#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ckc s ASP 2564N 0.00 7.42 0.45 1.96 -1.08 -1.26 -4.92 116.67 119.23 2ckc s ASP 2564Ca 0.00 2.10 0.31 0.00 -0.52 0.00 0.00 52.55 54.44 2ckc s ASP 2564Cb 0.00 -2.62 1.56 0.00 -1.46 0.00 0.00 42.92 40.41 2ckc s ASP 2564CO 0.00 -0.02 1.94 1.55 0.52 0.00 0.00 175.17 179.15 2ckc h PRO 2565N 3.87 0.00 0.00 4.34 0.13 -1.99 -2.21 132.00 136.14 2ckc h PRO 2565Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2ckc h PRO 2565Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2ckc h PRO 2565CO 0.67 0.00 -0.74 0.22 -0.23 0.00 0.00 178.00 177.92 2ckc h ASP 2566N 0.00 0.00 -1.86 1.44 3.58 -1.94 -1.37 116.42 116.28 2ckc h ASP 2566Ca 0.00 -0.01 -0.66 0.00 0.42 0.00 0.00 57.03 56.78 2ckc h ASP 2566Cb 0.13 0.00 0.03 0.00 1.72 0.00 0.00 39.33 41.21 2ckc h ASP 2566CO 0.00 0.00 0.92 0.41 -2.88 0.00 0.00 179.24 177.69 2ckc n THR 2567N -2.76 0.34 -2.69 2.25 -1.04 -0.83 -4.49 114.28 105.06 2ckc n THR 2567Ca 0.01 -0.06 -0.36 0.00 -2.04 0.00 0.00 64.05 61.60 2ckc n THR 2567Cb 0.54 -1.49 -0.06 0.00 -1.82 0.00 0.00 70.33 67.51 2ckc n THR 2567CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 2ckc s ARG 2568N 3.03 4.38 -0.36 -2.82 1.81 -1.26 0.07 118.95 123.81 2ckc s ARG 2568Ca 0.92 1.38 -0.02 0.00 -1.72 0.00 0.00 55.73 56.28 2ckc s ARG 2568Cb -0.85 -2.63 0.08 0.00 -0.45 0.00 0.00 34.95 31.11 2ckc s ARG 2568CO 0.54 0.08 0.11 0.42 -0.68 0.00 0.00 175.30 175.77 2ckc s ILE 2569N -1.70 3.14 -0.59 1.52 -1.09 0.44 -4.12 121.20 118.81 2ckc s ILE 2569Ca 0.55 -1.76 -0.27 0.00 -2.23 0.00 0.00 60.65 56.93 2ckc s ILE 2569Cb -0.19 -3.01 -0.00 0.00 -1.58 0.00 0.00 42.46 37.68 2ckc s ILE 2569CO 0.24 -0.43 1.65 -2.16 -1.23 0.00 0.00 174.94 173.01 2ckc s PRO 2570N 1.18 2.97 0.30 2.79 0.04 -1.26 -3.88 135.00 137.13 2ckc s PRO 2570Ca 0.03 0.54 0.09 0.00 0.04 0.00 0.00 61.00 61.69 2ckc s PRO 2570Cb -0.21 -4.27 -0.06 0.00 0.04 0.00 0.00 34.50 30.01 2ckc s PRO 2570CO -0.03 -2.34 -0.11 0.14 0.04 0.00 0.00 177.00 174.70 2ckc s VAL 2571N 7.54 2.05 -0.01 -0.36 -7.23 -0.84 -0.72 120.40 120.83 2ckc s VAL 2571Ca 0.60 -2.22 0.02 0.00 -1.81 0.00 0.00 61.98 58.57 2ckc s VAL 2571Cb -0.12 -2.45 -0.00 0.00 0.56 0.00 0.00 36.38 34.36 2ckc s VAL 2571CO 0.22 -0.31 -0.07 -0.51 -0.31 0.00 0.00 175.10 174.12 2ckc s ILE 2572N -2.75 0.61 -0.21 -0.62 2.07 0.01 -0.48 121.20 119.82 2ckc s ILE 2572Ca 0.30 -0.29 -0.12 0.00 -1.41 0.00 0.00 60.65 59.13 2ckc s ILE 2572Cb 0.01 -0.53 -0.05 0.00 0.13 0.00 0.00 42.46 42.02 2ckc s ILE 2572CO 0.14 0.19 0.21 0.21 -1.91 0.00 0.00 174.94 173.78 2ckc s ASN 2573N 0.05 6.25 0.17 4.50 3.84 0.58 -1.00 114.94 129.33 2ckc s ASN 2573Ca -0.00 0.28 0.25 0.00 0.21 0.00 0.00 52.86 53.59 2ckc s ASN 2573Cb -0.06 -2.13 0.50 0.00 -0.55 0.00 0.00 41.25 39.01 2ckc s ASN 2573CO -0.00 0.08 1.49 -0.07 -2.79 0.00 0.00 177.10 175.81 2ckc h LEU 2574N 7.15 0.00 -0.12 3.21 3.38 -1.67 0.18 115.31 127.44 2ckc h LEU 2574Ca -0.39 -0.11 -0.23 0.00 0.09 0.00 0.00 57.88 57.24 2ckc h LEU 2574Cb 1.16 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.91 2ckc h LEU 2574CO 0.71 0.06 -1.01 1.05 0.09 0.00 0.00 178.44 179.34 2ckc h GLU 2575N 0.00 0.25 0.00 1.13 4.11 -1.94 -3.39 114.58 114.74 2ckc h GLU 2575Ca 0.00 -0.32 -0.35 0.00 0.07 0.00 0.00 59.36 58.76 2ckc h GLU 2575Cb 0.77 0.10 -0.05 0.00 0.50 0.00 0.00 28.75 30.07 2ckc h GLU 2575CO 0.00 1.07 -2.16 -3.47 0.07 0.00 0.00 179.01 174.51 2ckc n ASP 2576N -3.61 1.50 0.00 3.06 2.03 -1.24 -5.02 116.55 113.27 2ckc n ASP 2576Ca -0.05 0.24 0.00 0.00 0.52 0.00 0.00 54.79 55.50 2ckc n ASP 2576Cb 0.89 -0.60 0.00 0.00 -0.72 0.00 0.00 41.12 40.68 2ckc n ASP 2576CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2ckc n GLY 2577N 1.72 0.90 3.73 0.27 0.00 0.62 -5.07 105.19 107.36 2ckc n GLY 2577Ca -0.41 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.28 2ckc n GLY 2577CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2ckc s THR 2578N -2.00 2.64 -0.18 2.61 -1.32 -1.22 -4.75 115.64 111.42 2ckc s THR 2578Ca 0.00 0.27 -0.08 0.00 -1.21 0.00 0.00 61.69 60.67 2ckc s THR 2578Cb 0.00 -2.69 0.07 0.00 -1.51 0.00 0.00 72.50 68.37 2ckc s THR 2578CO 0.00 -0.21 0.40 -0.60 -2.21 0.00 0.00 174.62 172.00 2ckc s ARG 2579N -4.29 0.35 -0.32 7.08 3.52 -1.26 -0.30 118.95 123.72 2ckc s ARG 2579Ca 0.69 0.87 0.03 0.00 -0.13 0.00 0.00 55.73 57.19 2ckc s ARG 2579Cb -0.24 0.10 0.09 0.00 -1.56 0.00 0.00 34.95 33.34 2ckc s ARG 2579CO 0.49 -0.20 0.02 -0.51 -0.81 0.00 0.00 175.30 174.29 2ckc s LEU 2580N 1.89 4.34 0.19 -0.88 2.01 0.36 -4.99 118.68 121.60 2ckc s LEU 2580Ca -0.06 -1.97 0.09 0.00 0.01 0.00 0.00 54.13 52.20 2ckc s LEU 2580Cb -0.10 -1.56 -0.04 0.00 0.01 0.00 0.00 46.19 44.50 2ckc s LEU 2580CO -0.12 -0.35 -0.18 0.68 1.01 0.00 0.00 176.35 177.39 2ckc s VAL 2581N 0.99 1.95 0.00 -1.59 -7.23 -1.26 -1.99 120.40 111.27 2ckc s VAL 2581Ca 0.07 -2.05 0.00 0.00 -1.81 0.00 0.00 61.98 58.19 2ckc s VAL 2581Cb -0.19 -1.97 0.00 0.00 0.56 0.00 0.00 36.38 34.78 2ckc s VAL 2581CO -0.08 -0.35 0.00 0.61 -0.31 0.00 0.00 175.10 174.96 2ckc n GLY 2582N 0.05 0.48 0.12 2.32 0.00 -1.23 -3.30 105.19 103.64 2ckc n GLY 2582Ca -0.11 -0.97 0.12 0.00 0.00 0.00 0.00 46.02 45.06 2ckc n GLY 2582CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 2ckc h GLU 2583N 0.00 0.00 0.00 1.61 4.11 -1.96 -3.23 114.58 115.12 2ckc h GLU 2583Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2ckc h GLU 2583Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2ckc h GLU 2583CO 0.00 0.00 0.00 -0.44 0.07 0.00 0.00 179.01 178.64 2ckc h ASP 2584N 0.00 0.00 -4.18 3.06 5.19 -1.91 -3.45 116.42 115.14 2ckc h ASP 2584Ca 0.00 0.00 -0.53 0.00 -0.62 0.00 0.00 57.03 55.88 2ckc h ASP 2584Cb 0.89 0.00 0.14 0.00 0.18 0.00 0.00 39.33 40.54 2ckc h ASP 2584CO 0.00 0.00 0.39 0.00 -3.12 0.00 0.00 179.24 176.51 2ckc s ALA 2585N -3.51 2.23 0.63 3.45 0.00 -1.22 -4.72 121.76 118.62 2ckc s ALA 2585Ca 0.03 0.80 -0.17 0.00 0.00 0.00 0.00 51.96 52.62 2ckc s ALA 2585Cb 0.09 -3.43 -0.01 0.00 0.00 0.00 0.00 23.12 19.76 2ckc s ALA 2585CO 0.53 -1.69 1.15 -1.25 0.00 0.00 0.00 175.76 174.50 2ckc s PRO 2586N -3.93 2.86 0.37 0.00 0.04 -1.25 -4.72 135.00 128.37 2ckc s PRO 2586Ca 0.72 1.58 -0.15 0.00 0.04 0.00 0.00 61.00 63.20 2ckc s PRO 2586Cb -0.27 -1.94 -0.09 0.00 0.04 0.00 0.00 34.50 32.24 2ckc s PRO 2586CO 0.44 -1.24 0.79 0.15 0.04 0.00 0.00 177.00 177.17 2ckc s LYS 2587N -3.73 3.97 0.48 4.56 1.02 -1.26 -0.42 119.74 124.36 2ckc s LYS 2587Ca 0.71 0.70 0.26 0.00 0.02 0.00 0.00 55.97 57.66 2ckc s LYS 2587Cb -0.24 -2.37 1.31 0.00 -0.52 0.00 0.00 37.83 36.01 2ckc s LYS 2587CO 0.37 0.06 1.85 -0.97 -0.92 0.00 0.00 175.35 175.74 2ckc h ASN 2588N 1.89 0.19 -0.13 2.83 -1.24 0.13 0.73 115.58 119.98 2ckc h ASN 2588Ca -0.48 0.03 -0.04 0.00 0.71 0.00 0.00 56.30 56.52 2ckc h ASN 2588Cb 1.18 -0.01 -0.00 0.00 0.73 0.00 0.00 38.32 40.22 2ckc h ASN 2588CO 0.64 0.06 -0.09 0.07 -1.29 0.00 0.00 177.43 176.82 2ckc h LYS 2589N 0.18 0.28 -0.02 6.67 2.10 -1.55 -3.23 116.57 121.02 2ckc h LYS 2589Ca 0.48 -0.14 0.00 0.00 -2.00 0.00 0.00 60.65 58.99 2ckc h LYS 2589Cb 1.57 -0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.90 2ckc h LYS 2589CO -0.10 0.65 -0.12 -0.25 -2.00 0.00 0.00 179.45 177.63 2ckc n ASP 2590N -4.64 1.72 -0.21 7.07 8.00 -0.57 -4.24 116.55 123.67 2ckc n ASP 2590Ca -0.06 -1.44 0.00 0.00 0.71 0.00 0.00 54.79 54.01 2ckc n ASP 2590Cb 0.31 0.09 0.08 0.00 -0.02 0.00 0.00 41.12 41.58 2ckc n ASP 2590CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 2ckc h LEU 2591N 2.50 -0.46 -1.14 0.64 7.12 -0.92 -1.62 115.31 121.43 2ckc h LEU 2591Ca 0.00 0.18 0.04 0.00 0.13 0.00 0.00 57.88 58.23 2ckc h LEU 2591Cb 0.62 0.35 -0.05 0.00 -0.53 0.00 0.00 40.66 41.05 2ckc h LEU 2591CO 0.00 -0.18 0.59 -0.37 -0.13 0.00 0.00 178.44 178.35 2ckc h VAL 2592N 0.05 1.13 -0.16 1.05 -1.51 -1.78 -1.15 116.25 113.87 2ckc h VAL 2592Ca 0.32 -0.38 -0.18 0.00 -1.23 0.00 0.00 66.70 65.24 2ckc h VAL 2592Cb 0.51 -0.06 -0.00 0.00 -2.13 0.00 0.00 31.29 29.61 2ckc h VAL 2592CO -0.61 0.20 -0.63 -0.33 -1.23 0.00 0.00 177.57 174.97 2ckc h GLU 2593N 1.09 0.58 -0.70 5.19 5.08 -1.62 -1.32 114.58 122.88 2ckc h GLU 2593Ca 0.36 -0.41 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 2ckc h GLU 2593Cb 0.06 0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.34 2ckc h GLU 2593CO -0.12 1.02 0.41 2.35 -1.00 0.00 0.00 179.01 181.68 2ckc h TRP 2594N 0.42 0.93 -0.15 4.33 7.01 -0.79 -0.93 115.95 126.76 2ckc h TRP 2594Ca -0.01 -0.00 -0.12 0.00 2.11 0.00 0.00 58.89 60.86 2ckc h TRP 2594Cb 1.20 -0.30 -0.01 0.00 -2.10 0.00 0.00 29.16 27.95 2ckc h TRP 2594CO 0.05 0.63 -0.44 -0.07 -2.79 0.00 0.00 178.44 175.82 2ckc h LEU 2595N 0.97 0.39 -0.41 0.65 4.07 -0.87 0.25 115.31 120.36 2ckc h LEU 2595Ca 0.25 -0.18 -0.04 0.00 0.08 0.00 0.00 57.88 58.00 2ckc h LEU 2595Cb -0.02 -0.11 -0.02 0.00 1.08 0.00 0.00 40.66 41.60 2ckc h LEU 2595CO -0.05 0.78 0.11 0.11 -1.08 0.00 0.00 178.44 178.32 2ckc h LYS 2596N 0.30 0.64 -0.04 1.13 1.57 -0.35 -3.04 116.57 116.79 2ckc h LYS 2596Ca 0.02 -0.15 -0.16 0.00 -1.87 0.00 0.00 60.65 58.50 2ckc h LYS 2596Cb 0.90 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.11 2ckc h LYS 2596CO 0.07 0.66 -0.68 -0.07 -0.57 0.00 0.00 179.45 178.86 2ckc h LEU 2597N 0.51 0.23 -6.91 2.94 3.38 -0.94 -3.38 115.31 111.14 2ckc h LEU 2597Ca 0.13 -0.15 -0.61 0.00 0.09 0.00 0.00 57.88 57.34 2ckc h LEU 2597Cb 0.29 -0.07 -0.41 0.00 0.09 0.00 0.00 40.66 40.57 2ckc h LEU 2597CO -0.00 0.84 -0.71 -1.00 0.09 0.00 0.00 178.44 177.66 2ckc s HIS 2598N -3.59 2.63 -1.71 1.13 3.76 0.84 -4.85 115.29 113.50 2ckc s HIS 2598Ca -0.03 -2.91 0.26 0.00 -0.15 0.00 0.00 55.06 52.23 2ckc s HIS 2598Cb 0.12 -2.12 1.43 0.00 1.11 0.00 0.00 32.58 33.12 2ckc s HIS 2598CO 0.80 -0.67 1.90 -0.35 -0.85 0.00 0.00 174.74 175.56 2ckc n PRO 2599N 2.56 0.60 0.00 8.40 -0.04 -1.16 -2.72 135.00 142.63 2ckc n PRO 2599Ca 0.19 0.02 0.14 0.00 -0.04 0.00 0.00 63.50 63.82 2ckc n PRO 2599Cb 0.38 -1.50 0.56 0.00 -0.04 0.00 0.00 33.50 32.89 2ckc n PRO 2599CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2ckc n THR 2600N -1.14 0.00 -2.37 0.52 -2.24 -1.26 -4.93 114.28 102.85 2ckc n THR 2600Ca 0.16 -0.15 -0.25 0.00 -2.27 0.00 0.00 64.05 61.54 2ckc n THR 2600Cb 0.15 0.22 0.12 0.00 -2.10 0.00 0.00 70.33 68.72 2ckc n THR 2600CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 2ckc s TYR 2601N -2.24 1.76 0.10 4.78 1.13 -1.10 -1.86 117.35 119.92 2ckc s TYR 2601Ca 0.34 -0.04 -0.20 0.00 -1.41 0.00 0.00 57.07 55.75 2ckc s TYR 2601Cb 0.20 -3.31 0.05 0.00 -1.10 0.00 0.00 41.96 37.80 2ckc s TYR 2601CO 0.42 -1.91 0.50 -0.08 -2.51 0.00 0.00 175.55 171.97 2ckc s THR 2602N -3.35 0.03 0.02 -3.49 -1.32 -0.17 -4.82 115.64 102.55 2ckc s THR 2602Ca 0.68 -0.29 -0.23 0.00 -1.21 0.00 0.00 61.69 60.63 2ckc s THR 2602Cb -0.06 -1.04 -0.05 0.00 -1.51 0.00 0.00 72.50 69.84 2ckc s THR 2602CO 0.47 -0.16 0.71 -0.69 -2.21 0.00 0.00 174.62 172.74 2ckc s VAL 2603N -3.22 4.80 -0.18 5.08 1.01 -1.26 -0.81 120.40 125.82 2ckc s VAL 2603Ca -0.01 1.50 -0.18 0.00 0.00 0.00 0.00 61.98 63.29 2ckc s VAL 2603Cb 0.00 -4.05 -0.14 0.00 0.00 0.00 0.00 36.38 32.18 2ckc s VAL 2603CO -0.08 0.37 0.14 -0.78 0.00 0.00 0.00 175.10 174.76 2ckc h ASP 2604N 5.72 0.00 -4.13 3.32 3.58 -1.21 -3.46 116.42 120.24 2ckc h ASP 2604Ca -0.44 -0.39 -0.60 0.00 0.42 0.00 0.00 57.03 56.02 2ckc h ASP 2604Cb 1.20 0.00 -0.23 0.00 1.72 0.00 0.00 39.33 42.03 2ckc h ASP 2604CO 0.71 1.21 -0.84 -0.04 -2.88 0.00 0.00 179.24 177.39 2ckc s MET 2605N -2.28 1.26 0.11 0.28 -1.94 -1.00 -5.01 119.30 110.71 2ckc s MET 2605Ca -0.23 -1.18 0.25 0.00 -1.71 0.00 0.00 55.69 52.83 2ckc s MET 2605Cb 0.04 -1.56 0.96 0.00 2.01 0.00 0.00 34.83 36.28 2ckc s MET 2605CO 0.47 0.37 1.78 -0.35 -0.01 0.00 0.00 175.02 177.28 2ckc n PRO 2606N 1.18 0.12 -3.90 2.03 -0.04 -1.26 -4.41 135.00 128.71 2ckc n PRO 2606Ca -0.19 0.17 -0.21 0.00 -0.04 0.00 0.00 63.50 63.24 2ckc n PRO 2606Cb 0.53 -1.66 -0.17 0.00 -0.04 0.00 0.00 33.50 32.16 2ckc n PRO 2606CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2ckc s SER 2607N -3.73 1.17 0.04 3.54 0.01 -1.26 -5.01 113.70 108.47 2ckc s SER 2607Ca 0.10 -0.08 -0.17 0.00 1.31 0.00 0.00 55.95 57.12 2ckc s SER 2607Cb 0.14 -0.39 -0.08 0.00 0.21 0.00 0.00 66.02 65.91 2ckc s SER 2607CO 0.49 -0.14 1.27 0.10 0.41 0.00 0.00 173.24 175.37 2ckc h TYR 2608N 7.82 -0.71 -3.42 2.43 -0.00 -1.84 -3.44 116.97 117.82 2ckc h TYR 2608Ca -0.29 0.01 -0.21 0.00 -0.00 0.00 0.00 58.73 58.24 2ckc h TYR 2608Cb 1.13 0.29 -0.28 0.00 -0.00 0.00 0.00 36.73 37.87 2ckc h TYR 2608CO 0.49 -0.31 -0.59 0.54 -0.00 0.00 0.00 178.16 178.28 2ckc s VAL 2609N -4.35 -0.01 -0.51 -0.90 0.11 -1.26 -3.47 120.40 110.01 2ckc s VAL 2609Ca -0.08 0.05 -0.27 0.00 -2.93 0.00 0.00 61.98 58.75 2ckc s VAL 2609Cb 0.02 -0.18 -0.04 0.00 -1.53 0.00 0.00 36.38 34.66 2ckc s VAL 2609CO 0.29 0.02 2.06 -2.84 -3.33 0.00 0.00 175.10 171.30 2ckc s PRO 2610N 0.34 2.57 -0.21 1.54 0.02 -1.26 -4.74 135.00 133.25 2ckc s PRO 2610Ca -0.02 1.07 -0.13 0.00 0.02 0.00 0.00 61.00 61.93 2ckc s PRO 2610Cb -0.04 -4.43 -0.19 0.00 0.02 0.00 0.00 34.50 29.87 2ckc s PRO 2610CO -0.01 -2.77 0.04 1.17 -0.33 0.00 0.00 177.00 175.10 2ckc n LYS 2611N 9.00 0.63 0.09 5.54 3.00 -1.26 -4.37 118.16 130.78 2ckc n LYS 2611Ca 0.27 0.37 -0.06 0.00 -0.00 0.00 0.00 58.31 58.88 2ckc n LYS 2611Cb 0.52 -1.64 0.08 0.00 0.00 0.00 0.00 35.03 33.98 2ckc n LYS 2611CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.40 176.43 2ckc h ASN 2612N -0.62 0.25 -3.42 3.14 -1.24 -2.04 -3.42 115.58 108.22 2ckc h ASN 2612Ca -0.49 -0.17 -0.66 0.00 0.71 0.00 0.00 56.30 55.70 2ckc h ASN 2612Cb 1.63 -0.07 -0.23 0.00 0.73 0.00 0.00 38.32 40.38 2ckc h ASN 2612CO -0.18 0.87 -0.71 0.00 -1.29 0.00 0.00 177.43 176.12 2ckc s ALA 2613N -3.55 2.84 -0.81 1.57 0.00 -1.26 -5.05 121.76 115.49 2ckc s ALA 2613Ca -0.03 -0.87 -0.18 0.00 0.00 0.00 0.00 51.96 50.88 2ckc s ALA 2613Cb 0.11 -1.33 0.14 0.00 0.00 0.00 0.00 23.12 22.04 2ckc s ALA 2613CO 0.81 0.32 0.95 0.34 0.00 0.00 0.00 175.76 178.17 2ckc s ASP 2614N 0.07 6.53 -0.27 0.00 2.15 -1.26 -4.60 116.67 119.29 2ckc s ASP 2614Ca -0.03 -1.97 -0.10 0.00 0.43 0.00 0.00 52.55 50.88 2ckc s ASP 2614Cb -0.14 -2.34 -0.14 0.00 -0.30 0.00 0.00 42.92 40.00 2ckc s ASP 2614CO 0.04 -1.00 -0.29 0.52 -0.17 0.00 0.00 175.17 174.26 2ckc n VAL 2615N 5.21 1.52 -4.06 1.11 0.31 -1.26 -5.06 118.33 116.09 2ckc n VAL 2615Ca 0.12 -0.43 -0.10 0.00 -0.01 0.00 0.00 64.34 63.93 2ckc n VAL 2615Cb 0.47 -1.77 -0.08 0.00 -0.91 0.00 0.00 33.84 31.55 2ckc n VAL 2615CO 0.00 0.00 0.00 -1.48 -1.32 0.00 0.00 176.83 174.03 2ckc s LEU 2616N -7.27 0.95 0.00 7.52 0.05 -1.26 -5.08 118.68 113.59 2ckc s LEU 2616Ca -0.37 -1.08 0.00 0.00 0.05 0.00 0.00 54.13 52.73 2ckc s LEU 2616Cb 0.13 0.99 0.00 0.00 -2.05 0.00 0.00 46.19 45.26 2ckc s LEU 2616CO 0.53 -0.92 0.00 0.33 -0.55 0.00 0.00 176.35 175.74 2ckc n PHE 2617N -0.26 0.00 0.00 3.48 7.35 -1.26 -4.93 117.46 121.84 2ckc n PHE 2617Ca -0.03 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.66 2ckc n PHE 2617Cb 0.64 0.13 0.00 0.00 0.35 0.00 0.00 39.48 40.59 2ckc n PHE 2617CO 0.00 0.00 0.00 0.43 -0.76 0.00 0.00 176.76 176.43 2ckc n SER 2618N -1.51 0.00 0.15 -2.13 7.64 -1.26 0.05 113.62 116.56 2ckc n SER 2618Ca 0.00 0.00 0.02 0.00 1.01 0.00 0.00 58.87 59.90 2ckc n SER 2618Cb 0.00 0.00 0.19 0.00 -1.01 0.00 0.00 64.21 63.39 2ckc n SER 2618CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2ckc h SER 2619N 0.00 0.00 -2.91 6.43 0.02 -2.06 -3.34 113.55 111.68 2ckc h SER 2619Ca 0.00 0.00 -0.77 0.00 -0.84 0.00 0.00 61.79 60.18 2ckc h SER 2619Cb 0.00 0.00 -0.23 0.00 0.14 0.00 0.00 62.40 62.31 2ckc h SER 2619CO 0.00 0.51 0.86 -0.36 -1.14 0.00 0.00 176.83 176.71 2ckc s PHE 2620N -3.38 3.89 -0.03 3.45 0.08 0.11 -4.61 117.98 117.49 2ckc s PHE 2620Ca 0.01 -2.39 0.01 0.00 0.12 0.00 0.00 56.93 54.67 2ckc s PHE 2620Cb 0.10 -4.07 -0.03 0.00 -0.57 0.00 0.00 43.02 38.46 2ckc s PHE 2620CO 0.73 -1.17 -0.02 0.00 -0.10 0.00 0.00 175.22 174.66 2ckc n GLN 2621N 4.16 1.07 0.00 0.44 10.64 -1.26 -4.73 117.38 127.70 2ckc n GLN 2621Ca 0.29 0.01 0.01 0.00 -1.83 0.00 0.00 57.00 55.49 2ckc n GLN 2621Cb 0.41 -1.07 0.01 0.00 -0.86 0.00 0.00 30.24 28.73 2ckc n GLN 2621CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86