#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vsp n LYS 11 N 0.00 0.00 -4.50 -0.78 5.02 -1.26 -5.11 118.16 111.52 1vsp n LYS 11 Ca 0.00 0.00 -0.24 0.00 -2.02 0.00 0.00 58.31 56.05 1vsp n LYS 11 Cb 0.00 0.00 -0.11 0.00 -0.02 0.00 0.00 35.03 34.90 1vsp n LYS 11 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1vsp s ASN 12 N -1.53 2.83 0.00 4.39 0.01 -1.26 -5.16 114.94 114.22 1vsp s ASN 12 Ca 0.00 -1.39 0.00 0.00 -0.71 0.00 0.00 52.86 50.76 1vsp s ASN 12 Cb 0.00 -0.14 0.00 0.00 0.41 0.00 0.00 41.25 41.52 1vsp s ASN 12 CO 0.00 -0.58 0.00 0.61 -1.51 0.00 0.00 177.10 175.62 1vsp n GLY 13 N -0.78 -2.79 0.00 0.66 0.00 -1.26 -5.11 105.19 95.90 1vsp n GLY 13 Ca -0.03 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.61 1vsp n GLY 13 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vsp n ARG 14 N 0.00 0.00 -4.25 1.61 5.12 -1.26 -5.19 116.66 112.69 1vsp n ARG 14 Ca 0.00 0.00 -0.14 0.00 -1.93 0.00 0.00 57.85 55.78 1vsp n ARG 14 Cb 0.00 0.00 -0.10 0.00 -1.16 0.00 0.00 32.46 31.20 1vsp n ARG 14 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1vsp s ASP 15 N 0.00 1.69 0.00 0.55 3.68 -1.26 -5.17 116.67 116.16 1vsp s ASP 15 Ca 0.00 -1.05 0.00 0.00 2.13 0.00 0.00 52.55 53.63 1vsp s ASP 15 Cb 0.00 0.01 0.00 0.00 -1.45 0.00 0.00 42.92 41.48 1vsp s ASP 15 CO 0.00 -0.39 0.00 -0.24 0.13 0.00 0.00 175.17 174.67 1vsp n SER 16 N -0.21 0.00 0.00 -0.34 2.88 -1.26 -4.07 113.62 110.62 1vsp n SER 16 Ca -0.09 -0.95 0.00 0.00 -1.33 0.00 0.00 58.87 56.50 1vsp n SER 16 Cb 0.61 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.07 1vsp n SER 16 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 1vsp n GLN 17 N 0.00 0.00 0.00 -1.46 -0.06 -1.26 -2.66 117.38 111.94 1vsp n GLN 17 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.00 1vsp n GLN 17 Cb 0.00 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.18 1vsp n GLN 17 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1vsp n ALA 18 N 0.00 0.00 -1.80 1.69 0.00 -1.26 -4.75 120.51 114.39 1vsp n ALA 18 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1vsp n ALA 18 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1vsp n ALA 18 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1vsp n LYS 19 N 0.00 0.00 -1.01 0.00 5.02 -1.26 -4.90 118.16 116.01 1vsp n LYS 19 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1vsp n LYS 19 Cb 0.00 -2.03 0.00 0.00 -0.02 0.00 0.00 35.03 32.98 1vsp n LYS 19 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1vsp n ARG 20 N -0.64 -2.09 0.00 1.97 3.00 -1.25 -4.90 116.66 112.76 1vsp n ARG 20 Ca 0.00 1.73 0.00 0.00 -0.01 0.00 0.00 57.85 59.57 1vsp n ARG 20 Cb 0.41 -1.60 0.00 0.00 0.00 0.00 0.00 32.46 31.27 1vsp n ARG 20 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1vsp n LEU 21 N 0.56 0.00 0.00 0.55 4.32 -1.09 -4.79 117.00 116.55 1vsp n LEU 21 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 1vsp n LEU 21 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 1vsp n LEU 21 CO 0.00 0.00 0.00 0.61 -1.22 0.00 0.00 177.39 176.78 1vsp n GLY 22 N 0.00 0.34 3.51 -0.72 0.00 -1.23 -4.71 105.19 102.38 1vsp n GLY 22 Ca 0.00 -0.57 -0.27 0.00 0.00 0.00 0.00 46.02 45.18 1vsp n GLY 22 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1vsp n VAL 23 N 0.00 0.85 -1.98 1.61 0.31 -1.26 -3.53 118.33 114.33 1vsp n VAL 23 Ca 0.00 -0.85 0.00 0.00 -0.01 0.00 0.00 64.34 63.48 1vsp n VAL 23 Cb 0.00 -2.09 0.00 0.00 -0.91 0.00 0.00 33.84 30.84 1vsp n VAL 23 CO 0.00 0.00 0.00 2.29 -1.32 0.00 0.00 176.83 177.80 1vsp n LYS 24 N 8.03 2.53 -2.63 5.55 2.85 -0.92 -4.88 118.16 128.69 1vsp n LYS 24 Ca 0.44 0.00 -0.05 0.00 -1.05 0.00 0.00 58.31 57.65 1vsp n LYS 24 Cb 0.45 0.00 -0.05 0.00 -0.65 0.00 0.00 35.03 34.79 1vsp n LYS 24 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 1vsp n ARG 25 N -0.15 -4.46 -0.75 -1.58 5.12 -1.26 -4.35 116.66 109.23 1vsp n ARG 25 Ca 0.00 3.37 -0.33 0.00 -1.93 0.00 0.00 57.85 58.96 1vsp n ARG 25 Cb 0.00 -4.93 0.14 0.00 -1.16 0.00 0.00 32.46 26.51 1vsp n ARG 25 CO 0.00 0.00 0.00 2.48 -1.93 0.00 0.00 177.63 178.18 1vsp n TYR 26 N 1.72 -1.55 -0.11 -1.55 0.18 -1.26 -4.71 117.16 109.88 1vsp n TYR 26 Ca -0.40 0.19 -0.05 0.00 1.88 0.00 0.00 57.90 59.52 1vsp n TYR 26 Cb 0.61 -1.66 -0.01 0.00 -0.38 0.00 0.00 39.34 37.91 1vsp n TYR 26 CO 0.00 0.00 0.00 -1.91 -2.08 0.00 0.00 176.86 172.87 1vsp n GLU 27 N -1.67 0.00 -3.49 -3.48 4.07 -1.26 -1.62 120.64 113.19 1vsp n GLU 27 Ca 0.03 0.00 -0.15 0.00 -0.06 0.00 0.00 57.16 56.99 1vsp n GLU 27 Cb 0.58 -0.12 -0.02 0.00 -0.06 0.00 0.00 31.44 31.83 1vsp n GLU 27 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1vsp n GLY 28 N 0.50 -0.16 3.69 8.31 0.00 -1.04 -4.85 105.19 111.64 1vsp n GLY 28 Ca 0.04 0.09 -0.22 0.00 0.00 0.00 0.00 46.02 45.93 1vsp n GLY 28 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1vsp n GLN 29 N -2.45 -0.06 -0.81 1.61 7.27 -0.64 -2.55 117.38 119.75 1vsp n GLN 29 Ca -0.09 -2.59 -0.32 0.00 0.07 0.00 0.00 57.00 54.06 1vsp n GLN 29 Cb 0.25 -0.62 0.14 0.00 2.41 0.00 0.00 30.24 32.42 1vsp n GLN 29 CO 0.00 0.00 0.00 1.55 0.07 0.00 0.00 177.06 178.68 1vsp n VAL 30 N -2.77 0.38 -3.61 1.69 3.14 -1.25 -3.01 118.33 112.91 1vsp n VAL 30 Ca 0.16 -0.13 -0.03 0.00 -2.96 0.00 0.00 64.34 61.39 1vsp n VAL 30 Cb 0.56 -0.86 -0.05 0.00 -1.06 0.00 0.00 33.84 32.42 1vsp n VAL 30 CO 0.00 0.00 0.00 0.68 -6.46 0.00 0.00 176.83 171.05 1vsp s VAL 31 N -2.43 -0.47 -0.07 1.55 -7.23 -1.15 -4.95 120.40 105.64 1vsp s VAL 31 Ca 0.64 0.00 0.01 0.00 -1.81 0.00 0.00 61.98 60.81 1vsp s VAL 31 Cb -0.24 -1.00 0.02 0.00 0.56 0.00 0.00 36.38 35.72 1vsp s VAL 31 CO 0.61 0.00 -0.06 -0.60 -0.31 0.00 0.00 175.10 174.73 1vsp s ARG 32 N 2.22 1.20 0.00 4.82 3.52 -1.26 -3.37 118.95 126.08 1vsp s ARG 32 Ca -0.07 -0.19 0.00 0.00 -0.13 0.00 0.00 55.73 55.34 1vsp s ARG 32 Cb -0.08 -1.21 0.00 0.00 -1.56 0.00 0.00 34.95 32.10 1vsp s ARG 32 CO -0.18 -0.14 0.00 0.00 -0.81 0.00 0.00 175.30 174.16 1vsp n ALA 33 N 4.42 0.00 -2.63 6.12 0.00 -0.92 -1.39 120.51 126.12 1vsp n ALA 33 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1vsp n ALA 33 Cb 0.51 0.00 0.04 0.00 0.00 0.00 0.00 19.45 20.00 1vsp n ALA 33 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vsp n GLY 34 N 0.00 1.46 3.56 0.00 0.00 -1.08 -4.32 105.19 104.81 1vsp n GLY 34 Ca 0.00 -0.75 -0.40 0.00 0.00 0.00 0.00 46.02 44.87 1vsp n GLY 34 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1vsp s ASN 35 N -2.57 6.42 0.30 1.61 0.02 -0.48 -4.69 114.94 115.54 1vsp s ASN 35 Ca 0.23 -1.42 -0.27 0.00 -1.02 0.00 0.00 52.86 50.39 1vsp s ASN 35 Cb 0.33 -2.57 -0.14 0.00 0.02 0.00 0.00 41.25 38.89 1vsp s ASN 35 CO -0.09 -1.58 0.83 -0.38 0.02 0.00 0.00 177.10 175.90 1vsp n ILE 36 N 6.95 1.99 0.00 0.60 -0.00 -1.26 -1.23 119.36 126.40 1vsp n ILE 36 Ca 0.34 -0.50 0.00 0.00 -0.00 0.00 0.00 62.75 62.59 1vsp n ILE 36 Cb 0.51 -0.73 0.00 0.00 -0.00 0.00 0.00 39.64 39.42 1vsp n ILE 36 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1vsp n LEU 37 N 1.34 0.00 -4.57 1.39 -0.00 -1.11 -4.75 117.00 109.31 1vsp n LEU 37 Ca 0.12 0.00 -0.33 0.00 -0.00 0.00 0.00 56.01 55.80 1vsp n LEU 37 Cb 0.32 0.00 -0.04 0.00 -0.00 0.00 0.00 43.42 43.70 1vsp n LEU 37 CO 0.58 0.00 1.47 -0.69 -0.00 0.00 0.00 177.39 178.75 1vsp s VAL 38 N 0.64 3.67 -0.58 1.47 1.01 -0.59 -2.15 120.40 123.86 1vsp s VAL 38 Ca 0.00 -0.73 -0.24 0.00 0.00 0.00 0.00 61.98 61.01 1vsp s VAL 38 Cb 0.00 -4.52 0.05 0.00 0.00 0.00 0.00 36.38 31.90 1vsp s VAL 38 CO 0.00 -1.35 0.97 -0.60 0.00 0.00 0.00 175.10 174.12 1vsp s ARG 39 N 6.05 3.28 0.00 2.72 6.06 -1.23 0.23 118.95 136.06 1vsp s ARG 39 Ca 0.61 -0.37 0.00 0.00 -2.50 0.00 0.00 55.73 53.47 1vsp s ARG 39 Cb -0.03 -4.10 0.00 0.00 0.06 0.00 0.00 34.95 30.89 1vsp s ARG 39 CO -0.00 -1.59 0.00 0.94 -2.50 0.00 0.00 175.30 172.14 1vsp n GLN 40 N 7.64 0.00 0.00 5.12 7.27 -1.26 -3.47 117.38 132.67 1vsp n GLN 40 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.08 1vsp n GLN 40 Cb 0.47 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.12 1vsp n GLN 40 CO 0.00 0.00 0.00 -2.13 0.07 0.00 0.00 177.06 175.00 1vsp n ARG 41 N 0.00 0.00 0.00 3.69 0.63 -1.26 -1.83 116.66 117.89 1vsp n ARG 41 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 1vsp n ARG 41 Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 1vsp n ARG 41 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1vsp n GLY 42 N 0.00 0.82 0.00 5.14 0.00 -1.26 -4.46 105.19 105.43 1vsp n GLY 42 Ca 0.00 0.46 0.00 0.00 0.00 0.00 0.00 46.02 46.48 1vsp n GLY 42 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1vsp n THR 43 N 0.00 0.00 0.00 2.61 -1.04 -1.26 -5.17 114.28 109.42 1vsp n THR 43 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1vsp n THR 43 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1vsp n THR 43 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29 1vsp n ARG 44 N 0.00 0.00 -0.91 -2.82 0.63 -1.26 -5.08 116.66 107.21 1vsp n ARG 44 Ca 0.00 0.00 -0.36 0.00 -0.92 0.00 0.00 57.85 56.57 1vsp n ARG 44 Cb 0.00 0.00 0.06 0.00 0.45 0.00 0.00 32.46 32.97 1vsp n ARG 44 CO 0.00 0.00 0.00 1.19 -2.51 0.00 0.00 177.63 176.31 1vsp n PHE 45 N 0.00 -1.33 -4.19 -0.14 3.01 -1.22 -4.53 117.46 109.07 1vsp n PHE 45 Ca 0.00 0.56 -0.16 0.00 1.01 0.00 0.00 57.45 58.86 1vsp n PHE 45 Cb 0.00 -1.41 -0.11 0.00 -0.01 0.00 0.00 39.48 37.95 1vsp n PHE 45 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 1vsp s LYS 46 N -2.31 0.89 -0.38 -1.08 3.01 -0.94 -4.90 119.74 114.03 1vsp s LYS 46 Ca 0.38 -1.14 -0.29 0.00 -1.01 0.00 0.00 55.97 53.91 1vsp s LYS 46 Cb 0.06 -0.68 0.01 0.00 -1.01 0.00 0.00 37.83 36.21 1vsp s LYS 46 CO 0.62 0.12 1.41 -1.25 0.51 0.00 0.00 175.35 176.76 1vsp s PRO 47 N -2.58 3.64 0.50 -1.68 0.04 -1.26 -4.05 135.00 129.60 1vsp s PRO 47 Ca 0.05 1.04 -0.01 0.00 0.04 0.00 0.00 61.00 62.12 1vsp s PRO 47 Cb -0.05 -4.00 0.10 0.00 0.04 0.00 0.00 34.50 30.59 1vsp s PRO 47 CO 0.01 -1.48 0.68 0.41 0.04 0.00 0.00 177.00 176.66 1vsp n GLY 48 N 4.92 0.51 3.77 0.56 0.00 -1.05 -4.99 105.19 108.90 1vsp n GLY 48 Ca 0.16 -1.98 -0.40 0.00 0.00 0.00 0.00 46.02 43.81 1vsp n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vsp s LYS 49 N -4.24 3.84 0.00 1.61 3.01 -1.26 -2.78 119.74 119.91 1vsp s LYS 49 Ca 0.44 2.33 0.00 0.00 -1.01 0.00 0.00 55.97 57.73 1vsp s LYS 49 Cb -0.02 -2.73 0.00 0.00 -1.01 0.00 0.00 37.83 34.07 1vsp s LYS 49 CO 0.29 -0.66 0.00 0.09 0.51 0.00 0.00 175.35 175.59 1vsp n ASN 50 N 0.00 0.00 -4.71 2.83 3.02 -1.26 -2.78 115.26 112.36 1vsp n ASN 50 Ca 0.04 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.17 1vsp n ASN 50 Cb 0.42 -0.01 -0.03 0.00 -0.61 0.00 0.00 39.78 39.55 1vsp n ASN 50 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1vsp s VAL 51 N -0.03 3.20 -0.08 2.41 1.01 -1.12 -2.36 120.40 123.43 1vsp s VAL 51 Ca 0.00 0.83 -0.01 0.00 0.00 0.00 0.00 61.98 62.79 1vsp s VAL 51 Cb 0.00 -3.53 -0.03 0.00 0.00 0.00 0.00 36.38 32.82 1vsp s VAL 51 CO 0.00 0.05 -0.01 -0.83 0.00 0.00 0.00 175.10 174.31 1vsp s GLY 52 N 1.32 1.82 0.55 4.51 0.00 -1.15 -4.46 107.32 109.92 1vsp s GLY 52 Ca 0.66 -0.82 0.07 0.00 0.00 0.00 0.00 44.72 44.63 1vsp s GLY 52 CO 0.30 -0.59 0.58 -0.29 0.00 0.00 0.00 173.10 173.10 1vsp s MET 53 N -0.88 2.29 -0.30 2.90 1.75 -1.26 -2.63 119.30 121.18 1vsp s MET 53 Ca 0.13 -1.82 -0.14 0.00 -1.25 0.00 0.00 55.69 52.61 1vsp s MET 53 Cb -0.11 -2.37 0.17 0.00 2.84 0.00 0.00 34.83 35.36 1vsp s MET 53 CO 0.02 -0.71 0.99 0.20 -0.65 0.00 0.00 175.02 174.86 1vsp s GLY 54 N -4.45 -0.25 0.75 2.11 0.00 -1.07 -4.58 107.32 99.83 1vsp s GLY 54 Ca 0.47 2.95 -0.15 0.00 0.00 0.00 0.00 44.72 48.00 1vsp s GLY 54 CO 0.30 3.35 -0.54 -0.96 0.00 0.00 0.00 173.10 175.24 1vsp n ARG 55 N 5.08 0.00 -1.64 2.90 1.85 -1.26 -1.18 116.66 122.40 1vsp n ARG 55 Ca -0.08 0.00 -0.15 0.00 -1.00 0.00 0.00 57.85 56.62 1vsp n ARG 55 Cb 0.53 -0.86 -0.05 0.00 -1.05 0.00 0.00 32.46 31.02 1vsp n ARG 55 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 1vsp n ASP 56 N 2.80 -4.76 0.00 2.89 10.43 -1.26 -4.37 116.55 122.28 1vsp n ASP 56 Ca 0.01 0.28 0.00 0.00 2.57 0.00 0.00 54.79 57.65 1vsp n ASP 56 Cb 0.46 -3.67 0.00 0.00 1.84 0.00 0.00 41.12 39.75 1vsp n ASP 56 CO 0.00 0.00 0.00 0.33 -1.07 0.00 0.00 177.20 176.46 1vsp n PHE 57 N -2.91 0.00 0.00 1.24 7.35 -0.32 -4.72 117.46 118.09 1vsp n PHE 57 Ca -0.16 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.53 1vsp n PHE 57 Cb 0.53 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.36 1vsp n PHE 57 CO 0.00 0.00 0.00 2.41 -0.76 0.00 0.00 176.76 178.41 1vsp n THR 58 N 0.00 0.00 -3.77 -2.13 -1.04 -0.76 -2.64 114.28 103.93 1vsp n THR 58 Ca 0.00 0.00 -0.37 0.00 -2.04 0.00 0.00 64.05 61.64 1vsp n THR 58 Cb 0.00 0.00 -0.06 0.00 -1.82 0.00 0.00 70.33 68.45 1vsp n THR 58 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 1vsp s LEU 59 N 0.00 4.36 0.00 -4.42 1.02 0.13 -2.58 118.68 117.19 1vsp s LEU 59 Ca 0.00 0.51 0.00 0.00 0.02 0.00 0.00 54.13 54.66 1vsp s LEU 59 Cb 0.00 -2.17 0.00 0.00 0.02 0.00 0.00 46.19 44.04 1vsp s LEU 59 CO 0.00 0.34 0.00 2.22 0.02 0.00 0.00 176.35 178.93 1vsp n PHE 60 N 2.33 0.00 -2.16 0.29 -1.74 -1.08 -1.54 117.46 113.57 1vsp n PHE 60 Ca -0.18 0.00 -0.40 0.00 -0.56 0.00 0.00 57.45 56.31 1vsp n PHE 60 Cb 0.54 0.00 -0.03 0.00 1.52 0.00 0.00 39.48 41.51 1vsp n PHE 60 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 1vsp s ALA 61 N -2.00 2.47 0.00 1.98 0.00 -0.36 -2.91 121.76 120.93 1vsp s ALA 61 Ca 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 51.96 51.38 1vsp s ALA 61 Cb 0.00 -4.21 0.00 0.00 0.00 0.00 0.00 23.12 18.91 1vsp s ALA 61 CO 0.00 -3.44 0.00 -0.11 0.00 0.00 0.00 175.76 172.21 1vsp n LEU 62 N 11.39 0.00 0.00 0.00 0.00 -1.19 -2.65 117.00 124.55 1vsp n LEU 62 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 56.01 56.18 1vsp n LEU 62 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 43.42 43.92 1vsp n LEU 62 CO 0.71 0.00 0.09 0.52 0.00 0.00 0.00 177.39 178.71 1vsp n VAL 63 N 0.00 0.00 -3.94 1.96 0.31 -0.99 -2.16 118.33 113.50 1vsp n VAL 63 Ca 0.00 0.56 0.03 0.00 -0.01 0.00 0.00 64.34 64.92 1vsp n VAL 63 Cb 0.00 -1.31 0.01 0.00 -0.91 0.00 0.00 33.84 31.63 1vsp n VAL 63 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 1vsp s ASP 64 N -1.75 -0.00 0.00 4.52 1.11 -1.23 -2.94 116.67 116.37 1vsp s ASP 64 Ca 0.00 -0.11 0.00 0.00 0.18 0.00 0.00 52.55 52.62 1vsp s ASP 64 Cb 0.00 0.08 0.00 0.00 1.07 0.00 0.00 42.92 44.07 1vsp s ASP 64 CO 0.00 -0.16 0.00 0.61 1.18 0.00 0.00 175.17 176.80 1vsp n GLY 65 N -0.87 -1.45 3.75 0.21 0.00 -1.22 -4.70 105.19 100.92 1vsp n GLY 65 Ca 0.03 -2.08 -0.28 0.00 0.00 0.00 0.00 46.02 43.69 1vsp n GLY 65 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1vsp s VAL 66 N 0.00 4.28 -0.16 1.61 -7.23 -1.22 -2.94 120.40 114.74 1vsp s VAL 66 Ca 0.00 -1.01 -0.17 0.00 -1.81 0.00 0.00 61.98 58.99 1vsp s VAL 66 Cb 0.00 -3.11 -0.04 0.00 0.56 0.00 0.00 36.38 33.79 1vsp s VAL 66 CO 0.00 0.02 0.45 -0.69 -0.31 0.00 0.00 175.10 174.57 1vsp s VAL 67 N -1.53 5.18 -1.13 1.32 1.01 -1.06 -1.67 120.40 122.51 1vsp s VAL 67 Ca 0.29 0.86 -0.22 0.00 0.00 0.00 0.00 61.98 62.91 1vsp s VAL 67 Cb -0.11 -3.79 -0.04 0.00 0.00 0.00 0.00 36.38 32.44 1vsp s VAL 67 CO 0.21 0.27 1.86 -0.70 0.00 0.00 0.00 175.10 176.75 1vsp s GLU 68 N 1.05 2.87 -0.99 2.72 2.56 -1.24 -2.50 118.70 123.17 1vsp s GLU 68 Ca 0.23 -1.13 -0.23 0.00 0.00 0.00 0.00 54.97 53.84 1vsp s GLU 68 Cb -0.15 -5.27 0.03 0.00 2.00 0.00 0.00 34.13 30.74 1vsp s GLU 68 CO 0.09 -3.39 1.58 0.12 -0.56 0.00 0.00 175.26 173.10 1vsp s PHE 69 N 9.08 2.35 0.00 5.30 2.19 -1.26 -3.35 117.98 132.28 1vsp s PHE 69 Ca 0.64 -0.47 0.00 0.00 0.33 0.00 0.00 56.93 57.43 1vsp s PHE 69 Cb -0.01 -4.53 0.00 0.00 -1.31 0.00 0.00 43.02 37.17 1vsp s PHE 69 CO 0.07 -1.89 0.00 1.04 1.83 0.00 0.00 175.22 176.28 1vsp n GLN 70 N 8.87 0.00 -3.07 10.12 6.02 -1.19 -4.80 117.38 133.33 1vsp n GLN 70 Ca 0.35 0.00 -0.08 0.00 -0.01 0.00 0.00 57.00 57.27 1vsp n GLN 70 Cb 0.50 0.00 0.01 0.00 1.02 0.00 0.00 30.24 31.77 1vsp n GLN 70 CO 0.00 0.00 0.00 -0.40 -1.01 0.00 0.00 177.06 175.65 1vsp n ASP 71 N 0.00 -1.45 -3.85 1.08 5.68 -1.26 -2.78 116.55 113.97 1vsp n ASP 71 Ca 0.00 -2.20 -0.20 0.00 -0.50 0.00 0.00 54.79 51.89 1vsp n ASP 71 Cb 0.00 2.48 -0.17 0.00 -1.14 0.00 0.00 41.12 42.29 1vsp n ASP 71 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 1vsp s ARG 72 N -2.21 0.68 1.67 0.11 1.81 -1.06 -4.67 118.95 115.28 1vsp s ARG 72 Ca 0.14 -0.01 0.00 0.00 -1.72 0.00 0.00 55.73 54.14 1vsp s ARG 72 Cb -0.03 -0.81 0.00 0.00 -0.45 0.00 0.00 34.95 33.66 1vsp s ARG 72 CO 0.10 -0.15 0.00 0.41 -0.68 0.00 0.00 175.30 174.98 1vsp n GLY 73 N 4.37 2.33 0.00 -3.53 0.00 -1.26 -3.23 105.19 103.87 1vsp n GLY 73 Ca -0.20 0.38 0.00 0.00 0.00 0.00 0.00 46.02 46.20 1vsp n GLY 73 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1vsp n ARG 74 N 9.45 0.70 0.00 1.61 0.00 -1.26 -4.81 116.66 122.35 1vsp n ARG 74 Ca 0.00 0.00 0.07 0.00 -0.00 0.00 0.00 57.85 57.92 1vsp n ARG 74 Cb 0.00 -0.60 0.44 0.00 0.00 0.00 0.00 32.46 32.29 1vsp n ARG 74 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1vsp n LEU 75 N -0.96 0.00 -3.52 6.15 7.99 -1.24 -4.75 117.00 120.67 1vsp n LEU 75 Ca 0.00 0.00 -0.10 0.00 -0.01 0.00 0.00 56.01 55.90 1vsp n LEU 75 Cb 0.10 0.00 -0.02 0.00 -0.11 0.00 0.00 43.42 43.40 1vsp n LEU 75 CO 0.00 0.00 0.52 -0.83 -1.51 0.00 0.00 177.39 175.57 1vsp s GLY 76 N -1.96 -0.49 -0.14 -0.72 0.00 -1.20 -5.09 107.32 97.72 1vsp s GLY 76 Ca 0.22 0.55 -0.00 0.00 0.00 0.00 0.00 44.72 45.48 1vsp s GLY 76 CO 0.17 0.18 -0.07 0.50 0.00 0.00 0.00 173.10 173.87 1vsp s ARG 77 N -3.53 1.59 0.42 2.90 0.52 -1.26 -2.56 118.95 117.02 1vsp s ARG 77 Ca 0.04 -0.40 0.07 0.00 -0.52 0.00 0.00 55.73 54.92 1vsp s ARG 77 Cb -0.02 -1.83 -0.04 0.00 0.52 0.00 0.00 34.95 33.59 1vsp s ARG 77 CO -0.08 -0.33 0.23 0.71 0.02 0.00 0.00 175.30 175.84 1vsp s TYR 78 N 1.65 2.57 -0.31 -0.53 1.51 -1.12 -2.22 117.35 118.91 1vsp s TYR 78 Ca 0.03 -0.59 0.04 0.00 -1.01 0.00 0.00 57.07 55.55 1vsp s TYR 78 Cb -0.14 -2.00 0.18 0.00 -0.11 0.00 0.00 41.96 39.89 1vsp s TYR 78 CO -0.08 0.09 0.49 0.14 -1.11 0.00 0.00 175.55 175.08 1vsp s VAL 79 N -2.59 -0.78 -0.98 0.71 -7.23 -1.21 -3.17 120.40 105.16 1vsp s VAL 79 Ca 0.42 -0.21 -0.12 0.00 -1.81 0.00 0.00 61.98 60.26 1vsp s VAL 79 Cb 0.02 -0.88 0.24 0.00 0.56 0.00 0.00 36.38 36.32 1vsp s VAL 79 CO 0.23 -0.18 0.97 -1.00 -0.31 0.00 0.00 175.10 174.81 1vsp s HIS 80 N 2.51 3.95 -0.04 2.82 3.76 -1.25 -2.54 115.29 124.51 1vsp s HIS 80 Ca 0.11 -2.29 -0.38 0.00 -0.15 0.00 0.00 55.06 52.36 1vsp s HIS 80 Cb -0.11 -3.87 -0.16 0.00 1.11 0.00 0.00 32.58 29.55 1vsp s HIS 80 CO -0.25 -1.01 1.51 0.28 -0.85 0.00 0.00 174.74 174.42 1vsp n VAL 81 N 3.50 0.12 -2.59 -0.90 0.31 -1.12 -3.62 118.33 114.03 1vsp n VAL 81 Ca 0.20 -0.02 -0.42 0.00 -0.01 0.00 0.00 64.34 64.08 1vsp n VAL 81 Cb 0.43 -1.03 -0.02 0.00 -0.91 0.00 0.00 33.84 32.31 1vsp n VAL 81 CO 0.00 0.00 0.00 -0.13 -1.32 0.00 0.00 176.83 175.38 1vsp s ARG 82 N 1.65 3.57 0.00 5.55 0.52 -0.67 -4.70 118.95 124.87 1vsp s ARG 82 Ca 0.89 0.33 0.00 0.00 -0.52 0.00 0.00 55.73 56.43 1vsp s ARG 82 Cb -0.97 -3.98 0.00 0.00 0.52 0.00 0.00 34.95 30.52 1vsp s ARG 82 CO 0.53 -1.59 0.00 -0.35 0.02 0.00 0.00 175.30 173.91 1vsp n PRO 83 N 8.24 0.00 0.00 3.54 -0.04 -1.26 -3.44 135.00 142.04 1vsp n PRO 83 Ca 0.09 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.55 1vsp n PRO 83 Cb 0.49 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.95 1vsp n PRO 83 CO 0.00 0.00 0.00 -0.11 -0.04 0.00 0.00 175.50 175.35 1vsp n LEU 84 N 0.00 0.00 0.00 1.53 7.94 -1.26 -4.91 117.00 120.30 1vsp n LEU 84 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 1vsp n LEU 84 Cb 0.00 0.00 0.00 0.00 0.53 0.00 0.00 43.42 43.95 1vsp n LEU 84 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.39 176.28