87 -3.47 115.58 113.18 2vlr h ASN 190 Ca 0.00 0.00 -0.52 0.00 -0.00 0.00 0.00 56.30 55.78 2vlr h ASN 190 Cb 0.15 0.00 -0.01 0.00 -0.00 0.00 0.00 38.32 38.46 2vlr h ASN 190 CO 0.00 0.29 -0.27 -0.94 -0.00 0.00 0.00 177.43 176.50 2vlr s SER 191 N -5.92 6.38 -0.33 1.15 1.04 -1.10 -4.85 113.70 110.07 2vlr s SER 191 Ca 0.01 0.46 -0.29 0.00 0.48 0.00 0.00 55.95 56.61 2vlr s SER 191 Cb 0.08 -2.03 -0.01 0.00 0.10 0.00 0.00 66.02 64.16 2vlr s SER 191 CO 0.76 -0.12 1.55 -0.63 0.98 0.00 0.00 173.24 175.78 2vlr s ILE 192 N -2.00 3.76 -0.03 -1.02 -1.09 -1.26 -4.99 121.20 114.57 2vlr s ILE 192 Ca 0.40 0.81 0.08 0.00 -2.23 0.00 0.00 60.65 59.70 2vlr s ILE 192 Cb -0.11 -3.93 -0.02 0.00 -1.58 0.00 0.00 42.46 36.83 2vlr s ILE 192 CO 0.30 -0.52 -0.26 -0.63 -1.23 0.00 0.00 174.94 172.61 2vlr s ILE 193 N 5.65 2.07 0.19 2.92 1.09 -1.26 -4.55 121.20 127.30 2vlr s ILE 193 Ca 0.68 -1.10 -0.32 0.00 -1.10 0.00 0.00 60.65 58.82 2vlr s ILE 193 Cb -0.19 -1.71 -0.16 0.00 -1.06 0.00 0.00 42.46 39.34 2vlr s ILE 193 CO 0.31 0.58 1.12 -2.65 -0.10 0.00 0.00 174.94 174.20 2vlr n PRO 194 N 2.54 1.13 0.26 2.79 -0.02 -1.26 -4.87 135.00 135.58 2vlr n PRO 194 Ca -0.16 0.40 0.11 0.00 -2.02 0.00 0.00 63.50 61.83 2vlr n PRO 194 Cb 0.51 -1.87 0.70 0.00 -0.02 0.00 0.00 33.50 32.82 2vlr n PRO 194 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2vlr h GLU 195 N 3.12 0.00 -0.89 -0.52 4.57 -2.01 -2.77 114.58 116.07 2vlr h GLU 195 Ca -0.42 0.00 -0.49 0.00 -1.18 0.00 0.00 59.36 57.27 2vlr h GLU 195 Cb 1.35 0.00 -0.28 0.00 -0.16 0.00 0.00 28.75 29.66 2vlr h GLU 195 CO 0.68 0.10 0.55 -0.40 -1.18 0.00 0.00 179.01 178.76 2vlr n ASP 196 N -3.96 4.05 -4.70 1.04 5.68 -1.26 -5.00 116.55 112.39 2vlr n ASP 196 Ca -0.02 -3.66 -0.42 0.00 -0.50 0.00 0.00 54.79 50.18 2vlr n ASP 196 Cb 0.19 -0.82 -0.03 0.00 -1.14 0.00 0.00 41.12 39.32 2vlr n ASP 196 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 2vlr s THR 197 N -3.50 3.29 -0.23 2.12 2.01 -1.05 -4.84 115.64 113.44 2vlr s THR 197 Ca 0.56 0.80 -0.29 0.00 0.31 0.00 0.00 61.69 63.07 2vlr s THR 197 Cb 0.47 -3.52 -0.01 0.00 0.01 0.00 0.00 72.50 69.45 2vlr s THR 197 CO 0.08 0.02 1.42 0.12 -0.69 0.00 0.00 174.62 175.56 2vlr s PHE 198 N 2.00 2.49 -0.68 4.92 5.36 0.74 -4.92 117.98 127.89 2vlr s PHE 198 Ca 0.68 0.75 0.04 0.00 -0.96 0.00 0.00 56.93 57.43 2vlr s PHE 198 Cb -0.37 -3.85 0.17 0.00 -0.34 0.00 0.00 43.02 38.63 2vlr s PHE 198 CO 0.30 -2.25 0.47 -0.06 -1.46 0.00 0.00 175.22 172.21 2vlr s PHE 199 N 4.42 3.51 -0.08 10.12 0.08 -1.26 -1.37 117.98 133.40 2vlr s PHE 199 Ca 0.62 -3.24 -0.22 0.00 0.12 0.00 0.00 56.93 54.21 2vlr s PHE 199 Cb -0.21 -2.82 -0.10 0.00 -0.57 0.00 0.00 43.02 39.31 2vlr s PHE 199 CO 0.24 -0.63 0.64 -2.30 -0.10 0.00 0.00 175.22 173.07 2vlr n PRO 200 N 2.34 0.00 0.00 0.24 -0.02 -1.26 -5.07 135.00 131.23 2vlr n PRO 200 Ca 0.16 0.00 0.08 0.00 -2.02 0.00 0.00 63.50 61.72 2vlr n PRO 200 Cb 0.35 -0.78 0.48 0.00 -0.02 0.00 0.00 33.50 33.53 2vlr n PRO 200 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93