#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vsp s ILE 2 N 0.00 0.36 -0.08 3.17 1.09 -1.18 -4.76 121.20 119.81 1vsp s ILE 2 Ca 0.00 -0.26 0.04 0.00 -1.10 0.00 0.00 60.65 59.33 1vsp s ILE 2 Cb 0.00 -0.32 -0.00 0.00 -1.06 0.00 0.00 42.46 41.08 1vsp s ILE 2 CO 0.00 0.05 -0.22 -1.58 -0.10 0.00 0.00 174.94 173.09 1vsp s GLN 3 N -0.23 2.59 -0.89 2.79 -0.44 -1.26 -3.24 119.66 118.97 1vsp s GLN 3 Ca 0.01 -0.80 -0.25 0.00 -2.50 0.00 0.00 55.36 51.82 1vsp s GLN 3 Cb -0.02 -2.06 -0.05 0.00 -1.64 0.00 0.00 33.01 29.23 1vsp s GLN 3 CO -0.00 0.23 1.95 -1.25 0.50 0.00 0.00 175.29 176.72 1vsp s PRO 4 N 0.18 2.54 0.00 1.67 0.04 -1.26 -2.65 135.00 135.52 1vsp s PRO 4 Ca -0.12 -0.25 0.00 0.00 0.04 0.00 0.00 61.00 60.67 1vsp s PRO 4 Cb -0.16 -5.04 0.00 0.00 0.04 0.00 0.00 34.50 29.35 1vsp s PRO 4 CO 0.06 -3.38 0.00 0.94 0.04 0.00 0.00 177.00 174.66 1vsp n GLN 5 N 8.86 0.00 -1.36 4.56 -0.06 -1.20 -4.60 117.38 123.58 1vsp n GLN 5 Ca 0.40 0.00 -0.24 0.00 -2.00 0.00 0.00 57.00 55.15 1vsp n GLN 5 Cb 0.47 0.00 0.18 0.00 -4.06 0.00 0.00 30.24 26.83 1vsp n GLN 5 CO 0.00 0.00 0.00 2.41 -0.20 0.00 0.00 177.06 179.27 1vsp n THR 6 N 0.00 0.00 -3.30 1.69 -1.04 -1.09 -4.68 114.28 105.86 1vsp n THR 6 Ca 0.00 -0.69 -0.27 0.00 -2.04 0.00 0.00 64.05 61.05 1vsp n THR 6 Cb 0.00 -1.48 -0.02 0.00 -1.82 0.00 0.00 70.33 67.01 1vsp n THR 6 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1vsp s TYR 7 N -3.18 3.49 -0.02 -1.42 4.12 -1.26 -2.52 117.35 116.56 1vsp s TYR 7 Ca 0.61 0.54 -0.06 0.00 0.02 0.00 0.00 57.07 58.18 1vsp s TYR 7 Cb -0.03 -2.04 0.00 0.00 -1.52 0.00 0.00 41.96 38.38 1vsp s TYR 7 CO 0.44 0.12 0.13 -0.51 0.02 0.00 0.00 175.55 175.75 1vsp s LEU 8 N -3.91 1.56 0.23 -1.29 2.01 -1.12 -4.89 118.68 111.28 1vsp s LEU 8 Ca 0.43 -0.04 0.09 0.00 0.01 0.00 0.00 54.13 54.62 1vsp s LEU 8 Cb -0.10 0.56 -0.04 0.00 0.01 0.00 0.00 46.19 46.62 1vsp s LEU 8 CO 0.33 -0.24 -0.05 -1.83 1.01 0.00 0.00 176.35 175.57 1vsp s GLU 9 N -0.83 2.17 0.25 1.70 4.04 -1.15 -3.08 118.70 121.80 1vsp s GLU 9 Ca -0.09 -1.38 -0.31 0.00 0.04 0.00 0.00 54.97 53.23 1vsp s GLU 9 Cb -0.05 -2.14 -0.11 0.00 0.02 0.00 0.00 34.13 31.84 1vsp s GLU 9 CO 0.01 0.39 1.62 0.14 -1.84 0.00 0.00 175.26 175.58 1vsp s VAL 10 N -2.10 2.13 -0.03 1.83 -7.23 -1.22 -2.49 120.40 111.29 1vsp s VAL 10 Ca 0.29 0.10 0.05 0.00 -1.81 0.00 0.00 61.98 60.61 1vsp s VAL 10 Cb -0.07 -3.07 0.08 0.00 0.56 0.00 0.00 36.38 33.88 1vsp s VAL 10 CO 0.18 0.01 0.93 0.00 -0.31 0.00 0.00 175.10 175.91 1vsp n ALA 11 N 2.89 1.84 -3.49 1.32 0.00 -0.98 -4.74 120.51 117.36 1vsp n ALA 11 Ca 0.11 -1.32 -0.17 0.00 0.00 0.00 0.00 53.44 52.06 1vsp n ALA 11 Cb 0.37 -0.19 -0.06 0.00 0.00 0.00 0.00 19.45 19.56 1vsp n ALA 11 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1vsp s ASP 12 N -1.27 -0.61 -0.22 0.00 3.84 -1.22 -4.59 116.67 112.60 1vsp s ASP 12 Ca 0.08 0.70 -0.03 0.00 -0.00 0.00 0.00 52.55 53.30 1vsp s ASP 12 Cb 0.07 0.58 0.07 0.00 -1.38 0.00 0.00 42.92 42.26 1vsp s ASP 12 CO 0.01 -0.56 0.06 0.20 -0.00 0.00 0.00 175.17 174.88 1vsp s ASN 13 N -1.09 3.11 -0.36 2.11 -0.87 -1.26 -4.64 114.94 111.94 1vsp s ASN 13 Ca -0.10 -0.99 0.02 0.00 -1.57 0.00 0.00 52.86 50.21 1vsp s ASN 13 Cb -0.01 -0.58 0.19 0.00 -0.02 0.00 0.00 41.25 40.83 1vsp s ASN 13 CO 0.09 -0.34 0.77 -0.89 -2.57 0.00 0.00 177.10 174.15 1vsp s THR 14 N 1.87 -0.73 0.00 1.60 2.01 -1.26 -4.51 115.64 114.62 1vsp s THR 14 Ca 0.02 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.02 1vsp s THR 14 Cb -0.17 -0.19 0.00 0.00 0.01 0.00 0.00 72.50 72.15 1vsp s THR 14 CO -0.14 0.00 0.00 0.61 -0.69 0.00 0.00 174.62 174.40 1vsp n GLY 15 N 4.47 2.59 3.07 4.40 0.00 -1.25 -4.33 105.19 114.15 1vsp n GLY 15 Ca 0.08 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.89 1vsp n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vsp s ALA 16 N -1.19 1.02 0.00 4.61 0.00 -1.18 -3.30 121.76 121.72 1vsp s ALA 16 Ca 0.00 -0.51 0.00 0.00 0.00 0.00 0.00 51.96 51.45 1vsp s ALA 16 Cb 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 23.12 22.84 1vsp s ALA 16 CO 0.00 0.23 0.00 0.54 0.00 0.00 0.00 175.76 176.53 1vsp n ARG 17 N 2.88 2.51 -3.64 0.00 5.12 -1.06 -4.24 116.66 118.22 1vsp n ARG 17 Ca -0.15 0.00 -0.05 0.00 -1.93 0.00 0.00 57.85 55.72 1vsp n ARG 17 Cb 0.55 -0.78 -0.07 0.00 -1.16 0.00 0.00 32.46 31.00 1vsp n ARG 17 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 1vsp s LYS 18 N -1.26 0.33 0.00 5.56 2.47 -0.92 -3.39 119.74 122.53 1vsp s LYS 18 Ca 0.00 0.43 0.00 0.00 -1.56 0.00 0.00 55.97 54.84 1vsp s LYS 18 Cb 0.00 0.14 0.00 0.00 -1.46 0.00 0.00 37.83 36.51 1vsp s LYS 18 CO 0.00 -0.05 0.00 0.44 0.16 0.00 0.00 175.35 175.90 1vsp n ILE 19 N 2.38 0.00 -3.79 5.43 -5.35 -1.18 -1.84 119.36 115.01 1vsp n ILE 19 Ca -0.13 0.00 -0.12 0.00 -0.27 0.00 0.00 62.75 62.23 1vsp n ILE 19 Cb 0.56 0.00 -0.08 0.00 -1.74 0.00 0.00 39.64 38.38 1vsp n ILE 19 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1vsp s MET 20 N 0.44 0.69 0.89 6.28 0.23 -1.01 -2.77 119.30 124.04 1vsp s MET 20 Ca 0.00 -0.42 -0.11 0.00 -1.03 0.00 0.00 55.69 54.13 1vsp s MET 20 Cb 0.00 0.30 0.20 0.00 -1.53 0.00 0.00 34.83 33.79 1vsp s MET 20 CO 0.00 -0.20 1.21 0.00 -2.03 0.00 0.00 175.02 174.00 1vsp n ILE 22 N -3.50 0.00 -4.35 0.00 -5.35 -1.14 -4.56 119.36 100.47 1vsp n ILE 22 Ca 0.16 0.00 -0.23 0.00 -0.27 0.00 0.00 62.75 62.41 1vsp n ILE 22 Cb 0.57 -0.00 -0.11 0.00 -1.74 0.00 0.00 39.64 38.36 1vsp n ILE 22 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 1vsp s ARG 23 N 0.00 1.32 0.00 6.28 3.52 -1.26 -3.24 118.95 125.57 1vsp s ARG 23 Ca 0.00 -1.42 0.00 0.00 -0.13 0.00 0.00 55.73 54.18 1vsp s ARG 23 Cb 0.00 -1.47 0.00 0.00 -1.56 0.00 0.00 34.95 31.92 1vsp s ARG 23 CO 0.00 0.31 0.00 1.55 -0.81 0.00 0.00 175.30 176.35 1vsp n VAL 24 N 0.36 0.00 0.00 7.11 3.14 -1.26 -2.69 118.33 124.99 1vsp n VAL 24 Ca -0.14 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.24 1vsp n VAL 24 Cb 0.56 -0.29 0.00 0.00 -1.06 0.00 0.00 33.84 33.05 1vsp n VAL 24 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 1vsp n LEU 25 N 0.00 0.00 0.00 6.55 4.77 -1.21 -4.78 117.00 122.33 1vsp n LEU 25 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1vsp n LEU 25 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1vsp n LEU 25 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.39 177.23 1vsp n LYS 26 N 0.00 0.00 0.00 3.23 4.81 -1.26 -4.27 118.16 120.67 1vsp n LYS 26 Ca 0.00 0.00 0.02 0.00 -0.87 0.00 0.00 58.31 57.46 1vsp n LYS 26 Cb 0.00 0.00 0.01 0.00 0.02 0.00 0.00 35.03 35.06 1vsp n LYS 26 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1vsp n GLY 27 N 0.00 -0.55 0.00 3.14 0.00 -1.26 -5.01 105.19 101.51 1vsp n GLY 27 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1vsp n GLY 27 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1vsp n SER 28 N -0.14 0.00 -0.03 1.61 3.41 -1.26 -4.94 113.62 112.26 1vsp n SER 28 Ca 0.02 0.00 0.09 0.00 -0.26 0.00 0.00 58.87 58.72 1vsp n SER 28 Cb 0.10 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 63.95 1vsp n SER 28 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1vsp n ASN 29 N 0.00 0.99 0.00 4.04 2.04 -1.26 -5.07 115.26 116.00 1vsp n ASN 29 Ca 0.00 -0.99 0.00 0.00 -0.44 0.00 0.00 54.58 53.15 1vsp n ASN 29 Cb 0.00 0.96 0.00 0.00 -2.53 0.00 0.00 39.78 38.21 1vsp n ASN 29 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1vsp n ALA 30 N -1.35 0.00 -1.00 -2.53 0.00 -1.26 -4.99 120.51 109.37 1vsp n ALA 30 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.48 1vsp n ALA 30 Cb 0.31 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.76 1vsp n ALA 30 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1vsp n LYS 31 N 0.00 0.00 0.00 0.00 5.02 -1.26 -5.06 118.16 116.86 1vsp n LYS 31 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1vsp n LYS 31 Cb 0.00 -0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 1vsp n LYS 31 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1vsp n TYR 32 N 0.00 0.00 0.00 2.13 4.02 -1.26 -4.88 117.16 117.17 1vsp n TYR 32 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 1vsp n TYR 32 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.32 1vsp n TYR 32 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1vsp n ALA 33 N -3.00 0.00 -3.06 -0.72 0.00 -1.20 -4.94 120.51 107.59 1vsp n ALA 33 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 1vsp n ALA 33 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1vsp n ALA 33 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1vsp s THR 34 N -2.00 0.00 0.55 0.00 2.01 -1.26 -3.08 115.64 111.86 1vsp s THR 34 Ca 0.00 -1.49 -0.19 0.00 0.31 0.00 0.00 61.69 60.32 1vsp s THR 34 Cb 0.00 -2.65 -0.08 0.00 0.01 0.00 0.00 72.50 69.78 1vsp s THR 34 CO 0.00 0.00 0.69 1.33 -0.69 0.00 0.00 174.62 175.95 1vsp n VAL 35 N -0.55 2.65 -0.49 3.82 0.24 -1.26 -3.24 118.33 119.50 1vsp n VAL 35 Ca -0.01 -0.50 0.00 0.00 -2.04 0.00 0.00 64.34 61.79 1vsp n VAL 35 Cb 0.61 -0.85 0.00 0.00 -1.47 0.00 0.00 33.84 32.14 1vsp n VAL 35 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1vsp n GLY 36 N 1.59 0.70 3.27 7.63 0.00 -1.26 -4.97 105.19 112.14 1vsp n GLY 36 Ca 0.12 -0.53 -0.15 0.00 0.00 0.00 0.00 46.02 45.47 1vsp n GLY 36 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1vsp s ASP 37 N -2.48 1.07 0.04 1.61 1.01 -1.20 -5.06 116.67 111.66 1vsp s ASP 37 Ca 0.00 -1.30 0.05 0.00 0.71 0.00 0.00 52.55 52.02 1vsp s ASP 37 Cb 0.00 0.17 -0.02 0.00 1.01 0.00 0.00 42.92 44.08 1vsp s ASP 37 CO 0.00 -0.68 -0.15 -0.69 0.21 0.00 0.00 175.17 173.86 1vsp s VAL 38 N -3.77 1.18 0.00 -1.27 1.01 -1.26 -0.65 120.40 115.64 1vsp s VAL 38 Ca 0.32 -1.05 0.00 0.00 0.00 0.00 0.00 61.98 61.25 1vsp s VAL 38 Cb 0.07 -1.07 0.00 0.00 0.00 0.00 0.00 36.38 35.38 1vsp s VAL 38 CO 0.09 0.01 0.00 2.30 0.00 0.00 0.00 175.10 177.50 1vsp n ILE 39 N 1.84 0.00 -3.91 2.22 -0.00 -1.26 -3.31 119.36 114.94 1vsp n ILE 39 Ca -0.18 0.00 -0.11 0.00 -0.00 0.00 0.00 62.75 62.46 1vsp n ILE 39 Cb 0.54 0.00 -0.12 0.00 -0.00 0.00 0.00 39.64 40.06 1vsp n ILE 39 CO 0.00 0.00 0.00 -0.69 -0.00 0.00 0.00 176.55 175.86 1vsp s VAL 40 N -0.81 0.05 0.36 7.28 1.01 -1.09 -2.66 120.40 124.53 1vsp s VAL 40 Ca 0.00 -0.43 -0.06 0.00 0.00 0.00 0.00 61.98 61.49 1vsp s VAL 40 Cb 0.00 -0.18 0.02 0.00 0.00 0.00 0.00 36.38 36.22 1vsp s VAL 40 CO 0.00 -0.24 0.56 0.00 0.00 0.00 0.00 175.10 175.42 1vsp s ALA 41 N -0.72 0.41 -0.06 5.51 0.00 -0.53 -2.87 121.76 123.51 1vsp s ALA 41 Ca -0.08 -1.33 0.02 0.00 0.00 0.00 0.00 51.96 50.57 1vsp s ALA 41 Cb -0.05 1.03 0.02 0.00 0.00 0.00 0.00 23.12 24.12 1vsp s ALA 41 CO -0.00 -0.84 -0.09 -1.54 0.00 0.00 0.00 175.76 173.28 1vsp s SER 42 N -3.20 1.45 0.83 0.00 1.04 -0.85 -2.57 113.70 110.41 1vsp s SER 42 Ca 0.27 -0.23 -0.11 0.00 0.48 0.00 0.00 55.95 56.35 1vsp s SER 42 Cb -0.02 -0.67 0.10 0.00 0.10 0.00 0.00 66.02 65.53 1vsp s SER 42 CO 0.18 0.01 1.14 -0.69 0.98 0.00 0.00 173.24 174.86 1vsp s VAL 43 N 0.72 2.46 0.00 5.02 1.01 -1.22 -2.41 120.40 125.99 1vsp s VAL 43 Ca -0.13 0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.01 1vsp s VAL 43 Cb -0.15 -2.43 0.00 0.00 0.00 0.00 0.00 36.38 33.80 1vsp s VAL 43 CO 0.02 -0.18 0.00 0.29 0.00 0.00 0.00 175.10 175.24 1vsp n LYS 44 N -3.70 0.00 -3.77 2.72 5.02 -1.00 -2.78 118.16 114.65 1vsp n LYS 44 Ca 0.11 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.27 1vsp n LYS 44 Cb 0.52 -0.47 -0.14 0.00 -0.02 0.00 0.00 35.03 34.92 1vsp n LYS 44 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1vsp s GLU 45 N -1.77 0.11 -0.24 1.97 2.56 -0.77 -4.65 118.70 115.91 1vsp s GLU 45 Ca 0.00 0.32 -0.28 0.00 0.00 0.00 0.00 54.97 55.01 1vsp s GLU 45 Cb 0.00 -0.11 0.16 0.00 2.00 0.00 0.00 34.13 36.17 1vsp s GLU 45 CO 0.00 -0.13 1.18 0.00 -0.56 0.00 0.00 175.26 175.75 1vsp s ALA 46 N 0.88 -2.04 -0.26 6.30 0.00 -1.26 -2.16 121.76 123.21 1vsp s ALA 46 Ca -0.07 1.74 -0.29 0.00 0.00 0.00 0.00 51.96 53.34 1vsp s ALA 46 Cb -0.09 -1.22 -0.01 0.00 0.00 0.00 0.00 23.12 21.80 1vsp s ALA 46 CO -0.04 -0.25 1.45 0.42 0.00 0.00 0.00 175.76 177.34 1vsp s ILE 47 N -0.72 3.92 0.36 0.00 -1.09 -1.21 -4.89 121.20 117.57 1vsp s ILE 47 Ca 0.03 1.04 0.06 0.00 -2.23 0.00 0.00 60.65 59.55 1vsp s ILE 47 Cb -0.02 -3.94 0.29 0.00 -1.58 0.00 0.00 42.46 37.21 1vsp s ILE 47 CO -0.05 -0.39 1.96 -0.65 -1.23 0.00 0.00 174.94 174.57 1vsp h PRO 48 N 10.01 0.75 -2.06 2.79 0.11 -1.86 -3.26 132.00 138.46 1vsp h PRO 48 Ca -0.30 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.76 1vsp h PRO 48 Cb 1.12 -0.17 -0.00 0.00 0.11 0.00 0.00 31.00 32.06 1vsp h PRO 48 CO 1.02 0.50 0.02 2.89 -0.21 0.00 0.00 178.00 182.21 1vsp n ARG 49 N -4.48 0.44 0.11 1.05 0.00 -1.26 -2.88 116.66 109.64 1vsp n ARG 49 Ca 0.11 -0.04 0.00 0.00 -0.00 0.00 0.00 57.85 57.91 1vsp n ARG 49 Cb 0.23 -1.34 0.00 0.00 -0.00 0.00 0.00 32.46 31.34 1vsp n ARG 49 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1vsp n GLY 50 N 1.91 -0.39 0.00 2.89 0.00 -1.23 -4.81 105.19 103.56 1vsp n GLY 50 Ca 0.02 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1vsp n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vsp n ALA 51 N -3.15 0.00 -2.04 4.61 0.00 -1.14 -4.69 120.51 114.10 1vsp n ALA 51 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1vsp n ALA 51 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1vsp n ALA 51 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1vsp n VAL 52 N 9.00 -1.05 -3.93 0.00 0.31 -1.26 -3.96 118.33 117.44 1vsp n VAL 52 Ca 0.00 0.23 -0.09 0.00 -0.01 0.00 0.00 64.34 64.47 1vsp n VAL 52 Cb 0.00 -1.72 -0.09 0.00 -0.91 0.00 0.00 33.84 31.12 1vsp n VAL 52 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 1vsp s LYS 53 N -0.45 0.63 0.00 5.55 -2.85 -1.26 -3.12 119.74 118.23 1vsp s LYS 53 Ca 0.00 -0.81 0.00 0.00 -1.00 0.00 0.00 55.97 54.16 1vsp s LYS 53 Cb 0.00 0.24 0.00 0.00 -2.06 0.00 0.00 37.83 36.01 1vsp s LYS 53 CO 0.00 -0.16 0.00 0.39 0.10 0.00 0.00 175.35 175.68 1vsp n GLU 54 N 0.61 -0.45 0.00 1.78 1.02 -1.26 -0.89 120.64 121.45 1vsp n GLU 54 Ca -0.18 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.96 1vsp n GLU 54 Cb 0.59 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.01 1vsp n GLU 54 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1vsp n GLY 55 N -0.38 -0.04 3.70 0.62 0.00 -1.12 -4.78 105.19 103.20 1vsp n GLY 55 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 1vsp n GLY 55 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1vsp s ASP 56 N 0.00 6.82 0.12 1.61 1.11 -0.07 -4.65 116.67 121.61 1vsp s ASP 56 Ca 0.00 2.24 -0.22 0.00 0.18 0.00 0.00 52.55 54.75 1vsp s ASP 56 Cb 0.00 -2.57 -0.07 0.00 1.07 0.00 0.00 42.92 41.34 1vsp s ASP 56 CO 0.00 -0.70 0.68 0.54 1.18 0.00 0.00 175.17 176.87 1vsp s VAL 57 N 1.82 4.54 0.17 -1.27 0.11 -1.25 -3.40 120.40 121.12 1vsp s VAL 57 Ca 0.65 1.47 -0.19 0.00 -2.93 0.00 0.00 61.98 60.98 1vsp s VAL 57 Cb -0.35 -4.02 0.04 0.00 -1.53 0.00 0.00 36.38 30.53 1vsp s VAL 57 CO 0.29 0.54 0.52 0.68 -3.33 0.00 0.00 175.10 173.80 1vsp s VAL 58 N -1.13 0.03 -0.99 2.04 -7.23 -1.06 -4.97 120.40 107.09 1vsp s VAL 58 Ca 0.33 -0.45 -0.16 0.00 -1.81 0.00 0.00 61.98 59.88 1vsp s VAL 58 Cb -0.21 -1.27 0.16 0.00 0.56 0.00 0.00 36.38 35.62 1vsp s VAL 58 CO 0.23 -0.13 1.14 -1.59 -0.31 0.00 0.00 175.10 174.44 1vsp s LYS 59 N -3.81 3.75 0.00 4.82 0.00 -1.26 -1.45 119.74 121.79 1vsp s LYS 59 Ca 0.04 -2.15 0.00 0.00 0.00 0.00 0.00 55.97 53.87 1vsp s LYS 59 Cb -0.00 -4.85 0.00 0.00 0.00 0.00 0.00 37.83 32.97 1vsp s LYS 59 CO -0.09 -1.66 0.00 0.00 0.00 0.00 0.00 175.35 173.60 1vsp n ALA 60 N 5.71 0.00 -3.30 0.59 0.00 -1.09 0.14 120.51 122.57 1vsp n ALA 60 Ca 0.25 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.72 1vsp n ALA 60 Cb 0.47 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.87 1vsp n ALA 60 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1vsp s VAL 61 N 0.00 -0.11 0.76 0.00 0.11 -1.26 -3.33 120.40 116.56 1vsp s VAL 61 Ca 0.00 0.00 -0.14 0.00 -2.93 0.00 0.00 61.98 58.91 1vsp s VAL 61 Cb 0.00 -1.00 0.05 0.00 -1.53 0.00 0.00 36.38 33.90 1vsp s VAL 61 CO 0.00 0.00 1.19 -0.69 -3.33 0.00 0.00 175.10 172.27 1vsp s VAL 62 N 1.94 2.34 0.00 2.04 1.01 0.18 -2.74 120.40 125.16 1vsp s VAL 62 Ca -0.01 0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.12 1vsp s VAL 62 Cb -0.02 -2.65 0.00 0.00 0.00 0.00 0.00 36.38 33.71 1vsp s VAL 62 CO -0.15 -0.10 0.00 1.33 0.00 0.00 0.00 175.10 176.18 1vsp n VAL 63 N -2.95 0.00 -0.02 2.92 0.24 -1.08 -4.51 118.33 112.93 1vsp n VAL 63 Ca 0.13 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.42 1vsp n VAL 63 Cb 0.51 0.00 -0.00 0.00 -1.47 0.00 0.00 33.84 32.87 1vsp n VAL 63 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 1vsp n ARG 64 N 0.00 0.00 -3.46 7.34 1.85 -1.26 -4.45 116.66 116.67 1vsp n ARG 64 Ca 0.00 0.00 -0.25 0.00 -1.00 0.00 0.00 57.85 56.60 1vsp n ARG 64 Cb 0.00 -0.02 -0.02 0.00 -1.05 0.00 0.00 32.46 31.37 1vsp n ARG 64 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 1vsp s THR 65 N 0.13 5.12 -2.00 8.89 -4.23 -1.21 -2.76 115.64 119.58 1vsp s THR 65 Ca 0.02 -0.39 0.10 0.00 -1.18 0.00 0.00 61.69 60.24 1vsp s THR 65 Cb -0.02 -3.82 0.30 0.00 1.34 0.00 0.00 72.50 70.30 1vsp s THR 65 CO 0.01 -0.44 1.18 0.29 -0.54 0.00 0.00 174.62 175.12 1vsp n LYS 66 N -1.42 0.71 -4.44 3.99 4.76 -0.96 -1.26 118.16 119.53 1vsp n LYS 66 Ca -0.05 0.00 -0.22 0.00 -2.87 0.00 0.00 58.31 55.17 1vsp n LYS 66 Cb 0.55 -1.23 -0.09 0.00 -1.84 0.00 0.00 35.03 32.42 1vsp n LYS 66 CO 0.00 0.00 0.00 -1.59 -1.37 0.00 0.00 177.40 174.44 1vsp s LYS 67 N -2.00 1.75 0.60 1.97 0.00 -1.26 -4.36 119.74 116.45 1vsp s LYS 67 Ca 0.16 -2.03 -0.17 0.00 0.00 0.00 0.00 55.97 53.93 1vsp s LYS 67 Cb 0.07 -0.52 -0.03 0.00 0.00 0.00 0.00 37.83 37.35 1vsp s LYS 67 CO 0.12 -0.40 1.12 -1.83 0.00 0.00 0.00 175.35 174.36 1vsp s GLU 68 N -3.80 3.07 0.08 1.78 1.03 -1.09 -3.69 118.70 116.08 1vsp s GLU 68 Ca 0.30 1.49 -0.12 0.00 0.03 0.00 0.00 54.97 56.67 1vsp s GLU 68 Cb 0.05 -1.98 -0.23 0.00 -0.80 0.00 0.00 34.13 31.17 1vsp s GLU 68 CO 0.15 -1.06 1.18 -0.24 -1.33 0.00 0.00 175.26 173.97 1vsp h VAL 69 N 0.59 1.30 -2.30 1.83 3.04 -1.67 -3.42 116.25 115.62 1vsp h VAL 69 Ca -0.48 -2.37 0.24 0.00 -1.01 0.00 0.00 66.70 63.08 1vsp h VAL 69 Cb 1.25 2.50 -0.11 0.00 -2.01 0.00 0.00 31.29 32.92 1vsp h VAL 69 CO 0.55 0.72 -0.71 1.17 -1.01 0.00 0.00 177.57 178.30 1vsp n LYS 70 N -3.81 -2.16 -3.60 4.17 3.00 -1.26 -4.90 118.16 109.60 1vsp n LYS 70 Ca -0.11 1.68 -0.03 0.00 -0.00 0.00 0.00 58.31 59.84 1vsp n LYS 70 Cb 0.91 -2.56 -0.02 0.00 0.00 0.00 0.00 35.03 33.37 1vsp n LYS 70 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.40 177.90 1vsp s ARG 71 N -3.24 0.29 0.00 1.64 3.52 -1.26 -4.67 118.95 115.23 1vsp s ARG 71 Ca 0.00 -0.11 0.00 0.00 -0.13 0.00 0.00 55.73 55.49 1vsp s ARG 71 Cb 0.00 0.13 0.00 0.00 -1.56 0.00 0.00 34.95 33.52 1vsp s ARG 71 CO 0.00 -0.13 0.10 -0.35 -0.81 0.00 0.00 175.30 174.11 1vsp n PRO 72 N -0.13 0.11 -2.65 5.12 -0.04 -1.26 -3.06 135.00 133.09 1vsp n PRO 72 Ca -0.00 0.00 -0.05 0.00 -0.04 0.00 0.00 63.50 63.41 1vsp n PRO 72 Cb 0.59 -1.01 0.10 0.00 -0.04 0.00 0.00 33.50 33.14 1vsp n PRO 72 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1vsp n ASP 73 N -0.40 -1.65 -1.20 3.54 3.85 -1.26 -5.16 116.55 114.28 1vsp n ASP 73 Ca 0.00 -2.25 0.16 0.00 -0.71 0.00 0.00 54.79 51.99 1vsp n ASP 73 Cb 0.00 0.92 -0.04 0.00 -1.35 0.00 0.00 41.12 40.66 1vsp n ASP 73 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1vsp n GLY 74 N -0.74 -1.53 0.31 6.12 0.00 -1.17 -4.99 105.19 103.19 1vsp n GLY 74 Ca -0.09 -0.95 0.00 0.00 0.00 0.00 0.00 46.02 44.98 1vsp n GLY 74 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1vsp n SER 75 N -4.27 -0.48 -3.33 1.61 7.64 -1.26 -4.49 113.62 109.03 1vsp n SER 75 Ca 0.01 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.89 1vsp n SER 75 Cb 0.52 -0.12 0.00 0.00 -1.01 0.00 0.00 64.21 63.60 1vsp n SER 75 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1vsp n ALA 76 N -0.46 0.00 0.00 -0.43 0.00 -1.26 -4.55 120.51 113.81 1vsp n ALA 76 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1vsp n ALA 76 Cb 0.12 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.57 1vsp n ALA 76 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 1vsp n ILE 77 N -0.84 0.00 -3.18 0.00 0.00 -1.26 -4.58 119.36 109.50 1vsp n ILE 77 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 62.75 62.32 1vsp n ILE 77 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 39.64 39.57 1vsp n ILE 77 CO 0.00 0.00 0.00 -0.60 0.00 0.00 0.00 176.55 175.95 1vsp s ARG 78 N 0.00 3.19 0.35 9.51 3.52 -1.25 -2.13 118.95 132.14 1vsp s ARG 78 Ca 0.00 -0.59 -0.25 0.00 -0.13 0.00 0.00 55.73 54.76 1vsp s ARG 78 Cb 0.00 -3.98 -0.10 0.00 -1.56 0.00 0.00 34.95 29.31 1vsp s ARG 78 CO 0.00 -1.00 0.95 -0.06 -0.81 0.00 0.00 175.30 174.38 1vsp s PHE 79 N 2.57 3.60 -1.24 5.12 0.40 -0.39 -4.84 117.98 123.20 1vsp s PHE 79 Ca 0.18 1.75 0.00 0.00 -0.60 0.00 0.00 56.93 58.25 1vsp s PHE 79 Cb -0.16 -2.93 0.00 0.00 0.51 0.00 0.00 43.02 40.44 1vsp s PHE 79 CO 0.16 0.10 0.40 -0.25 0.70 0.00 0.00 175.22 176.33 1vsp n ASP 80 N 0.33 0.50 -2.28 1.36 9.92 -1.26 -3.55 116.55 121.56 1vsp n ASP 80 Ca 0.03 -1.30 0.00 0.00 -0.53 0.00 0.00 54.79 52.99 1vsp n ASP 80 Cb 0.51 -0.25 0.01 0.00 -0.64 0.00 0.00 41.12 40.75 1vsp n ASP 80 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 1vsp n ASP 81 N 0.01 -0.67 -3.73 -2.24 5.68 -1.26 -4.96 116.55 109.38 1vsp n ASP 81 Ca 0.00 -1.23 -0.13 0.00 -0.50 0.00 0.00 54.79 52.92 1vsp n ASP 81 Cb 0.12 1.07 -0.10 0.00 -1.14 0.00 0.00 41.12 41.07 1vsp n ASP 81 CO 0.00 0.00 0.00 0.20 -1.33 0.00 0.00 177.20 176.07 1vsp s ASN 82 N -2.31 -0.42 0.40 -1.12 -0.87 -1.11 -2.26 114.94 107.24 1vsp s ASN 82 Ca 0.13 0.81 0.04 0.00 -1.57 0.00 0.00 52.86 52.27 1vsp s ASN 82 Cb -0.01 0.82 -0.04 0.00 -0.02 0.00 0.00 41.25 42.00 1vsp s ASN 82 CO 0.01 -0.16 0.07 0.00 -2.57 0.00 0.00 177.10 174.45 1vsp s ALA 83 N 0.15 2.95 -0.29 0.60 0.00 -1.19 -2.93 121.76 121.04 1vsp s ALA 83 Ca -0.01 -1.49 -0.21 0.00 0.00 0.00 0.00 51.96 50.25 1vsp s ALA 83 Cb -0.03 0.54 0.18 0.00 0.00 0.00 0.00 23.12 23.81 1vsp s ALA 83 CO 0.01 -0.25 1.24 0.00 0.00 0.00 0.00 175.76 176.76 1vsp s ALA 84 N -3.14 -2.33 0.00 0.00 0.00 -1.04 -2.64 121.76 112.62 1vsp s ALA 84 Ca 0.26 1.89 0.00 0.00 0.00 0.00 0.00 51.96 54.12 1vsp s ALA 84 Cb 0.05 -1.78 0.00 0.00 0.00 0.00 0.00 23.12 21.40 1vsp s ALA 84 CO 0.13 -0.23 0.00 0.28 0.00 0.00 0.00 175.76 175.94 1vsp n VAL 85 N 2.51 0.00 -3.43 0.00 0.31 -1.11 -2.31 118.33 114.31 1vsp n VAL 85 Ca -0.14 0.00 0.01 0.00 -0.01 0.00 0.00 64.34 64.20 1vsp n VAL 85 Cb 0.57 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 33.46 1vsp n VAL 85 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1vsp s ILE 86 N 1.77 -0.72 -0.47 2.52 1.01 -1.26 -4.10 121.20 119.95 1vsp s ILE 86 Ca 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 60.65 60.47 1vsp s ILE 86 Cb 0.00 -1.00 0.05 0.00 0.01 0.00 0.00 42.46 41.52 1vsp s ILE 86 CO 0.00 0.00 0.55 -0.63 0.00 0.00 0.00 174.94 174.86 1vsp s ILE 87 N 2.71 4.97 -0.40 2.92 -1.09 0.38 -1.50 121.20 129.19 1vsp s ILE 87 Ca -0.00 -0.47 -0.28 0.00 -2.23 0.00 0.00 60.65 57.67 1vsp s ILE 87 Cb -0.10 -4.20 -0.00 0.00 -1.58 0.00 0.00 42.46 36.58 1vsp s ILE 87 CO -0.18 -0.65 1.61 0.21 -1.23 0.00 0.00 174.94 174.69 1vsp s ASN 88 N 2.37 6.07 0.00 3.58 3.84 -1.25 -4.68 114.94 124.87 1vsp s ASN 88 Ca 0.14 0.98 0.00 0.00 0.21 0.00 0.00 52.86 54.18 1vsp s ASN 88 Cb -0.19 -2.53 0.00 0.00 -0.55 0.00 0.00 41.25 37.98 1vsp s ASN 88 CO 0.12 -1.62 0.00 0.59 -2.79 0.00 0.00 177.10 173.40 1vsp n ASN 89 N 9.73 0.00 0.00 -4.21 4.13 -1.26 -3.22 115.26 120.43 1vsp n ASN 89 Ca 0.19 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.45 1vsp n ASN 89 Cb 0.48 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.72 1vsp n ASN 89 CO 0.00 0.00 0.00 1.67 0.28 0.00 0.00 177.26 179.21 1vsp n GLN 90 N 0.00 0.00 0.00 3.52 7.27 -1.26 -4.49 117.38 122.42 1vsp n GLN 90 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 1vsp n GLN 90 Cb 0.00 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.65 1vsp n GLN 90 CO 0.00 0.00 0.00 1.47 0.07 0.00 0.00 177.06 178.60 1vsp n LEU 91 N -0.04 0.00 -4.02 1.69 -0.00 -1.20 -5.04 117.00 108.40 1vsp n LEU 91 Ca 0.00 0.00 -0.41 0.00 -0.00 0.00 0.00 56.01 55.60 1vsp n LEU 91 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 43.42 43.41 1vsp n LEU 91 CO 0.00 0.00 0.82 1.21 -0.00 0.00 0.00 177.39 179.42 1vsp n GLU 92 N 0.00 3.79 -1.57 1.47 2.13 -1.23 -4.66 120.64 120.57 1vsp n GLU 92 Ca 0.00 -4.54 -0.49 0.00 0.66 0.00 0.00 57.16 52.79 1vsp n GLU 92 Cb 0.00 -2.47 -0.04 0.00 0.27 0.00 0.00 31.44 29.20 1vsp n GLU 92 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 1vsp n PRO 93 N 1.68 1.13 0.00 5.31 -0.04 -1.26 -3.91 135.00 137.91 1vsp n PRO 93 Ca 0.25 0.40 0.00 0.00 -0.04 0.00 0.00 63.50 64.12 1vsp n PRO 93 Cb 0.36 -1.88 0.01 0.00 -0.04 0.00 0.00 33.50 31.95 1vsp n PRO 93 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1vsp n ARG 94 N 1.65 0.12 -2.60 0.54 0.63 -0.56 -4.41 116.66 112.03 1vsp n ARG 94 Ca 0.15 0.00 -0.41 0.00 -0.92 0.00 0.00 57.85 56.66 1vsp n ARG 94 Cb 0.25 -1.04 -0.03 0.00 0.45 0.00 0.00 32.46 32.09 1vsp n ARG 94 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 1vsp s GLY 95 N -1.89 0.99 -0.01 5.14 0.00 -1.13 -4.84 107.32 105.58 1vsp s GLY 95 Ca 0.00 -1.36 0.17 0.00 0.00 0.00 0.00 44.72 43.54 1vsp s GLY 95 CO 0.00 2.54 1.43 -1.30 0.00 0.00 0.00 173.10 175.77 1vsp n THR 96 N 6.35 0.86 -4.28 0.90 -2.24 -1.26 -4.92 114.28 109.70 1vsp n THR 96 Ca 0.03 -0.79 -0.25 0.00 -2.27 0.00 0.00 64.05 60.76 1vsp n THR 96 Cb 0.49 0.34 -0.17 0.00 -2.10 0.00 0.00 70.33 68.88 1vsp n THR 96 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1vsp s ARG 97 N -1.31 1.61 0.67 -0.78 1.81 -1.26 -4.91 118.95 114.77 1vsp s ARG 97 Ca 0.39 -0.34 -0.14 0.00 -1.72 0.00 0.00 55.73 53.91 1vsp s ARG 97 Cb 0.21 -1.47 0.00 0.00 -0.45 0.00 0.00 34.95 33.24 1vsp s ARG 97 CO 0.25 -0.10 1.10 0.54 -0.68 0.00 0.00 175.30 176.41 1vsp s VAL 98 N 1.11 3.35 0.00 3.52 0.11 -1.26 -3.38 120.40 123.85 1vsp s VAL 98 Ca -0.06 0.60 0.00 0.00 -2.93 0.00 0.00 61.98 59.58 1vsp s VAL 98 Cb -0.14 -3.12 0.00 0.00 -1.53 0.00 0.00 36.38 31.58 1vsp s VAL 98 CO -0.02 -0.42 0.00 0.49 -3.33 0.00 0.00 175.10 171.82 1vsp n PHE 99 N -2.54 -0.56 -1.30 1.54 3.72 -1.26 -4.84 117.46 112.23 1vsp n PHE 99 Ca 0.10 0.00 -0.37 0.00 -0.05 0.00 0.00 57.45 57.13 1vsp n PHE 99 Cb 0.52 0.00 0.06 0.00 -0.94 0.00 0.00 39.48 39.12 1vsp n PHE 99 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1vsp n GLY 100 N 0.00 -1.77 3.62 1.37 0.00 -1.26 -4.73 105.19 102.42 1vsp n GLY 100 Ca 0.00 -0.34 -0.34 0.00 0.00 0.00 0.00 46.02 45.34 1vsp n GLY 100 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1vsp s PRO 101 N -2.45 3.82 -0.23 1.61 0.04 -1.26 -4.96 135.00 131.56 1vsp s PRO 101 Ca 0.65 -0.38 -0.32 0.00 0.04 0.00 0.00 61.00 60.99 1vsp s PRO 101 Cb -0.37 -3.12 0.16 0.00 0.04 0.00 0.00 34.50 31.21 1vsp s PRO 101 CO 0.59 0.32 1.23 0.14 0.04 0.00 0.00 177.00 179.32 1vsp s VAL 102 N 0.21 0.00 0.00 -0.36 -7.23 -1.26 -4.64 120.40 107.13 1vsp s VAL 102 Ca 0.03 0.00 0.00 0.00 -1.81 0.00 0.00 61.98 60.20 1vsp s VAL 102 Cb -0.13 -1.00 0.00 0.00 0.56 0.00 0.00 36.38 35.81 1vsp s VAL 102 CO 0.01 0.00 0.00 0.00 -0.31 0.00 0.00 175.10 174.80 1vsp n ALA 103 N 0.32 -2.66 0.11 1.32 0.00 0.88 -4.70 120.51 115.78 1vsp n ALA 103 Ca -0.02 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.38 1vsp n ALA 103 Cb 0.58 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.05 1vsp n ALA 103 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 1vsp n ARG 104 N -0.17 1.20 -0.04 0.00 0.00 -1.06 -3.49 116.66 113.11 1vsp n ARG 104 Ca 0.00 -0.43 -0.02 0.00 -0.00 0.00 0.00 57.85 57.40 1vsp n ARG 104 Cb 0.00 -1.17 -0.09 0.00 -0.00 0.00 0.00 32.46 31.20 1vsp n ARG 104 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 1vsp n GLU 105 N 0.67 1.62 0.02 2.89 -0.58 -1.26 -4.44 120.64 119.56 1vsp n GLU 105 Ca 0.09 -0.04 -0.05 0.00 -0.42 0.00 0.00 57.16 56.74 1vsp n GLU 105 Cb 0.60 -1.28 0.16 0.00 -0.57 0.00 0.00 31.44 30.35 1vsp n GLU 105 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1vsp h LEU 106 N 0.00 0.50 -0.29 -4.62 4.07 -1.93 -1.40 115.31 111.64 1vsp h LEU 106 Ca -0.20 -0.20 0.05 0.00 0.08 0.00 0.00 57.88 57.61 1vsp h LEU 106 Cb 1.31 -0.14 -0.08 0.00 1.08 0.00 0.00 40.66 42.84 1vsp h LEU 106 CO 0.01 0.81 -0.51 -0.09 -1.08 0.00 0.00 178.44 177.58 1vsp h ARG 107 N 0.41 -0.44 0.00 1.13 2.43 -1.80 -1.90 114.38 114.21 1vsp h ARG 107 Ca 0.05 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 1vsp h ARG 107 Cb 0.80 0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.45 1vsp h ARG 107 CO 0.06 -0.29 -0.01 0.93 -1.51 0.00 0.00 179.97 179.16 1vsp h GLU 108 N -0.45 0.00 0.00 0.20 4.39 -1.77 -3.10 114.58 113.84 1vsp h GLU 108 Ca 0.08 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.78 1vsp h GLU 108 Cb 0.63 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.28 1vsp h GLU 108 CO -0.52 0.00 0.00 1.63 -1.16 0.00 0.00 179.01 178.96 1vsp n LYS 109 N -2.69 0.20 -0.37 2.33 4.76 -0.53 -4.90 118.16 116.96 1vsp n LYS 109 Ca 0.05 0.10 0.00 0.00 -2.87 0.00 0.00 58.31 55.58 1vsp n LYS 109 Cb 0.48 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 32.17 1vsp n LYS 109 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1vsp n GLY 110 N 0.64 0.65 2.63 0.72 0.00 -0.89 -5.04 105.19 103.90 1vsp n GLY 110 Ca 0.09 -0.63 -0.09 0.00 0.00 0.00 0.00 46.02 45.38 1vsp n GLY 110 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1vsp n PHE 111 N -0.28 -1.30 0.00 1.61 3.72 -1.07 -5.02 117.46 115.11 1vsp n PHE 111 Ca 0.00 -2.43 0.00 0.00 -0.05 0.00 0.00 57.45 54.97 1vsp n PHE 111 Cb 0.12 0.85 0.00 0.00 -0.94 0.00 0.00 39.48 39.51 1vsp n PHE 111 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 1vsp n MET 112 N -0.15 0.00 -0.04 -1.08 2.81 -1.26 -1.30 117.12 116.09 1vsp n MET 112 Ca 0.06 0.26 -0.01 0.00 -1.81 0.00 0.00 57.70 56.20 1vsp n MET 112 Cb 0.79 -0.87 -0.01 0.00 -0.71 0.00 0.00 33.22 32.42 1vsp n MET 112 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1vsp n LYS 113 N -0.63 -0.04 0.00 0.03 5.02 -1.26 -2.14 118.16 119.13 1vsp n LYS 113 Ca 0.00 0.29 0.00 0.00 -2.02 0.00 0.00 58.31 56.58 1vsp n LYS 113 Cb 0.00 -0.43 0.00 0.00 -0.02 0.00 0.00 35.03 34.58 1vsp n LYS 113 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 1vsp n ILE 114 N -3.10 0.00 0.00 -0.18 -0.00 -1.17 -2.91 119.36 111.99 1vsp n ILE 114 Ca 0.00 1.09 0.00 0.00 -0.00 0.00 0.00 62.75 63.84 1vsp n ILE 114 Cb 0.03 -2.01 0.00 0.00 -0.00 0.00 0.00 39.64 37.65 1vsp n ILE 114 CO 0.00 0.00 0.00 0.52 -0.00 0.00 0.00 176.55 177.07 1vsp n VAL 115 N -0.87 0.00 -0.28 7.28 0.31 -0.42 -1.98 118.33 122.37 1vsp n VAL 115 Ca 0.00 0.69 -0.02 0.00 -0.01 0.00 0.00 64.34 65.00 1vsp n VAL 115 Cb 0.00 -0.97 0.10 0.00 -0.91 0.00 0.00 33.84 32.06 1vsp n VAL 115 CO 0.00 0.00 0.00 -1.28 -1.32 0.00 0.00 176.83 174.23 1vsp h SER 116 N 0.00 0.81 -0.53 4.52 0.87 -1.71 -2.55 113.55 114.95 1vsp h SER 116 Ca 0.00 0.00 0.10 0.00 -1.23 0.00 0.00 61.79 60.67 1vsp h SER 116 Cb 0.00 -0.17 -0.09 0.00 -0.44 0.00 0.00 62.40 61.70 1vsp h SER 116 CO 0.00 0.55 -0.00 -0.07 -0.53 0.00 0.00 176.83 176.78 1vsp h LEU 117 N 0.95 -0.23 -8.66 2.23 3.38 -1.27 -3.27 115.31 108.44 1vsp h LEU 117 Ca 0.32 0.13 -0.48 0.00 0.09 0.00 0.00 57.88 57.94 1vsp h LEU 117 Cb 0.05 0.23 0.01 0.00 0.09 0.00 0.00 40.66 41.04 1vsp h LEU 117 CO -0.13 -0.08 1.62 0.00 0.09 0.00 0.00 178.44 179.94 1vsp n ALA 118 N -2.70 0.93 -1.84 1.53 0.00 -0.88 -4.85 120.51 112.69 1vsp n ALA 118 Ca 0.06 -0.85 -0.42 0.00 0.00 0.00 0.00 53.44 52.23 1vsp n ALA 118 Cb 0.29 -3.18 -0.03 0.00 0.00 0.00 0.00 19.45 16.53 1vsp n ALA 118 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1vsp s PRO 119 N 8.02 4.17 0.00 0.00 0.04 -1.24 -4.68 135.00 141.32 1vsp s PRO 119 Ca 0.98 2.41 0.00 0.00 0.04 0.00 0.00 61.00 64.44 1vsp s PRO 119 Cb -0.19 -3.87 0.00 0.00 0.04 0.00 0.00 34.50 30.47 1vsp s PRO 119 CO 0.27 -0.85 0.00 -1.91 0.04 0.00 0.00 177.00 174.56 1vsp n GLU 120 N 6.61 0.00 -3.74 4.56 2.13 -1.26 -4.42 120.64 124.52 1vsp n GLU 120 Ca 0.18 0.00 -0.10 0.00 0.66 0.00 0.00 57.16 57.90 1vsp n GLU 120 Cb 0.41 0.00 -0.04 0.00 0.27 0.00 0.00 31.44 32.08 1vsp n GLU 120 CO 0.00 0.00 0.00 0.14 -0.41 0.00 0.00 177.13 176.86 1vsp s VAL 121 N -2.86 0.02 0.00 6.31 -7.23 -1.26 -4.02 120.40 111.36 1vsp s VAL 121 Ca 0.00 -0.79 0.00 0.00 -1.81 0.00 0.00 61.98 59.38 1vsp s VAL 121 Cb 0.00 -1.60 0.00 0.00 0.56 0.00 0.00 36.38 35.34 1vsp s VAL 121 CO 0.00 -0.11 0.00 0.18 -0.31 0.00 0.00 175.10 174.86