#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i2t n GLY 7 N 0.00 0.57 3.09 -0.02 0.00 -1.26 -4.97 105.19 102.60 2i2t n GLY 7 Ca 0.00 -0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.79 2i2t n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2i2t s SER 8 N -2.36 1.73 0.00 1.61 0.01 -1.26 -5.07 113.70 108.36 2i2t s SER 8 Ca 0.00 -0.27 0.00 0.00 1.31 0.00 0.00 55.95 56.99 2i2t s SER 8 Cb 0.00 -0.36 0.00 0.00 0.21 0.00 0.00 66.02 65.87 2i2t s SER 8 CO 0.00 0.14 0.00 1.07 0.41 0.00 0.00 173.24 174.86 2i2t n THR 9 N 3.01 0.00 -1.24 1.44 5.66 -1.26 -5.18 114.28 116.71 2i2t n THR 9 Ca -0.17 0.00 0.14 0.00 -3.05 0.00 0.00 64.05 60.98 2i2t n THR 9 Cb 0.54 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.26 2i2t n THR 9 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 2i2t n ARG 10 N 0.00 -2.46 0.00 1.09 3.00 -1.26 -5.07 116.66 111.96 2i2t n ARG 10 Ca 0.00 1.87 0.00 0.00 -0.01 0.00 0.00 57.85 59.71 2i2t n ARG 10 Cb 0.00 -3.04 0.00 0.00 0.00 0.00 0.00 32.46 29.42 2i2t n ARG 10 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 2i2t n ASN 11 N -4.24 0.00 -3.15 0.55 2.85 -1.26 -5.17 115.26 104.84 2i2t n ASN 11 Ca -0.04 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.43 2i2t n ASN 11 Cb 0.62 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.64 2i2t n ASN 11 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2i2t n GLY 12 N -0.78 -2.96 0.00 8.20 0.00 -1.26 -5.09 105.19 103.30 2i2t n GLY 12 Ca 0.00 -1.32 0.00 0.00 0.00 0.00 0.00 46.02 44.70 2i2t n GLY 12 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2i2t n ARG 13 N -1.05 3.71 0.00 1.61 3.00 -1.26 -5.09 116.66 117.59 2i2t n ARG 13 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 2i2t n ARG 13 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 2i2t n ARG 13 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 2i2t n ASP 14 N -0.01 0.00 -2.03 6.15 9.92 -1.26 -4.79 116.55 124.53 2i2t n ASP 14 Ca 0.00 0.29 -0.20 0.00 -0.53 0.00 0.00 54.79 54.35 2i2t n ASP 14 Cb 0.00 0.00 -0.04 0.00 -0.64 0.00 0.00 41.12 40.44 2i2t n ASP 14 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 2i2t n SER 15 N -0.59 -5.46 0.00 -2.24 7.64 -1.26 -4.80 113.62 106.90 2i2t n SER 15 Ca 0.00 0.23 0.00 0.00 1.01 0.00 0.00 58.87 60.11 2i2t n SER 15 Cb 0.00 -4.68 0.00 0.00 -1.01 0.00 0.00 64.21 58.52 2i2t n SER 15 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2i2t n GLU 16 N -2.68 0.00 -2.28 1.43 -0.58 -1.26 -4.86 120.64 110.41 2i2t n GLU 16 Ca -0.22 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.52 2i2t n GLU 16 Cb 0.67 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.54 2i2t n GLU 16 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2i2t n ALA 17 N 0.00 -1.96 0.00 0.62 0.00 -1.26 -4.93 120.51 112.98 2i2t n ALA 17 Ca 0.00 0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.92 2i2t n ALA 17 Cb 0.00 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 17.99 2i2t n ALA 17 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2i2t n LYS 18 N 1.90 -3.56 -2.53 0.00 3.00 -1.26 -4.42 118.16 111.29 2i2t n LYS 18 Ca 0.00 0.00 -0.42 0.00 -0.00 0.00 0.00 58.31 57.89 2i2t n LYS 18 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 35.03 35.00 2i2t n LYS 18 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 2i2t s ARG 19 N -2.00 4.51 0.00 1.64 3.00 -1.26 -0.84 118.95 123.99 2i2t s ARG 19 Ca 0.00 1.65 0.00 0.00 0.00 0.00 0.00 55.73 57.38 2i2t s ARG 19 Cb 0.00 -3.37 0.00 0.00 0.00 0.00 0.00 34.95 31.58 2i2t s ARG 19 CO 0.00 -0.12 0.84 1.28 0.00 0.00 0.00 175.30 177.30 2i2t n LEU 20 N 3.63 1.63 -2.93 2.53 4.77 0.18 -4.73 117.00 122.07 2i2t n LEU 20 Ca 0.07 -1.63 -0.13 0.00 -0.03 0.00 0.00 56.01 54.29 2i2t n LEU 20 Cb 0.48 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.59 2i2t n LEU 20 CO 0.54 0.41 -0.01 0.61 -1.33 0.00 0.00 177.39 177.60 2i2t n GLY 21 N -0.35 2.31 3.77 -0.72 0.00 -0.42 -4.56 105.19 105.22 2i2t n GLY 21 Ca 0.00 -1.09 -0.40 0.00 0.00 0.00 0.00 46.02 44.53 2i2t n GLY 21 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2i2t s VAL 22 N -1.74 2.39 0.11 1.61 -7.23 -1.26 -4.80 120.40 109.48 2i2t s VAL 22 Ca 0.32 0.39 0.00 0.00 -1.81 0.00 0.00 61.98 60.87 2i2t s VAL 22 Cb 0.36 -3.24 0.00 0.00 0.56 0.00 0.00 36.38 34.06 2i2t s VAL 22 CO -0.05 0.08 0.00 2.29 -0.31 0.00 0.00 175.10 177.11 2i2t n LYS 23 N 0.47 -0.95 -1.68 4.82 -0.00 -1.26 -4.45 118.16 115.11 2i2t n LYS 23 Ca 0.01 0.63 -0.46 0.00 -0.00 0.00 0.00 58.31 58.49 2i2t n LYS 23 Cb 0.41 -1.16 -0.04 0.00 -0.00 0.00 0.00 35.03 34.24 2i2t n LYS 23 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.40 180.29 2i2t n ARG 24 N -1.93 2.35 -4.63 -1.58 -4.01 -0.99 -3.96 116.66 101.92 2i2t n ARG 24 Ca 0.00 0.86 -0.29 0.00 -1.04 0.00 0.00 57.85 57.38 2i2t n ARG 24 Cb 0.21 -2.70 -0.08 0.00 -3.04 0.00 0.00 32.46 26.85 2i2t n ARG 24 CO 0.00 0.00 0.00 -0.06 -3.04 0.00 0.00 177.63 174.53 2i2t s PHE 25 N 2.99 1.90 0.47 2.89 2.99 -1.26 -4.62 117.98 123.33 2i2t s PHE 25 Ca 0.87 -1.07 0.17 0.00 0.00 0.00 0.00 56.93 56.90 2i2t s PHE 25 Cb -0.63 -1.42 1.14 0.00 0.00 0.00 0.00 43.02 42.12 2i2t s PHE 25 CO 0.44 0.02 2.05 0.78 -0.00 0.00 0.00 175.22 178.51 2i2t h GLY 26 N 1.62 0.00 -6.10 4.36 0.00 -1.93 -3.02 103.07 98.01 2i2t h GLY 26 Ca -0.40 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 46.83 2i2t h GLY 26 CO 0.67 0.00 -1.01 0.61 0.00 0.00 0.00 176.54 176.81 2i2t n GLY 27 N -1.12 -0.86 3.13 4.60 0.00 -1.24 -3.21 105.19 106.49 2i2t n GLY 27 Ca -0.03 0.51 -0.29 0.00 0.00 0.00 0.00 46.02 46.21 2i2t n GLY 27 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2i2t n GLU 28 N 0.66 -4.65 0.17 1.61 4.07 -1.26 0.55 120.64 121.79 2i2t n GLU 28 Ca -0.01 -1.39 0.17 0.00 -0.06 0.00 0.00 57.16 55.87 2i2t n GLU 28 Cb 0.46 -1.85 0.65 0.00 -0.06 0.00 0.00 31.44 30.63 2i2t n GLU 28 CO 0.00 0.00 0.00 0.77 -0.06 0.00 0.00 177.13 177.84 2i2t h SER 29 N -3.59 0.00 0.00 4.31 0.02 -1.91 -3.22 113.55 109.16 2i2t h SER 29 Ca -0.38 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.45 2i2t h SER 29 Cb 1.27 0.00 -0.12 0.00 0.14 0.00 0.00 62.40 63.69 2i2t h SER 29 CO 0.23 0.00 -0.07 0.55 -1.14 0.00 0.00 176.83 176.40 2i2t n VAL 30 N -3.21 0.00 -0.68 2.27 3.14 -1.25 -3.64 118.33 114.97 2i2t n VAL 30 Ca 0.05 -0.84 -0.15 0.00 -2.96 0.00 0.00 64.34 60.44 2i2t n VAL 30 Cb 0.69 1.17 0.13 0.00 -1.06 0.00 0.00 33.84 34.78 2i2t n VAL 30 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 2i2t n LEU 31 N 0.80 0.00 -0.01 6.55 4.77 -1.24 -4.93 117.00 122.93 2i2t n LEU 31 Ca -0.01 -0.58 -0.00 0.00 -0.03 0.00 0.00 56.01 55.39 2i2t n LEU 31 Cb 0.73 -0.52 -0.00 0.00 -2.33 0.00 0.00 43.42 41.30 2i2t n LEU 31 CO -0.08 -1.70 -0.00 0.00 -1.33 0.00 0.00 177.39 174.28 2i2t h ALA 32 N -2.46 0.00 0.00 -1.18 0.00 -1.88 -3.39 119.26 110.36 2i2t h ALA 32 Ca -0.21 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2i2t h ALA 32 Cb 0.65 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2i2t h ALA 32 CO 0.14 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.80 2i2t n GLY 33 N 1.95 2.00 2.78 0.00 0.00 -1.26 -4.34 105.19 106.32 2i2t n GLY 33 Ca -0.00 -0.44 -0.16 0.00 0.00 0.00 0.00 46.02 45.42 2i2t n GLY 33 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2i2t s SER 34 N -1.43 1.35 -0.04 1.61 0.15 -1.25 0.52 113.70 114.60 2i2t s SER 34 Ca 0.00 -0.43 -0.06 0.00 0.70 0.00 0.00 55.95 56.16 2i2t s SER 34 Cb 0.00 0.57 -0.03 0.00 -1.71 0.00 0.00 66.02 64.84 2i2t s SER 34 CO 0.00 -0.35 0.31 0.40 1.20 0.00 0.00 173.24 174.80 2i2t h ILE 35 N 6.27 0.00 -1.57 6.45 2.04 -1.29 -1.68 117.51 127.72 2i2t h ILE 35 Ca -0.15 -0.53 0.00 0.00 1.00 0.00 0.00 64.86 65.17 2i2t h ILE 35 Cb 1.11 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 37.19 2i2t h ILE 35 CO 0.31 0.00 0.00 -0.38 0.00 0.00 0.00 178.15 178.08 2i2t n ILE 36 N -4.05 0.00 -0.17 -0.67 5.41 -1.25 -4.33 119.36 114.30 2i2t n ILE 36 Ca -0.03 0.00 -0.15 0.00 1.00 0.00 0.00 62.75 63.57 2i2t n ILE 36 Cb 0.08 0.00 0.15 0.00 -0.71 0.00 0.00 39.64 39.16 2i2t n ILE 36 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 2i2t n VAL 37 N -0.05 0.00 0.00 1.39 0.31 -1.26 -2.97 118.33 115.75 2i2t n VAL 37 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2i2t n VAL 37 Cb 0.00 -0.50 0.00 0.00 -0.91 0.00 0.00 33.84 32.43 2i2t n VAL 37 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2i2t n ARG 38 N -3.42 0.00 -1.53 5.55 5.12 -1.26 -4.84 116.66 116.29 2i2t n ARG 38 Ca 0.07 0.00 -0.44 0.00 -1.93 0.00 0.00 57.85 55.55 2i2t n ARG 38 Cb 0.30 -0.12 -0.05 0.00 -1.16 0.00 0.00 32.46 31.43 2i2t n ARG 38 CO 0.00 0.00 0.00 0.94 -1.93 0.00 0.00 177.63 176.64 2i2t n GLN 39 N 0.00 1.33 -0.06 5.56 0.00 -1.16 -4.74 117.38 118.31 2i2t n GLN 39 Ca 0.00 0.30 -0.07 0.00 -0.00 0.00 0.00 57.00 57.24 2i2t n GLN 39 Cb 0.00 -2.89 -0.10 0.00 0.00 0.00 0.00 30.24 27.25 2i2t n GLN 39 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.06 174.93 2i2t n ARG 40 N 8.59 1.82 0.00 3.69 0.63 -1.26 -4.65 116.66 125.49 2i2t n ARG 40 Ca 0.38 0.00 0.02 0.00 -0.92 0.00 0.00 57.85 57.33 2i2t n ARG 40 Cb 0.36 -1.32 -0.01 0.00 0.45 0.00 0.00 32.46 31.93 2i2t n ARG 40 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2i2t n GLY 41 N 2.26 0.39 0.23 5.14 0.00 -1.26 -4.27 105.19 107.68 2i2t n GLY 41 Ca -0.21 -0.11 0.08 0.00 0.00 0.00 0.00 46.02 45.78 2i2t n GLY 41 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2i2t h THR 42 N 0.13 0.94 -2.42 2.61 2.02 -1.93 -3.40 112.91 110.85 2i2t h THR 42 Ca 0.00 -0.65 -0.07 0.00 0.77 0.00 0.00 66.41 66.45 2i2t h THR 42 Cb 0.10 1.37 -0.24 0.00 -1.74 0.00 0.00 68.15 67.64 2i2t h THR 42 CO 0.00 0.18 -0.16 -0.54 0.37 0.00 0.00 175.52 175.37 2i2t s LYS 43 N -4.44 0.54 0.17 6.66 -0.14 -1.26 -4.71 119.74 116.56 2i2t s LYS 43 Ca -0.03 0.89 0.08 0.00 -1.36 0.00 0.00 55.97 55.54 2i2t s LYS 43 Cb 0.15 0.11 -0.04 0.00 -1.68 0.00 0.00 37.83 36.37 2i2t s LYS 43 CO 0.66 -0.13 -0.02 -0.06 -0.76 0.00 0.00 175.35 175.04 2i2t s PHE 44 N 1.14 2.80 0.20 3.18 0.08 -1.26 -4.52 117.98 119.60 2i2t s PHE 44 Ca -0.07 -0.15 -0.30 0.00 0.12 0.00 0.00 56.93 56.53 2i2t s PHE 44 Cb -0.06 -1.36 -0.08 0.00 -0.57 0.00 0.00 43.02 40.95 2i2t s PHE 44 CO -0.11 0.52 1.01 -3.38 -0.10 0.00 0.00 175.22 173.16 2i2t s HIS 45 N -1.72 3.78 -0.07 0.36 -3.43 -1.26 0.50 115.29 113.45 2i2t s HIS 45 Ca 0.27 1.77 -0.30 0.00 -0.80 0.00 0.00 55.06 56.01 2i2t s HIS 45 Cb -0.09 -3.12 0.11 0.00 -1.43 0.00 0.00 32.58 28.05 2i2t s HIS 45 CO 0.18 -0.04 0.92 0.00 -2.00 0.00 0.00 174.74 173.80 2i2t s ALA 46 N -0.67 -1.87 0.00 -1.38 0.00 -0.56 -4.75 121.76 112.53 2i2t s ALA 46 Ca 0.45 1.26 0.00 0.00 0.00 0.00 0.00 51.96 53.67 2i2t s ALA 46 Cb -0.27 -0.04 0.00 0.00 0.00 0.00 0.00 23.12 22.81 2i2t s ALA 46 CO 0.34 -0.53 0.00 0.41 0.00 0.00 0.00 175.76 175.98 2i2t n GLY 47 N 0.19 0.58 0.96 0.00 0.00 -1.26 -3.33 105.19 102.32 2i2t n GLY 47 Ca -0.10 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.09 2i2t n GLY 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i2t n ALA 48 N 3.28 1.69 -3.54 4.61 0.00 -1.25 -4.43 120.51 120.87 2i2t n ALA 48 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.27 2i2t n ALA 48 Cb 0.00 -1.00 -0.06 0.00 0.00 0.00 0.00 19.45 18.39 2i2t n ALA 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2i2t s ASN 49 N 0.86 -0.66 0.00 0.00 4.22 -1.21 -3.20 114.94 114.95 2i2t s ASN 49 Ca 0.00 0.81 0.00 0.00 -2.14 0.00 0.00 52.86 51.53 2i2t s ASN 49 Cb 0.00 0.66 0.00 0.00 1.28 0.00 0.00 41.25 43.19 2i2t s ASN 49 CO 0.00 -0.55 0.00 1.33 -2.04 0.00 0.00 177.10 175.84 2i2t n VAL 50 N 1.16 0.00 0.00 3.54 0.24 -1.26 -2.83 118.33 119.19 2i2t n VAL 50 Ca -0.18 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.12 2i2t n VAL 50 Cb 0.57 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.94 2i2t n VAL 50 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2i2t n GLY 51 N 0.00 0.62 3.26 7.63 0.00 -1.26 -1.90 105.19 113.53 2i2t n GLY 51 Ca 0.00 0.51 -0.10 0.00 0.00 0.00 0.00 46.02 46.42 2i2t n GLY 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2i2t n GLY 53 N -1.61 -2.72 0.28 0.00 0.00 -1.06 -4.55 105.19 95.53 2i2t n GLY 53 Ca -0.06 -0.97 0.04 0.00 0.00 0.00 0.00 46.02 45.03 2i2t n GLY 53 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2i2t h ARG 54 N -2.73 0.05 -1.04 1.61 3.08 -1.92 0.56 114.38 113.97 2i2t h ARG 54 Ca -0.34 -0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.58 2i2t h ARG 54 Cb 0.99 -0.01 -0.08 0.00 0.08 0.00 0.00 29.97 30.96 2i2t h ARG 54 CO 0.22 0.03 0.17 -0.40 -1.07 0.00 0.00 179.97 178.92 2i2t n ASP 55 N -5.42 3.34 -1.94 7.04 5.75 -1.26 -4.82 116.55 119.24 2i2t n ASP 55 Ca 0.12 -2.42 -0.15 0.00 -0.01 0.00 0.00 54.79 52.34 2i2t n ASP 55 Cb 0.44 -0.61 -0.03 0.00 -1.03 0.00 0.00 41.12 39.88 2i2t n ASP 55 CO 0.00 0.00 0.00 1.41 -0.11 0.00 0.00 177.20 178.50 2i2t n HIS 56 N 0.14 -0.80 -2.33 2.11 8.25 0.19 -4.01 115.22 118.77 2i2t n HIS 56 Ca 0.15 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.18 2i2t n HIS 56 Cb 0.78 -2.94 -0.02 0.00 1.12 0.00 0.00 29.99 28.93 2i2t n HIS 56 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2i2t s THR 57 N -2.50 3.86 -0.80 1.59 2.01 -1.25 -4.71 115.64 113.84 2i2t s THR 57 Ca 0.00 0.86 -0.23 0.00 0.31 0.00 0.00 61.69 62.62 2i2t s THR 57 Cb 0.00 -4.19 -0.18 0.00 0.01 0.00 0.00 72.50 68.14 2i2t s THR 57 CO 0.00 -0.78 2.42 0.18 -0.69 0.00 0.00 174.62 175.75 2i2t n LEU 58 N 9.05 0.90 0.00 4.42 7.99 -0.63 -2.55 117.00 136.17 2i2t n LEU 58 Ca 0.17 -0.66 0.00 0.00 -0.01 0.00 0.00 56.01 55.50 2i2t n LEU 58 Cb 0.48 -1.24 0.00 0.00 -0.11 0.00 0.00 43.42 42.55 2i2t n LEU 58 CO 0.70 -1.68 0.02 0.33 -1.51 0.00 0.00 177.39 175.26 2i2t n PHE 59 N 13.33 0.00 0.00 -1.77 7.35 -0.80 -3.86 117.46 131.71 2i2t n PHE 59 Ca 0.53 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 57.22 2i2t n PHE 59 Cb 0.31 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.14 2i2t n PHE 59 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2i2t n ALA 60 N -2.80 0.00 -1.00 3.13 0.00 -1.25 -4.24 120.51 114.35 2i2t n ALA 60 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2i2t n ALA 60 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2i2t n ALA 60 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2i2t n LYS 61 N 0.00 2.36 -1.33 0.00 4.01 -1.22 -3.79 118.16 118.18 2i2t n LYS 61 Ca 0.00 0.00 -0.52 0.00 -0.51 0.00 0.00 58.31 57.28 2i2t n LYS 61 Cb 0.00 0.00 -0.07 0.00 -0.51 0.00 0.00 35.03 34.45 2i2t n LYS 61 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2i2t n ALA 62 N -3.00 -2.56 -1.40 7.82 0.00 -1.19 -3.81 120.51 116.36 2i2t n ALA 62 Ca 0.00 0.48 -0.46 0.00 0.00 0.00 0.00 53.44 53.46 2i2t n ALA 62 Cb 0.00 -1.53 -0.02 0.00 0.00 0.00 0.00 19.45 17.90 2i2t n ALA 62 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2i2t n ASP 63 N 1.91 -1.31 0.00 0.00 5.75 -1.22 -4.90 116.55 116.78 2i2t n ASP 63 Ca 0.20 1.05 0.00 0.00 -0.01 0.00 0.00 54.79 56.03 2i2t n ASP 63 Cb 0.03 -0.98 0.00 0.00 -1.03 0.00 0.00 41.12 39.14 2i2t n ASP 63 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2i2t n GLY 64 N 1.98 2.63 3.38 6.12 0.00 0.19 -4.74 105.19 114.74 2i2t n GLY 64 Ca 0.15 -1.38 -0.36 0.00 0.00 0.00 0.00 46.02 44.44 2i2t n GLY 64 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2i2t n LYS 65 N -1.45 0.15 -4.04 1.61 4.76 -0.58 -3.66 118.16 114.94 2i2t n LYS 65 Ca 0.00 0.09 -0.29 0.00 -2.87 0.00 0.00 58.31 55.23 2i2t n LYS 65 Cb 0.00 -1.64 -0.06 0.00 -1.84 0.00 0.00 35.03 31.49 2i2t n LYS 65 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2i2t s VAL 66 N -1.99 4.61 -0.02 -0.18 1.01 -1.25 -2.33 120.40 120.24 2i2t s VAL 66 Ca 0.60 -0.81 -0.02 0.00 0.00 0.00 0.00 61.98 61.76 2i2t s VAL 66 Cb -0.33 -3.26 -0.01 0.00 0.00 0.00 0.00 36.38 32.78 2i2t s VAL 66 CO 0.63 0.07 -0.04 1.17 0.00 0.00 0.00 175.10 176.92 2i2t n LYS 67 N 0.22 0.06 -1.91 2.72 3.00 0.11 -2.34 118.16 120.03 2i2t n LYS 67 Ca -0.08 0.02 -0.02 0.00 -0.00 0.00 0.00 58.31 58.23 2i2t n LYS 67 Cb 0.52 -0.50 -0.02 0.00 0.00 0.00 0.00 35.03 35.03 2i2t n LYS 67 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 2i2t n PHE 68 N -2.77 -1.70 0.00 5.64 3.72 -1.25 -4.79 117.46 116.32 2i2t n PHE 68 Ca -0.02 0.97 0.00 0.00 -0.05 0.00 0.00 57.45 58.36 2i2t n PHE 68 Cb 0.06 -2.43 0.00 0.00 -0.94 0.00 0.00 39.48 36.18 2i2t n PHE 68 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 2i2t n GLU 69 N 0.62 1.11 0.00 -1.08 1.02 -0.43 -5.00 120.64 116.88 2i2t n GLU 69 Ca -0.15 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.99 2i2t n GLU 69 Cb 0.23 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.65 2i2t n GLU 69 CO 0.00 0.00 0.00 1.55 1.18 0.00 0.00 177.13 179.86 2i2t n VAL 70 N 0.00 0.00 0.00 2.62 3.14 -0.68 -4.65 118.33 118.76 2i2t n VAL 70 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 2i2t n VAL 70 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.78 2i2t n VAL 70 CO 0.00 0.00 0.00 0.29 -6.46 0.00 0.00 176.83 170.66 2i2t n LYS 71 N 0.00 1.86 0.00 1.45 4.01 -0.70 -4.98 118.16 119.79 2i2t n LYS 71 Ca 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 2i2t n LYS 71 Cb 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 34.52 2i2t n LYS 71 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2i2t n GLY 72 N 4.32 -0.03 0.00 0.72 0.00 -1.26 -3.27 105.19 105.67 2i2t n GLY 72 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2i2t n GLY 72 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2i2t n PRO 73 N 0.00 0.00 -2.88 1.61 -0.02 -1.26 -1.95 135.00 130.50 2i2t n PRO 73 Ca 0.00 0.00 -0.09 0.00 -2.02 0.00 0.00 63.50 61.39 2i2t n PRO 73 Cb 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 33.50 33.49 2i2t n PRO 73 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 2i2t n LYS 74 N 0.00 -2.34 0.00 -0.52 4.81 -1.26 -4.31 118.16 114.53 2i2t n LYS 74 Ca 0.00 2.09 0.00 0.00 -0.87 0.00 0.00 58.31 59.53 2i2t n LYS 74 Cb 0.00 -5.56 0.00 0.00 0.02 0.00 0.00 35.03 29.49 2i2t n LYS 74 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 2i2t n ASN 75 N -0.34 0.00 -1.63 3.14 2.85 -0.82 -4.94 115.26 113.52 2i2t n ASN 75 Ca 0.11 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.58 2i2t n ASN 75 Cb 0.47 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.49 2i2t n ASN 75 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 2i2t n ARG 76 N 0.00 -4.51 0.00 1.20 5.12 -1.26 -1.72 116.66 115.48 2i2t n ARG 76 Ca 0.00 3.26 0.00 0.00 -1.93 0.00 0.00 57.85 59.18 2i2t n ARG 76 Cb 0.00 -3.56 0.00 0.00 -1.16 0.00 0.00 32.46 27.74 2i2t n ARG 76 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 2i2t n LYS 77 N 0.58 0.00 -0.68 5.56 4.01 -1.26 -2.89 118.16 123.48 2i2t n LYS 77 Ca 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 2i2t n LYS 77 Cb 0.00 -0.96 0.00 0.00 -0.51 0.00 0.00 35.03 33.56 2i2t n LYS 77 CO 0.00 0.00 0.00 1.19 -1.11 0.00 0.00 177.40 177.48 2i2t n PHE 78 N -0.47 -0.52 -4.62 2.13 3.72 -1.26 -1.69 117.46 114.76 2i2t n PHE 78 Ca 0.00 0.31 -0.33 0.00 -0.05 0.00 0.00 57.45 57.38 2i2t n PHE 78 Cb 0.00 -2.18 -0.15 0.00 -0.94 0.00 0.00 39.48 36.21 2i2t n PHE 78 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2i2t s ILE 79 N -0.05 2.62 0.11 4.37 1.01 0.18 -1.31 121.20 128.12 2i2t s ILE 79 Ca 0.00 -0.79 0.03 0.00 0.00 0.00 0.00 60.65 59.88 2i2t s ILE 79 Cb 0.00 -2.10 -0.04 0.00 0.01 0.00 0.00 42.46 40.33 2i2t s ILE 79 CO 0.00 0.52 -0.08 -0.94 0.00 0.00 0.00 174.94 174.44 2i2t s SER 80 N 0.72 1.33 -0.12 3.58 1.04 -1.24 -1.50 113.70 117.52 2i2t s SER 80 Ca -0.07 -0.98 -0.00 0.00 0.48 0.00 0.00 55.95 55.38 2i2t s SER 80 Cb -0.16 0.06 0.02 0.00 0.10 0.00 0.00 66.02 66.05 2i2t s SER 80 CO 0.01 -0.41 -0.09 0.27 0.98 0.00 0.00 173.24 174.01 2i2t s ILE 81 N -3.39 1.10 0.33 -1.02 -4.36 -1.26 0.10 121.20 112.69 2i2t s ILE 81 Ca 0.12 -0.34 -0.13 0.00 -0.26 0.00 0.00 60.65 60.05 2i2t s ILE 81 Cb 0.04 -1.10 -0.08 0.00 1.25 0.00 0.00 42.46 42.57 2i2t s ILE 81 CO -0.03 0.38 0.71 -1.61 0.24 0.00 0.00 174.94 174.63 2i2t s GLU 82 N 1.66 3.90 0.37 0.37 2.02 -0.99 -3.95 118.70 122.09 2i2t s GLU 82 Ca 0.05 0.54 -0.23 0.00 0.02 0.00 0.00 54.97 55.34 2i2t s GLU 82 Cb -0.13 -2.46 -0.10 0.00 0.10 0.00 0.00 34.13 31.54 2i2t s GLU 82 CO -0.08 0.13 0.94 0.00 0.02 0.00 0.00 175.26 176.27 2i2t s ALA 83 N -2.06 3.13 -2.00 5.21 0.00 -1.26 -1.53 121.76 123.25 2i2t s ALA 83 Ca 0.52 0.44 0.16 0.00 0.00 0.00 0.00 51.96 53.09 2i2t s ALA 83 Cb -0.10 -3.15 0.98 0.00 0.00 0.00 0.00 23.12 20.84 2i2t s ALA 83 CO 0.22 0.16 1.38 -0.85 0.00 0.00 0.00 175.76 176.67