# AA SS3 SS8 ASA HSEa-u HSEa-d CN13 theta tau phi psi P(3-C) P(3-E) P(3-H) P(8-C) P(8-S) P(8-T) P(8-H) P(8-G) P(8-I) P(8-E) P(8-B) 0 Q C C 110.16 5.09 19.45 25.40 114.99 -143.34 -92.05 131.55 99.34 0.66 0.00 99.39 0.06 0.01 0.00 0.00 0.00 0.52 0.01 1 V C C 41.68 18.90 11.15 29.02 120.82 -157.03 -107.32 132.41 56.08 43.81 0.11 55.54 0.41 0.12 0.03 0.04 0.00 43.18 0.68 2 Q E E 94.43 5.26 20.93 26.98 122.22 -165.82 -116.53 134.97 19.73 80.06 0.21 18.12 1.23 0.28 0.08 0.12 0.00 79.52 0.65 3 L E E 48.98 19.14 13.37 31.84 118.95 -149.43 -102.78 129.85 14.06 85.64 0.30 13.11 0.78 0.22 0.11 0.16 0.00 85.11 0.51 4 V E E 63.07 8.37 20.53 29.82 121.35 -167.67 -116.65 131.88 15.60 83.96 0.43 13.96 1.27 0.32 0.16 0.23 0.00 83.34 0.73 5 Q E E 80.42 14.60 14.78 29.04 118.44 -147.53 -99.53 132.40 30.97 68.38 0.65 26.36 3.45 0.91 0.18 0.44 0.00 67.70 0.95 6 S C C 55.35 9.35 16.86 26.89 109.39 -167.07 -99.16 57.84 63.01 36.09 0.91 39.98 17.03 5.47 0.12 0.86 0.00 35.69 0.84 7 G C S 38.46 6.38 19.36 26.05 115.87 -71.33 103.80 -33.11 75.55 23.80 0.65 27.76 39.85 6.97 0.06 0.67 0.00 23.98 0.70 8 A C C 45.84 14.63 15.10 29.32 121.99 -64.60 -102.39 143.70 64.49 35.15 0.37 51.68 9.78 1.39 0.04 0.36 0.00 36.10 0.64 9 E E E 65.86 13.00 18.82 32.00 127.59 -164.82 -126.20 141.81 19.68 80.21 0.11 17.09 2.35 0.32 0.03 0.08 0.00 79.31 0.82 10 V E E 69.19 12.58 20.22 32.62 121.64 -153.45 -112.34 131.13 8.84 91.12 0.03 8.25 0.54 0.05 0.01 0.02 0.00 90.58 0.55 11 K E E 45.47 15.91 16.43 32.48 132.48 -175.29 -131.49 151.02 14.00 85.97 0.03 13.68 0.49 0.03 0.02 0.01 0.00 82.24 3.53 12 K C C 104.98 5.23 22.38 27.66 119.68 -116.40 -80.37 150.49 95.33 4.65 0.02 94.53 1.02 0.06 0.00 0.01 0.00 3.94 0.44 13 P C T 61.59 13.51 13.39 27.15 110.06 -83.50 -59.22 137.64 99.55 0.29 0.16 0.28 2.31 97.07 0.01 0.11 0.00 0.18 0.04 14 G C T 50.54 3.23 18.79 22.75 95.36 22.59 88.24 -6.03 99.72 0.17 0.11 0.37 2.47 96.93 0.00 0.09 0.00 0.12 0.01 15 E C C 83.14 7.58 16.89 25.81 123.70 117.55 -89.12 155.75 94.21 5.71 0.08 75.36 19.05 0.29 0.01 0.09 0.00 4.41 0.79 16 S C C 58.68 9.41 18.43 28.64 124.64 -126.49 -103.95 148.65 75.21 24.77 0.02 75.07 0.79 0.06 0.00 0.02 0.00 23.28 0.77 17 L E E 14.64 22.33 14.84 37.14 125.02 -159.47 -120.27 139.79 6.29 93.70 0.00 6.10 0.17 0.01 0.00 0.00 0.00 93.47 0.24 18 K E E 109.74 6.63 24.94 32.38 117.07 -144.23 -106.09 128.08 1.24 98.76 0.00 1.19 0.03 0.00 0.00 0.00 0.00 98.72 0.05 19 I E E 5.28 25.88 15.77 42.35 122.10 -169.03 -117.97 131.86 3.14 96.85 0.01 3.06 0.09 0.01 0.00 0.00 0.00 96.74 0.09 20 S E E 38.04 9.21 26.90 36.63 125.99 -164.56 -112.49 145.75 14.55 85.42 0.04 13.45 0.53 0.05 0.01 0.02 0.00 85.80 0.14 21 C E E 6.74 25.62 16.02 41.88 127.22 -171.25 -130.61 137.09 20.81 79.12 0.06 19.52 0.78 0.08 0.02 0.03 0.00 79.17 0.39 22 R E E 110.18 7.39 26.49 34.55 123.73 -169.37 -119.99 136.33 12.98 86.89 0.13 11.38 1.42 0.24 0.06 0.08 0.00 84.16 2.67 23 G E E 11.44 20.87 15.94 35.76 125.53 148.26 -134.67 156.00 36.22 63.49 0.29 30.76 4.65 0.83 0.08 0.26 0.00 60.70 2.71 24 S C C 56.20 8.81 20.62 29.80 120.37 -137.89 -109.10 143.17 62.99 36.29 0.73 35.23 20.19 9.73 0.10 0.80 0.00 32.20 1.75 25 G C S 46.71 4.58 20.89 26.04 97.94 16.18 84.26 -0.08 82.40 16.79 0.81 26.22 41.22 15.47 0.08 0.93 0.00 14.62 1.47 26 Y C C 49.69 18.93 12.56 30.83 120.91 127.13 -93.60 141.04 82.00 16.94 1.05 63.32 14.44 3.99 0.22 1.09 0.00 13.07 3.86 27 R C C 140.39 4.89 22.38 28.06 116.05 -160.88 -111.42 123.90 87.35 11.82 0.83 70.39 12.28 4.30 0.15 0.89 0.00 8.49 3.49 28 F C C 37.67 20.47 12.96 32.45 120.77 -158.90 -105.54 136.54 86.24 12.17 1.59 67.75 13.49 4.50 0.33 1.53 0.00 7.73 4.66 29 T C S 86.91 4.93 20.99 26.45 98.43 -159.34 -89.38 -17.89 90.21 8.60 1.19 21.67 42.65 26.18 0.11 1.31 0.00 6.98 1.11 30 S C S 50.44 8.66 20.97 29.93 112.52 34.20 -117.06 34.45 82.48 16.40 1.12 19.72 37.01 25.76 0.08 1.28 0.00 15.27 0.88 31 Y C C 25.94 21.33 17.07 37.72 132.03 125.84 -128.70 151.96 58.69 41.10 0.21 48.94 7.77 0.67 0.03 0.21 0.00 41.54 0.84 32 W E E 46.51 14.52 26.66 41.31 127.60 -158.43 -123.30 143.56 10.96 89.03 0.01 10.42 0.41 0.02 0.00 0.01 0.00 88.81 0.32 33 I E E 2.06 26.97 22.16 49.78 121.03 -155.76 -115.47 131.96 1.19 98.81 0.00 1.14 0.03 0.00 0.00 0.00 0.00 98.81 0.02 34 N E E 15.99 18.14 28.00 45.68 131.68 -175.07 -127.69 152.07 0.38 99.62 0.00 0.35 0.01 0.00 0.00 0.00 0.00 99.63 0.00 35 W E E 6.59 24.83 23.30 48.02 124.87 -150.90 -116.36 139.10 0.29 99.71 0.00 0.26 0.01 0.00 0.00 0.00 0.00 99.73 0.00 36 V E E 11.17 19.37 24.78 43.85 129.32 -169.26 -127.24 144.08 0.26 99.74 0.00 0.23 0.00 0.00 0.00 0.00 0.00 99.77 0.00 37 R E E 40.23 17.35 22.47 39.31 123.90 -161.23 -116.41 135.90 0.34 99.66 0.00 0.30 0.01 0.00 0.00 0.00 0.00 99.69 0.00 38 Q E E 52.49 13.13 18.81 32.64 115.35 -140.63 -98.13 126.16 3.30 96.69 0.00 2.99 0.12 0.01 0.00 0.00 0.00 96.77 0.12 39 L C C 44.20 11.16 14.26 26.98 118.53 -145.94 -86.00 146.13 66.97 32.92 0.11 64.77 1.48 0.19 0.02 0.07 0.00 32.76 0.71 40 P C T 90.82 5.64 12.81 20.20 109.43 -87.90 -58.77 136.43 95.31 0.34 4.34 0.36 3.29 91.30 0.05 4.74 0.00 0.19 0.07 41 G C T 69.30 0.31 13.23 11.02 95.74 14.72 81.86 -3.99 95.40 0.10 4.50 0.38 2.86 91.73 0.06 4.89 0.00 0.05 0.03 42 K C T 129.61 3.40 12.14 16.99 105.75 69.69 -108.73 -5.88 90.21 3.55 6.24 9.23 27.90 51.95 0.20 7.66 0.00 2.32 0.73 43 G C C 32.00 4.19 16.73 22.14 127.23 -116.26 89.71 -166.03 59.71 40.17 0.12 45.41 12.81 1.36 0.02 0.13 0.00 39.06 1.21 44 L E E 58.35 15.81 13.39 29.00 116.35 -26.32 -75.75 138.28 22.24 77.75 0.01 19.94 0.88 0.05 0.00 0.01 0.00 79.00 0.12 45 E E E 71.77 10.32 21.20 32.07 127.90 -169.50 -124.87 141.39 1.03 98.97 0.00 0.86 0.05 0.00 0.00 0.00 0.00 99.07 0.01 46 W E E 93.19 15.53 20.13 35.15 110.86 -112.58 -72.20 128.02 0.20 99.80 0.00 0.18 0.01 0.00 0.00 0.00 0.00 99.80 0.00 47 M E E 12.52 21.20 20.83 42.30 100.56 177.79 -99.28 -25.57 3.77 96.22 0.01 2.52 0.92 0.19 0.00 0.01 0.00 96.34 0.02 48 G E E 2.93 18.71 23.58 42.72 145.35 -44.06 158.29 173.48 3.39 96.60 0.01 2.10 0.91 0.17 0.00 0.01 0.00 96.77 0.03 49 R E E 67.26 14.78 25.66 40.17 130.16 -103.77 -132.92 143.45 3.27 96.70 0.03 2.89 0.24 0.03 0.01 0.01 0.00 96.65 0.16 50 I E E 10.00 23.06 18.55 41.84 118.49 -151.79 -111.37 128.57 11.56 88.40 0.03 10.12 1.30 0.07 0.02 0.02 0.00 86.25 2.23 51 D C C 37.86 10.70 22.32 33.81 113.97 -162.80 -107.67 117.61 72.47 27.46 0.07 66.39 4.66 0.32 0.02 0.06 0.00 27.07 1.48 52 P C T 54.67 14.99 14.66 29.76 93.26 -139.24 -66.12 -19.69 97.07 1.21 1.72 3.83 12.99 79.83 0.08 2.06 0.00 0.98 0.22 53 T C T 102.62 2.04 18.56 20.28 96.03 54.44 -87.24 -7.78 97.55 0.58 1.87 2.51 12.64 81.96 0.09 2.22 0.00 0.40 0.17 54 D C C 59.70 11.36 12.74 24.59 111.10 61.06 -111.41 105.78 89.92 6.34 3.74 40.80 33.33 15.45 0.37 4.09 0.00 3.75 2.21 55 S C C 67.05 8.71 15.28 24.90 98.76 -161.10 -88.10 -8.66 90.73 7.89 1.38 44.52 36.31 10.29 0.21 1.37 0.00 5.61 1.69 56 Y C C 122.27 6.65 19.37 26.72 113.99 79.73 -98.26 122.71 79.14 19.54 1.32 47.20 25.87 6.95 0.25 1.32 0.00 14.52 3.88 57 T C C 38.37 19.71 12.32 30.76 118.16 124.29 -103.73 133.53 70.88 28.49 0.63 62.21 6.27 1.36 0.14 0.57 0.00 27.11 2.35 58 N E E 86.10 5.34 23.43 29.50 127.11 -168.91 -127.08 141.77 44.57 55.07 0.36 36.43 6.59 1.02 0.12 0.32 0.00 47.81 7.72 59 Y E C 77.41 18.97 13.61 31.31 121.47 -146.02 -97.93 140.68 43.58 56.27 0.15 39.36 3.14 0.19 0.11 0.08 0.00 37.34 19.77 60 S C C 25.73 13.00 13.64 27.84 114.37 -115.67 -75.11 146.86 98.66 1.32 0.02 98.12 0.84 0.04 0.00 0.01 0.00 0.82 0.17 61 P H G 108.26 2.16 16.62 19.37 91.33 -118.36 -60.56 -30.15 26.66 0.18 73.16 1.08 1.89 21.11 0.99 74.78 0.00 0.12 0.02 62 S H G 66.06 5.78 16.40 23.50 90.48 64.08 -69.33 -18.71 27.28 0.13 72.60 0.46 1.39 24.02 0.90 73.14 0.00 0.08 0.02 63 F H G 15.91 21.53 10.25 31.62 97.45 46.00 -102.05 4.66 28.23 0.82 70.95 1.94 3.16 21.47 1.16 71.57 0.00 0.57 0.13 64 K C T 125.08 6.63 15.01 24.08 109.67 124.58 -60.67 128.18 93.85 2.82 3.33 3.28 4.02 87.17 0.82 1.83 0.00 1.44 1.43 65 G C T 60.43 1.69 18.31 19.42 94.81 13.56 80.79 -3.64 97.24 0.36 2.41 0.68 3.81 93.26 0.26 1.65 0.00 0.22 0.11 66 H C T 77.84 11.96 17.18 29.37 100.59 70.30 -100.95 -19.52 96.84 1.56 1.59 5.64 20.51 70.67 0.18 1.36 0.00 1.43 0.21 67 V E E 7.23 23.92 12.88 37.11 131.99 37.80 -133.69 145.99 14.32 85.63 0.05 10.06 4.33 0.25 0.01 0.04 0.00 84.35 0.96 68 T E E 61.74 7.08 26.54 34.30 125.05 -159.55 -121.17 138.52 1.45 98.55 0.00 1.30 0.07 0.00 0.00 0.00 0.00 98.57 0.05 69 V E E 13.74 24.96 15.22 40.17 124.66 -165.60 -124.04 133.90 1.35 98.64 0.01 1.24 0.05 0.01 0.00 0.00 0.00 98.65 0.06 70 S E E 49.47 6.76 27.00 34.42 131.42 -176.12 -131.54 149.02 9.01 90.94 0.05 7.68 1.15 0.16 0.01 0.03 0.00 90.71 0.26 71 A E E 22.13 22.75 13.18 34.93 131.96 -169.43 -133.89 148.27 40.72 59.11 0.17 35.51 4.56 0.37 0.04 0.14 0.00 57.64 1.75 72 D C C 62.16 7.29 21.11 28.85 118.43 -141.01 -104.18 136.07 86.80 13.02 0.17 84.47 2.20 0.39 0.05 0.12 0.00 11.05 1.72 73 K C T 124.43 9.15 15.33 25.65 92.07 -131.04 -66.24 -20.53 97.30 0.53 2.17 1.50 13.08 82.68 0.14 2.08 0.00 0.35 0.17 74 S C T 77.90 2.78 20.00 22.72 93.69 56.14 -85.28 -13.08 96.92 0.48 2.59 1.56 13.73 81.58 0.18 2.49 0.00 0.32 0.16 75 I C S 40.28 16.59 14.74 31.08 121.36 65.11 -108.03 135.61 93.36 3.82 2.82 30.06 50.98 12.10 0.38 2.56 0.00 1.94 1.98 76 N C S 69.96 12.36 20.85 33.10 98.40 -155.55 -94.78 -4.86 97.34 2.36 0.30 13.54 74.76 9.02 0.02 0.31 0.00 2.06 0.29 77 T C E 36.47 11.98 23.76 36.67 131.35 61.39 -127.85 147.46 52.01 47.83 0.15 33.62 19.09 1.42 0.03 0.17 0.00 43.01 2.66 78 A E E 2.04 26.03 18.52 45.33 128.30 -168.80 -128.32 142.50 20.41 79.57 0.02 19.53 0.69 0.05 0.00 0.02 0.00 79.06 0.65 79 Y E E 52.00 12.62 27.90 41.34 121.40 -156.83 -115.84 132.58 3.49 96.51 0.00 3.16 0.15 0.01 0.00 0.00 0.00 96.60 0.07 80 L E E 2.35 26.60 20.38 47.82 120.05 -160.60 -111.77 129.65 0.30 99.70 0.00 0.28 0.01 0.00 0.00 0.00 0.00 99.72 0.00 81 Q E E 56.05 11.41 27.44 39.29 120.43 -165.21 -116.32 128.81 0.14 99.86 0.00 0.14 0.00 0.00 0.00 0.00 0.00 99.85 0.01 82 W E E 13.81 24.10 16.90 41.11 122.53 -171.19 -116.35 133.53 9.86 90.14 0.00 10.05 0.08 0.00 0.00 0.00 0.00 89.39 0.47 83 S C C 46.45 7.80 23.03 31.11 122.79 -158.67 -107.73 155.22 95.54 4.41 0.05 46.55 44.65 3.61 0.00 0.08 0.00 4.92 0.19 84 S C S 65.03 4.96 24.50 29.58 96.56 11.64 57.35 51.43 98.74 1.23 0.02 11.89 83.73 3.17 0.00 0.03 0.00 1.02 0.14 85 L C C 12.48 24.90 11.23 36.00 114.29 -158.54 -73.42 135.72 98.03 1.96 0.01 97.67 0.81 0.01 0.00 0.00 0.00 0.80 0.70 86 K C C 92.42 4.97 25.37 30.51 132.26 -173.53 -127.42 159.61 96.60 3.36 0.05 96.65 0.39 0.01 0.01 0.02 0.00 0.75 2.17 87 A H G 47.51 15.74 15.63 30.89 91.29 -102.56 -59.82 -30.85 5.53 0.04 94.43 0.24 0.36 3.57 0.24 95.57 0.00 0.02 0.00 88 S H G 71.98 4.41 22.23 27.42 89.75 63.50 -72.95 -13.99 4.65 0.05 95.29 0.18 0.28 3.00 0.22 96.27 0.00 0.04 0.00 89 D H G 12.99 21.83 17.02 38.97 93.88 70.39 -82.21 1.14 7.83 0.11 92.06 2.31 0.99 1.85 0.42 94.34 0.00 0.08 0.00 90 T C C 41.43 15.92 21.80 37.44 115.53 113.95 -76.22 137.57 95.07 4.79 0.14 91.36 3.85 0.18 0.02 0.12 0.00 4.15 0.32 91 G E E 8.78 15.06 24.07 39.79 145.65 99.92 147.08 -174.26 5.49 94.49 0.01 4.94 0.59 0.03 0.00 0.01 0.00 94.04 0.38 92 M E E 41.82 15.74 26.10 41.66 120.45 -72.44 -105.88 136.04 0.68 99.32 0.00 0.69 0.02 0.00 0.00 0.00 0.00 99.25 0.03 93 Y E E 5.28 25.78 22.10 47.96 122.78 -160.79 -112.42 136.81 0.45 99.54 0.00 0.43 0.02 0.00 0.00 0.00 0.00 99.53 0.01 94 Y E E 19.76 20.39 28.19 47.55 129.59 -171.12 -126.72 145.54 1.22 98.77 0.01 1.05 0.07 0.01 0.00 0.00 0.00 98.85 0.02 95 C E E 2.74 25.47 25.19 50.16 129.57 -165.07 -126.00 144.52 6.52 93.34 0.14 5.49 0.53 0.11 0.04 0.06 0.00 93.68 0.10 96 A E E 5.33 21.96 25.49 46.83 131.22 -169.95 -128.59 147.66 7.96 91.78 0.26 6.69 0.98 0.22 0.10 0.12 0.00 91.58 0.31 97 R E E 45.79 17.76 24.64 41.49 127.09 -160.55 -122.43 138.87 10.40 89.41 0.19 8.92 1.37 0.23 0.10 0.10 0.00 88.20 1.07 98 L E E 35.31 16.94 18.09 34.97 116.65 -132.24 -90.78 135.99 37.84 61.98 0.18 33.29 3.64 0.35 0.06 0.13 0.00 60.56 1.96 99 E C C 78.53 9.42 16.89 27.31 115.76 -126.55 -82.77 140.13 87.43 12.18 0.38 76.23 9.19 1.38 0.08 0.36 0.00 11.44 1.31 100 P C T 95.42 5.42 13.78 20.65 108.93 -97.58 -63.86 136.88 92.86 2.65 4.49 15.04 16.92 60.54 0.51 4.37 0.00 1.94 0.68 101 G C T 63.40 1.03 15.06 15.27 98.91 21.32 83.24 -2.06 93.38 1.80 4.83 14.80 17.89 60.32 0.57 4.63 0.00 1.22 0.58 102 Y C C 97.48 10.77 9.32 20.72 116.80 107.83 -96.11 137.16 86.30 6.53 7.17 44.37 27.34 14.62 1.41 5.83 0.00 3.24 3.18 103 S C C 73.49 4.27 14.25 19.75 113.18 -145.22 -94.23 139.86 88.51 4.73 6.76 45.88 23.05 19.78 1.71 5.16 0.00 2.64 1.79 104 S C C 61.27 9.00 12.23 22.04 106.55 -123.58 -87.50 53.72 82.72 4.67 12.61 30.32 26.21 27.03 2.87 9.31 0.01 2.52 1.72 105 T C C 90.36 4.91 16.05 21.89 99.08 63.36 -82.37 -10.87 78.59 6.46 14.95 34.41 21.42 23.84 3.13 11.43 0.01 3.81 1.95 106 W C C 108.93 11.34 15.59 27.20 104.13 63.77 -94.00 14.05 73.38 13.11 13.51 33.66 21.51 20.13 2.82 10.10 0.03 9.02 2.73 107 S C C 33.93 15.72 16.07 31.48 117.93 75.08 -103.39 138.31 68.73 23.79 7.47 41.63 15.28 12.86 1.79 5.70 0.01 20.21 2.50 108 V C E 48.14 14.00 19.29 33.41 118.48 -143.32 -102.90 129.65 52.32 45.24 2.44 40.13 9.94 3.49 0.77 1.82 0.01 40.45 3.39 109 N E E 68.79 13.59 20.55 33.56 116.06 -147.31 -96.32 128.91 35.90 62.59 1.51 29.21 4.47 1.84 0.73 0.99 0.01 55.63 7.11 110 W E E 59.52 18.39 17.57 34.99 114.75 -166.23 -104.91 119.71 47.27 50.54 2.19 33.73 8.33 5.64 0.97 1.57 0.02 41.87 7.87 111 G C C 23.59 12.32 20.04 32.11 123.85 -94.65 94.17 -165.75 76.58 21.16 2.26 36.91 24.01 17.02 0.40 1.95 0.01 17.29 2.41 112 Q C S 104.11 8.23 21.27 29.65 100.52 -36.28 -79.79 33.17 81.53 15.73 2.74 21.54 35.12 25.71 0.37 2.36 0.01 12.83 2.06 113 G C C 20.43 15.72 18.85 33.52 114.18 -87.44 92.17 -151.09 77.89 21.06 1.04 32.29 31.44 14.51 0.10 1.10 0.00 19.31 1.24 114 T E E 28.95 17.77 19.90 37.06 118.21 -99.21 -98.23 133.60 41.93 57.92 0.15 35.88 4.72 0.51 0.03 0.13 0.00 57.81 0.92 115 L E E 71.04 11.89 23.73 35.32 116.88 -141.34 -97.19 128.29 6.30 93.69 0.01 5.70 0.42 0.03 0.00 0.01 0.00 93.55 0.29 116 V E E 14.34 22.65 16.67 39.01 121.15 -166.05 -113.34 129.90 2.40 97.60 0.00 2.30 0.09 0.01 0.00 0.00 0.00 97.51 0.09 117 T E E 61.48 7.93 23.85 32.08 119.50 -158.62 -107.27 131.89 4.25 95.74 0.01 4.13 0.14 0.01 0.00 0.00 0.00 95.32 0.39 118 V E E 27.22 20.39 12.57 32.15 118.36 -162.39 -107.78 128.33 32.27 67.68 0.05 31.61 0.43 0.08 0.02 0.02 0.00 66.79 1.05 119 S C C 60.62 6.05 19.99 26.50 120.75 -165.35 -104.42 150.26 99.57 0.42 0.00 99.57 0.07 0.01 0.00 0.00 0.00 0.33 0.01