# 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 E C C 111.44 5.68 20.07 26.52 116.29 -146.64 -97.81 127.55 99.23 0.76 0.00 99.28 0.07 0.01 0.00 0.00 0.00 0.62 0.01 1 V C C 35.20 19.94 11.48 30.41 121.15 -160.44 -109.51 133.22 50.03 49.91 0.06 49.59 0.38 0.08 0.01 0.03 0.00 49.38 0.53 2 Q E E 90.56 5.46 22.21 28.27 122.34 -164.61 -116.27 135.83 13.14 86.74 0.11 12.01 0.82 0.18 0.03 0.08 0.00 86.54 0.35 3 L E E 40.77 20.57 13.44 33.31 119.14 -150.15 -103.59 129.36 6.80 92.99 0.21 6.20 0.48 0.16 0.07 0.13 0.00 92.72 0.23 4 V E E 62.41 8.19 21.43 30.44 121.70 -168.54 -118.26 132.39 7.12 92.57 0.31 6.42 0.51 0.15 0.11 0.15 0.00 92.26 0.39 5 Q E E 81.11 14.68 15.05 29.34 118.15 -144.59 -96.49 131.04 22.80 76.80 0.40 20.01 1.93 0.45 0.10 0.26 0.00 76.64 0.61 6 S C C 53.36 9.52 16.60 26.86 111.03 -164.93 -96.40 115.78 62.13 36.93 0.94 46.83 11.41 2.68 0.14 0.83 0.00 37.34 0.76 7 G C C 39.22 5.32 19.27 25.05 120.15 -89.98 108.33 -175.19 76.12 23.24 0.64 39.67 32.08 4.17 0.07 0.63 0.00 22.63 0.74 8 A C C 51.99 12.90 15.16 27.96 118.80 -62.21 -89.53 141.32 68.29 31.11 0.60 55.03 10.49 1.62 0.08 0.57 0.00 31.41 0.81 9 E E E 70.26 12.69 17.85 30.76 124.40 -168.29 -115.38 141.60 32.24 67.54 0.22 25.39 6.18 0.96 0.04 0.21 0.00 65.60 1.62 10 V E E 71.91 11.29 20.10 31.47 120.98 -145.67 -110.89 130.53 18.72 81.21 0.07 17.08 1.41 0.13 0.02 0.05 0.00 80.10 1.21 11 K E E 48.68 16.25 15.61 31.80 132.54 -173.28 -131.12 151.89 23.65 76.30 0.05 22.94 0.87 0.05 0.03 0.02 0.00 69.42 6.66 12 K C C 107.89 4.90 22.22 27.22 119.66 -116.53 -84.38 148.97 95.30 4.67 0.03 93.89 1.57 0.09 0.01 0.02 0.00 3.86 0.58 13 P C T 63.56 13.11 13.29 26.72 110.13 -84.56 -59.25 138.10 99.52 0.30 0.17 0.33 2.41 96.89 0.01 0.12 0.00 0.19 0.05 14 G C T 50.76 3.22 18.53 22.50 95.27 22.55 88.01 -5.80 99.70 0.18 0.12 0.44 2.55 96.76 0.00 0.09 0.00 0.14 0.02 15 E C C 82.75 7.52 16.60 25.52 123.90 116.17 -89.41 156.70 93.80 6.10 0.11 72.22 21.71 0.37 0.02 0.11 0.00 4.66 0.91 16 S C C 59.87 8.85 18.49 28.21 124.18 -125.09 -104.10 147.45 77.30 22.67 0.03 76.38 1.08 0.08 0.00 0.02 0.00 21.62 0.81 17 L E E 15.28 22.27 14.56 36.74 124.86 -159.29 -121.30 138.90 9.73 90.27 0.01 9.38 0.26 0.01 0.00 0.00 0.00 90.01 0.33 18 K E E 110.11 6.61 24.77 32.22 118.48 -147.67 -108.19 128.35 1.67 98.33 0.00 1.60 0.05 0.00 0.00 0.00 0.00 98.28 0.07 19 I E E 5.62 25.63 15.81 42.11 122.29 -168.99 -118.61 132.48 2.64 97.35 0.00 2.63 0.08 0.00 0.00 0.00 0.00 97.20 0.09 20 S E E 38.21 9.23 26.69 36.40 127.74 -167.45 -116.60 147.27 10.90 89.08 0.02 10.41 0.32 0.02 0.00 0.01 0.00 89.11 0.13 21 C E E 7.27 25.39 15.86 41.39 130.88 -173.25 -133.33 145.97 17.74 82.21 0.05 16.57 0.75 0.06 0.02 0.02 0.00 82.14 0.44 22 K E E 102.16 6.90 26.04 33.65 123.61 -161.94 -118.28 137.48 15.10 84.76 0.15 13.35 1.51 0.25 0.07 0.09 0.00 81.03 3.70 23 G E E 13.74 20.71 14.87 34.36 126.96 153.11 -124.23 156.46 47.41 52.11 0.48 39.54 6.44 1.34 0.12 0.44 0.00 49.56 2.56 24 S C C 60.62 7.96 19.86 28.30 114.98 -132.26 -103.19 140.36 73.23 25.42 1.35 40.60 23.35 10.29 0.19 1.37 0.00 22.39 1.81 25 G C S 49.28 4.50 19.92 24.95 100.01 3.75 84.99 0.52 80.58 17.41 2.01 26.79 39.12 15.70 0.24 1.89 0.00 14.33 1.92 26 Y C C 62.14 17.06 13.28 29.87 120.94 121.39 -98.31 142.91 75.87 21.50 2.62 54.19 15.99 5.76 0.61 2.34 0.00 16.14 4.96 27 S C C 56.25 7.40 20.89 29.03 124.74 -161.91 -118.20 142.34 79.85 17.73 2.42 63.80 10.28 5.04 0.63 2.02 0.00 12.81 5.41 28 F C C 50.02 19.13 12.69 31.11 104.72 -151.93 -95.19 40.37 80.29 12.22 7.49 48.32 16.87 15.50 1.63 6.04 0.01 7.76 3.86 29 T C T 88.14 4.90 18.12 23.85 99.67 111.09 -84.84 -19.96 88.14 4.15 7.71 22.80 28.47 37.22 1.11 6.51 0.01 2.55 1.34 30 S C T 65.23 5.08 18.47 23.99 102.95 33.43 -101.29 -10.98 87.55 5.17 7.28 14.89 35.63 37.84 0.89 6.01 0.01 3.51 1.23 31 Y C C 74.14 13.80 16.15 30.09 121.49 19.98 -114.13 135.35 75.53 21.66 2.81 45.27 21.08 9.63 0.49 2.56 0.00 18.10 2.86 32 Y C C 65.58 15.33 20.43 35.43 115.13 -171.07 -106.08 124.59 59.40 40.34 0.26 48.98 7.95 0.91 0.05 0.23 0.00 40.78 1.11 33 W E E 40.79 17.66 24.34 41.40 127.50 -136.85 -121.81 141.62 15.59 84.39 0.02 14.38 0.81 0.05 0.00 0.01 0.00 84.44 0.30 34 I E E 3.79 25.52 23.45 48.85 125.25 -164.01 -119.03 136.11 1.48 98.52 0.00 1.39 0.05 0.00 0.00 0.00 0.00 98.53 0.03 35 G E E 3.09 21.18 27.22 47.90 136.01 -171.06 -134.85 157.81 0.35 99.65 0.00 0.31 0.01 0.00 0.00 0.00 0.00 99.68 0.00 36 W E E 6.69 24.65 25.03 49.23 127.62 -143.87 -123.58 143.34 0.26 99.74 0.00 0.23 0.00 0.00 0.00 0.00 0.00 99.77 0.00 37 V E E 9.13 20.97 24.99 45.45 129.37 -167.79 -126.37 142.04 0.24 99.76 0.00 0.21 0.00 0.00 0.00 0.00 0.00 99.78 0.00 38 R E E 40.71 17.33 23.51 40.17 123.74 -158.11 -114.28 136.79 0.41 99.59 0.00 0.35 0.01 0.00 0.00 0.00 0.00 99.63 0.00 39 Q E E 50.80 14.06 18.87 33.34 116.24 -140.29 -99.08 127.75 3.19 96.81 0.00 2.87 0.12 0.01 0.00 0.00 0.00 96.84 0.15 40 M C C 50.62 11.17 14.68 27.30 119.62 -145.90 -91.54 146.87 69.60 30.30 0.09 67.59 1.39 0.17 0.02 0.06 0.00 30.06 0.71 41 P C T 92.16 5.53 12.91 20.20 109.41 -87.62 -58.51 136.19 96.51 0.25 3.24 0.23 2.70 93.50 0.03 3.37 0.00 0.13 0.05 42 G C T 69.42 0.29 13.24 10.93 95.64 14.82 82.09 -4.11 96.62 0.08 3.30 0.27 2.45 93.69 0.04 3.49 0.00 0.04 0.02 43 K C T 127.08 3.66 12.26 17.38 106.41 70.87 -108.38 -6.42 89.89 4.80 5.32 11.74 33.91 43.40 0.19 6.72 0.00 3.17 0.88 44 G C C 31.75 4.51 16.92 22.68 127.23 -118.43 88.94 -165.60 63.97 35.92 0.10 47.36 15.30 1.33 0.02 0.12 0.00 34.51 1.37 45 L E E 54.69 16.42 13.68 29.90 116.14 -25.64 -74.83 137.83 23.51 76.47 0.01 20.65 1.12 0.05 0.00 0.01 0.00 78.04 0.13 46 E E E 70.94 10.63 21.91 32.90 127.31 -170.12 -124.05 141.60 1.18 98.82 0.00 0.97 0.06 0.00 0.00 0.00 0.00 98.95 0.02 47 W E E 87.75 16.51 20.32 36.14 110.69 -112.47 -72.93 128.13 0.24 99.76 0.00 0.21 0.01 0.00 0.00 0.00 0.00 99.77 0.01 48 M E E 13.38 21.00 21.72 42.90 100.41 177.12 -100.20 -25.45 3.71 96.29 0.01 2.64 0.82 0.12 0.00 0.00 0.00 96.40 0.02 49 G E E 2.54 19.23 24.48 44.08 144.91 -45.73 165.05 174.09 2.88 97.11 0.01 1.99 0.56 0.09 0.00 0.01 0.00 97.33 0.02 50 I E E 26.21 18.66 25.94 43.99 127.09 -99.36 -125.46 139.40 2.03 97.96 0.01 1.83 0.10 0.01 0.00 0.00 0.00 97.97 0.08 51 V E E 7.17 23.16 20.38 43.71 119.81 -154.92 -113.86 128.39 5.74 94.25 0.02 5.16 0.42 0.02 0.01 0.00 0.00 93.21 1.17 52 Y C C 51.47 12.02 22.97 35.59 114.68 -162.23 -106.47 121.84 65.03 34.94 0.03 60.58 3.49 0.19 0.01 0.03 0.00 34.38 1.32 53 P C T 47.52 15.86 15.10 30.98 93.12 -130.36 -62.52 -24.75 97.62 1.70 0.68 2.36 10.68 84.46 0.03 0.80 0.00 1.48 0.18 54 D C T 115.49 1.72 18.54 19.76 95.41 53.80 -87.34 -3.10 98.93 0.46 0.61 1.68 10.82 86.27 0.02 0.78 0.00 0.34 0.09 55 D C C 51.39 11.72 10.76 23.29 112.89 82.36 -103.85 113.96 86.76 12.01 1.23 62.76 20.54 3.51 0.18 1.47 0.00 7.83 3.71 56 S C S 85.84 3.56 14.53 20.11 95.57 -166.46 -84.10 -12.88 84.51 12.84 2.65 19.38 33.70 32.06 0.20 2.78 0.00 10.49 1.39 57 D C T 101.87 3.06 18.34 21.83 98.40 65.84 -91.75 11.56 84.27 13.91 1.82 26.17 28.01 30.24 0.12 2.02 0.00 12.44 1.01 58 T C C 30.79 20.25 9.86 28.74 115.01 126.30 -78.54 134.97 81.44 17.93 0.64 74.82 4.88 0.88 0.09 0.61 0.00 17.80 0.92 59 R E E 131.19 4.07 23.58 28.53 128.08 -173.61 -130.34 144.06 35.36 64.39 0.26 30.84 3.48 0.34 0.11 0.17 0.00 54.58 10.50 60 Y E E 77.93 19.07 13.63 31.50 118.67 -122.87 -84.34 139.24 29.98 69.93 0.09 28.19 1.39 0.06 0.09 0.03 0.00 46.79 23.45 61 S C C 24.08 13.54 13.24 27.90 114.70 -112.23 -72.55 147.32 98.88 1.11 0.01 98.56 0.59 0.02 0.00 0.00 0.00 0.70 0.12 62 P H G 111.58 1.73 16.73 18.69 91.15 -116.09 -59.91 -31.51 32.55 0.14 67.31 0.83 2.08 27.10 0.87 69.02 0.00 0.09 0.03 63 S H G 66.66 5.71 16.21 23.26 90.26 62.39 -69.09 -19.13 32.32 0.09 67.59 0.32 1.39 29.59 0.76 67.89 0.00 0.05 0.02 64 F H G 14.01 21.87 10.27 32.11 97.80 43.77 -103.04 -0.92 33.03 0.61 66.35 1.54 3.07 26.28 1.10 67.48 0.00 0.40 0.13 65 Q C T 110.33 6.87 14.71 23.99 109.95 122.32 -60.06 129.00 94.62 1.71 3.67 2.22 3.12 90.01 0.78 2.07 0.00 0.75 1.05 66 G C T 60.56 1.65 18.29 19.41 94.19 14.44 80.81 -2.34 96.02 0.33 3.65 0.63 3.26 92.87 0.40 2.53 0.00 0.21 0.10 67 Q C T 70.38 12.02 17.32 29.64 99.09 79.91 -99.36 -17.87 95.22 1.87 2.91 9.76 22.94 62.52 0.34 2.50 0.00 1.66 0.26 68 V E E 6.92 24.58 12.41 37.20 130.45 44.29 -130.69 145.00 18.42 81.45 0.13 14.56 3.76 0.34 0.04 0.10 0.00 79.80 1.40 69 T E E 64.23 6.53 26.53 33.74 127.21 -166.30 -125.41 141.90 2.07 97.92 0.01 1.93 0.09 0.01 0.00 0.00 0.00 97.82 0.14 70 I E E 20.97 24.60 14.67 39.02 124.79 -163.78 -122.65 134.02 2.13 97.86 0.02 1.98 0.10 0.01 0.01 0.00 0.00 97.74 0.16 71 S E E 51.44 6.18 26.74 33.51 129.06 -177.45 -132.40 146.31 16.62 83.27 0.11 14.13 2.19 0.27 0.03 0.07 0.00 82.74 0.57 72 A C C 26.09 22.39 13.04 34.23 129.93 -165.28 -129.67 143.82 61.47 38.20 0.33 52.02 8.04 0.77 0.08 0.28 0.00 37.21 1.60 73 D C C 62.20 7.50 20.44 28.58 117.61 -150.38 -107.47 131.55 90.67 8.94 0.39 86.07 3.84 0.98 0.11 0.30 0.00 6.87 1.84 74 K C T 126.34 8.82 15.08 25.25 92.57 -131.21 -67.20 -18.90 96.30 0.80 2.90 3.18 19.22 73.82 0.31 2.66 0.00 0.53 0.28 75 S C T 79.17 2.55 19.66 22.10 93.64 57.26 -86.14 -11.69 95.99 0.80 3.20 3.35 18.99 73.49 0.34 3.03 0.00 0.52 0.28 76 I C S 40.15 16.27 13.91 30.19 122.35 66.43 -111.70 138.82 92.65 4.60 2.75 34.24 47.19 11.05 0.48 2.29 0.00 2.12 2.63 77 S C S 50.80 11.59 20.72 32.49 98.95 -156.18 -97.68 -4.09 97.21 2.38 0.41 14.19 74.67 8.45 0.04 0.38 0.00 1.91 0.37 78 T C C 37.69 11.85 23.46 36.16 130.39 60.39 -125.81 148.08 62.91 36.73 0.36 36.26 26.19 2.37 0.07 0.37 0.00 31.45 3.30 79 A E E 2.51 25.61 18.39 44.67 125.96 -164.60 -125.59 139.98 38.30 61.61 0.09 36.32 1.58 0.15 0.02 0.08 0.00 60.57 1.29 80 Y E E 54.23 12.73 27.66 41.04 122.01 -158.16 -115.96 133.35 9.75 90.24 0.01 8.87 0.46 0.03 0.00 0.01 0.00 90.34 0.29 81 L E E 2.76 26.33 20.25 47.35 119.35 -159.05 -110.26 129.15 0.90 99.10 0.00 0.81 0.03 0.00 0.00 0.00 0.00 99.15 0.01 82 Q E E 56.23 11.57 27.17 39.06 121.71 -167.51 -116.91 130.80 0.20 99.80 0.00 0.19 0.00 0.00 0.00 0.00 0.00 99.79 0.02 83 W E E 15.91 23.60 16.86 40.51 121.66 -170.93 -117.39 132.71 8.70 91.29 0.00 8.91 0.07 0.00 0.00 0.00 0.00 90.44 0.57 84 S C C 47.21 7.77 22.60 30.71 123.08 -161.60 -110.50 154.53 93.71 6.25 0.05 48.89 40.99 2.92 0.00 0.08 0.00 6.91 0.21 85 S C S 67.02 4.59 24.13 28.80 96.67 9.72 59.44 52.32 98.43 1.56 0.02 11.72 84.23 2.48 0.00 0.03 0.00 1.40 0.14 86 L C C 15.15 24.44 10.79 34.84 114.93 -159.30 -72.42 136.09 97.54 2.45 0.01 97.11 0.92 0.02 0.00 0.00 0.00 1.14 0.82 87 K C C 94.53 4.57 24.91 29.51 131.29 -171.05 -123.14 159.70 96.26 3.70 0.04 95.87 0.63 0.02 0.01 0.02 0.00 0.88 2.58 88 A H G 50.73 14.77 15.35 29.80 91.30 -100.46 -59.60 -30.61 7.67 0.07 92.26 0.29 0.53 5.26 0.22 93.66 0.00 0.04 0.00 89 S H G 72.77 4.20 21.89 26.77 90.22 62.56 -75.46 -13.17 6.36 0.08 93.56 0.22 0.42 4.30 0.18 94.83 0.00 0.05 0.00 90 D H G 16.68 20.62 17.07 37.67 96.12 70.84 -83.46 3.79 8.96 0.18 90.86 2.80 1.37 2.26 0.31 93.13 0.00 0.11 0.01 91 T C C 37.76 16.07 21.81 37.68 116.67 113.58 -80.88 137.92 89.39 10.47 0.14 86.64 2.94 0.12 0.01 0.13 0.00 9.77 0.38 92 A E E 9.13 19.91 23.55 42.71 144.13 146.09 -155.32 171.26 3.58 96.42 0.01 3.40 0.17 0.01 0.00 0.00 0.00 96.14 0.29 93 M E E 34.62 16.82 26.36 42.81 119.33 -103.49 -102.37 133.92 0.54 99.46 0.00 0.55 0.01 0.00 0.00 0.00 0.00 99.42 0.01 94 Y E E 5.21 25.69 22.11 47.91 123.47 -162.93 -114.80 136.78 0.43 99.57 0.00 0.40 0.02 0.00 0.00 0.00 0.00 99.57 0.01 95 Y E E 21.73 19.55 27.85 46.59 130.97 -171.54 -126.81 146.18 1.22 98.76 0.01 1.03 0.08 0.01 0.00 0.00 0.00 98.84 0.03 96 C E E 3.25 25.02 23.74 48.60 127.69 -164.22 -124.43 141.37 7.86 92.00 0.14 6.49 0.89 0.11 0.04 0.06 0.00 92.22 0.19 97 V E E 11.96 18.86 25.20 43.89 127.59 -162.76 -123.33 143.30 10.74 89.09 0.17 9.40 0.98 0.14 0.07 0.07 0.00 88.87 0.46 98 R E E 50.45 17.15 21.25 37.96 121.31 -146.15 -108.72 134.95 18.66 81.17 0.17 16.00 2.35 0.27 0.08 0.10 0.00 78.41 2.79 99 H C C 56.04 13.10 16.72 30.60 116.77 -139.44 -98.94 132.14 62.18 37.57 0.25 54.10 6.25 0.72 0.06 0.22 0.00 37.42 1.23 100 P C C 80.13 7.14 15.04 23.30 108.23 -114.63 -68.81 139.54 82.93 14.14 2.93 40.84 19.64 22.24 0.31 3.00 0.00 12.93 1.03 101 G C T 56.73 2.63 13.77 17.32 106.01 10.02 79.83 5.01 89.85 5.67 4.48 23.56 28.65 37.70 0.41 4.55 0.00 3.88 1.24 102 G C S 54.30 2.98 12.14 16.59 110.02 29.37 95.29 72.75 91.46 3.12 5.42 25.59 34.00 31.56 0.54 5.49 0.00 1.75 1.08 103 G C S 48.14 4.00 12.21 17.75 116.44 58.18 106.02 -168.90 90.53 3.54 5.93 28.54 36.67 25.36 0.78 5.41 0.00 2.02 1.22 104 D C C 107.20 3.58 13.91 18.83 105.83 -62.60 -89.03 56.12 84.19 8.37 7.43 35.20 29.65 20.25 1.18 6.29 0.01 5.34 2.10 105 W C C 121.44 10.27 13.38 24.21 112.36 141.37 -96.78 117.64 72.08 18.96 8.97 42.67 17.82 12.47 1.94 7.37 0.02 13.94 3.77 106 Y C C 101.52 10.96 17.13 28.32 110.85 121.97 -97.79 108.98 64.46 27.48 8.06 39.61 15.81 10.49 2.04 6.04 0.03 22.53 3.44 107 F C E 57.02 16.61 16.91 32.99 121.95 -131.95 -109.95 134.99 51.22 41.73 7.05 34.20 11.64 7.25 2.44 4.80 0.05 34.67 4.95 108 D C C 47.96 14.18 20.12 34.16 114.45 -146.31 -98.49 120.35 53.28 41.94 4.78 41.03 8.36 4.56 1.79 2.93 0.01 38.25 3.07 109 L C E 58.19 15.70 20.26 35.12 111.42 -154.83 -93.20 113.73 50.29 44.53 5.18 31.78 11.92 8.56 2.03 3.16 0.07 38.31 4.16 110 W C E 66.18 17.76 19.07 35.63 108.35 40.35 -97.21 57.75 51.16 44.28 4.56 29.18 12.51 12.41 1.75 2.86 0.11 30.88 10.29 111 G C C 22.32 14.33 19.94 33.49 119.52 -150.27 78.13 -158.54 77.38 20.13 2.49 39.92 23.73 14.91 0.53 2.00 0.01 16.37 2.53 112 R C S 132.61 8.13 22.34 30.43 100.13 -40.63 -85.17 12.10 80.97 16.61 2.42 30.15 33.55 18.39 0.41 1.97 0.01 13.40 2.13 113 G C C 16.63 17.29 18.51 34.58 124.18 -115.61 87.93 175.04 75.37 23.76 0.87 44.99 20.64 9.59 0.10 0.89 0.00 22.65 1.14 114 T E E 25.74 18.13 20.11 37.75 121.78 -100.52 -107.36 138.14 28.76 71.16 0.09 25.23 2.68 0.23 0.02 0.07 0.00 71.13 0.66 115 L E E 73.34 11.51 23.80 35.13 115.53 -137.01 -92.61 129.05 3.09 96.90 0.00 2.81 0.15 0.01 0.00 0.00 0.00 96.89 0.14 116 V E E 12.02 23.03 16.13 39.04 121.22 -167.16 -113.74 131.08 1.33 98.67 0.00 1.27 0.04 0.00 0.00 0.00 0.00 98.65 0.04 117 T E E 61.91 7.57 23.94 31.83 120.20 -157.95 -107.30 133.30 3.45 96.54 0.00 3.32 0.11 0.01 0.00 0.00 0.00 96.28 0.27 118 V E E 26.51 20.61 12.05 31.79 117.99 -158.76 -106.86 129.22 34.57 65.39 0.05 33.89 0.50 0.08 0.01 0.02 0.00 64.51 0.97 119 S C C 63.86 5.50 19.81 25.74 118.62 -158.65 -95.48 148.39 99.62 0.38 0.00 99.61 0.08 0.02 0.00 0.00 0.00 0.29 0.01