#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t3v s ILE 2 N 0.00 1.03 -0.32 3.17 1.01 -1.26 -2.58 121.20 122.24 1t3v s ILE 2 Ca 0.00 -0.64 0.02 0.00 0.00 0.00 0.00 60.65 60.03 1t3v s ILE 2 Cb 0.00 -0.87 0.10 0.00 0.01 0.00 0.00 42.46 41.69 1t3v s ILE 2 CO 0.00 0.23 0.06 -0.63 0.00 0.00 0.00 174.94 174.60 1t3v s ILE 3 N -0.41 1.67 0.28 2.92 1.01 0.76 -1.09 121.20 126.33 1t3v s ILE 3 Ca 0.04 -1.90 -0.21 0.00 0.00 0.00 0.00 60.65 58.58 1t3v s ILE 3 Cb -0.06 -2.23 -0.09 0.00 0.01 0.00 0.00 42.46 40.10 1t3v s ILE 3 CO -0.00 -0.60 0.80 0.00 0.00 0.00 0.00 174.94 175.13 1t3v s ALA 4 N 1.22 3.32 -0.07 9.38 0.00 -0.67 -0.06 121.76 134.88 1t3v s ALA 4 Ca 0.10 0.26 0.01 0.00 0.00 0.00 0.00 51.96 52.32 1t3v s ALA 4 Cb -0.18 -2.93 0.02 0.00 0.00 0.00 0.00 23.12 20.03 1t3v s ALA 4 CO -0.15 0.28 -0.08 0.42 0.00 0.00 0.00 175.76 176.23 1t3v s ILE 5 N -1.66 0.85 -0.42 0.00 1.01 -0.39 -0.97 121.20 119.62 1t3v s ILE 5 Ca 0.48 -0.26 -0.29 0.00 0.00 0.00 0.00 60.65 60.57 1t3v s ILE 5 Cb -0.16 -0.84 0.01 0.00 0.01 0.00 0.00 42.46 41.49 1t3v s ILE 5 CO 0.21 0.31 1.39 -2.16 0.00 0.00 0.00 174.94 174.68 1t3v s PRO 6 N 1.10 3.59 0.29 2.79 0.04 -1.26 -0.78 135.00 140.77 1t3v s PRO 6 Ca -0.07 0.91 0.08 0.00 0.04 0.00 0.00 61.00 61.96 1t3v s PRO 6 Cb -0.14 -4.01 -0.04 0.00 0.04 0.00 0.00 34.50 30.35 1t3v s PRO 6 CO -0.01 -1.54 0.12 0.14 0.04 0.00 0.00 177.00 175.74 1t3v s VAL 7 N 5.33 3.63 -0.15 -0.36 -7.23 -0.70 -0.15 120.40 120.77 1t3v s VAL 7 Ca 0.60 -1.66 0.20 0.00 -1.81 0.00 0.00 61.98 59.31 1t3v s VAL 7 Cb -0.13 -3.07 -0.15 0.00 0.56 0.00 0.00 36.38 33.59 1t3v s VAL 7 CO 0.32 -0.30 0.75 -1.20 -0.31 0.00 0.00 175.10 174.36 1t3v n SER 8 N -1.08 0.58 -3.92 4.85 7.64 0.31 -2.78 113.62 119.22 1t3v n SER 8 Ca -0.06 0.24 -0.10 0.00 1.01 0.00 0.00 58.87 59.97 1t3v n SER 8 Cb 0.59 0.75 -0.06 0.00 -1.01 0.00 0.00 64.21 64.48 1t3v n SER 8 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1t3v s GLU 9 N -3.17 1.20 -1.20 1.43 2.02 -1.26 -4.83 118.70 112.89 1t3v s GLU 9 Ca -0.04 -1.12 -0.11 0.00 0.02 0.00 0.00 54.97 53.72 1t3v s GLU 9 Cb 0.10 0.40 0.20 0.00 0.10 0.00 0.00 34.13 34.94 1t3v s GLU 9 CO 0.83 -0.46 1.47 -1.71 0.02 0.00 0.00 175.26 175.41 1t3v n ASN 10 N -0.24 5.35 -2.88 -0.19 2.85 -1.26 -4.63 115.26 114.26 1t3v n ASN 10 Ca -0.08 -3.05 -0.25 0.00 -0.11 0.00 0.00 54.58 51.09 1t3v n ASN 10 Cb 0.63 -1.49 -0.03 0.00 1.24 0.00 0.00 39.78 40.13 1t3v n ASN 10 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 1t3v n ARG 11 N 4.37 2.83 -0.41 1.20 1.74 -1.26 -5.04 116.66 120.10 1t3v n ARG 11 Ca 0.34 -4.50 -0.16 0.00 -0.77 0.00 0.00 57.85 52.76 1t3v n ARG 11 Cb 0.40 -2.11 -0.02 0.00 -1.02 0.00 0.00 32.46 29.70 1t3v n ARG 11 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1t3v n GLY 12 N -0.20 0.04 4.96 -0.13 0.00 -1.26 0.33 105.19 108.94 1t3v n GLY 12 Ca 0.31 0.24 0.00 0.00 0.00 0.00 0.00 46.02 46.56 1t3v n GLY 12 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1t3v n LYS 13 N 0.98 0.00 0.00 1.61 5.02 -1.26 -4.58 118.16 119.93 1t3v n LYS 13 Ca 0.08 0.00 0.04 0.00 -2.02 0.00 0.00 58.31 56.41 1t3v n LYS 13 Cb -0.01 0.00 0.20 0.00 -0.02 0.00 0.00 35.03 35.20 1t3v n LYS 13 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1t3v n ASP 14 N 3.79 0.00 -4.48 4.39 8.00 0.05 -2.62 116.55 125.68 1t3v n ASP 14 Ca 0.00 0.21 -0.43 0.00 0.71 0.00 0.00 54.79 55.28 1t3v n ASP 14 Cb 0.00 -0.31 -0.10 0.00 -0.02 0.00 0.00 41.12 40.69 1t3v n ASP 14 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1t3v n SER 15 N -1.31 1.28 -4.68 -2.24 7.64 0.15 -4.64 113.62 109.83 1t3v n SER 15 Ca 0.04 0.07 -0.43 0.00 1.01 0.00 0.00 58.87 59.56 1t3v n SER 15 Cb 0.07 -1.18 -0.02 0.00 -1.01 0.00 0.00 64.21 62.06 1t3v n SER 15 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1t3v s PRO 16 N 7.99 4.32 0.45 1.43 0.04 -1.26 -1.93 135.00 146.04 1t3v s PRO 16 Ca 1.19 1.62 -0.25 0.00 0.04 0.00 0.00 61.00 63.60 1t3v s PRO 16 Cb -0.89 -3.61 -0.09 0.00 0.04 0.00 0.00 34.50 29.95 1t3v s PRO 16 CO 0.44 -0.51 1.24 1.51 0.04 0.00 0.00 177.00 179.72 1t3v n ILE 17 N 4.84 2.75 -3.21 0.56 3.06 -0.85 -0.53 119.36 125.98 1t3v n ILE 17 Ca 0.11 -0.50 -0.18 0.00 -2.50 0.00 0.00 62.75 59.68 1t3v n ILE 17 Cb 0.46 -1.53 0.00 0.00 0.54 0.00 0.00 39.64 39.11 1t3v n ILE 17 CO 0.00 0.00 0.00 -0.55 -2.50 0.00 0.00 176.55 173.50 1t3v s SER 18 N -0.63 5.64 -0.03 9.51 0.15 0.78 -4.61 113.70 124.52 1t3v s SER 18 Ca 0.63 -0.41 -0.13 0.00 0.70 0.00 0.00 55.95 56.73 1t3v s SER 18 Cb -0.50 -0.79 -0.32 0.00 -1.71 0.00 0.00 66.02 62.71 1t3v s SER 18 CO 0.56 -0.66 0.77 -0.33 1.20 0.00 0.00 173.24 174.78 1t3v h GLU 19 N 0.77 0.43 -6.45 5.44 3.07 -1.93 -3.38 114.58 112.52 1t3v h GLU 19 Ca -0.42 -0.73 -0.45 0.00 -0.50 0.00 0.00 59.36 57.26 1t3v h GLU 19 Cb 1.27 0.27 0.01 0.00 -0.84 0.00 0.00 28.75 29.47 1t3v h GLU 19 CO 0.49 1.35 -0.23 -1.01 -1.40 0.00 0.00 179.01 178.21 1t3v s HIS 20 N -2.57 2.39 0.02 4.33 3.76 -1.26 -1.77 115.29 120.19 1t3v s HIS 20 Ca -0.14 -0.51 0.00 0.00 -0.15 0.00 0.00 55.06 54.26 1t3v s HIS 20 Cb 0.05 -2.30 0.00 0.00 1.11 0.00 0.00 32.58 31.44 1t3v s HIS 20 CO 0.88 -0.58 0.00 0.34 -0.85 0.00 0.00 174.74 174.52 1t3v n PHE 21 N -1.92 -0.00 0.06 1.40 -0.00 -1.26 -4.07 117.46 111.67 1t3v n PHE 21 Ca 0.09 0.00 0.01 0.00 -0.00 0.00 0.00 57.45 57.55 1t3v n PHE 21 Cb 0.60 0.01 0.03 0.00 -0.00 0.00 0.00 39.48 40.12 1t3v n PHE 21 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1t3v n GLY 22 N 3.07 -0.40 2.72 7.13 0.00 -1.26 -1.50 105.19 114.96 1t3v n GLY 22 Ca 0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 46.02 46.01 1t3v n GLY 22 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1t3v n ARG 23 N -1.35 1.56 -2.53 1.61 0.63 -1.26 -4.81 116.66 110.51 1t3v n ARG 23 Ca 0.01 -2.94 -0.43 0.00 -0.92 0.00 0.00 57.85 53.57 1t3v n ARG 23 Cb 0.01 -1.10 -0.02 0.00 0.45 0.00 0.00 32.46 31.80 1t3v n ARG 23 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1t3v s ALA 24 N -2.79 3.52 0.09 5.13 0.00 -0.56 -4.71 121.76 122.43 1t3v s ALA 24 Ca 0.23 0.50 0.34 0.00 0.00 0.00 0.00 51.96 53.02 1t3v s ALA 24 Cb 0.35 -3.52 1.38 0.00 0.00 0.00 0.00 23.12 21.33 1t3v s ALA 24 CO -0.06 -0.82 1.98 -1.00 0.00 0.00 0.00 175.76 175.86 1t3v h PRO 25 N 7.49 0.00 -3.77 0.00 0.13 -1.88 -3.41 132.00 130.55 1t3v h PRO 25 Ca -0.31 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.74 1t3v h PRO 25 Cb 1.14 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.14 1t3v h PRO 25 CO 0.90 0.00 -0.32 0.71 -0.23 0.00 0.00 178.00 179.06 1t3v s TYR 26 N -3.66 0.17 -0.23 1.56 1.51 -1.12 -0.91 117.35 114.67 1t3v s TYR 26 Ca 0.01 -0.57 -0.03 0.00 -1.01 0.00 0.00 57.07 55.47 1t3v s TYR 26 Cb 0.09 -0.01 0.07 0.00 -0.11 0.00 0.00 41.96 42.00 1t3v s TYR 26 CO 0.53 -0.62 0.07 -0.06 -1.11 0.00 0.00 175.55 174.37 1t3v s PHE 27 N -3.88 0.92 -0.92 2.71 0.08 -0.74 -1.72 117.98 114.42 1t3v s PHE 27 Ca 0.08 -0.95 -0.24 0.00 0.12 0.00 0.00 56.93 55.94 1t3v s PHE 27 Cb 0.04 -1.09 0.04 0.00 -0.57 0.00 0.00 43.02 41.45 1t3v s PHE 27 CO -0.08 -0.68 1.39 0.00 -0.10 0.00 0.00 175.22 175.75 1t3v s ALA 28 N 1.89 2.72 -0.84 5.36 0.00 0.04 -3.13 121.76 127.80 1t3v s ALA 28 Ca 0.03 -1.93 -0.24 0.00 0.00 0.00 0.00 51.96 49.82 1t3v s ALA 28 Cb -0.17 -4.43 0.05 0.00 0.00 0.00 0.00 23.12 18.57 1t3v s ALA 28 CO -0.16 -3.51 1.27 -0.06 0.00 0.00 0.00 175.76 173.31 1t3v s PHE 29 N 5.29 2.51 0.47 0.00 0.08 0.09 -1.26 117.98 125.16 1t3v s PHE 29 Ca 0.42 -0.52 -0.19 0.00 0.12 0.00 0.00 56.93 56.76 1t3v s PHE 29 Cb -0.03 -4.57 -0.09 0.00 -0.57 0.00 0.00 43.02 37.76 1t3v s PHE 29 CO -0.01 -1.91 0.97 0.08 -0.10 0.00 0.00 175.22 174.25 1t3v s VAL 30 N 4.93 4.41 0.26 -0.44 1.01 0.92 -0.48 120.40 131.00 1t3v s VAL 30 Ca 0.37 1.35 0.04 0.00 0.00 0.00 0.00 61.98 63.73 1t3v s VAL 30 Cb -0.06 -3.64 0.04 0.00 0.00 0.00 0.00 36.38 32.72 1t3v s VAL 30 CO 0.03 -0.47 0.30 0.29 0.00 0.00 0.00 175.10 175.25 1t3v n LYS 31 N -1.06 0.94 -3.78 2.72 5.02 0.22 -0.17 118.16 122.05 1t3v n LYS 31 Ca 0.07 -1.46 -0.13 0.00 -2.02 0.00 0.00 58.31 54.77 1t3v n LYS 31 Cb 0.54 -0.01 -0.12 0.00 -0.02 0.00 0.00 35.03 35.42 1t3v n LYS 31 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1t3v s VAL 32 N -0.85 -0.01 -0.06 -0.18 1.01 -1.07 -4.35 120.40 114.89 1t3v s VAL 32 Ca 0.22 0.04 -0.03 0.00 0.00 0.00 0.00 61.98 62.21 1t3v s VAL 32 Cb -0.02 -0.33 0.04 0.00 0.00 0.00 0.00 36.38 36.07 1t3v s VAL 32 CO 0.14 0.01 0.13 -0.75 0.00 0.00 0.00 175.10 174.63 1t3v s LYS 33 N 0.38 0.04 -1.53 2.72 2.20 -0.23 -4.65 119.74 118.67 1t3v s LYS 33 Ca -0.02 0.41 -0.14 0.00 -0.36 0.00 0.00 55.97 55.86 1t3v s LYS 33 Cb -0.04 -0.25 0.09 0.00 -1.51 0.00 0.00 37.83 36.12 1t3v s LYS 33 CO -0.02 -0.23 0.95 -1.71 -0.36 0.00 0.00 175.35 173.98 1t3v n ASN 34 N 4.66 -4.80 -0.37 1.43 5.15 -1.26 -0.89 115.26 119.18 1t3v n ASN 34 Ca -0.18 -0.75 -0.05 0.00 -0.60 0.00 0.00 54.58 53.01 1t3v n ASN 34 Cb 0.51 -3.84 -0.02 0.00 -0.53 0.00 0.00 39.78 35.90 1t3v n ASN 34 CO 0.00 0.00 0.00 -3.20 1.40 0.00 0.00 177.26 175.46 1t3v n ASN 35 N -2.79 -5.28 -4.90 1.20 5.15 -1.26 -4.98 115.26 102.40 1t3v n ASN 35 Ca 0.04 0.11 -0.20 0.00 -0.60 0.00 0.00 54.58 53.93 1t3v n ASN 35 Cb 0.53 -3.49 -0.02 0.00 -0.53 0.00 0.00 39.78 36.26 1t3v n ASN 35 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1t3v s ALA 36 N -1.31 4.11 0.24 5.20 0.00 -0.07 -5.02 121.76 124.90 1t3v s ALA 36 Ca 0.00 -1.78 0.36 0.00 0.00 0.00 0.00 51.96 50.54 1t3v s ALA 36 Cb 0.00 -1.18 1.73 0.00 0.00 0.00 0.00 23.12 23.67 1t3v s ALA 36 CO 0.00 -0.18 2.08 0.82 0.00 0.00 0.00 175.76 178.48 1t3v h ILE 37 N 1.00 0.00 0.00 0.00 5.03 -1.80 -0.59 117.51 121.15 1t3v h ILE 37 Ca -0.42 -0.25 0.00 0.00 -0.12 0.00 0.00 64.86 64.07 1t3v h ILE 37 Cb 1.27 1.18 0.00 0.00 -3.03 0.00 0.00 36.82 36.23 1t3v h ILE 37 CO 0.55 0.00 0.00 0.00 -0.68 0.00 0.00 178.15 178.02 1t3v n ALA 38 N -2.03 0.00 -3.79 1.87 0.00 -1.26 -2.79 120.51 112.51 1t3v n ALA 38 Ca -0.01 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.34 1t3v n ALA 38 Cb 0.18 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.66 1t3v n ALA 38 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1t3v s ASP 39 N 0.00 0.02 0.01 0.00 2.15 -1.26 -5.01 116.67 112.58 1t3v s ASP 39 Ca 0.00 -1.15 0.03 0.00 0.43 0.00 0.00 52.55 51.87 1t3v s ASP 39 Cb 0.00 0.85 -0.01 0.00 -0.30 0.00 0.00 42.92 43.46 1t3v s ASP 39 CO 0.00 -1.68 -0.11 -0.63 -0.17 0.00 0.00 175.17 172.58 1t3v s ILE 40 N -2.34 0.82 -0.65 4.11 1.01 -1.26 -0.61 121.20 122.29 1t3v s ILE 40 Ca 0.16 -0.64 -0.02 0.00 0.00 0.00 0.00 60.65 60.14 1t3v s ILE 40 Cb -0.05 -0.73 0.17 0.00 0.01 0.00 0.00 42.46 41.86 1t3v s ILE 40 CO 0.12 0.09 0.46 -0.44 0.00 0.00 0.00 174.94 175.17 1t3v s SER 41 N -0.63 5.21 -1.30 3.58 0.01 0.37 -4.97 113.70 115.97 1t3v s SER 41 Ca 0.02 -3.01 -0.12 0.00 1.31 0.00 0.00 55.95 54.15 1t3v s SER 41 Cb -0.05 -1.83 0.14 0.00 0.21 0.00 0.00 66.02 64.48 1t3v s SER 41 CO 0.00 -0.32 1.83 0.55 0.41 0.00 0.00 173.24 175.70 1t3v n VAL 42 N 3.26 4.16 -3.25 3.43 3.14 -1.26 -0.73 118.33 127.08 1t3v n VAL 42 Ca 0.10 -4.23 -0.32 0.00 -2.96 0.00 0.00 64.34 56.93 1t3v n VAL 42 Cb 0.37 -2.42 -0.05 0.00 -1.06 0.00 0.00 33.84 30.68 1t3v n VAL 42 CO 0.00 0.00 0.00 -1.61 -6.46 0.00 0.00 176.83 168.76 1t3v s GLU 43 N 1.34 3.85 0.51 1.45 0.41 -1.18 -4.96 118.70 120.13 1t3v s GLU 43 Ca 0.42 0.41 -0.19 0.00 -0.41 0.00 0.00 54.97 55.20 1t3v s GLU 43 Cb 0.07 -2.54 -0.07 0.00 -1.78 0.00 0.00 34.13 29.81 1t3v s GLU 43 CO -0.01 0.21 1.06 -1.21 -0.49 0.00 0.00 175.26 174.82 1t3v s GLU 44 N -3.07 3.63 -0.32 1.61 2.02 -1.26 -1.79 118.70 119.53 1t3v s GLU 44 Ca 0.50 1.39 -0.27 0.00 0.02 0.00 0.00 54.97 56.61 1t3v s GLU 44 Cb -0.11 -2.07 0.01 0.00 0.10 0.00 0.00 34.13 32.07 1t3v s GLU 44 CO 0.22 -0.58 0.96 1.21 0.02 0.00 0.00 175.26 177.10 1t3v s ASN 45 N -2.06 6.82 0.00 -0.19 3.84 -0.09 -4.73 114.94 118.53 1t3v s ASN 45 Ca 0.68 0.89 0.12 0.00 0.21 0.00 0.00 52.86 54.76 1t3v s ASN 45 Cb -0.18 -2.49 0.56 0.00 -0.55 0.00 0.00 41.25 38.59 1t3v s ASN 45 CO 0.24 -0.78 1.37 -0.81 -2.79 0.00 0.00 177.10 174.33 1t3v n PRO 46 N 6.61 0.05 -2.64 0.43 -0.04 -1.26 -3.19 135.00 134.96 1t3v n PRO 46 Ca 0.09 0.25 -0.05 0.00 -0.04 0.00 0.00 63.50 63.75 1t3v n PRO 46 Cb 0.47 -1.50 0.04 0.00 -0.04 0.00 0.00 33.50 32.48 1t3v n PRO 46 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1t3v n LEU 47 N -1.44 2.25 0.08 1.53 7.99 -1.26 -4.88 117.00 121.27 1t3v n LEU 47 Ca 0.04 -3.36 0.11 0.00 -0.01 0.00 0.00 56.01 52.79 1t3v n LEU 47 Cb 0.13 0.30 0.59 0.00 -0.11 0.00 0.00 43.42 44.33 1t3v n LEU 47 CO 0.11 1.24 1.14 0.00 -1.51 0.00 0.00 177.39 178.37 1t3v h ALA 48 N 2.49 2.08 0.00 -1.18 0.00 -1.78 -3.33 119.26 117.54 1t3v h ALA 48 Ca -0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1t3v h ALA 48 Cb 1.33 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1t3v h ALA 48 CO 0.30 -0.15 -0.05 1.04 0.00 0.00 0.00 179.25 180.38 1t3v n GLN 49 N -4.48 2.30 -3.49 0.00 1.13 -1.26 -4.45 117.38 107.13 1t3v n GLN 49 Ca 0.04 0.00 -0.40 0.00 -1.94 0.00 0.00 57.00 54.70 1t3v n GLN 49 Cb 0.27 -0.23 -0.10 0.00 0.11 0.00 0.00 30.24 30.29 1t3v n GLN 49 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 1t3v s ASP 50 N -0.24 6.11 -1.38 1.08 2.15 -1.25 -4.53 116.67 118.60 1t3v s ASP 50 Ca 0.00 -0.23 -0.04 0.00 0.43 0.00 0.00 52.55 52.70 1t3v s ASP 50 Cb 0.00 -2.16 0.04 0.00 -0.30 0.00 0.00 42.92 40.50 1t3v s ASP 50 CO 0.00 -0.24 0.10 1.41 -0.17 0.00 0.00 175.17 176.28 1t3v n HIS 51 N 5.21 -1.06 -0.24 -5.34 8.25 -1.26 -4.74 115.22 116.04 1t3v n HIS 51 Ca -0.11 0.54 -0.00 0.00 -0.26 0.00 0.00 57.72 57.88 1t3v n HIS 51 Cb 0.50 -2.23 0.12 0.00 1.12 0.00 0.00 29.99 29.50 1t3v n HIS 51 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1t3v h VAL 52 N -1.25 0.92 0.00 1.59 2.07 -1.90 -3.43 116.25 114.25 1t3v h VAL 52 Ca -0.55 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 66.74 1t3v h VAL 52 Cb 1.19 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 31.16 1t3v h VAL 52 CO 0.64 0.12 0.00 1.41 0.02 0.00 0.00 177.57 179.76 1t3v n HIS 53 N -4.81 0.00 -1.97 1.57 8.25 -1.26 -1.37 115.22 115.63 1t3v n HIS 53 Ca 0.10 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.56 1t3v n HIS 53 Cb 0.22 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.33 1t3v n HIS 53 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1t3v n GLY 54 N 0.00 0.87 0.01 -1.41 0.00 -1.26 -5.01 105.19 98.38 1t3v n GLY 54 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.11 1t3v n GLY 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t3v n ALA 55 N 0.00 3.00 -0.05 4.61 0.00 -0.47 -3.86 120.51 123.74 1t3v n ALA 55 Ca 0.00 -0.45 -0.08 0.00 0.00 0.00 0.00 53.44 52.91 1t3v n ALA 55 Cb 0.50 -0.63 -0.02 0.00 0.00 0.00 0.00 19.45 19.30 1t3v n ALA 55 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1t3v h VAL 56 N 0.00 0.63 0.00 0.00 2.07 -1.87 -2.33 116.25 114.75 1t3v h VAL 56 Ca 0.00 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.41 1t3v h VAL 56 Cb 0.76 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 31.14 1t3v h VAL 56 CO 0.00 0.00 -0.54 1.55 0.02 0.00 0.00 177.57 178.60 1t3v h PRO 57 N -0.10 0.00 -0.64 1.57 0.13 -1.95 -3.20 132.00 127.81 1t3v h PRO 57 Ca 0.12 0.00 0.10 0.00 -0.87 0.00 0.00 66.00 65.35 1t3v h PRO 57 Cb 0.28 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 31.34 1t3v h PRO 57 CO -0.29 0.54 0.26 -0.97 -0.23 0.00 0.00 178.00 177.31 1t3v h ASN 58 N 0.00 0.28 0.14 1.44 -0.73 -1.54 -0.20 115.58 114.98 1t3v h ASN 58 Ca -0.01 0.08 -0.01 0.00 1.87 0.00 0.00 56.30 58.23 1t3v h ASN 58 Cb 1.05 0.04 -0.00 0.00 0.27 0.00 0.00 38.32 39.68 1t3v h ASN 58 CO 0.07 0.16 -0.09 0.15 -0.37 0.00 0.00 177.43 177.35 1t3v h PHE 59 N 0.45 -0.24 0.00 0.67 3.57 -1.48 -3.23 116.94 116.69 1t3v h PHE 59 Ca 0.32 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.82 1t3v h PHE 59 Cb 0.39 0.08 0.00 0.00 2.79 0.00 0.00 35.95 39.22 1t3v h PHE 59 CO -0.16 -0.13 0.00 -0.39 -2.23 0.00 0.00 178.31 175.40 1t3v h VAL 60 N -0.22 0.00 0.00 1.41 -1.51 -1.47 0.20 116.25 114.66 1t3v h VAL 60 Ca -0.02 -0.06 -0.06 0.00 -1.23 0.00 0.00 66.70 65.33 1t3v h VAL 60 Cb 0.17 0.95 -0.01 0.00 -2.13 0.00 0.00 31.29 30.28 1t3v h VAL 60 CO 0.02 0.00 -0.29 0.11 -1.23 0.00 0.00 177.57 176.18 1t3v h LYS 61 N 0.00 0.00 0.00 5.19 1.57 -1.06 -2.27 116.57 120.00 1t3v h LYS 61 Ca 0.00 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 1t3v h LYS 61 Cb 0.07 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.37 1t3v h LYS 61 CO 0.00 0.29 -0.17 1.05 -0.57 0.00 0.00 179.45 180.05 1t3v h GLU 62 N 0.00 0.00 -1.66 3.15 4.11 -0.63 -3.28 114.58 116.26 1t3v h GLU 62 Ca -0.00 0.00 -0.17 0.00 0.07 0.00 0.00 59.36 59.26 1t3v h GLU 62 Cb 0.65 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.83 1t3v h GLU 62 CO 0.04 0.17 0.22 1.63 0.07 0.00 0.00 179.01 181.14 1t3v n LYS 63 N -3.37 1.42 -2.25 1.06 4.76 -0.85 -4.85 118.16 114.07 1t3v n LYS 63 Ca -0.00 -0.83 -0.08 0.00 -2.87 0.00 0.00 58.31 54.53 1t3v n LYS 63 Cb 0.38 -1.33 -0.01 0.00 -1.84 0.00 0.00 35.03 32.23 1t3v n LYS 63 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1t3v n GLY 64 N 0.80 -0.29 3.82 0.72 0.00 -1.24 -4.86 105.19 104.14 1t3v n GLY 64 Ca 0.16 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.89 1t3v n GLY 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t3v s ALA 65 N -2.27 2.12 0.00 4.61 0.00 -1.26 -4.52 121.76 120.44 1t3v s ALA 65 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 51.96 51.51 1t3v s ALA 65 Cb 0.00 -3.04 0.00 0.00 0.00 0.00 0.00 23.12 20.08 1t3v s ALA 65 CO 0.00 -1.96 0.00 0.39 0.00 0.00 0.00 175.76 174.19 1t3v n GLU 66 N -3.55 0.00 -4.29 0.00 1.02 -0.82 -4.82 120.64 108.18 1t3v n GLU 66 Ca 0.07 0.00 -0.22 0.00 -0.02 0.00 0.00 57.16 56.99 1t3v n GLU 66 Cb 0.59 -0.42 -0.12 0.00 -0.02 0.00 0.00 31.44 31.47 1t3v n GLU 66 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 1t3v s LEU 67 N -1.67 2.37 -0.01 -4.62 2.96 -0.25 -1.46 118.68 116.00 1t3v s LEU 67 Ca 0.00 -0.77 0.01 0.00 -0.22 0.00 0.00 54.13 53.16 1t3v s LEU 67 Cb 0.00 -0.79 -0.00 0.00 0.50 0.00 0.00 46.19 45.90 1t3v s LEU 67 CO 0.00 -0.02 -0.04 -0.69 -1.32 0.00 0.00 176.35 174.28 1t3v s VAL 68 N -1.65 0.35 -0.19 1.68 1.01 -0.46 -1.67 120.40 119.47 1t3v s VAL 68 Ca 0.10 -0.18 -0.01 0.00 0.00 0.00 0.00 61.98 61.89 1t3v s VAL 68 Cb -0.08 -0.30 0.00 0.00 0.00 0.00 0.00 36.38 36.00 1t3v s VAL 68 CO 0.05 0.10 -0.12 -0.63 0.00 0.00 0.00 175.10 174.50 1t3v s ILE 69 N -0.04 2.77 0.16 2.22 1.01 -0.15 -0.76 121.20 126.42 1t3v s ILE 69 Ca 0.01 -0.71 0.03 0.00 0.00 0.00 0.00 60.65 59.98 1t3v s ILE 69 Cb -0.02 -2.21 -0.05 0.00 0.01 0.00 0.00 42.46 40.19 1t3v s ILE 69 CO -0.00 0.49 -0.04 0.68 0.00 0.00 0.00 174.94 176.06 1t3v s VAL 70 N 1.20 0.90 0.00 2.92 -7.23 0.30 -4.14 120.40 114.35 1t3v s VAL 70 Ca 0.02 -2.01 0.00 0.00 -1.81 0.00 0.00 61.98 58.18 1t3v s VAL 70 Cb -0.14 -2.01 0.00 0.00 0.56 0.00 0.00 36.38 34.79 1t3v s VAL 70 CO -0.05 -0.59 0.00 -1.14 -0.31 0.00 0.00 175.10 173.01 1t3v n ARG 71 N -0.23 0.00 -0.03 4.82 0.63 -1.26 -1.47 116.66 119.11 1t3v n ARG 71 Ca -0.08 0.10 -0.02 0.00 -0.92 0.00 0.00 57.85 56.93 1t3v n ARG 71 Cb 0.62 -0.46 -0.08 0.00 0.45 0.00 0.00 32.46 33.00 1t3v n ARG 71 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1t3v n GLY 72 N 2.11 -0.47 6.04 5.14 0.00 -0.73 -2.36 105.19 114.93 1t3v n GLY 72 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1t3v n GLY 72 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1t3v n ILE 73 N -2.21 0.00 -3.62 -0.61 3.06 -1.20 -4.96 119.36 109.83 1t3v n ILE 73 Ca -0.12 0.00 -0.04 0.00 -2.50 0.00 0.00 62.75 60.10 1t3v n ILE 73 Cb 0.65 0.00 -0.03 0.00 0.54 0.00 0.00 39.64 40.81 1t3v n ILE 73 CO 0.00 0.00 0.00 -0.83 -2.50 0.00 0.00 176.55 173.22 1t3v s GLY 74 N 0.00 -0.16 0.31 4.50 0.00 -1.26 -4.61 107.32 106.10 1t3v s GLY 74 Ca 0.00 2.07 0.01 0.00 0.00 0.00 0.00 44.72 46.80 1t3v s GLY 74 CO 0.00 0.77 1.88 -0.09 0.00 0.00 0.00 173.10 175.66 1t3v h ARG 75 N 2.07 0.76 -0.67 2.90 1.12 -1.99 -0.82 114.38 117.76 1t3v h ARG 75 Ca -0.08 -0.13 0.14 0.00 -1.11 0.00 0.00 59.98 58.80 1t3v h ARG 75 Cb 1.16 -0.13 -0.04 0.00 -0.01 0.00 0.00 29.97 30.96 1t3v h ARG 75 CO 0.23 0.66 0.45 -0.09 -3.11 0.00 0.00 179.97 178.11 1t3v h ARG 76 N 0.75 0.29 0.18 0.20 2.43 -2.00 -1.09 114.38 115.15 1t3v h ARG 76 Ca 0.17 -0.02 -0.34 0.00 -0.81 0.00 0.00 59.98 58.99 1t3v h ARG 76 Cb 0.21 -0.07 0.01 0.00 -0.42 0.00 0.00 29.97 29.71 1t3v h ARG 76 CO -0.01 0.19 -1.67 0.00 -1.51 0.00 0.00 179.97 176.97 1t3v h ALA 77 N 1.68 0.12 -0.84 2.80 0.00 -1.58 -3.26 119.26 118.18 1t3v h ALA 77 Ca 0.32 -1.10 0.21 0.00 0.00 0.00 0.00 54.91 54.33 1t3v h ALA 77 Cb 0.84 0.43 -0.15 0.00 0.00 0.00 0.00 17.79 18.91 1t3v h ALA 77 CO -0.08 0.96 0.05 0.82 0.00 0.00 0.00 179.25 181.00 1t3v h ILE 78 N 0.05 0.26 0.00 0.00 5.03 -0.89 -0.32 117.51 121.64 1t3v h ILE 78 Ca -0.33 -0.04 0.00 0.00 -0.12 0.00 0.00 64.86 64.37 1t3v h ILE 78 Cb 2.05 0.15 0.00 0.00 -3.03 0.00 0.00 36.82 35.99 1t3v h ILE 78 CO 0.17 0.02 0.00 0.00 -0.68 0.00 0.00 178.15 177.66 1t3v n ALA 79 N -2.95 1.13 -0.04 1.87 0.00 -0.46 -0.97 120.51 119.09 1t3v n ALA 79 Ca 0.17 0.06 -0.12 0.00 0.00 0.00 0.00 53.44 53.55 1t3v n ALA 79 Cb 0.57 -1.15 -0.14 0.00 0.00 0.00 0.00 19.45 18.74 1t3v n ALA 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1t3v n ALA 80 N -1.60 1.36 -0.15 0.00 0.00 -0.14 -2.58 120.51 117.40 1t3v n ALA 80 Ca 0.00 -0.84 -0.08 0.00 0.00 0.00 0.00 53.44 52.51 1t3v n ALA 80 Cb 0.04 -0.65 -0.03 0.00 0.00 0.00 0.00 19.45 18.81 1t3v n ALA 80 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1t3v h PHE 81 N 0.02 -1.15 0.00 0.00 3.57 -1.17 -2.07 116.94 116.13 1t3v h PHE 81 Ca -0.38 0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.19 1t3v h PHE 81 Cb 2.05 0.57 0.00 0.00 2.79 0.00 0.00 35.95 41.36 1t3v h PHE 81 CO 0.02 -0.42 0.00 0.39 -2.23 0.00 0.00 178.31 176.07 1t3v n GLU 82 N -5.42 0.33 0.00 1.11 1.02 -0.14 -0.20 120.64 117.34 1t3v n GLU 82 Ca 0.01 0.08 0.12 0.00 -0.02 0.00 0.00 57.16 57.35 1t3v n GLU 82 Cb 0.35 -1.50 0.29 0.00 -0.02 0.00 0.00 31.44 30.55 1t3v n GLU 82 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1t3v n ALA 83 N -1.16 3.40 -0.91 0.62 0.00 -0.78 -4.47 120.51 117.21 1t3v n ALA 83 Ca 0.09 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.21 1t3v n ALA 83 Cb 0.09 -1.16 0.00 0.00 0.00 0.00 0.00 19.45 18.38 1t3v n ALA 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1t3v n MET 84 N -1.52 0.11 -2.78 0.00 -0.00 0.65 -5.00 117.12 108.58 1t3v n MET 84 Ca 0.06 -0.36 -0.21 0.00 -0.00 0.00 0.00 57.70 57.19 1t3v n MET 84 Cb 0.34 -0.55 0.02 0.00 -0.00 0.00 0.00 33.22 33.03 1t3v n MET 84 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1t3v n GLY 85 N -0.03 -0.45 3.55 3.17 0.00 0.72 -4.95 105.19 107.20 1t3v n GLY 85 Ca 0.00 0.03 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 1t3v n GLY 85 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1t3v s VAL 86 N -3.09 3.81 0.45 1.61 1.01 -0.36 -4.98 120.40 118.86 1t3v s VAL 86 Ca 0.20 0.00 -0.22 0.00 0.00 0.00 0.00 61.98 61.96 1t3v s VAL 86 Cb -0.09 -4.95 -0.11 0.00 0.00 0.00 0.00 36.38 31.24 1t3v s VAL 86 CO 0.24 -1.87 0.76 1.17 0.00 0.00 0.00 175.10 175.41 1t3v n LYS 87 N 9.14 0.89 -3.92 2.72 4.81 -0.54 -4.62 118.16 126.64 1t3v n LYS 87 Ca 0.12 0.32 -0.30 0.00 -0.87 0.00 0.00 58.31 57.58 1t3v n LYS 87 Cb 0.49 -1.79 -0.15 0.00 0.02 0.00 0.00 35.03 33.60 1t3v n LYS 87 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1t3v s VAL 88 N -1.43 1.53 -0.62 3.15 1.01 -1.26 -1.36 120.40 121.42 1t3v s VAL 88 Ca 0.65 -1.37 -0.20 0.00 0.00 0.00 0.00 61.98 61.06 1t3v s VAL 88 Cb -0.55 -1.88 0.10 0.00 0.00 0.00 0.00 36.38 34.05 1t3v s VAL 88 CO 0.56 -0.23 0.78 -0.63 0.00 0.00 0.00 175.10 175.58 1t3v s ILE 89 N 1.37 4.71 0.66 2.22 1.01 0.06 -4.33 121.20 126.90 1t3v s ILE 89 Ca -0.02 -0.89 -0.08 0.00 0.00 0.00 0.00 60.65 59.66 1t3v s ILE 89 Cb -0.19 -4.55 0.02 0.00 0.01 0.00 0.00 42.46 37.76 1t3v s ILE 89 CO -0.09 -1.22 1.00 -0.54 0.00 0.00 0.00 174.94 174.09 1t3v s LYS 90 N 2.97 2.73 0.00 2.79 1.02 -1.25 -0.53 119.74 127.47 1t3v s LYS 90 Ca 0.15 0.12 0.00 0.00 0.02 0.00 0.00 55.97 56.25 1t3v s LYS 90 Cb -0.22 -2.15 0.00 0.00 -0.52 0.00 0.00 37.83 34.94 1t3v s LYS 90 CO 0.06 -0.95 0.00 0.41 -0.92 0.00 0.00 175.35 173.95 1t3v n GLY 91 N -2.82 0.46 3.90 -3.33 0.00 -0.54 -4.78 105.19 98.08 1t3v n GLY 91 Ca 0.06 -0.78 -0.28 0.00 0.00 0.00 0.00 46.02 45.02 1t3v n GLY 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t3v s ALA 92 N -2.00 2.99 0.11 4.61 0.00 -0.91 -4.98 121.76 121.57 1t3v s ALA 92 Ca 0.00 -0.59 -0.15 0.00 0.00 0.00 0.00 51.96 51.22 1t3v s ALA 92 Cb 0.00 -2.84 0.03 0.00 0.00 0.00 0.00 23.12 20.31 1t3v s ALA 92 CO 0.00 -1.19 0.37 -1.54 0.00 0.00 0.00 175.76 173.40 1t3v s SER 93 N -4.42 -0.19 0.00 0.00 1.04 -1.26 -4.27 113.70 104.60 1t3v s SER 93 Ca 0.58 -0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.71 1t3v s SER 93 Cb -0.11 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.46 1t3v s SER 93 CO 0.48 -0.80 0.00 0.61 0.98 0.00 0.00 173.24 174.51 1t3v n GLY 94 N -0.07 -0.02 3.87 7.32 0.00 -1.26 -4.57 105.19 110.47 1t3v n GLY 94 Ca -0.16 -2.29 -0.31 0.00 0.00 0.00 0.00 46.02 43.26 1t3v n GLY 94 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1t3v s THR 95 N -0.56 4.49 0.16 2.61 -4.23 -1.26 -2.01 115.64 114.84 1t3v s THR 95 Ca 0.00 0.81 -0.16 0.00 -1.18 0.00 0.00 61.69 61.16 1t3v s THR 95 Cb 0.00 -3.78 0.03 0.00 1.34 0.00 0.00 72.50 70.08 1t3v s THR 95 CO 0.00 -1.06 1.78 0.58 -0.54 0.00 0.00 174.62 175.39 1t3v h VAL 96 N -0.39 0.99 0.00 2.29 2.07 -1.22 -0.85 116.25 119.13 1t3v h VAL 96 Ca -0.44 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 66.93 1t3v h VAL 96 Cb 1.20 0.54 -0.00 0.00 -1.52 0.00 0.00 31.29 31.51 1t3v h VAL 96 CO 0.62 0.08 -0.02 1.05 0.02 0.00 0.00 177.57 179.31 1t3v h GLU 97 N 0.41 0.00 0.08 1.57 4.11 -1.83 0.12 114.58 119.04 1t3v h GLU 97 Ca 0.17 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.59 1t3v h GLU 97 Cb 0.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1t3v h GLU 97 CO -0.11 0.02 -0.04 1.49 0.07 0.00 0.00 179.01 180.44 1t3v h GLU 98 N 0.00 -0.10 -0.47 1.06 4.81 -1.57 -3.06 114.58 115.25 1t3v h GLU 98 Ca -0.00 0.01 0.08 0.00 -0.13 0.00 0.00 59.36 59.32 1t3v h GLU 98 Cb 0.05 0.02 -0.10 0.00 0.63 0.00 0.00 28.75 29.36 1t3v h GLU 98 CO 0.00 -0.07 -0.40 0.28 -0.73 0.00 0.00 179.01 178.09 1t3v h VAL 99 N -0.93 0.13 -0.09 0.32 2.07 -0.93 -0.59 116.25 116.23 1t3v h VAL 99 Ca -0.01 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.55 1t3v h VAL 99 Cb 0.08 0.13 -0.05 0.00 -1.52 0.00 0.00 31.29 29.93 1t3v h VAL 99 CO 0.02 0.00 -0.20 0.58 0.02 0.00 0.00 177.57 177.99 1t3v h VAL 100 N -0.27 0.50 -0.80 2.57 2.07 -1.15 -1.78 116.25 117.40 1t3v h VAL 100 Ca 0.17 0.00 0.10 0.00 0.82 0.00 0.00 66.70 67.79 1t3v h VAL 100 Cb 0.57 0.50 -0.07 0.00 -1.52 0.00 0.00 31.29 30.77 1t3v h VAL 100 CO -0.61 0.00 0.44 -1.13 0.02 0.00 0.00 177.57 176.28 1t3v h ASN 101 N -0.28 0.60 -0.52 0.57 -0.73 -1.15 -0.32 115.58 113.75 1t3v h ASN 101 Ca 0.09 0.06 -0.00 0.00 1.87 0.00 0.00 56.30 58.31 1t3v h ASN 101 Cb 0.40 -0.06 -0.02 0.00 0.27 0.00 0.00 38.32 38.91 1t3v h ASN 101 CO -0.25 0.33 0.31 1.56 -0.37 0.00 0.00 177.43 179.02 1t3v h GLN 102 N 0.72 0.71 -0.38 6.67 4.20 -0.33 0.63 115.11 127.33 1t3v h GLN 102 Ca 0.39 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 59.01 1t3v h GLN 102 Cb 0.40 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 28.01 1t3v h GLN 102 CO -0.27 0.52 0.13 -0.92 -0.67 0.00 0.00 178.83 177.62 1t3v h TYR 103 N 0.69 0.59 -0.26 2.96 3.20 -0.89 -1.80 116.97 121.46 1t3v h TYR 103 Ca 0.19 -0.06 0.02 0.00 3.14 0.00 0.00 58.73 62.02 1t3v h TYR 103 Cb -0.00 -0.17 -0.01 0.00 1.54 0.00 0.00 36.73 38.08 1t3v h TYR 103 CO -0.02 0.56 0.18 -0.07 -1.64 0.00 0.00 178.16 177.16 1t3v h LEU 104 N 0.46 0.25 0.00 2.82 4.07 -0.66 0.11 115.31 122.36 1t3v h LEU 104 Ca 0.12 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 58.08 1t3v h LEU 104 Cb 0.24 -0.06 0.00 0.00 1.08 0.00 0.00 40.66 41.91 1t3v h LEU 104 CO -0.01 0.18 0.00 -1.20 -1.08 0.00 0.00 178.44 176.33 1t3v n SER 105 N -4.50 0.00 0.00 -0.43 7.64 0.18 -4.91 113.62 111.60 1t3v n SER 105 Ca 0.01 0.49 0.00 0.00 1.01 0.00 0.00 58.87 60.38 1t3v n SER 105 Cb 0.12 -0.50 0.00 0.00 -1.01 0.00 0.00 64.21 62.82 1t3v n SER 105 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1t3v n GLY 106 N 0.72 0.78 0.07 0.23 0.00 0.38 -4.95 105.19 102.42 1t3v n GLY 106 Ca 0.05 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.94 1t3v n GLY 106 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1t3v h GLN 107 N 2.83 -0.03 -7.01 1.61 4.20 -1.54 -3.45 115.11 111.71 1t3v h GLN 107 Ca 0.00 0.00 -0.53 0.00 0.06 0.00 0.00 58.65 58.18 1t3v h GLN 107 Cb 0.00 0.01 0.10 0.00 0.30 0.00 0.00 27.48 27.89 1t3v h GLN 107 CO 0.00 0.50 0.59 -0.51 -0.67 0.00 0.00 178.83 178.74 1t3v s LEU 108 N -9.11 3.99 0.11 1.46 1.02 -1.24 -5.02 118.68 109.89 1t3v s LEU 108 Ca -0.16 2.64 -0.08 0.00 0.02 0.00 0.00 54.13 56.55 1t3v s LEU 108 Cb 0.01 -4.16 -0.01 0.00 0.02 0.00 0.00 46.19 42.05 1t3v s LEU 108 CO 0.66 -1.22 0.18 -1.59 0.02 0.00 0.00 176.35 174.40 1t3v s LYS 109 N -2.68 0.90 -0.07 1.70 0.00 -1.26 -4.85 119.74 113.48 1t3v s LYS 109 Ca 0.66 -1.06 0.15 0.00 0.00 0.00 0.00 55.97 55.72 1t3v s LYS 109 Cb -0.37 0.33 0.51 0.00 0.00 0.00 0.00 37.83 38.30 1t3v s LYS 109 CO 0.45 -0.29 1.43 -0.40 0.00 0.00 0.00 175.35 176.54 1t3v n ASP 110 N -0.08 3.78 0.00 0.03 5.75 -1.26 -3.86 116.55 120.91 1t3v n ASP 110 Ca -0.13 -2.36 0.00 0.00 -0.01 0.00 0.00 54.79 52.29 1t3v n ASP 110 Cb 0.62 -0.43 0.00 0.00 -1.03 0.00 0.00 41.12 40.29 1t3v n ASP 110 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 1t3v n SER 111 N 0.56 -0.07 -3.74 -1.12 3.41 -1.26 -4.74 113.62 106.66 1t3v n SER 111 Ca 0.19 0.00 -0.27 0.00 -0.26 0.00 0.00 58.87 58.53 1t3v n SER 111 Cb 0.69 0.00 -0.17 0.00 -0.26 0.00 0.00 64.21 64.47 1t3v n SER 111 CO 0.00 0.00 0.00 -1.81 -0.16 0.00 0.00 175.04 173.07 1t3v s ASP 112 N -4.00 2.74 0.32 4.04 1.01 -1.26 -5.12 116.67 114.40 1t3v s ASP 112 Ca 0.00 -0.73 0.05 0.00 0.71 0.00 0.00 52.55 52.58 1t3v s ASP 112 Cb 0.00 -0.57 -0.03 0.00 1.01 0.00 0.00 42.92 43.33 1t3v s ASP 112 CO 0.00 -0.29 0.22 -0.47 0.21 0.00 0.00 175.17 174.84 1t3v s TYR 113 N 1.88 1.67 -0.92 4.23 5.04 -1.26 -5.08 117.35 122.91 1t3v s TYR 113 Ca -0.00 -1.54 -0.24 0.00 -2.44 0.00 0.00 57.07 52.84 1t3v s TYR 113 Cb -0.16 -0.78 -0.05 0.00 0.35 0.00 0.00 41.96 41.32 1t3v s TYR 113 CO -0.08 -0.72 1.93 -1.21 -1.34 0.00 0.00 175.55 174.14 1t3v s GLU 114 N -3.61 2.59 0.00 4.97 0.41 -1.26 -4.83 118.70 116.96 1t3v s GLU 114 Ca 0.37 -0.37 -0.02 0.00 -0.41 0.00 0.00 54.97 54.54 1t3v s GLU 114 Cb 0.03 -5.08 -0.10 0.00 -1.78 0.00 0.00 34.13 27.20 1t3v s GLU 114 CO 0.23 -3.37 2.59 1.33 -0.49 0.00 0.00 175.26 175.54 1t3v n VAL 115 N 7.84 2.35 -3.72 2.63 0.24 -1.26 -4.85 118.33 121.55 1t3v n VAL 115 Ca 0.40 -0.87 -0.33 0.00 -2.04 0.00 0.00 64.34 61.50 1t3v n VAL 115 Cb 0.47 -1.68 -0.05 0.00 -1.47 0.00 0.00 33.84 31.11 1t3v n VAL 115 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1t3v s HIS 116 N 0.42 3.53 0.11 6.34 5.04 -1.26 -5.08 115.29 124.39 1t3v s HIS 116 Ca 0.25 0.55 -0.31 0.00 -1.54 0.00 0.00 55.06 54.02 1t3v s HIS 116 Cb 0.12 -1.99 -0.08 0.00 0.04 0.00 0.00 32.58 30.67 1t3v s HIS 116 CO 0.00 0.53 1.41 0.16 -2.34 0.00 0.00 174.74 174.49 1t3v s ASP 117 N -2.10 6.81 -0.18 9.88 -4.77 -1.26 -5.03 116.67 120.02 1t3v s ASP 117 Ca 0.34 2.34 -0.30 0.00 -3.30 0.00 0.00 52.55 51.64 1t3v s ASP 117 Cb -0.13 -2.59 0.13 0.00 -1.09 0.00 0.00 42.92 39.25 1t3v s ASP 117 CO 0.21 -0.67 1.04 -1.38 0.70 0.00 0.00 175.17 175.07 1t3v s HIS 118 N 1.17 -0.33 0.52 2.11 -3.43 -1.26 -5.17 115.29 108.90 1t3v s HIS 118 Ca 0.65 0.58 0.00 0.00 -0.80 0.00 0.00 55.06 55.49 1t3v s HIS 118 Cb -0.37 0.45 0.00 0.00 -1.43 0.00 0.00 32.58 31.23 1t3v s HIS 118 CO 0.30 -0.30 0.00 1.58 -2.00 0.00 0.00 174.74 174.32 1t3v n HIS 119 N 0.75 -3.61 -1.80 0.38 -0.00 -1.26 -5.05 115.22 104.62 1t3v n HIS 119 Ca -0.09 1.94 0.15 0.00 -0.00 0.00 0.00 57.72 59.71 1t3v n HIS 119 Cb 0.58 -3.29 -0.04 0.00 -0.00 0.00 0.00 29.99 27.25 1t3v n HIS 119 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 1t3v n HIS 120 N -4.22 -3.20 0.00 1.57 -0.00 -1.26 -5.04 115.22 103.06 1t3v n HIS 120 Ca -0.06 1.33 0.00 0.00 -0.00 0.00 0.00 57.72 58.99 1t3v n HIS 120 Cb 0.64 -2.42 0.00 0.00 -0.00 0.00 0.00 29.99 28.22 1t3v n HIS 120 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 1t3v n HIS 121 N -3.47 0.00 -3.53 4.41 -0.00 -1.26 -5.20 115.22 106.17 1t3v n HIS 121 Ca 0.01 0.00 -0.12 0.00 0.46 0.00 0.00 57.72 58.07 1t3v n HIS 121 Cb 0.49 0.00 -0.04 0.00 -0.12 0.00 0.00 29.99 30.32 1t3v n HIS 121 CO 0.00 0.00 0.00 -1.83 0.46 0.00 0.00 176.34 174.97 1t3v s GLU 122 N 0.00 0.81 0.77 1.57 1.03 -1.26 -5.18 118.70 116.44 1t3v s GLU 122 Ca 0.00 -0.00 -0.07 0.00 0.03 0.00 0.00 54.97 54.93 1t3v s GLU 122 Cb 0.00 0.38 0.12 0.00 -0.80 0.00 0.00 34.13 33.83 1t3v s GLU 122 CO 0.00 -0.29 1.08 -1.01 -1.33 0.00 0.00 175.26 173.71 1t3v s HIS 123 N -1.90 2.07 -2.99 4.83 3.76 -1.26 -5.28 115.29 114.52 1t3v s HIS 123 Ca -0.02 0.13 0.24 0.00 -0.15 0.00 0.00 55.06 55.26 1t3v s HIS 123 Cb -0.01 -3.36 0.20 0.00 1.11 0.00 0.00 32.58 30.53 1t3v s HIS 123 CO -0.01 -1.84 1.27 -2.39 -0.85 0.00 0.00 174.74 170.92