#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vlp s GLU 2 N 0.00 2.73 -0.09 0.03 2.02 -1.26 -5.09 118.70 117.04 2vlp s GLU 2 Ca 0.00 -0.66 -0.29 0.00 0.02 0.00 0.00 54.97 54.04 2vlp s GLU 2 Cb 0.00 -2.48 -0.05 0.00 0.10 0.00 0.00 34.13 31.70 2vlp s GLU 2 CO 0.00 0.56 1.75 0.45 0.02 0.00 0.00 175.26 178.04 2vlp s SER 3 N -0.55 6.45 0.29 -0.19 0.15 -1.26 -4.90 113.70 113.69 2vlp s SER 3 Ca 0.08 2.14 0.03 0.00 0.70 0.00 0.00 55.95 58.89 2vlp s SER 3 Cb -0.12 -2.53 0.45 0.00 -1.71 0.00 0.00 66.02 62.11 2vlp s SER 3 CO 0.02 -1.12 1.75 0.11 1.20 0.00 0.00 173.24 175.20 2vlp h LYS 4 N 10.51 0.50 0.00 5.44 1.57 -1.98 -2.76 116.57 129.85 2vlp h LYS 4 Ca -0.40 -0.17 0.00 0.00 -1.87 0.00 0.00 60.65 58.21 2vlp h LYS 4 Cb 1.19 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.46 2vlp h LYS 4 CO 0.96 0.67 0.00 0.07 -0.57 0.00 0.00 179.45 180.58 2vlp h ARG 5 N 0.45 0.00 -0.24 3.15 0.11 -1.99 -1.85 114.38 114.02 2vlp h ARG 5 Ca 0.07 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.15 2vlp h ARG 5 Cb 0.59 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.67 2vlp h ARG 5 CO 0.04 0.00 0.00 0.09 0.10 0.00 0.00 179.97 180.20 2vlp n ASN 6 N -2.32 2.81 -4.61 0.08 3.02 -1.04 -0.43 115.26 112.76 2vlp n ASN 6 Ca 0.01 -1.89 -0.29 0.00 -0.03 0.00 0.00 54.58 52.37 2vlp n ASN 6 Cb 0.20 -0.15 -0.09 0.00 -0.61 0.00 0.00 39.78 39.13 2vlp n ASN 6 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2vlp s LYS 7 N -1.71 2.24 0.88 3.52 1.02 -0.70 -4.78 119.74 120.22 2vlp s LYS 7 Ca 0.35 -1.00 -0.12 0.00 0.02 0.00 0.00 55.97 55.22 2vlp s LYS 7 Cb 0.21 -2.36 0.11 0.00 -0.52 0.00 0.00 37.83 35.27 2vlp s LYS 7 CO 0.30 0.51 1.07 -2.30 -0.92 0.00 0.00 175.35 174.01 2vlp n PRO 8 N 0.58 -0.19 -3.89 -1.68 -0.02 -1.03 -4.24 135.00 124.53 2vlp n PRO 8 Ca -0.12 0.02 -0.02 0.00 -2.02 0.00 0.00 63.50 61.36 2vlp n PRO 8 Cb 0.53 -2.33 0.01 0.00 -0.02 0.00 0.00 33.50 31.69 2vlp n PRO 8 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 2vlp s GLY 9 N -2.35 0.02 -0.16 -1.23 0.00 -0.52 -4.95 107.32 98.13 2vlp s GLY 9 Ca 0.68 -0.19 -0.01 0.00 0.00 0.00 0.00 44.72 45.20 2vlp s GLY 9 CO 0.56 2.87 -0.11 1.25 0.00 0.00 0.00 173.10 177.67 2vlp s LYS 10 N -2.21 3.34 0.29 2.90 2.20 -1.26 -0.80 119.74 124.20 2vlp s LYS 10 Ca 0.23 -0.69 -0.29 0.00 -0.36 0.00 0.00 55.97 54.86 2vlp s LYS 10 Cb -0.02 -2.73 -0.10 0.00 -1.51 0.00 0.00 37.83 33.47 2vlp s LYS 10 CO 0.03 0.05 1.32 0.00 -0.36 0.00 0.00 175.35 176.39 2vlp s ALA 11 N 0.78 3.52 0.25 3.13 0.00 -0.05 -4.76 121.76 124.64 2vlp s ALA 11 Ca -0.04 1.22 0.01 0.00 0.00 0.00 0.00 51.96 53.15 2vlp s ALA 11 Cb -0.15 -3.48 -0.05 0.00 0.00 0.00 0.00 23.12 19.44 2vlp s ALA 11 CO 0.01 -0.61 0.11 0.95 0.00 0.00 0.00 175.76 176.22 2vlp s THR 12 N -0.70 0.44 0.00 0.00 -4.23 -0.18 -1.01 115.64 109.96 2vlp s THR 12 Ca 0.52 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 59.03 2vlp s THR 12 Cb -0.39 -2.60 0.00 0.00 1.34 0.00 0.00 72.50 70.85 2vlp s THR 12 CO 0.48 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.17 2vlp n GLY 13 N -0.45 1.05 0.05 3.99 0.00 -1.26 0.19 105.19 108.76 2vlp n GLY 13 Ca 0.00 -2.04 -0.03 0.00 0.00 0.00 0.00 46.02 43.95 2vlp n GLY 13 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2vlp n LYS 14 N 1.39 1.59 0.00 1.61 5.02 -1.26 -4.79 118.16 121.72 2vlp n LYS 14 Ca 0.00 -0.03 0.00 0.00 -2.02 0.00 0.00 58.31 56.26 2vlp n LYS 14 Cb 0.00 -1.33 0.00 0.00 -0.02 0.00 0.00 35.03 33.68 2vlp n LYS 14 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2vlp n GLY 15 N 2.11 -0.51 3.02 0.72 0.00 -1.26 -4.25 105.19 105.01 2vlp n GLY 15 Ca -0.17 -1.01 -0.09 0.00 0.00 0.00 0.00 46.02 44.76 2vlp n GLY 15 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2vlp s LYS 16 N 0.00 0.41 0.26 1.61 1.02 -0.52 -4.65 119.74 117.87 2vlp s LYS 16 Ca 0.00 -0.79 -0.31 0.00 0.02 0.00 0.00 55.97 54.89 2vlp s LYS 16 Cb 0.00 0.10 -0.13 0.00 -0.52 0.00 0.00 37.83 37.29 2vlp s LYS 16 CO 0.00 -0.06 1.50 -2.30 -0.92 0.00 0.00 175.35 173.57 2vlp n PRO 17 N 1.18 2.34 -4.22 -1.68 -0.02 -1.26 -0.75 135.00 130.58 2vlp n PRO 17 Ca -0.21 0.83 -0.13 0.00 -2.02 0.00 0.00 63.50 61.97 2vlp n PRO 17 Cb 0.57 -2.55 -0.10 0.00 -0.02 0.00 0.00 33.50 31.40 2vlp n PRO 17 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2vlp s VAL 18 N 0.02 0.66 0.43 -1.45 -7.23 -1.26 -4.91 120.40 106.66 2vlp s VAL 18 Ca 0.67 -1.97 0.03 0.00 -1.81 0.00 0.00 61.98 58.90 2vlp s VAL 18 Cb -0.58 -2.02 0.08 0.00 0.56 0.00 0.00 36.38 34.41 2vlp s VAL 18 CO 0.48 -0.56 0.59 0.61 -0.31 0.00 0.00 175.10 175.91 2vlp n GLY 19 N -0.19 1.28 0.00 2.32 0.00 -1.26 -4.96 105.19 102.37 2vlp n GLY 19 Ca -0.08 -2.09 0.12 0.00 0.00 0.00 0.00 46.02 43.97 2vlp n GLY 19 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2vlp n ASP 20 N -2.77 0.00 -1.72 1.61 3.85 -1.26 -1.86 116.55 114.40 2vlp n ASP 20 Ca 0.11 0.20 -0.04 0.00 -0.71 0.00 0.00 54.79 54.35 2vlp n ASP 20 Cb 0.38 -0.39 0.28 0.00 -1.35 0.00 0.00 41.12 40.04 2vlp n ASP 20 CO 0.00 0.00 0.00 2.29 -1.01 0.00 0.00 177.20 178.48 2vlp n LYS 21 N -1.39 3.28 -0.34 0.11 -0.00 -1.26 -4.34 118.16 114.22 2vlp n LYS 21 Ca 0.09 -3.07 0.26 0.00 -0.00 0.00 0.00 58.31 55.60 2vlp n LYS 21 Cb 0.24 -2.11 0.51 0.00 -0.00 0.00 0.00 35.03 33.68 2vlp n LYS 21 CO 0.00 0.00 0.00 2.35 0.00 0.00 0.00 177.40 179.75 2vlp h TRP 22 N 2.23 0.86 0.00 5.58 7.01 -1.74 -0.97 115.95 128.91 2vlp h TRP 22 Ca 0.24 0.04 -0.04 0.00 2.11 0.00 0.00 58.89 61.23 2vlp h TRP 22 Cb 2.14 -0.22 -0.01 0.00 -2.10 0.00 0.00 29.16 28.97 2vlp h TRP 22 CO 1.15 -0.21 -0.20 -0.07 -2.79 0.00 0.00 178.44 176.32 2vlp h LEU 23 N 0.26 0.00 -1.66 0.65 3.38 -1.87 -2.01 115.31 114.06 2vlp h LEU 23 Ca 0.75 0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.76 2vlp h LEU 23 Cb 1.85 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.57 2vlp h LEU 23 CO -0.59 0.20 0.28 0.44 0.09 0.00 0.00 178.44 178.86 2vlp h ASP 24 N 0.00 0.38 0.86 -0.43 5.19 -1.56 -2.32 116.42 118.54 2vlp h ASP 24 Ca -0.00 -0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.40 2vlp h ASP 24 Cb 0.87 -0.09 0.00 0.00 0.18 0.00 0.00 39.33 40.29 2vlp h ASP 24 CO 0.03 0.26 0.00 0.44 -3.12 0.00 0.00 179.24 176.85 2vlp h ASP 25 N 0.44 0.00 0.47 6.45 3.45 -1.43 -3.06 116.42 122.75 2vlp h ASP 25 Ca 0.17 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.63 2vlp h ASP 25 Cb 0.14 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 38.91 2vlp h ASP 25 CO -0.04 0.00 -0.01 0.00 -1.57 0.00 0.00 179.24 177.62 2vlp h ALA 26 N 2.01 1.01 -0.01 3.45 0.00 -1.47 -2.41 119.26 121.84 2vlp h ALA 26 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2vlp h ALA 26 Cb 0.43 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.22 2vlp h ALA 26 CO 0.00 0.01 -0.08 0.41 0.00 0.00 0.00 179.25 179.58 2vlp n GLY 27 N -0.56 -0.16 3.27 0.00 0.00 -1.15 -1.96 105.19 104.63 2vlp n GLY 27 Ca -0.01 -0.44 -0.15 0.00 0.00 0.00 0.00 46.02 45.42 2vlp n GLY 27 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2vlp s LYS 28 N -2.16 1.24 6.74 1.61 -2.85 -0.91 -4.75 119.74 118.66 2vlp s LYS 28 Ca 0.33 -1.63 0.00 0.00 -1.00 0.00 0.00 55.97 53.67 2vlp s LYS 28 Cb 0.20 -0.28 0.00 0.00 -2.06 0.00 0.00 37.83 35.69 2vlp s LYS 28 CO 0.39 -0.19 0.00 -0.25 0.10 0.00 0.00 175.35 175.40 2vlp n ASP 29 N -0.34 0.00 -1.27 0.03 8.00 -1.26 -1.38 116.55 120.34 2vlp n ASP 29 Ca -0.04 0.00 0.08 0.00 0.71 0.00 0.00 54.79 55.54 2vlp n ASP 29 Cb 0.64 0.00 0.30 0.00 -0.02 0.00 0.00 41.12 42.05 2vlp n ASP 29 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2vlp n SER 30 N 6.20 4.42 0.00 -2.24 7.64 -1.26 -5.00 113.62 123.37 2vlp n SER 30 Ca 0.00 -2.71 0.00 0.00 1.01 0.00 0.00 58.87 57.17 2vlp n SER 30 Cb 0.00 -0.54 0.00 0.00 -1.01 0.00 0.00 64.21 62.66 2vlp n SER 30 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2vlp n GLY 31 N 0.31 -0.53 3.85 0.23 0.00 -0.48 -4.73 105.19 103.84 2vlp n GLY 31 Ca 0.23 -1.78 -0.34 0.00 0.00 0.00 0.00 46.02 44.13 2vlp n GLY 31 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vlp s ALA 32 N -1.13 3.46 0.87 4.61 0.00 0.59 -4.76 121.76 125.39 2vlp s ALA 32 Ca 0.00 -0.06 -0.12 0.00 0.00 0.00 0.00 51.96 51.78 2vlp s ALA 32 Cb 0.00 -2.64 0.11 0.00 0.00 0.00 0.00 23.12 20.60 2vlp s ALA 32 CO 0.00 0.41 1.15 -1.25 0.00 0.00 0.00 175.76 176.06 2vlp s PRO 33 N -2.52 1.49 0.11 0.00 0.04 -1.26 0.45 135.00 133.30 2vlp s PRO 33 Ca 0.47 0.26 -0.31 0.00 0.04 0.00 0.00 61.00 61.46 2vlp s PRO 33 Cb -0.13 -1.88 -0.08 0.00 0.04 0.00 0.00 34.50 32.45 2vlp s PRO 33 CO 0.19 -1.95 1.43 0.42 0.04 0.00 0.00 177.00 177.13 2vlp s ILE 34 N -3.36 3.24 0.28 0.56 -1.09 -1.25 -4.68 121.20 114.89 2vlp s ILE 34 Ca 0.63 0.86 -0.30 0.00 -2.23 0.00 0.00 60.65 59.61 2vlp s ILE 34 Cb -0.14 -3.55 -0.12 0.00 -1.58 0.00 0.00 42.46 37.07 2vlp s ILE 34 CO 0.52 0.06 1.54 -2.65 -1.23 0.00 0.00 174.94 173.18 2vlp n PRO 35 N 4.18 2.52 -0.24 2.79 -0.02 -1.26 -1.43 135.00 141.53 2vlp n PRO 35 Ca 0.12 0.90 0.14 0.00 -2.02 0.00 0.00 63.50 62.64 2vlp n PRO 35 Cb 0.42 -2.64 0.43 0.00 -0.02 0.00 0.00 33.50 31.69 2vlp n PRO 35 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 2vlp h ASP 36 N 4.61 0.55 0.19 2.55 3.04 -1.12 -0.60 116.42 125.65 2vlp h ASP 36 Ca -0.46 0.04 -0.14 0.00 -3.24 0.00 0.00 57.03 53.22 2vlp h ASP 36 Cb 1.24 -0.07 -0.01 0.00 -1.04 0.00 0.00 39.33 39.45 2vlp h ASP 36 CO 0.78 0.26 -0.54 0.03 -2.04 0.00 0.00 179.24 177.74 2vlp h ARG 37 N 0.57 0.37 0.03 4.15 3.08 -1.86 0.12 114.38 120.84 2vlp h ARG 37 Ca 0.44 -0.23 -0.00 0.00 0.07 0.00 0.00 59.98 60.26 2vlp h ARG 37 Cb 0.86 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.93 2vlp h ARG 37 CO -0.19 0.82 -0.01 0.82 -1.07 0.00 0.00 179.97 180.34 2vlp h ILE 38 N 0.29 1.02 -0.83 2.04 1.08 -1.54 -2.37 117.51 117.20 2vlp h ILE 38 Ca 0.01 -0.14 0.12 0.00 -0.39 0.00 0.00 64.86 64.46 2vlp h ILE 38 Cb 1.04 1.11 -0.08 0.00 -3.07 0.00 0.00 36.82 35.82 2vlp h ILE 38 CO 0.09 0.04 0.45 0.00 -0.69 0.00 0.00 178.15 178.04 2vlp h ALA 39 N 0.87 1.22 -0.82 1.87 0.00 -0.84 -0.48 119.26 121.07 2vlp h ALA 39 Ca -0.00 0.06 0.01 0.00 0.00 0.00 0.00 54.91 54.97 2vlp h ALA 39 Cb 0.09 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 2vlp h ALA 39 CO 0.01 0.01 0.54 -0.44 0.00 0.00 0.00 179.25 179.37 2vlp h ASP 40 N 0.71 0.95 0.60 0.00 3.32 -0.65 0.29 116.42 121.64 2vlp h ASP 40 Ca 0.43 -0.03 -0.20 0.00 0.02 0.00 0.00 57.03 57.25 2vlp h ASP 40 Cb 0.50 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.80 2vlp h ASP 40 CO -0.30 0.69 -0.89 0.11 -1.72 0.00 0.00 179.24 177.13 2vlp h LYS 41 N 1.12 0.19 0.00 3.56 1.79 -0.64 -3.35 116.57 119.24 2vlp h LYS 41 Ca 0.30 -0.22 -0.12 0.00 -2.18 0.00 0.00 60.65 58.43 2vlp h LYS 41 Cb -0.12 0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 30.57 2vlp h LYS 41 CO -0.06 0.96 -1.82 1.28 -1.08 0.00 0.00 179.45 178.73 2vlp n LEU 42 N -3.64 0.31 -4.68 2.94 4.77 -0.33 -4.93 117.00 111.44 2vlp n LEU 42 Ca -0.04 0.13 -0.44 0.00 -0.03 0.00 0.00 56.01 55.64 2vlp n LEU 42 Cb 0.82 0.12 -0.02 0.00 -2.33 0.00 0.00 43.42 42.01 2vlp n LEU 42 CO 0.48 0.12 1.00 -1.14 -1.33 0.00 0.00 177.39 176.52 2vlp n ARG 43 N -2.57 2.12 -0.83 3.23 0.63 0.98 -1.66 116.66 118.55 2vlp n ARG 43 Ca -0.11 0.75 0.00 0.00 -0.92 0.00 0.00 57.85 57.57 2vlp n ARG 43 Cb 0.76 -2.40 0.00 0.00 0.45 0.00 0.00 32.46 31.28 2vlp n ARG 43 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2vlp n ASP 44 N 1.77 0.00 -4.86 6.15 8.00 -0.18 -4.98 116.55 122.46 2vlp n ASP 44 Ca 0.09 0.00 -0.32 0.00 0.71 0.00 0.00 54.79 55.27 2vlp n ASP 44 Cb 0.33 -0.47 -0.06 0.00 -0.02 0.00 0.00 41.12 40.90 2vlp n ASP 44 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2vlp s LYS 45 N -0.18 3.94 -0.08 -1.24 1.02 -0.67 -4.79 119.74 117.75 2vlp s LYS 45 Ca 0.00 0.56 -0.07 0.00 0.02 0.00 0.00 55.97 56.47 2vlp s LYS 45 Cb 0.00 -2.49 -0.04 0.00 -0.52 0.00 0.00 37.83 34.78 2vlp s LYS 45 CO 0.00 0.19 0.19 -2.00 -0.92 0.00 0.00 175.35 172.81 2vlp s GLU 46 N -2.97 3.51 0.11 1.68 2.12 -1.26 -0.87 118.70 121.02 2vlp s GLU 46 Ca 0.52 -0.09 0.07 0.00 0.36 0.00 0.00 54.97 55.83 2vlp s GLU 46 Cb -0.10 -3.17 -0.04 0.00 0.26 0.00 0.00 34.13 31.08 2vlp s GLU 46 CO 0.19 0.74 -0.16 -0.06 -0.54 0.00 0.00 175.26 175.43 2vlp s PHE 47 N -1.11 1.50 -0.22 5.30 0.40 0.02 -4.97 117.98 118.91 2vlp s PHE 47 Ca 0.19 -0.50 0.19 0.00 -0.60 0.00 0.00 56.93 56.21 2vlp s PHE 47 Cb -0.13 -0.80 0.27 0.00 0.51 0.00 0.00 43.02 42.87 2vlp s PHE 47 CO 0.08 0.17 1.55 0.87 0.70 0.00 0.00 175.22 178.59 2vlp h LYS 48 N 3.75 0.00 -1.96 0.44 1.79 -1.89 -1.39 116.57 117.31 2vlp h LYS 48 Ca -0.42 0.00 0.22 0.00 -2.18 0.00 0.00 60.65 58.27 2vlp h LYS 48 Cb 1.19 0.00 -0.12 0.00 -1.58 0.00 0.00 32.23 31.72 2vlp h LYS 48 CO 0.46 0.30 0.63 -1.54 -1.08 0.00 0.00 179.45 178.22 2vlp s SER 49 N -6.33 -0.17 0.33 0.86 1.04 -1.26 -2.45 113.70 105.71 2vlp s SER 49 Ca 0.05 -0.20 0.01 0.00 0.48 0.00 0.00 55.95 56.29 2vlp s SER 49 Cb 0.07 0.33 0.57 0.00 0.10 0.00 0.00 66.02 67.09 2vlp s SER 49 CO 0.71 -0.59 1.98 0.15 0.98 0.00 0.00 173.24 176.46 2vlp h PHE 50 N 2.00 0.91 -0.80 5.02 3.57 -1.00 -1.23 116.94 125.40 2vlp h PHE 50 Ca -0.24 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.26 2vlp h PHE 50 Cb 1.22 -0.30 -0.04 0.00 2.79 0.00 0.00 35.95 39.61 2vlp h PHE 50 CO 0.33 0.55 0.40 -0.44 -2.23 0.00 0.00 178.31 176.92 2vlp h ASP 51 N 0.96 1.03 -0.29 0.41 3.45 -1.96 0.02 116.42 120.04 2vlp h ASP 51 Ca 0.29 -0.11 -0.03 0.00 0.43 0.00 0.00 57.03 57.61 2vlp h ASP 51 Cb -0.03 -0.26 -0.01 0.00 -0.56 0.00 0.00 39.33 38.47 2vlp h ASP 51 CO -0.07 0.86 0.07 -0.78 -1.57 0.00 0.00 179.24 177.75 2vlp h ASP 52 N 1.14 0.43 -0.50 6.45 3.58 -1.77 -2.00 116.42 123.76 2vlp h ASP 52 Ca 0.28 -0.23 0.08 0.00 0.42 0.00 0.00 57.03 57.58 2vlp h ASP 52 Cb 0.09 -0.11 -0.06 0.00 1.72 0.00 0.00 39.33 40.96 2vlp h ASP 52 CO -0.04 0.55 0.13 0.15 -2.88 0.00 0.00 179.24 177.15 2vlp h PHE 53 N 0.30 0.22 -0.59 0.28 3.57 -0.84 -2.30 116.94 117.58 2vlp h PHE 53 Ca 0.09 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.56 2vlp h PHE 53 Cb 0.28 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 38.97 2vlp h PHE 53 CO 0.01 0.03 0.14 0.00 -2.23 0.00 0.00 178.31 176.26 2vlp h ALA 54 N 1.37 0.78 -0.40 2.41 0.00 -0.70 -0.20 119.26 122.52 2vlp h ALA 54 Ca 0.25 -0.23 0.07 0.00 0.00 0.00 0.00 54.91 55.00 2vlp h ALA 54 Cb 0.31 -0.23 -0.06 0.00 0.00 0.00 0.00 17.79 17.81 2vlp h ALA 54 CO -0.29 0.50 0.00 -0.22 0.00 0.00 0.00 179.25 179.24 2vlp h LYS 55 N 0.87 0.10 -0.87 0.00 3.64 -1.24 -1.59 116.57 117.49 2vlp h LYS 55 Ca 0.19 -0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.62 2vlp h LYS 55 Cb 0.36 -0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 32.10 2vlp h LYS 55 CO 0.00 0.07 0.54 0.00 -2.27 0.00 0.00 179.45 177.79 2vlp h ALA 56 N 1.35 1.19 -0.03 5.00 0.00 -0.83 -0.40 119.26 125.55 2vlp h ALA 56 Ca 0.20 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.12 2vlp h ALA 56 Cb 0.28 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2vlp h ALA 56 CO -0.33 0.29 -0.10 0.28 0.00 0.00 0.00 179.25 179.39 2vlp h VAL 57 N 0.99 0.74 -0.12 0.00 2.07 -0.32 -0.86 116.25 118.75 2vlp h VAL 57 Ca 0.38 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 67.81 2vlp h VAL 57 Cb 0.17 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 30.67 2vlp h VAL 57 CO -0.17 0.00 -0.33 -0.50 0.02 0.00 0.00 177.57 176.59 2vlp h TRP 58 N -0.16 0.27 -0.62 1.57 4.06 -0.89 -1.05 115.95 119.13 2vlp h TRP 58 Ca 0.05 -0.06 -0.03 0.00 2.06 0.00 0.00 58.89 60.91 2vlp h TRP 58 Cb 0.22 -0.07 -0.03 0.00 -1.00 0.00 0.00 29.16 28.29 2vlp h TRP 58 CO -0.17 0.54 0.28 0.93 -3.56 0.00 0.00 178.44 176.46 2vlp h GLU 59 N 0.21 0.90 -0.16 0.49 5.08 -0.84 -1.67 114.58 118.59 2vlp h GLU 59 Ca 0.03 -0.14 -0.11 0.00 -1.00 0.00 0.00 59.36 58.13 2vlp h GLU 59 Cb 0.68 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 2vlp h GLU 59 CO 0.05 0.74 -0.39 0.93 -1.00 0.00 0.00 179.01 179.34 2vlp h GLU 60 N 0.86 0.35 -0.19 2.33 4.39 -0.57 -2.21 114.58 119.54 2vlp h GLU 60 Ca 0.21 -0.17 -0.01 0.00 0.34 0.00 0.00 59.36 59.74 2vlp h GLU 60 Cb 0.14 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.78 2vlp h GLU 60 CO -0.02 0.69 0.10 0.28 -1.16 0.00 0.00 179.01 178.89 2vlp h VAL 61 N 0.30 1.12 0.00 3.13 2.07 -0.85 -1.98 116.25 120.04 2vlp h VAL 61 Ca 0.03 -0.34 -0.04 0.00 0.82 0.00 0.00 66.70 67.17 2vlp h VAL 61 Cb 0.82 1.00 -0.01 0.00 -1.52 0.00 0.00 31.29 31.58 2vlp h VAL 61 CO 0.07 0.11 -0.20 0.77 0.02 0.00 0.00 177.57 178.34 2vlp h SER 62 N 0.19 0.00 1.08 0.57 4.64 -0.99 -2.17 113.55 116.87 2vlp h SER 62 Ca 0.07 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 2vlp h SER 62 Cb 0.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.19 2vlp h SER 62 CO -0.01 0.20 -0.30 0.29 -0.87 0.00 0.00 176.83 176.15 2vlp n LYS 63 N -3.96 0.22 -3.34 4.77 5.02 -0.86 -4.72 118.16 115.28 2vlp n LYS 63 Ca -0.02 0.12 -0.43 0.00 -2.02 0.00 0.00 58.31 55.96 2vlp n LYS 63 Cb 0.29 -1.69 -0.09 0.00 -0.02 0.00 0.00 35.03 33.52 2vlp n LYS 63 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2vlp s ASP 64 N -4.07 6.19 0.36 4.39 2.15 -0.77 -4.95 116.67 119.96 2vlp s ASP 64 Ca 0.09 -0.67 0.06 0.00 0.43 0.00 0.00 52.55 52.46 2vlp s ASP 64 Cb 0.14 -2.22 0.74 0.00 -0.30 0.00 0.00 42.92 41.29 2vlp s ASP 64 CO 0.65 -0.55 1.97 -0.65 -0.17 0.00 0.00 175.17 176.42 2vlp h PRO 65 N 8.70 0.73 -0.33 4.34 0.11 -1.84 -1.70 132.00 141.99 2vlp h PRO 65 Ca -0.27 -0.04 -0.17 0.00 0.11 0.00 0.00 66.00 65.63 2vlp h PRO 65 Cb 1.11 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 32.06 2vlp h PRO 65 CO 0.78 0.48 -0.45 0.93 -0.21 0.00 0.00 178.00 179.53 2vlp h GLU 66 N 0.75 0.87 0.00 1.05 3.07 -1.92 -2.21 114.58 116.19 2vlp h GLU 66 Ca 0.30 -0.49 0.00 0.00 -0.50 0.00 0.00 59.36 58.66 2vlp h GLU 66 Cb 0.21 0.03 0.00 0.00 -0.84 0.00 0.00 28.75 28.16 2vlp h GLU 66 CO -0.09 1.14 -0.12 -0.07 -1.40 0.00 0.00 179.01 178.46 2vlp h LEU 67 N 0.70 0.00 0.00 1.33 3.38 -1.67 -3.25 115.31 115.80 2vlp h LEU 67 Ca 0.04 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.00 2vlp h LEU 67 Cb 1.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.79 2vlp h LEU 67 CO 0.10 0.00 -0.90 -1.54 0.09 0.00 0.00 178.44 176.20 2vlp n SER 68 N -2.85 0.87 0.20 -0.43 3.41 -0.70 -4.58 113.62 109.54 2vlp n SER 68 Ca 0.04 -0.91 0.04 0.00 -0.26 0.00 0.00 58.87 57.78 2vlp n SER 68 Cb 0.51 1.02 0.47 0.00 -0.26 0.00 0.00 64.21 65.95 2vlp n SER 68 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 175.04 174.95 2vlp h LYS 69 N 0.00 0.04 0.00 4.33 2.10 -1.43 -1.75 116.57 119.85 2vlp h LYS 69 Ca 0.00 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 2vlp h LYS 69 Cb 0.45 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 31.77 2vlp h LYS 69 CO 0.00 0.24 0.00 -1.71 -2.00 0.00 0.00 179.45 175.98 2vlp n ASN 70 N -4.29 0.70 -4.74 7.07 5.15 -1.26 -4.81 115.26 113.08 2vlp n ASN 70 Ca -0.02 0.59 -0.41 0.00 -0.60 0.00 0.00 54.58 54.14 2vlp n ASN 70 Cb 0.27 -0.77 -0.03 0.00 -0.53 0.00 0.00 39.78 38.71 2vlp n ASN 70 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2vlp s LEU 71 N -4.38 4.44 0.96 1.20 1.02 -0.66 -5.03 118.68 116.23 2vlp s LEU 71 Ca 0.09 2.35 -0.13 0.00 0.02 0.00 0.00 54.13 56.46 2vlp s LEU 71 Cb 0.12 -3.61 0.17 0.00 0.02 0.00 0.00 46.19 42.88 2vlp s LEU 71 CO 0.53 -0.44 1.13 0.54 0.02 0.00 0.00 176.35 178.13 2vlp s ASN 72 N 0.12 3.01 0.24 2.29 4.22 -1.26 -4.67 114.94 118.88 2vlp s ASN 72 Ca 0.54 0.98 -0.05 0.00 -2.14 0.00 0.00 52.86 52.19 2vlp s ASN 72 Cb -0.35 -1.54 0.39 0.00 1.28 0.00 0.00 41.25 41.03 2vlp s ASN 72 CO 0.39 -2.87 1.79 -0.65 -2.04 0.00 0.00 177.10 173.72 2vlp h PRO 73 N -1.71 0.68 -0.62 3.55 0.11 -1.98 0.88 132.00 132.92 2vlp h PRO 73 Ca -0.51 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.49 2vlp h PRO 73 Cb 1.33 -0.15 -0.03 0.00 0.11 0.00 0.00 31.00 32.26 2vlp h PRO 73 CO 0.58 0.45 0.15 0.77 -0.21 0.00 0.00 178.00 179.74 2vlp h SER 74 N 0.70 0.94 -0.33 -2.05 0.02 -2.00 -1.58 113.55 109.25 2vlp h SER 74 Ca 0.39 -0.23 -0.08 0.00 -0.84 0.00 0.00 61.79 61.02 2vlp h SER 74 Cb 0.40 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.68 2vlp h SER 74 CO -0.27 0.93 -0.08 0.78 -1.14 0.00 0.00 176.83 177.04 2vlp h ASN 75 N 0.90 0.72 -0.71 3.07 2.35 -1.81 -2.21 115.58 117.90 2vlp h ASN 75 Ca 0.19 -0.20 0.05 0.00 -0.55 0.00 0.00 56.30 55.79 2vlp h ASN 75 Cb 0.35 -0.19 -0.05 0.00 0.05 0.00 0.00 38.32 38.48 2vlp h ASN 75 CO 0.00 0.84 0.42 0.11 -1.65 0.00 0.00 177.43 177.16 2vlp h LYS 76 N 0.68 0.78 -0.80 0.81 1.57 -0.58 -1.32 116.57 117.70 2vlp h LYS 76 Ca 0.12 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.81 2vlp h LYS 76 Cb 0.54 -0.18 -0.04 0.00 0.08 0.00 0.00 32.23 32.64 2vlp h LYS 76 CO 0.03 0.51 0.32 0.77 -0.57 0.00 0.00 179.45 180.52 2vlp h SER 77 N 0.80 1.09 0.21 0.86 0.02 -0.89 -1.84 113.55 113.81 2vlp h SER 77 Ca 0.30 -0.16 -0.01 0.00 -0.84 0.00 0.00 61.79 61.08 2vlp h SER 77 Cb 0.11 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.37 2vlp h SER 77 CO -0.15 0.96 -0.10 -1.28 -1.14 0.00 0.00 176.83 175.12 2vlp h SER 78 N 1.16 -0.24 0.22 3.07 0.87 -1.00 -2.90 113.55 114.73 2vlp h SER 78 Ca 0.27 -0.01 -0.04 0.00 -1.23 0.00 0.00 61.79 60.77 2vlp h SER 78 Cb 0.20 0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.22 2vlp h SER 78 CO -0.02 -0.15 -0.20 -0.37 -0.53 0.00 0.00 176.83 175.56 2vlp h VAL 79 N -0.31 1.08 0.00 2.23 -1.51 -1.12 -1.59 116.25 115.02 2vlp h VAL 79 Ca -0.03 -0.69 -0.01 0.00 -1.23 0.00 0.00 66.70 64.73 2vlp h VAL 79 Cb 0.24 1.38 -0.00 0.00 -2.13 0.00 0.00 31.29 30.78 2vlp h VAL 79 CO 0.05 0.19 -0.07 0.77 -1.23 0.00 0.00 177.57 177.28 2vlp h SER 80 N 0.00 0.00 -0.04 4.19 4.64 -1.13 0.11 113.55 121.32 2vlp h SER 80 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2vlp h SER 80 Cb 0.36 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 2vlp h SER 80 CO 0.03 0.07 0.00 0.29 -0.87 0.00 0.00 176.83 176.34 2vlp n LYS 81 N -3.83 1.46 -0.92 4.77 5.02 -0.65 -4.92 118.16 119.09 2vlp n LYS 81 Ca -0.02 -0.67 0.00 0.00 -2.02 0.00 0.00 58.31 55.60 2vlp n LYS 81 Cb 0.16 -1.46 0.00 0.00 -0.02 0.00 0.00 35.03 33.72 2vlp n LYS 81 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2vlp n GLY 82 N 1.09 0.51 3.89 0.72 0.00 0.37 -4.99 105.19 106.78 2vlp n GLY 82 Ca 0.19 -0.29 -0.29 0.00 0.00 0.00 0.00 46.02 45.63 2vlp n GLY 82 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2vlp s TYR 83 N -2.00 3.49 0.31 1.61 2.02 -0.93 -4.39 117.35 117.46 2vlp s TYR 83 Ca 0.00 0.95 -0.29 0.00 -0.37 0.00 0.00 57.07 57.36 2vlp s TYR 83 Cb 0.00 -2.37 -0.10 0.00 -0.40 0.00 0.00 41.96 39.09 2vlp s TYR 83 CO 0.00 -0.11 1.15 0.45 -1.57 0.00 0.00 175.55 175.47 2vlp s SER 84 N -3.37 7.08 0.66 2.29 0.15 -1.26 -3.60 113.70 115.66 2vlp s SER 84 Ca 0.49 2.36 -0.15 0.00 0.70 0.00 0.00 55.95 59.35 2vlp s SER 84 Cb -0.10 -2.63 0.00 0.00 -1.71 0.00 0.00 66.02 61.58 2vlp s SER 84 CO 0.34 -0.29 1.14 -2.16 1.20 0.00 0.00 173.24 173.47 2vlp s PRO 85 N -1.64 2.69 0.21 5.44 0.05 -1.26 -4.72 135.00 135.77 2vlp s PRO 85 Ca 0.47 1.51 -0.30 0.00 0.05 0.00 0.00 61.00 62.73 2vlp s PRO 85 Cb -0.33 -1.93 -0.08 0.00 0.05 0.00 0.00 34.50 32.21 2vlp s PRO 85 CO 0.43 -1.36 1.17 -0.06 0.05 0.00 0.00 177.00 177.23 2vlp s PHE 86 N -2.19 3.46 0.70 0.56 0.40 -1.26 -1.87 117.98 117.78 2vlp s PHE 86 Ca 0.69 1.51 -0.08 0.00 -0.60 0.00 0.00 56.93 58.45 2vlp s PHE 86 Cb -0.23 -3.39 0.05 0.00 0.51 0.00 0.00 43.02 39.96 2vlp s PHE 86 CO 0.41 -1.02 1.02 0.95 0.70 0.00 0.00 175.22 177.28 2vlp s THR 87 N -0.38 2.57 0.47 0.64 -4.23 -0.01 -4.87 115.64 109.83 2vlp s THR 87 Ca 0.50 -0.13 -0.22 0.00 -1.18 0.00 0.00 61.69 60.66 2vlp s THR 87 Cb -0.32 -3.11 -0.09 0.00 1.34 0.00 0.00 72.50 70.31 2vlp s THR 87 CO 0.38 -0.13 0.91 -2.65 -0.54 0.00 0.00 174.62 172.59 2vlp n PRO 88 N -2.92 1.10 -0.29 3.99 -0.02 -1.26 -4.87 135.00 130.72 2vlp n PRO 88 Ca 0.07 0.40 0.11 0.00 -2.02 0.00 0.00 63.50 62.07 2vlp n PRO 88 Cb 0.60 -1.98 0.28 0.00 -0.02 0.00 0.00 33.50 32.37 2vlp n PRO 88 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2vlp h LYS 89 N 1.13 0.35 0.00 -0.52 3.64 -1.95 0.66 116.57 119.88 2vlp h LYS 89 Ca -0.45 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 58.91 2vlp h LYS 89 Cb 1.35 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 33.10 2vlp h LYS 89 CO 0.54 0.23 0.00 0.27 -2.27 0.00 0.00 179.45 178.22 2vlp n ASN 90 N -5.08 0.00 -0.56 4.20 0.23 -1.26 -1.67 115.26 111.12 2vlp n ASN 90 Ca 0.20 -0.03 0.07 0.00 -0.53 0.00 0.00 54.58 54.29 2vlp n ASN 90 Cb 0.61 -0.19 0.06 0.00 -2.08 0.00 0.00 39.78 38.18 2vlp n ASN 90 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2vlp n GLN 91 N -1.19 0.96 -2.51 -3.83 1.13 0.22 -4.95 117.38 107.21 2vlp n GLN 91 Ca 0.06 -1.34 -0.29 0.00 -1.94 0.00 0.00 57.00 53.48 2vlp n GLN 91 Cb 0.07 -1.27 -0.01 0.00 0.11 0.00 0.00 30.24 29.14 2vlp n GLN 91 CO 0.00 0.00 0.00 -0.65 -1.44 0.00 0.00 177.06 174.97 2vlp s GLN 92 N -1.16 3.66 -0.19 -1.09 -0.21 -0.67 -0.96 119.66 119.05 2vlp s GLN 92 Ca 0.16 0.47 -0.03 0.00 0.02 0.00 0.00 55.36 55.98 2vlp s GLN 92 Cb 0.12 -2.29 0.06 0.00 1.00 0.00 0.00 33.01 31.89 2vlp s GLN 92 CO 0.17 -0.24 0.05 0.08 -2.12 0.00 0.00 175.29 173.23 2vlp s VAL 93 N -2.72 0.41 0.00 1.09 1.01 -0.24 -4.61 120.40 115.34 2vlp s VAL 93 Ca 0.51 -0.49 0.00 0.00 0.00 0.00 0.00 61.98 62.00 2vlp s VAL 93 Cb -0.10 -0.95 0.00 0.00 0.00 0.00 0.00 36.38 35.33 2vlp s VAL 93 CO 0.42 -0.22 0.00 0.61 0.00 0.00 0.00 175.10 175.90 2vlp n GLY 94 N 5.09 3.10 0.19 4.51 0.00 -1.26 -0.24 105.19 116.59 2vlp n GLY 94 Ca -0.09 0.24 0.12 0.00 0.00 0.00 0.00 46.02 46.29 2vlp n GLY 94 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vlp n GLY 95 N 0.00 -0.57 3.39 -0.02 0.00 -1.26 -4.64 105.19 102.08 2vlp n GLY 95 Ca 0.00 -0.26 -0.44 0.00 0.00 0.00 0.00 46.02 45.32 2vlp n GLY 95 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2vlp s ARG 96 N -1.96 3.05 0.00 1.61 0.52 0.67 -4.85 118.95 117.99 2vlp s ARG 96 Ca 0.37 -1.23 0.00 0.00 -0.52 0.00 0.00 55.73 54.34 2vlp s ARG 96 Cb 0.18 -4.19 0.00 0.00 0.52 0.00 0.00 34.95 31.46 2vlp s ARG 96 CO 0.29 -1.30 0.30 1.63 0.02 0.00 0.00 175.30 176.24 2vlp n LYS 97 N 5.90 0.59 -4.35 3.54 5.02 -1.26 -1.08 118.16 126.52 2vlp n LYS 97 Ca -0.10 -0.30 -0.23 0.00 -2.02 0.00 0.00 58.31 55.66 2vlp n LYS 97 Cb 0.43 -0.77 -0.08 0.00 -0.02 0.00 0.00 35.03 34.59 2vlp n LYS 97 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 2vlp s VAL 98 N -0.17 3.10 0.51 -0.18 -7.23 -1.26 -0.83 120.40 114.33 2vlp s VAL 98 Ca 0.00 -2.06 -0.23 0.00 -1.81 0.00 0.00 61.98 57.88 2vlp s VAL 98 Cb 0.00 -2.68 -0.06 0.00 0.56 0.00 0.00 36.38 34.20 2vlp s VAL 98 CO 0.00 -0.37 1.38 -0.31 -0.31 0.00 0.00 175.10 175.49 2vlp s TYR 99 N -2.39 2.36 0.04 2.82 1.51 -0.78 -4.33 117.35 116.58 2vlp s TYR 99 Ca 0.31 1.34 0.06 0.00 -1.01 0.00 0.00 57.07 57.77 2vlp s TYR 99 Cb -0.05 -3.84 -0.03 0.00 -0.11 0.00 0.00 41.96 37.93 2vlp s TYR 99 CO 0.18 -2.88 -0.16 -1.21 -1.11 0.00 0.00 175.55 170.37 2vlp s GLU 100 N -2.73 2.14 -0.24 -0.62 2.02 0.48 -4.83 118.70 114.93 2vlp s GLU 100 Ca 0.67 -0.95 -0.09 0.00 0.02 0.00 0.00 54.97 54.63 2vlp s GLU 100 Cb -0.41 -2.24 -0.04 0.00 0.10 0.00 0.00 34.13 31.54 2vlp s GLU 100 CO 0.51 0.55 0.11 -0.51 0.02 0.00 0.00 175.26 175.94 2vlp s LEU 101 N -1.48 3.76 0.20 1.80 1.43 -1.26 -0.78 118.68 122.36 2vlp s LEU 101 Ca 0.15 -0.05 0.07 0.00 -1.03 0.00 0.00 54.13 53.26 2vlp s LEU 101 Cb -0.11 -2.01 -0.05 0.00 0.03 0.00 0.00 46.19 44.06 2vlp s LEU 101 CO 0.06 0.01 -0.11 -1.00 0.23 0.00 0.00 176.35 175.54 2vlp s HIS 102 N 1.34 1.63 -0.16 0.29 3.76 0.05 -4.96 115.29 117.25 2vlp s HIS 102 Ca 0.06 -0.66 -0.15 0.00 -0.15 0.00 0.00 55.06 54.16 2vlp s HIS 102 Cb -0.15 -0.81 -0.04 0.00 1.11 0.00 0.00 32.58 32.69 2vlp s HIS 102 CO 0.05 0.26 0.35 -1.01 -0.85 0.00 0.00 174.74 173.54 2vlp s HIS 103 N -3.09 3.46 -0.04 1.40 3.76 -1.26 -0.57 115.29 118.95 2vlp s HIS 103 Ca 0.23 0.66 -0.10 0.00 -0.15 0.00 0.00 55.06 55.70 2vlp s HIS 103 Cb 0.01 -2.42 -0.06 0.00 1.11 0.00 0.00 32.58 31.23 2vlp s HIS 103 CO 0.06 0.19 0.48 0.22 -0.85 0.00 0.00 174.74 174.84 2vlp h ASP 104 N 6.79 -0.32 -3.18 1.40 3.58 -1.24 -3.40 116.42 120.05 2vlp h ASP 104 Ca -0.40 0.01 -0.57 0.00 0.42 0.00 0.00 57.03 56.48 2vlp h ASP 104 Cb 1.17 0.08 -0.05 0.00 1.72 0.00 0.00 39.33 42.24 2vlp h ASP 104 CO 0.75 0.05 0.65 -0.75 -2.88 0.00 0.00 179.24 177.06 2vlp s LYS 105 N -2.78 4.32 0.57 0.28 2.20 -1.26 -5.04 119.74 118.03 2vlp s LYS 105 Ca -0.05 1.31 -0.21 0.00 -0.36 0.00 0.00 55.97 56.65 2vlp s LYS 105 Cb 0.01 -3.60 -0.04 0.00 -1.51 0.00 0.00 37.83 32.69 2vlp s LYS 105 CO 0.16 -0.47 1.34 -2.14 -0.36 0.00 0.00 175.35 173.88 2vlp s PRO 106 N 2.61 3.02 0.32 4.03 0.02 -1.26 -3.99 135.00 139.76 2vlp s PRO 106 Ca 0.44 2.18 0.01 0.00 0.02 0.00 0.00 61.00 63.65 2vlp s PRO 106 Cb -0.16 -2.17 0.54 0.00 0.02 0.00 0.00 34.50 32.73 2vlp s PRO 106 CO 0.11 -1.26 1.96 0.82 -0.33 0.00 0.00 177.00 178.30 2vlp h ILE 107 N 1.25 1.19 0.00 2.83 2.04 -1.93 0.96 117.51 123.85 2vlp h ILE 107 Ca -0.51 -0.44 0.00 0.00 1.00 0.00 0.00 64.86 64.91 2vlp h ILE 107 Cb 1.31 0.29 0.00 0.00 -0.74 0.00 0.00 36.82 37.68 2vlp h ILE 107 CO 0.56 0.20 0.00 0.77 0.00 0.00 0.00 178.15 179.69 2vlp h SER 108 N 0.89 0.00 -0.41 1.72 4.64 -1.90 -1.58 113.55 116.92 2vlp h SER 108 Ca 0.23 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.48 2vlp h SER 108 Cb -0.01 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.04 2vlp h SER 108 CO -0.04 0.00 0.05 0.00 -0.87 0.00 0.00 176.83 175.97 2vlp n GLN 109 N -2.77 3.17 -0.20 4.77 6.02 -0.68 -4.94 117.38 122.76 2vlp n GLN 109 Ca -0.00 -2.99 0.00 0.00 -0.01 0.00 0.00 57.00 54.00 2vlp n GLN 109 Cb 0.19 -1.97 0.00 0.00 1.02 0.00 0.00 30.24 29.47 2vlp n GLN 109 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2vlp n GLY 110 N -0.40 0.82 3.77 1.08 0.00 -0.59 -4.90 105.19 104.97 2vlp n GLY 110 Ca 0.28 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.91 2vlp n GLY 110 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2vlp s GLY 111 N -1.80 2.89 0.21 -0.02 0.00 0.25 -4.96 107.32 103.90 2vlp s GLY 111 Ca 0.00 1.08 -0.10 0.00 0.00 0.00 0.00 44.72 45.70 2vlp s GLY 111 CO 0.00 1.63 0.55 -0.54 0.00 0.00 0.00 173.10 174.73 2vlp s GLU 112 N -2.28 3.83 0.11 2.90 2.02 -1.26 -4.21 118.70 119.81 2vlp s GLU 112 Ca 0.57 0.31 -0.14 0.00 0.02 0.00 0.00 54.97 55.74 2vlp s GLU 112 Cb -0.34 -2.70 -0.09 0.00 0.10 0.00 0.00 34.13 31.10 2vlp s GLU 112 CO 0.43 0.35 1.40 0.28 0.02 0.00 0.00 175.26 177.74 2vlp h VAL 113 N 2.15 1.29 -0.12 2.63 2.07 -1.95 -3.29 116.25 119.03 2vlp h VAL 113 Ca -0.47 -1.60 0.00 0.00 0.82 0.00 0.00 66.70 65.44 2vlp h VAL 113 Cb 1.17 1.64 0.00 0.00 -1.52 0.00 0.00 31.29 32.58 2vlp h VAL 113 CO 0.68 0.52 0.00 -1.22 0.02 0.00 0.00 177.57 177.57 2vlp n TYR 114 N -4.14 0.37 -2.55 1.57 4.02 -1.26 -4.91 117.16 110.24 2vlp n TYR 114 Ca -0.04 -0.84 -0.43 0.00 -0.01 0.00 0.00 57.90 56.58 2vlp n TYR 114 Cb 0.55 -0.18 -0.02 0.00 -0.02 0.00 0.00 39.34 39.67 2vlp n TYR 114 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 2vlp s ASP 115 N -2.12 6.59 0.07 7.72 2.15 -1.24 -1.01 116.67 128.81 2vlp s ASP 115 Ca 0.30 0.56 0.20 0.00 0.43 0.00 0.00 52.55 54.04 2vlp s ASP 115 Cb 0.25 -2.55 0.85 0.00 -0.30 0.00 0.00 42.92 41.17 2vlp s ASP 115 CO 0.06 -1.28 1.64 0.23 -0.17 0.00 0.00 175.17 175.65 2vlp n MET 116 N 7.86 0.06 0.00 4.34 2.81 0.13 -1.01 117.12 131.31 2vlp n MET 116 Ca 0.13 0.22 0.13 0.00 -1.81 0.00 0.00 57.70 56.37 2vlp n MET 116 Cb 0.49 -1.60 0.43 0.00 -0.71 0.00 0.00 33.22 31.83 2vlp n MET 116 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 2vlp n ASP 117 N -1.70 0.48 -1.45 7.83 8.00 -1.26 -3.61 116.55 124.84 2vlp n ASP 117 Ca 0.04 -0.28 0.09 0.00 0.71 0.00 0.00 54.79 55.36 2vlp n ASP 117 Cb 0.24 0.01 0.33 0.00 -0.02 0.00 0.00 41.12 41.68 2vlp n ASP 117 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2vlp n ASN 118 N -1.24 4.49 -4.29 -2.24 5.15 -0.18 -4.97 115.26 111.99 2vlp n ASN 118 Ca 0.09 -2.39 -0.31 0.00 -0.60 0.00 0.00 54.58 51.37 2vlp n ASN 118 Cb 0.32 -0.54 -0.16 0.00 -0.53 0.00 0.00 39.78 38.87 2vlp n ASN 118 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2vlp s ILE 119 N -1.74 2.01 0.02 -1.44 1.01 -1.22 -0.65 121.20 119.19 2vlp s ILE 119 Ca 0.48 -1.07 0.06 0.00 0.00 0.00 0.00 60.65 60.12 2vlp s ILE 119 Cb 0.31 -1.68 -0.02 0.00 0.01 0.00 0.00 42.46 41.08 2vlp s ILE 119 CO 0.24 0.57 -0.18 -0.13 0.00 0.00 0.00 174.94 175.44 2vlp s ARG 120 N -0.45 1.24 -0.30 2.79 1.81 0.26 -3.91 118.95 120.39 2vlp s ARG 120 Ca 0.05 -0.78 -0.13 0.00 -1.72 0.00 0.00 55.73 53.16 2vlp s ARG 120 Cb -0.11 -1.28 -0.03 0.00 -0.45 0.00 0.00 34.95 33.08 2vlp s ARG 120 CO 0.01 0.33 0.26 0.08 -0.68 0.00 0.00 175.30 175.29 2vlp s VAL 121 N -0.69 5.26 0.17 3.52 1.01 0.17 -0.77 120.40 129.07 2vlp s VAL 121 Ca 0.05 0.11 0.08 0.00 0.00 0.00 0.00 61.98 62.22 2vlp s VAL 121 Cb -0.08 -3.65 -0.04 0.00 0.00 0.00 0.00 36.38 32.61 2vlp s VAL 121 CO 0.01 0.11 -0.18 0.42 0.00 0.00 0.00 175.10 175.46 2vlp s THR 122 N 1.84 1.80 0.66 3.92 -4.23 0.04 -0.30 115.64 119.36 2vlp s THR 122 Ca 0.09 -1.94 -0.14 0.00 -1.18 0.00 0.00 61.69 58.52 2vlp s THR 122 Cb -0.16 -1.85 -0.00 0.00 1.34 0.00 0.00 72.50 71.82 2vlp s THR 122 CO 0.11 -0.34 1.08 0.42 -0.54 0.00 0.00 174.62 175.35 2vlp s THR 123 N -2.13 3.58 0.24 3.99 -4.23 -0.83 -0.38 115.64 115.88 2vlp s THR 123 Ca 0.16 0.67 -0.05 0.00 -1.18 0.00 0.00 61.69 61.30 2vlp s THR 123 Cb -0.05 -3.22 0.20 0.00 1.34 0.00 0.00 72.50 70.77 2vlp s THR 123 CO 0.07 -0.51 1.78 -0.65 -0.54 0.00 0.00 174.62 174.77 2vlp h PRO 124 N -0.08 0.63 -0.40 3.99 0.11 -1.74 -1.61 132.00 132.90 2vlp h PRO 124 Ca -0.46 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2vlp h PRO 124 Cb 1.23 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.18 2vlp h PRO 124 CO 0.55 0.42 0.25 -0.22 -0.21 0.00 0.00 178.00 178.79 2vlp h LYS 125 N 0.65 0.53 -0.38 1.05 3.64 -1.30 -1.43 116.57 119.33 2vlp h LYS 125 Ca 0.39 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.68 2vlp h LYS 125 Cb 0.44 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 2vlp h LYS 125 CO -0.29 0.38 0.05 -0.09 -2.27 0.00 0.00 179.45 177.23 2vlp h ARG 126 N 0.53 0.64 -0.65 1.90 9.65 -1.77 -0.58 114.38 124.10 2vlp h ARG 126 Ca 0.14 -0.18 0.06 0.00 -1.10 0.00 0.00 59.98 58.91 2vlp h ARG 126 Cb -0.03 -0.07 -0.06 0.00 -1.39 0.00 0.00 29.97 28.43 2vlp h ARG 126 CO -0.03 0.70 0.34 1.25 2.80 0.00 0.00 179.97 185.04 2vlp h HIS 127 N 0.47 0.63 -0.49 2.20 2.76 -1.13 -1.19 115.15 118.40 2vlp h HIS 127 Ca 0.11 0.03 -0.12 0.00 -2.20 0.00 0.00 60.37 58.19 2vlp h HIS 127 Cb 0.39 -0.19 -0.02 0.00 1.55 0.00 0.00 27.41 29.14 2vlp h HIS 127 CO 0.03 0.28 -0.16 0.82 -1.30 0.00 0.00 177.93 177.60 2vlp h ILE 128 N 0.63 1.27 -0.48 6.26 2.04 -0.88 -0.07 117.51 126.28 2vlp h ILE 128 Ca 0.29 -1.30 0.01 0.00 1.00 0.00 0.00 64.86 64.87 2vlp h ILE 128 Cb 0.21 1.05 -0.03 0.00 -0.74 0.00 0.00 36.82 37.32 2vlp h ILE 128 CO -0.20 0.45 0.30 0.44 0.00 0.00 0.00 178.15 179.14 2vlp h ASP 129 N 0.84 0.50 -0.09 1.72 3.45 -0.63 0.30 116.42 122.50 2vlp h ASP 129 Ca 0.12 -0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.58 2vlp h ASP 129 Cb 0.71 -0.11 -0.00 0.00 -0.56 0.00 0.00 39.33 39.37 2vlp h ASP 129 CO 0.05 0.36 0.06 0.40 -1.57 0.00 0.00 179.24 178.54 2vlp h ILE 130 N 0.60 1.06 -0.60 0.35 2.04 -1.04 -2.74 117.51 117.18 2vlp h ILE 130 Ca 0.18 -0.15 -0.02 0.00 1.00 0.00 0.00 64.86 65.87 2vlp h ILE 130 Cb -0.02 0.99 -0.03 0.00 -0.74 0.00 0.00 36.82 37.02 2vlp h ILE 130 CO -0.06 0.05 0.28 -0.74 0.00 0.00 0.00 178.15 177.68 2vlp h HIS 131 N 0.09 0.87 0.00 1.37 2.76 -0.69 -2.38 115.15 117.17 2vlp h HIS 131 Ca 0.03 -0.05 -0.02 0.00 -2.20 0.00 0.00 60.37 58.14 2vlp h HIS 131 Cb 0.04 -0.27 -0.00 0.00 1.55 0.00 0.00 27.41 28.73 2vlp h HIS 131 CO -0.06 0.67 -0.08 0.00 -1.30 0.00 0.00 177.93 177.16 2vlp h ARG 132 N 0.81 0.00 -0.01 5.26 3.08 -0.88 -2.50 114.38 120.15 2vlp h ARG 132 Ca 0.20 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.25 2vlp h ARG 132 Cb 0.13 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.18 2vlp h ARG 132 CO -0.02 0.08 -0.06 0.41 -1.07 0.00 0.00 179.97 179.31 2vlp n GLY 133 N -0.87 -0.75 0.00 0.04 0.00 -0.90 -5.10 105.19 97.61 2vlp n GLY 133 Ca -0.02 -0.29 0.08 0.00 0.00 0.00 0.00 46.02 45.79 2vlp n GLY 133 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60