#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jvt s GLU 2 N 0.00 3.26 0.79 1.64 2.12 -1.26 -5.11 118.70 120.14 1jvt s GLU 2 Ca 0.00 -0.75 -0.11 0.00 0.36 0.00 0.00 54.97 54.47 1jvt s GLU 2 Cb 0.00 -2.54 0.07 0.00 0.26 0.00 0.00 34.13 31.92 1jvt s GLU 2 CO 0.00 0.17 1.10 0.95 -0.54 0.00 0.00 175.26 176.94 1jvt s THR 3 N 0.44 3.13 0.47 -1.70 -4.23 -1.26 -4.84 115.64 107.64 1jvt s THR 3 Ca -0.12 0.38 0.15 0.00 -1.18 0.00 0.00 61.69 60.91 1jvt s THR 3 Cb -0.16 -2.80 0.21 0.00 1.34 0.00 0.00 72.50 71.08 1jvt s THR 3 CO 0.06 -0.47 2.04 0.00 -0.54 0.00 0.00 174.62 175.70 1jvt h ALA 4 N -1.16 1.78 -0.05 3.99 0.00 -1.97 -1.49 119.26 120.36 1jvt h ALA 4 Ca -0.44 -0.12 -0.19 0.00 0.00 0.00 0.00 54.91 54.17 1jvt h ALA 4 Cb 1.24 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1jvt h ALA 4 CO 0.50 0.17 -0.77 0.00 0.00 0.00 0.00 179.25 179.15 1jvt h ALA 5 N 1.86 0.59 -0.05 0.00 0.00 -1.86 -2.25 119.26 117.56 1jvt h ALA 5 Ca 0.00 -0.63 -0.18 0.00 0.00 0.00 0.00 54.91 54.10 1jvt h ALA 5 Cb 0.22 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1jvt h ALA 5 CO 0.02 0.79 -0.75 0.00 0.00 0.00 0.00 179.25 179.31 1jvt h ALA 6 N 0.96 0.62 -0.51 0.00 0.00 -1.70 -2.65 119.26 115.98 1jvt h ALA 6 Ca -0.04 -0.63 -0.08 0.00 0.00 0.00 0.00 54.91 54.17 1jvt h ALA 6 Cb 1.35 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.05 1jvt h ALA 6 CO 0.13 0.80 0.01 -0.22 0.00 0.00 0.00 179.25 179.97 1jvt h LYS 7 N 0.20 0.90 -0.59 0.00 3.64 -1.29 -0.85 116.57 118.58 1jvt h LYS 7 Ca -0.03 -0.28 0.02 0.00 -1.27 0.00 0.00 60.65 59.09 1jvt h LYS 7 Cb 1.33 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 33.03 1jvt h LYS 7 CO 0.12 0.92 0.37 0.35 -2.27 0.00 0.00 179.45 178.94 1jvt h PHE 8 N 0.77 0.69 -0.51 1.91 3.57 -1.21 -0.51 116.94 121.66 1jvt h PHE 8 Ca 0.15 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.58 1jvt h PHE 8 Cb 0.51 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 39.00 1jvt h PHE 8 CO 0.04 0.41 -0.02 0.93 -2.23 0.00 0.00 178.31 177.43 1jvt h GLU 9 N 0.74 0.88 -0.19 1.11 5.08 -1.25 0.21 114.58 121.15 1jvt h GLU 9 Ca 0.23 -0.26 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 1jvt h GLU 9 Cb -0.01 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.14 1jvt h GLU 9 CO -0.08 0.89 0.06 -0.09 -1.00 0.00 0.00 179.01 178.79 1jvt h ARG 10 N 0.81 0.29 0.03 2.33 2.43 -0.26 -2.52 114.38 117.50 1jvt h ARG 10 Ca 0.15 -0.06 -0.23 0.00 -0.81 0.00 0.00 59.98 59.03 1jvt h ARG 10 Cb 0.52 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.00 1jvt h ARG 10 CO 0.03 0.40 -1.10 1.96 -1.51 0.00 0.00 179.97 179.75 1jvt h GLN 11 N 0.13 0.07 0.00 0.20 4.20 -1.13 -3.41 115.11 115.17 1jvt h GLN 11 Ca 0.06 -0.12 0.00 0.00 0.06 0.00 0.00 58.65 58.66 1jvt h GLN 11 Cb 0.23 0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.05 1jvt h GLN 11 CO -0.00 1.03 -0.31 0.72 -0.67 0.00 0.00 178.83 179.60 1jvt n HIS 12 N -3.38 0.00 -3.87 2.96 8.25 0.06 -4.69 115.22 114.55 1jvt n HIS 12 Ca -0.03 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.08 1jvt n HIS 12 Cb 0.97 -0.01 -0.09 0.00 1.12 0.00 0.00 29.99 31.97 1jvt n HIS 12 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 1jvt s MET 13 N -1.40 4.06 -0.43 -0.41 -1.94 -0.95 0.81 119.30 119.04 1jvt s MET 13 Ca 0.00 -0.29 0.04 0.00 -1.71 0.00 0.00 55.69 53.73 1jvt s MET 13 Cb 0.02 -3.32 0.17 0.00 2.01 0.00 0.00 34.83 33.71 1jvt s MET 13 CO 0.09 0.25 0.41 0.34 -0.01 0.00 0.00 175.02 176.10 1jvt s ASP 14 N 0.46 0.91 0.00 3.03 2.15 0.80 -4.86 116.67 119.16 1jvt s ASP 14 Ca 0.05 -2.76 0.31 0.00 0.43 0.00 0.00 52.55 50.58 1jvt s ASP 14 Cb -0.12 0.02 1.61 0.00 -0.30 0.00 0.00 42.92 44.14 1jvt s ASP 14 CO -0.00 -0.15 2.09 -1.20 -0.17 0.00 0.00 175.17 175.73 1jvt n SER 15 N 2.93 0.09 0.22 -0.34 7.64 -1.26 -4.02 113.62 118.88 1jvt n SER 15 Ca 0.27 -0.52 -0.09 0.00 1.01 0.00 0.00 58.87 59.54 1jvt n SER 15 Cb 0.49 -0.15 -0.04 0.00 -1.01 0.00 0.00 64.21 63.50 1jvt n SER 15 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 1jvt h SER 16 N 0.12 -0.48 -3.07 6.43 4.64 -1.92 -3.44 113.55 115.82 1jvt h SER 16 Ca 0.00 0.02 -0.48 0.00 -0.47 0.00 0.00 61.79 60.86 1jvt h SER 16 Cb 0.20 0.12 0.02 0.00 -0.31 0.00 0.00 62.40 62.44 1jvt h SER 16 CO 0.00 -0.34 -0.06 0.42 -0.87 0.00 0.00 176.83 175.98 1jvt s THR 17 N -4.18 4.81 -0.50 2.95 -4.23 -1.26 -5.02 115.64 108.21 1jvt s THR 17 Ca -0.08 -0.24 0.23 0.00 -1.18 0.00 0.00 61.69 60.42 1jvt s THR 17 Cb 0.01 -3.79 -0.10 0.00 1.34 0.00 0.00 72.50 69.96 1jvt s THR 17 CO 0.25 -0.61 1.01 -1.54 -0.54 0.00 0.00 174.62 173.18 1jvt n SER 18 N -2.02 0.61 -3.94 3.99 3.41 -1.26 -4.78 113.62 109.63 1jvt n SER 18 Ca -0.02 -0.07 -0.09 0.00 -0.26 0.00 0.00 58.87 58.43 1jvt n SER 18 Cb 0.56 0.79 -0.07 0.00 -0.26 0.00 0.00 64.21 65.23 1jvt n SER 18 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1jvt s ALA 19 N -3.25 -0.04 -0.01 7.33 0.00 -1.26 -4.86 121.76 119.67 1jvt s ALA 19 Ca 0.02 -0.84 -0.32 0.00 0.00 0.00 0.00 51.96 50.82 1jvt s ALA 19 Cb 0.13 0.82 -0.11 0.00 0.00 0.00 0.00 23.12 23.96 1jvt s ALA 19 CO 0.80 -0.63 1.90 0.00 0.00 0.00 0.00 175.76 177.83 1jvt n ALA 20 N -0.20 1.31 0.42 0.00 0.00 -1.26 -4.89 120.51 115.88 1jvt n ALA 20 Ca -0.08 0.27 -0.19 0.00 0.00 0.00 0.00 53.44 53.43 1jvt n ALA 20 Cb 0.63 -2.57 -0.10 0.00 0.00 0.00 0.00 19.45 17.41 1jvt n ALA 20 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1jvt h SER 21 N 9.47 -1.26 -3.05 0.00 0.02 -1.99 -3.48 113.55 113.26 1jvt h SER 21 Ca -0.49 0.07 -0.17 0.00 -0.84 0.00 0.00 61.79 60.36 1jvt h SER 21 Cb 1.25 0.37 -0.04 0.00 0.14 0.00 0.00 62.40 64.12 1jvt h SER 21 CO 0.94 -0.74 -0.10 -1.54 -1.14 0.00 0.00 176.83 174.25 1jvt n SER 22 N -5.56 -0.77 0.00 3.07 3.41 -1.26 -4.96 113.62 107.55 1jvt n SER 22 Ca -0.14 -2.13 0.09 0.00 -0.26 0.00 0.00 58.87 56.43 1jvt n SER 22 Cb 0.50 1.45 0.43 0.00 -0.26 0.00 0.00 64.21 66.33 1jvt n SER 22 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1jvt n SER 23 N -1.87 0.00 -0.07 4.04 3.41 -1.26 -1.64 113.62 116.23 1jvt n SER 23 Ca 0.01 0.30 0.11 0.00 -0.26 0.00 0.00 58.87 59.03 1jvt n SER 23 Cb 0.35 -0.41 0.08 0.00 -0.26 0.00 0.00 64.21 63.96 1jvt n SER 23 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1jvt n ASN 24 N -1.41 0.90 -0.17 4.04 2.85 -1.26 -4.39 115.26 115.82 1jvt n ASN 24 Ca 0.06 -0.75 -0.03 0.00 -0.11 0.00 0.00 54.58 53.75 1jvt n ASN 24 Cb 0.19 0.59 0.03 0.00 1.24 0.00 0.00 39.78 41.84 1jvt n ASN 24 CO 0.00 0.00 0.00 0.22 -2.11 0.00 0.00 177.26 175.37 1jvt h TYR 25 N 0.32 -0.43 -0.70 1.20 3.20 -1.68 -2.13 116.97 116.76 1jvt h TYR 25 Ca 0.00 0.05 -0.03 0.00 3.14 0.00 0.00 58.73 61.89 1jvt h TYR 25 Cb 0.52 0.27 -0.03 0.00 1.54 0.00 0.00 36.73 39.03 1jvt h TYR 25 CO 0.00 -0.27 0.32 0.00 -1.64 0.00 0.00 178.16 176.57 1jvt h ASN 27 N 0.98 0.93 0.63 0.00 2.35 -1.74 0.18 115.58 118.92 1jvt h ASN 27 Ca 0.24 -0.21 -0.03 0.00 -0.55 0.00 0.00 56.30 55.75 1jvt h ASN 27 Cb 0.14 -0.25 0.01 0.00 0.05 0.00 0.00 38.32 38.27 1jvt h ASN 27 CO -0.03 0.93 -0.30 -0.61 -1.65 0.00 0.00 177.43 175.77 1jvt h GLN 28 N 0.93 -0.82 -1.00 0.81 4.15 -1.03 -2.99 115.11 115.15 1jvt h GLN 28 Ca 0.19 0.06 0.01 0.00 0.77 0.00 0.00 58.65 59.68 1jvt h GLN 28 Cb 0.40 0.19 -0.05 0.00 0.21 0.00 0.00 27.48 28.22 1jvt h GLN 28 CO 0.01 -0.50 0.66 0.52 -1.93 0.00 0.00 178.83 177.59 1jvt h MET 29 N -1.09 1.31 -0.41 1.69 2.86 -0.75 -1.67 114.93 116.87 1jvt h MET 29 Ca -0.09 -0.08 -0.09 0.00 -2.06 0.00 0.00 59.70 57.38 1jvt h MET 29 Cb 0.69 -0.29 -0.02 0.00 0.06 0.00 0.00 31.60 32.04 1jvt h MET 29 CO 0.14 0.86 -0.13 0.52 1.06 0.00 0.00 176.91 179.37 1jvt h MET 30 N 1.34 0.73 -0.11 1.72 2.86 -1.04 -2.17 114.93 118.28 1jvt h MET 30 Ca 0.37 -0.25 -0.11 0.00 -2.06 0.00 0.00 59.70 57.65 1jvt h MET 30 Cb -0.13 -0.06 0.00 0.00 0.06 0.00 0.00 31.60 31.47 1jvt h MET 30 CO -0.09 0.83 -0.37 -0.22 1.06 0.00 0.00 176.91 178.13 1jvt h LYS 31 N 0.66 0.44 0.00 1.72 3.64 -1.34 -0.89 116.57 120.80 1jvt h LYS 31 Ca 0.11 -0.33 -0.05 0.00 -1.27 0.00 0.00 60.65 59.12 1jvt h LYS 31 Cb 0.60 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.47 1jvt h LYS 31 CO 0.04 0.95 -0.23 0.66 -2.27 0.00 0.00 179.45 178.60 1jvt h SER 32 N 0.01 0.00 -0.54 4.20 4.64 -1.18 -2.60 113.55 118.09 1jvt h SER 32 Ca -0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 1jvt h SER 32 Cb 0.99 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.08 1jvt h SER 32 CO 0.08 0.23 0.00 0.54 -0.87 0.00 0.00 176.83 176.81 1jvt n ARG 33 N -3.78 2.98 -2.97 4.77 5.12 -0.83 -4.95 116.66 117.01 1jvt n ARG 33 Ca -0.02 -2.24 -0.16 0.00 -1.93 0.00 0.00 57.85 53.50 1jvt n ARG 33 Cb 0.33 -1.69 0.04 0.00 -1.16 0.00 0.00 32.46 29.98 1jvt n ARG 33 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1jvt n ASN 34 N 0.96 -4.96 -1.19 0.55 3.02 -0.98 -4.80 115.26 107.86 1jvt n ASN 34 Ca 0.20 -0.27 0.12 0.00 -0.03 0.00 0.00 54.58 54.61 1jvt n ASN 34 Cb 0.68 -3.73 0.23 0.00 -0.61 0.00 0.00 39.78 36.35 1jvt n ASN 34 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1jvt n LEU 35 N -3.23 3.55 -0.17 3.41 4.77 -0.34 -4.13 117.00 120.86 1jvt n LEU 35 Ca -0.05 -1.55 0.04 0.00 -0.03 0.00 0.00 56.01 54.41 1jvt n LEU 35 Cb 0.57 -0.28 0.05 0.00 -2.33 0.00 0.00 43.42 41.44 1jvt n LEU 35 CO 0.38 0.78 0.41 0.35 -1.33 0.00 0.00 177.39 177.98 1jvt n THR 36 N 1.54 0.86 0.00 -5.08 -2.24 -1.24 -1.61 114.28 106.51 1jvt n THR 36 Ca 0.20 -0.99 0.00 0.00 -2.27 0.00 0.00 64.05 60.99 1jvt n THR 36 Cb 0.62 0.32 0.00 0.00 -2.10 0.00 0.00 70.33 69.16 1jvt n THR 36 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1jvt n LYS 37 N -0.60 0.00 -0.04 -0.78 0.00 -1.26 -4.16 118.16 111.31 1jvt n LYS 37 Ca 0.06 0.23 -0.12 0.00 0.00 0.00 0.00 58.31 58.48 1jvt n LYS 37 Cb 0.56 -1.12 -0.07 0.00 0.00 0.00 0.00 35.03 34.40 1jvt n LYS 37 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.40 177.78 1jvt h ASP 38 N 0.00 0.24 -5.58 3.14 2.03 -1.89 -3.47 116.42 110.89 1jvt h ASP 38 Ca 0.00 -0.39 -0.30 0.00 -0.73 0.00 0.00 57.03 55.61 1jvt h ASP 38 Cb 0.00 -0.07 -0.09 0.00 -0.83 0.00 0.00 39.33 38.35 1jvt h ASP 38 CO 0.00 0.58 -0.24 0.00 -1.03 0.00 0.00 179.24 178.55 1jvt s ARG 39 N -4.66 1.89 -0.25 4.15 1.70 -1.26 -5.08 118.95 115.44 1jvt s ARG 39 Ca -0.14 -1.80 -0.21 0.00 -0.47 0.00 0.00 55.73 53.11 1jvt s ARG 39 Cb 0.05 0.43 -0.02 0.00 -0.57 0.00 0.00 34.95 34.84 1jvt s ARG 39 CO 0.72 -0.77 0.68 0.00 -1.08 0.00 0.00 175.30 174.85 1jvt s LYS 41 N 2.59 4.29 0.11 0.00 2.20 -0.63 -4.94 119.74 123.36 1jvt s LYS 41 Ca 0.28 1.99 -0.24 0.00 -0.36 0.00 0.00 55.97 57.64 1jvt s LYS 41 Cb -0.15 -3.51 -0.09 0.00 -1.51 0.00 0.00 37.83 32.57 1jvt s LYS 41 CO 0.08 -0.54 1.69 -1.35 -0.36 0.00 0.00 175.35 174.87 1jvt h PRO 42 N 7.62 -0.19 -5.07 4.03 0.11 -1.94 -3.44 132.00 133.12 1jvt h PRO 42 Ca -0.39 0.01 -0.43 0.00 0.11 0.00 0.00 66.00 65.31 1jvt h PRO 42 Cb 1.19 0.04 -0.27 0.00 0.11 0.00 0.00 31.00 32.07 1jvt h PRO 42 CO 0.89 -0.13 -0.79 0.08 -0.21 0.00 0.00 178.00 177.85 1jvt s VAL 43 N -6.15 0.94 -0.21 3.15 1.01 -1.26 -0.51 120.40 117.37 1jvt s VAL 43 Ca -0.14 -0.69 -0.17 0.00 0.00 0.00 0.00 61.98 60.98 1jvt s VAL 43 Cb 0.08 -0.83 0.06 0.00 0.00 0.00 0.00 36.38 35.69 1jvt s VAL 43 CO 0.66 0.13 0.54 0.21 0.00 0.00 0.00 175.10 176.64 1jvt s ASN 44 N -0.64 -0.61 -0.13 3.32 2.47 -0.06 -5.00 114.94 114.29 1jvt s ASN 44 Ca 0.03 1.11 -0.03 0.00 0.42 0.00 0.00 52.86 54.39 1jvt s ASN 44 Cb -0.06 1.09 -0.03 0.00 -1.45 0.00 0.00 41.25 40.80 1jvt s ASN 44 CO 0.00 -0.20 -0.03 -0.89 -3.72 0.00 0.00 177.10 172.26 1jvt s THR 45 N 0.66 3.96 -0.08 -5.21 2.01 -1.26 0.09 115.64 115.82 1jvt s THR 45 Ca -0.03 -0.35 0.01 0.00 0.31 0.00 0.00 61.69 61.64 1jvt s THR 45 Cb -0.05 -2.71 -0.03 0.00 0.01 0.00 0.00 72.50 69.73 1jvt s THR 45 CO -0.04 0.53 -0.10 -0.36 -0.69 0.00 0.00 174.62 173.95 1jvt s PHE 46 N -0.01 2.84 -0.15 4.92 0.08 -0.01 -4.41 117.98 121.23 1jvt s PHE 46 Ca 0.01 -0.15 -0.04 0.00 0.12 0.00 0.00 56.93 56.87 1jvt s PHE 46 Cb -0.13 -1.71 -0.03 0.00 -0.57 0.00 0.00 43.02 40.57 1jvt s PHE 46 CO 0.03 0.18 -0.01 0.08 -0.10 0.00 0.00 175.22 175.40 1jvt s VAL 47 N -0.55 4.12 -0.96 -0.44 1.01 0.24 -1.31 120.40 122.51 1jvt s VAL 47 Ca 0.08 -0.28 -0.00 0.00 0.00 0.00 0.00 61.98 61.78 1jvt s VAL 47 Cb -0.12 -2.81 0.32 0.00 0.00 0.00 0.00 36.38 33.77 1jvt s VAL 47 CO 0.02 0.50 1.61 1.41 0.00 0.00 0.00 175.10 178.64 1jvt n HIS 48 N 3.38 2.88 -4.16 5.22 -0.00 0.50 -0.14 115.22 122.90 1jvt n HIS 48 Ca -0.17 -2.81 -0.10 0.00 -0.00 0.00 0.00 57.72 54.64 1jvt n HIS 48 Cb 0.52 -1.09 -0.10 0.00 -0.00 0.00 0.00 29.99 29.33 1jvt n HIS 48 CO 0.00 0.00 0.00 -1.21 -0.00 0.00 0.00 176.34 175.13 1jvt s GLU 49 N -3.90 0.89 0.54 -0.41 0.41 -1.26 -4.56 118.70 110.41 1jvt s GLU 49 Ca 0.39 -1.40 -0.21 0.00 -0.41 0.00 0.00 54.97 53.34 1jvt s GLU 49 Cb 0.18 0.11 -0.05 0.00 -1.78 0.00 0.00 34.13 32.58 1jvt s GLU 49 CO -0.09 -0.19 1.26 -1.54 -0.49 0.00 0.00 175.26 174.22 1jvt s SER 50 N -3.04 5.47 0.40 -0.19 1.04 -1.26 -4.31 113.70 111.81 1jvt s SER 50 Ca 0.20 2.52 0.12 0.00 0.48 0.00 0.00 55.95 59.27 1jvt s SER 50 Cb 0.07 -2.62 0.95 0.00 0.10 0.00 0.00 66.02 64.52 1jvt s SER 50 CO -0.01 -1.41 1.92 0.25 0.98 0.00 0.00 173.24 174.97 1jvt h LEU 51 N 1.42 0.49 -0.72 2.42 5.85 -1.98 -0.38 115.31 122.41 1jvt h LEU 51 Ca -0.50 0.02 -0.11 0.00 0.84 0.00 0.00 57.88 58.12 1jvt h LEU 51 Cb 1.29 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 42.22 1jvt h LEU 51 CO 0.57 0.27 -0.25 0.00 -0.34 0.00 0.00 178.44 178.70 1jvt h ALA 52 N 1.64 0.90 -0.14 1.25 0.00 -1.99 0.15 119.26 121.08 1jvt h ALA 52 Ca 0.37 -0.37 -0.11 0.00 0.00 0.00 0.00 54.91 54.79 1jvt h ALA 52 Cb 0.68 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1jvt h ALA 52 CO -0.13 0.62 -0.40 -0.44 0.00 0.00 0.00 179.25 178.90 1jvt h ASP 53 N 0.62 0.32 -0.01 0.00 3.32 -1.44 -2.52 116.42 116.71 1jvt h ASP 53 Ca 0.08 -0.13 -0.11 0.00 0.02 0.00 0.00 57.03 56.89 1jvt h ASP 53 Cb 0.74 -0.09 0.01 0.00 0.22 0.00 0.00 39.33 40.21 1jvt h ASP 53 CO 0.06 0.69 -0.44 0.58 -1.72 0.00 0.00 179.24 178.41 1jvt h VAL 54 N 0.26 1.47 0.00 -1.35 2.07 -1.17 -3.12 116.25 114.41 1jvt h VAL 54 Ca 0.02 -1.99 -0.00 0.00 0.82 0.00 0.00 66.70 65.55 1jvt h VAL 54 Cb 0.82 2.63 -0.00 0.00 -1.52 0.00 0.00 31.29 33.22 1jvt h VAL 54 CO 0.07 0.57 -0.00 1.56 0.02 0.00 0.00 177.57 179.78 1jvt h GLN 55 N -0.26 0.00 0.00 1.57 4.20 -0.95 -1.22 115.11 118.45 1jvt h GLN 55 Ca -0.05 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.64 1jvt h GLN 55 Cb 1.16 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.94 1jvt h GLN 55 CO 0.09 0.00 -0.08 0.00 -0.67 0.00 0.00 178.83 178.17 1jvt h ALA 56 N 2.00 1.26 0.00 3.87 0.00 -1.38 -2.74 119.26 122.27 1jvt h ALA 56 Ca -0.00 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1jvt h ALA 56 Cb 0.01 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1jvt h ALA 56 CO 0.00 0.10 -0.07 0.28 0.00 0.00 0.00 179.25 179.56 1jvt h VAL 57 N 0.00 0.61 0.00 0.00 2.07 -1.28 -2.36 116.25 115.30 1jvt h VAL 57 Ca -0.00 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 67.21 1jvt h VAL 57 Cb 0.26 1.19 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 1jvt h VAL 57 CO 0.01 0.07 0.00 0.00 0.02 0.00 0.00 177.57 177.67 1jvt n SER 59 N -1.26 2.08 0.00 0.00 7.64 -0.89 -5.02 113.62 116.18 1jvt n SER 59 Ca 0.06 -2.64 0.00 0.00 1.01 0.00 0.00 58.87 57.30 1jvt n SER 59 Cb 0.09 -0.27 0.00 0.00 -1.01 0.00 0.00 64.21 63.01 1jvt n SER 59 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1jvt n GLN 60 N -1.04 1.59 -2.51 1.43 6.02 0.00 -5.04 117.38 117.83 1jvt n GLN 60 Ca 0.10 0.00 -0.43 0.00 -0.01 0.00 0.00 57.00 56.66 1jvt n GLN 60 Cb 0.51 0.00 -0.02 0.00 1.02 0.00 0.00 30.24 31.75 1jvt n GLN 60 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 1jvt s LYS 61 N 4.53 3.82 0.01 -1.09 2.20 -1.03 -4.88 119.74 123.30 1jvt s LYS 61 Ca 0.00 0.93 -0.30 0.00 -0.36 0.00 0.00 55.97 56.24 1jvt s LYS 61 Cb 0.00 -3.89 -0.04 0.00 -1.51 0.00 0.00 37.83 32.39 1jvt s LYS 61 CO 0.00 -1.24 1.10 1.21 -0.36 0.00 0.00 175.35 176.06 1jvt s ASN 62 N 2.66 7.20 0.08 1.43 3.84 -1.26 -0.39 114.94 128.50 1jvt s ASN 62 Ca 0.52 1.82 -0.02 0.00 0.21 0.00 0.00 52.86 55.39 1jvt s ASN 62 Cb -0.12 -2.57 -0.04 0.00 -0.55 0.00 0.00 41.25 37.97 1jvt s ASN 62 CO 0.26 -0.41 0.02 0.68 -2.79 0.00 0.00 177.10 174.86 1jvt s VAL 63 N 1.28 0.18 0.48 -5.21 -7.23 -0.63 -4.95 120.40 104.32 1jvt s VAL 63 Ca 0.55 -1.79 -0.20 0.00 -1.81 0.00 0.00 61.98 58.73 1jvt s VAL 63 Cb -0.25 -1.67 -0.09 0.00 0.56 0.00 0.00 36.38 34.94 1jvt s VAL 63 CO 0.27 -0.80 1.03 0.00 -0.31 0.00 0.00 175.10 175.28 1jvt s ALA 64 N -3.96 2.88 0.61 1.32 0.00 -1.26 -3.26 121.76 118.10 1jvt s ALA 64 Ca 0.12 0.58 -0.05 0.00 0.00 0.00 0.00 51.96 52.61 1jvt s ALA 64 Cb 0.08 -3.24 0.02 0.00 0.00 0.00 0.00 23.12 19.98 1jvt s ALA 64 CO -0.06 -0.29 0.91 0.00 0.00 0.00 0.00 175.76 176.32 1jvt h LYS 66 N -0.25 0.76 0.00 0.00 1.57 -1.93 0.65 116.57 117.37 1jvt h LYS 66 Ca -0.45 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.29 1jvt h LYS 66 Cb 1.28 -0.17 0.00 0.00 0.08 0.00 0.00 32.23 33.41 1jvt h LYS 66 CO 0.60 0.50 0.00 0.27 -0.57 0.00 0.00 179.45 180.25 1jvt n ASN 67 N -4.45 0.00 0.00 0.86 6.94 -1.26 -4.88 115.26 112.47 1jvt n ASN 67 Ca 0.06 -0.97 0.00 0.00 -0.02 0.00 0.00 54.58 53.65 1jvt n ASN 67 Cb 0.06 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.48 1jvt n ASN 67 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1jvt n GLY 68 N 0.94 0.74 3.78 4.83 0.00 0.22 -5.05 105.19 110.66 1jvt n GLY 68 Ca 0.23 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.95 1jvt n GLY 68 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1jvt s GLN 69 N -0.74 2.16 -0.16 1.61 -0.21 -1.26 -4.67 119.66 116.39 1jvt s GLN 69 Ca 0.00 0.87 0.17 0.00 0.02 0.00 0.00 55.36 56.43 1jvt s GLN 69 Cb 0.00 -1.91 0.39 0.00 1.00 0.00 0.00 33.01 32.49 1jvt s GLN 69 CO 0.00 -1.63 1.26 0.25 -2.12 0.00 0.00 175.29 173.05 1jvt n THR 70 N -3.47 2.08 -1.37 -0.19 -2.24 -1.26 0.47 114.28 108.29 1jvt n THR 70 Ca 0.08 -2.23 -0.35 0.00 -2.27 0.00 0.00 64.05 59.28 1jvt n THR 70 Cb 0.55 -0.25 0.08 0.00 -2.10 0.00 0.00 70.33 68.60 1jvt n THR 70 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1jvt n ASN 71 N -1.09 7.58 -4.65 3.42 6.94 -1.26 -4.73 115.26 121.47 1jvt n ASN 71 Ca 0.19 -3.79 -0.32 0.00 -0.02 0.00 0.00 54.58 50.64 1jvt n ASN 71 Cb 0.75 -0.95 -0.09 0.00 -2.36 0.00 0.00 39.78 37.13 1jvt n ASN 71 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1jvt s TYR 73 N -1.07 0.83 -0.14 0.00 1.51 0.10 -1.60 117.35 116.97 1jvt s TYR 73 Ca 0.19 -0.17 -0.04 0.00 -1.01 0.00 0.00 57.07 56.04 1jvt s TYR 73 Cb -0.11 -0.55 -0.03 0.00 -0.11 0.00 0.00 41.96 41.15 1jvt s TYR 73 CO 0.10 -0.04 0.01 -1.14 -1.11 0.00 0.00 175.55 173.37 1jvt s GLN 74 N -0.09 3.58 0.36 -0.62 0.74 0.48 -1.46 119.66 122.64 1jvt s GLN 74 Ca 0.02 -0.42 -0.28 0.00 0.05 0.00 0.00 55.36 54.73 1jvt s GLN 74 Cb -0.05 -2.98 -0.10 0.00 1.10 0.00 0.00 33.01 30.98 1jvt s GLN 74 CO -0.00 0.40 1.34 -1.54 -0.55 0.00 0.00 175.29 174.93 1jvt s SER 75 N -0.02 6.56 0.12 6.67 1.04 -0.45 -2.47 113.70 125.15 1jvt s SER 75 Ca 0.03 2.74 -0.13 0.00 0.48 0.00 0.00 55.95 59.07 1jvt s SER 75 Cb -0.13 -2.65 -0.06 0.00 0.10 0.00 0.00 66.02 63.28 1jvt s SER 75 CO 0.02 -0.69 1.45 1.88 0.98 0.00 0.00 173.24 176.88 1jvt h TYR 76 N 3.10 0.95 -2.45 5.02 0.05 -1.95 -3.44 116.97 118.25 1jvt h TYR 76 Ca -0.49 -0.27 -0.45 0.00 0.05 0.00 0.00 58.73 57.56 1jvt h TYR 76 Cb 1.23 -0.20 0.02 0.00 1.01 0.00 0.00 36.73 38.79 1jvt h TYR 76 CO 0.55 1.05 -0.18 -1.12 -1.05 0.00 0.00 178.16 177.40 1jvt s SER 77 N -6.63 5.89 0.23 3.88 0.01 -1.26 -5.05 113.70 110.78 1jvt s SER 77 Ca -0.12 0.14 -0.13 0.00 1.31 0.00 0.00 55.95 57.15 1jvt s SER 77 Cb 0.10 -1.46 -0.08 0.00 0.21 0.00 0.00 66.02 64.79 1jvt s SER 77 CO 0.85 -0.60 0.62 0.42 0.41 0.00 0.00 173.24 174.93 1jvt s THR 78 N -2.42 4.81 0.24 1.44 -4.23 -1.26 -4.37 115.64 109.84 1jvt s THR 78 Ca 0.47 0.76 0.08 0.00 -1.18 0.00 0.00 61.69 61.82 1jvt s THR 78 Cb -0.10 -3.67 -0.05 0.00 1.34 0.00 0.00 72.50 70.02 1jvt s THR 78 CO 0.36 0.00 -0.11 -0.04 -0.54 0.00 0.00 174.62 174.28 1jvt s MET 79 N -2.57 1.44 -0.30 3.99 -1.94 0.13 -4.81 119.30 115.24 1jvt s MET 79 Ca 0.46 -1.68 -0.29 0.00 -1.71 0.00 0.00 55.69 52.47 1jvt s MET 79 Cb -0.12 -1.18 0.01 0.00 2.01 0.00 0.00 34.83 35.55 1jvt s MET 79 CO 0.20 0.14 1.11 0.45 -0.01 0.00 0.00 175.02 176.90 1jvt s SER 80 N -3.38 6.91 0.17 3.03 0.15 -1.26 -1.90 113.70 117.42 1jvt s SER 80 Ca 0.26 1.14 0.04 0.00 0.70 0.00 0.00 55.95 58.09 1jvt s SER 80 Cb 0.01 -2.54 -0.05 0.00 -1.71 0.00 0.00 66.02 61.73 1jvt s SER 80 CO 0.09 -0.88 -0.07 0.27 1.20 0.00 0.00 173.24 173.85 1jvt s ILE 81 N 3.70 1.11 -0.09 6.45 -4.36 0.02 -0.37 121.20 127.65 1jvt s ILE 81 Ca 0.47 -2.05 -0.01 0.00 -0.26 0.00 0.00 60.65 58.80 1jvt s ILE 81 Cb -0.14 -1.98 0.03 0.00 1.25 0.00 0.00 42.46 41.62 1jvt s ILE 81 CO 0.15 -0.63 -0.04 -0.89 0.24 0.00 0.00 174.94 173.78 1jvt s THR 82 N -3.37 0.69 -0.15 8.37 2.01 -0.43 -0.18 115.64 122.59 1jvt s THR 82 Ca 0.20 -0.08 -0.15 0.00 0.31 0.00 0.00 61.69 61.97 1jvt s THR 82 Cb 0.03 -0.78 -0.05 0.00 0.01 0.00 0.00 72.50 71.72 1jvt s THR 82 CO 0.03 0.31 0.34 -0.62 -0.69 0.00 0.00 174.62 173.99 1jvt s ASP 83 N 1.84 6.49 -0.16 3.53 -1.08 0.20 -0.83 116.67 126.66 1jvt s ASP 83 Ca 0.05 0.58 -0.01 0.00 -0.52 0.00 0.00 52.55 52.65 1jvt s ASP 83 Cb -0.12 -2.21 -0.01 0.00 -1.46 0.00 0.00 42.92 39.12 1jvt s ASP 83 CO -0.07 0.07 -0.12 0.00 0.52 0.00 0.00 175.17 175.57 1jvt s ARG 85 N 0.71 0.43 0.25 0.00 3.52 -1.01 -0.88 118.95 121.97 1jvt s ARG 85 Ca -0.06 -0.01 -0.31 0.00 -0.13 0.00 0.00 55.73 55.22 1jvt s ARG 85 Cb -0.15 -0.53 -0.11 0.00 -1.56 0.00 0.00 34.95 32.60 1jvt s ARG 85 CO 0.02 -0.07 1.60 -2.00 -0.81 0.00 0.00 175.30 174.03 1jvt s GLU 86 N 0.75 4.16 0.88 5.12 2.12 0.33 -0.69 118.70 131.37 1jvt s GLU 86 Ca -0.08 2.51 -0.11 0.00 0.36 0.00 0.00 54.97 57.65 1jvt s GLU 86 Cb -0.11 -3.07 0.12 0.00 0.26 0.00 0.00 34.13 31.33 1jvt s GLU 86 CO -0.01 -0.62 1.09 0.95 -0.54 0.00 0.00 175.26 176.13 1jvt s THR 87 N 0.42 2.73 0.28 -1.70 -4.23 -0.61 -4.86 115.64 107.67 1jvt s THR 87 Ca 0.66 0.24 0.28 0.00 -1.18 0.00 0.00 61.69 61.69 1jvt s THR 87 Cb -0.47 -2.70 0.29 0.00 1.34 0.00 0.00 72.50 70.96 1jvt s THR 87 CO 0.41 -0.31 1.98 1.23 -0.54 0.00 0.00 174.62 177.39 1jvt h GLY 88 N -1.51 0.00 0.69 3.99 0.00 -1.94 -3.05 103.07 101.24 1jvt h GLY 88 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.84 1jvt h GLY 88 CO 0.54 0.00 -1.02 -1.14 0.00 0.00 0.00 176.54 174.92 1jvt n SER 89 N -3.43 0.62 -4.70 0.19 3.41 -1.26 -4.97 113.62 103.47 1jvt n SER 89 Ca -0.01 -0.08 -0.44 0.00 -0.26 0.00 0.00 58.87 58.08 1jvt n SER 89 Cb 0.31 0.73 -0.03 0.00 -0.26 0.00 0.00 64.21 64.96 1jvt n SER 89 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1jvt n SER 90 N -2.09 3.62 -3.82 4.04 2.88 -1.16 -5.01 113.62 112.09 1jvt n SER 90 Ca 0.02 1.08 -0.18 0.00 -1.33 0.00 0.00 58.87 58.45 1jvt n SER 90 Cb 0.46 -1.52 -0.16 0.00 -0.75 0.00 0.00 64.21 62.24 1jvt n SER 90 CO 0.00 0.00 0.00 -0.75 -1.23 0.00 0.00 175.04 173.06 1jvt s LYS 91 N 0.89 0.40 0.34 -1.46 2.20 -0.97 -4.91 119.74 116.22 1jvt s LYS 91 Ca 0.75 0.06 -0.29 0.00 -0.36 0.00 0.00 55.97 56.14 1jvt s LYS 91 Cb -0.57 -0.58 -0.11 0.00 -1.51 0.00 0.00 37.83 35.06 1jvt s LYS 91 CO 0.36 -0.15 1.43 -0.47 -0.36 0.00 0.00 175.35 176.17 1jvt s TYR 92 N 1.13 2.80 -1.77 4.03 5.04 -1.26 0.16 117.35 127.49 1jvt s TYR 92 Ca -0.08 1.19 0.20 0.00 -2.44 0.00 0.00 57.07 55.94 1jvt s TYR 92 Cb -0.13 -3.89 1.12 0.00 0.35 0.00 0.00 41.96 39.40 1jvt s TYR 92 CO -0.02 -2.65 1.60 -0.35 -1.34 0.00 0.00 175.55 172.80 1jvt n PRO 93 N 0.97 0.49 -3.45 4.97 -0.04 -1.26 -4.98 135.00 131.69 1jvt n PRO 93 Ca 0.02 0.04 -0.41 0.00 -0.04 0.00 0.00 63.50 63.12 1jvt n PRO 93 Cb 0.40 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.33 1jvt n PRO 93 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1jvt n ASN 94 N -1.11 4.97 -4.70 3.54 4.13 0.43 -5.02 115.26 117.50 1jvt n ASN 94 Ca 0.13 -3.11 -0.42 0.00 1.68 0.00 0.00 54.58 52.86 1jvt n ASN 94 Cb 0.10 -1.22 -0.03 0.00 -1.54 0.00 0.00 39.78 37.10 1jvt n ASN 94 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1jvt s ALA 96 N 1.60 1.42 0.05 0.00 0.00 -1.26 -4.95 121.76 118.61 1jvt s ALA 96 Ca 0.56 -0.68 0.01 0.00 0.00 0.00 0.00 51.96 51.85 1jvt s ALA 96 Cb -0.25 -0.43 -0.03 0.00 0.00 0.00 0.00 23.12 22.41 1jvt s ALA 96 CO 0.25 0.30 -0.06 0.71 0.00 0.00 0.00 175.76 176.96 1jvt s TYR 97 N -0.14 0.61 -0.11 0.00 2.02 -1.26 -1.58 117.35 116.88 1jvt s TYR 97 Ca 0.01 -0.62 -0.11 0.00 -0.37 0.00 0.00 57.07 55.97 1jvt s TYR 97 Cb -0.09 -0.37 -0.05 0.00 -0.40 0.00 0.00 41.96 41.05 1jvt s TYR 97 CO 0.01 -0.14 0.25 -1.59 -1.57 0.00 0.00 175.55 172.51 1jvt s LYS 98 N -2.13 3.91 -0.28 -0.62 -2.85 0.13 -4.68 119.74 113.23 1jvt s LYS 98 Ca -0.06 0.06 -0.12 0.00 -1.00 0.00 0.00 55.97 54.86 1jvt s LYS 98 Cb -0.06 -3.30 -0.05 0.00 -2.06 0.00 0.00 37.83 32.36 1jvt s LYS 98 CO -0.02 0.52 0.22 0.99 0.10 0.00 0.00 175.35 177.17 1jvt s THR 99 N -0.38 5.29 -0.20 3.79 2.01 -1.26 -2.41 115.64 122.47 1jvt s THR 99 Ca 0.17 0.24 0.01 0.00 0.31 0.00 0.00 61.69 62.42 1jvt s THR 99 Cb -0.13 -3.56 0.04 0.00 0.01 0.00 0.00 72.50 68.86 1jvt s THR 99 CO 0.05 0.24 -0.13 -0.89 -0.69 0.00 0.00 174.62 173.21 1jvt s THR 100 N 1.78 1.83 0.07 -0.82 2.01 -0.36 -4.93 115.64 115.23 1jvt s THR 100 Ca 0.08 -1.10 -0.23 0.00 0.31 0.00 0.00 61.69 60.76 1jvt s THR 100 Cb -0.16 -1.85 -0.06 0.00 0.01 0.00 0.00 72.50 70.44 1jvt s THR 100 CO 0.11 0.22 0.68 -1.58 -0.69 0.00 0.00 174.62 173.36 1jvt s GLN 101 N 1.32 4.41 0.25 4.92 2.00 -1.26 0.59 119.66 131.89 1jvt s GLN 101 Ca -0.01 0.94 -0.16 0.00 -2.00 0.00 0.00 55.36 54.13 1jvt s GLN 101 Cb -0.16 -3.30 0.01 0.00 0.80 0.00 0.00 33.01 30.35 1jvt s GLN 101 CO -0.09 0.46 0.56 0.00 -0.50 0.00 0.00 175.29 175.73 1jvt s ALA 102 N -0.61 -0.63 -0.25 1.58 0.00 0.75 -4.96 121.76 117.64 1jvt s ALA 102 Ca 0.34 -0.64 0.01 0.00 0.00 0.00 0.00 51.96 51.67 1jvt s ALA 102 Cb -0.20 0.98 0.07 0.00 0.00 0.00 0.00 23.12 23.96 1jvt s ALA 102 CO 0.22 -0.91 -0.03 -0.80 0.00 0.00 0.00 175.76 174.23 1jvt s ASN 103 N -2.97 3.92 0.26 0.00 0.01 -1.26 -0.80 114.94 114.09 1jvt s ASN 103 Ca 0.18 -1.29 -0.06 0.00 -0.71 0.00 0.00 52.86 50.98 1jvt s ASN 103 Cb -0.03 -1.17 -0.02 0.00 0.41 0.00 0.00 41.25 40.45 1jvt s ASN 103 CO 0.07 -0.27 0.36 -0.54 -1.51 0.00 0.00 177.10 175.22 1jvt s LYS 104 N 1.39 1.52 0.30 -0.60 1.02 -0.80 -4.78 119.74 117.80 1jvt s LYS 104 Ca -0.03 -1.52 -0.23 0.00 0.02 0.00 0.00 55.97 54.22 1jvt s LYS 104 Cb -0.19 0.39 -0.09 0.00 -0.52 0.00 0.00 37.83 37.42 1jvt s LYS 104 CO -0.08 -0.60 0.86 -1.01 -0.92 0.00 0.00 175.35 173.60 1jvt s HIS 105 N -3.83 3.61 0.12 3.18 3.76 0.43 0.20 115.29 122.76 1jvt s HIS 105 Ca 0.30 1.60 0.08 0.00 -0.15 0.00 0.00 55.06 56.89 1jvt s HIS 105 Cb 0.02 -2.79 -0.04 0.00 1.11 0.00 0.00 32.58 30.88 1jvt s HIS 105 CO 0.13 0.21 -0.13 0.96 -0.85 0.00 0.00 174.74 175.06 1jvt s ILE 106 N -1.68 3.16 -0.12 0.60 -4.36 -1.26 0.04 121.20 117.58 1jvt s ILE 106 Ca 0.49 -1.40 0.03 0.00 -0.26 0.00 0.00 60.65 59.51 1jvt s ILE 106 Cb -0.16 -2.48 0.01 0.00 1.25 0.00 0.00 42.46 41.08 1jvt s ILE 106 CO 0.21 0.08 -0.21 -0.63 0.24 0.00 0.00 174.94 174.63 1jvt s ILE 107 N -1.24 1.94 0.08 8.37 1.09 0.14 -1.34 121.20 130.24 1jvt s ILE 107 Ca 0.20 -0.92 0.03 0.00 -1.10 0.00 0.00 60.65 58.86 1jvt s ILE 107 Cb -0.11 -1.71 -0.03 0.00 -1.06 0.00 0.00 42.46 39.55 1jvt s ILE 107 CO 0.13 0.53 -0.09 0.68 -0.10 0.00 0.00 174.94 176.09 1jvt s VAL 108 N 0.69 0.77 -0.14 2.92 -7.23 -0.53 -0.22 120.40 116.65 1jvt s VAL 108 Ca -0.11 -1.57 -0.14 0.00 -1.81 0.00 0.00 61.98 58.35 1jvt s VAL 108 Cb -0.16 -1.24 -0.05 0.00 0.56 0.00 0.00 36.38 35.49 1jvt s VAL 108 CO 0.02 -0.59 0.31 0.00 -0.31 0.00 0.00 175.10 174.53 1jvt s ALA 109 N -2.46 3.60 0.01 1.32 0.00 0.74 -0.72 121.76 124.24 1jvt s ALA 109 Ca 0.03 -0.42 0.03 0.00 0.00 0.00 0.00 51.96 51.60 1jvt s ALA 109 Cb -0.03 -2.40 -0.04 0.00 0.00 0.00 0.00 23.12 20.66 1jvt s ALA 109 CO -0.01 0.13 -0.04 0.00 0.00 0.00 0.00 175.76 175.84 1jvt s GLU 111 N -1.53 1.20 0.76 0.00 2.12 0.03 -4.89 118.70 116.39 1jvt s GLU 111 Ca 0.19 -0.29 0.00 0.00 0.36 0.00 0.00 54.97 55.23 1jvt s GLU 111 Cb -0.11 0.55 0.00 0.00 0.26 0.00 0.00 34.13 34.83 1jvt s GLU 111 CO 0.09 -0.49 0.00 0.41 -0.54 0.00 0.00 175.26 174.74 1jvt n GLY 112 N -0.01 -2.03 2.65 -1.50 0.00 -1.26 -2.66 105.19 100.38 1jvt n GLY 112 Ca -0.18 -1.57 -0.27 0.00 0.00 0.00 0.00 46.02 44.01 1jvt n GLY 112 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1jvt s ASN 113 N -3.95 2.65 0.51 1.61 3.04 -1.26 -1.80 114.94 115.74 1jvt s ASN 113 Ca 0.00 -0.75 -0.23 0.00 0.04 0.00 0.00 52.86 51.92 1jvt s ASN 113 Cb 0.00 -0.38 -0.06 0.00 -1.54 0.00 0.00 41.25 39.26 1jvt s ASN 113 CO 0.00 -0.34 1.40 -2.16 -3.04 0.00 0.00 177.10 172.95 1jvt s PRO 114 N 2.03 3.36 -0.79 0.43 0.04 -1.26 -5.08 135.00 133.73 1jvt s PRO 114 Ca 0.02 2.33 -0.25 0.00 0.04 0.00 0.00 61.00 63.13 1jvt s PRO 114 Cb -0.16 -2.43 -0.01 0.00 0.04 0.00 0.00 34.50 31.94 1jvt s PRO 114 CO -0.11 -1.05 1.70 -0.47 0.04 0.00 0.00 177.00 177.12 1jvt s TYR 115 N -1.25 1.97 0.33 0.56 5.04 -0.74 -4.86 117.35 118.39 1jvt s TYR 115 Ca 0.67 0.31 0.03 0.00 -2.44 0.00 0.00 57.07 55.64 1jvt s TYR 115 Cb -0.42 -4.28 -0.05 0.00 0.35 0.00 0.00 41.96 37.55 1jvt s TYR 115 CO 0.52 -2.04 0.08 0.14 -1.34 0.00 0.00 175.55 172.91 1jvt s VAL 116 N 8.03 0.98 0.22 3.14 -7.23 -1.09 -4.80 120.40 119.65 1jvt s VAL 116 Ca 0.58 -2.00 -0.31 0.00 -1.81 0.00 0.00 61.98 58.44 1jvt s VAL 116 Cb -0.08 -2.69 -0.11 0.00 0.56 0.00 0.00 36.38 34.06 1jvt s VAL 116 CO 0.08 0.00 1.59 -2.84 -0.31 0.00 0.00 175.10 173.62 1jvt s PRO 117 N -3.89 4.18 0.00 4.82 0.02 -1.26 -0.79 135.00 138.08 1jvt s PRO 117 Ca 0.34 2.45 0.00 0.00 0.02 0.00 0.00 61.00 63.82 1jvt s PRO 117 Cb 0.08 -3.10 0.00 0.00 0.02 0.00 0.00 34.50 31.49 1jvt s PRO 117 CO 0.15 -0.61 0.09 1.33 -0.33 0.00 0.00 177.00 177.62 1jvt n VAL 118 N 3.31 0.00 -3.69 3.83 0.24 0.15 -4.55 118.33 117.62 1jvt n VAL 118 Ca 0.12 -0.31 -0.11 0.00 -2.04 0.00 0.00 64.34 62.00 1jvt n VAL 118 Cb 0.38 1.10 -0.09 0.00 -1.47 0.00 0.00 33.84 33.75 1jvt n VAL 118 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1jvt s HIS 119 N -0.46 -0.68 -0.33 6.34 5.65 -1.02 -4.69 115.29 120.10 1jvt s HIS 119 Ca 0.00 1.49 -0.21 0.00 0.25 0.00 0.00 55.06 56.59 1jvt s HIS 119 Cb 0.00 0.32 -0.00 0.00 -1.18 0.00 0.00 32.58 31.71 1jvt s HIS 119 CO 0.00 -0.35 0.65 0.12 -0.65 0.00 0.00 174.74 174.51 1jvt s PHE 120 N 1.05 3.18 -0.17 3.88 2.19 -1.26 -0.19 117.98 126.66 1jvt s PHE 120 Ca -0.06 0.49 -0.16 0.00 0.33 0.00 0.00 56.93 57.52 1jvt s PHE 120 Cb -0.06 -3.10 -0.22 0.00 -1.31 0.00 0.00 43.02 38.33 1jvt s PHE 120 CO -0.10 -0.57 0.29 0.22 1.83 0.00 0.00 175.22 176.90 1jvt h ASP 121 N 8.33 0.17 0.00 6.13 3.58 -0.94 -3.48 116.42 130.22 1jvt h ASP 121 Ca -0.26 -0.69 0.00 0.00 0.42 0.00 0.00 57.03 56.50 1jvt h ASP 121 Cb 1.11 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 42.11 1jvt h ASP 121 CO 0.83 1.63 0.00 0.00 -2.88 0.00 0.00 179.24 178.82 1jvt n ALA 122 N -3.24 0.00 -2.70 -0.78 0.00 -1.08 -4.96 120.51 107.75 1jvt n ALA 122 Ca -0.32 0.00 -0.26 0.00 0.00 0.00 0.00 53.44 52.86 1jvt n ALA 122 Cb 0.82 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 20.20 1jvt n ALA 122 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1jvt s SER 123 N 0.00 4.96 0.00 0.00 1.04 -1.26 0.23 113.70 118.67 1jvt s SER 123 Ca 0.00 -0.33 0.00 0.00 0.48 0.00 0.00 55.95 56.10 1jvt s SER 123 Cb 0.00 -1.12 0.00 0.00 0.10 0.00 0.00 66.02 65.00 1jvt s SER 123 CO 0.00 0.08 0.06 0.52 0.98 0.00 0.00 173.24 174.88