# 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 107.36 6.56 19.76 27.06 119.28 -156.66 -101.16 133.94 98.90 1.09 0.01 98.99 0.06 0.01 0.00 0.00 0.00 0.91 0.02 1 V E E 35.07 19.99 11.85 30.83 121.49 -162.97 -112.87 133.80 31.76 68.10 0.14 31.73 0.38 0.10 0.06 0.05 0.00 66.75 0.93 2 Q E E 88.12 5.92 22.15 28.62 122.14 -164.43 -115.63 136.75 13.05 86.73 0.22 11.95 0.85 0.18 0.11 0.10 0.00 86.35 0.46 3 L E E 47.93 20.35 14.14 33.46 120.28 -151.58 -106.33 130.88 13.75 85.80 0.45 12.75 0.68 0.23 0.20 0.20 0.00 85.56 0.38 4 V E E 61.64 9.07 21.73 31.46 124.75 -170.96 -122.87 137.54 16.93 82.45 0.62 15.36 1.17 0.34 0.26 0.28 0.00 81.94 0.64 5 E E E 89.05 13.93 17.22 30.72 115.09 -131.62 -87.68 131.97 35.28 63.28 1.44 29.72 3.94 1.31 0.43 0.96 0.00 62.82 0.82 6 S C C 43.28 13.62 17.18 30.58 101.82 -164.54 -91.49 -6.12 69.30 28.40 2.30 44.70 15.99 7.86 0.29 2.19 0.00 28.01 0.96 7 G C S 40.16 8.29 19.93 28.28 110.67 -103.99 90.82 5.64 78.20 20.42 1.38 29.10 35.67 13.45 0.14 1.39 0.00 19.22 1.04 8 G C C 32.24 12.51 17.46 29.47 124.36 -19.39 102.35 168.08 72.26 27.08 0.65 42.29 24.06 5.75 0.07 0.73 0.00 26.14 0.95 9 G E E 26.13 11.96 19.13 31.01 126.49 110.81 141.75 23.72 35.80 64.11 0.09 27.31 8.28 0.58 0.01 0.09 0.00 62.97 0.75 10 L E E 83.25 10.51 22.00 32.36 120.40 -94.09 -104.69 134.80 7.57 92.41 0.02 6.51 0.88 0.05 0.01 0.01 0.00 92.04 0.49 11 V E E 21.04 20.64 14.83 35.05 127.06 -171.66 -123.54 140.32 4.51 95.48 0.01 4.33 0.22 0.01 0.01 0.01 0.00 91.92 3.50 12 Q C C 92.23 5.45 23.27 28.89 120.51 -131.70 -86.04 149.29 82.16 17.81 0.02 82.50 0.41 0.05 0.00 0.01 0.00 16.36 0.66 13 P C T 69.75 12.34 14.59 27.23 109.57 -86.37 -59.24 137.04 99.32 0.46 0.22 0.22 1.96 97.33 0.01 0.16 0.00 0.29 0.04 14 G C T 50.91 3.25 19.38 23.25 96.49 22.67 87.60 -5.44 99.53 0.30 0.18 0.28 2.33 97.04 0.01 0.12 0.00 0.21 0.02 15 G C C 24.29 8.86 16.41 26.66 128.23 115.94 -90.54 170.89 93.20 6.74 0.05 75.23 17.88 0.27 0.00 0.06 0.00 6.02 0.54 16 S C C 53.83 9.86 20.11 30.76 130.98 -122.45 -128.90 152.17 51.37 48.62 0.01 51.76 0.51 0.02 0.00 0.00 0.00 46.92 0.79 17 L E E 16.47 22.69 16.10 38.59 125.42 -158.19 -123.04 138.65 1.22 98.78 0.00 1.16 0.03 0.00 0.00 0.00 0.00 98.75 0.06 18 R E E 115.29 8.05 25.14 33.99 120.31 -156.24 -112.83 130.80 0.34 99.66 0.00 0.32 0.01 0.00 0.00 0.00 0.00 99.66 0.01 19 L E E 6.18 25.52 16.86 42.80 124.76 -171.44 -121.08 136.95 1.63 98.36 0.00 1.54 0.05 0.00 0.00 0.00 0.00 98.36 0.05 20 S E E 39.70 9.97 27.06 37.53 126.08 -164.29 -115.57 145.03 13.43 86.53 0.04 12.36 0.55 0.05 0.01 0.02 0.00 86.87 0.15 21 C E E 6.06 25.15 17.54 42.79 134.48 -175.75 -139.38 148.89 22.14 77.72 0.15 20.52 1.24 0.19 0.05 0.09 0.00 77.39 0.53 22 S E E 39.63 10.04 27.57 38.33 126.36 -159.36 -120.41 142.31 17.41 82.31 0.28 15.88 1.17 0.23 0.13 0.15 0.00 78.30 4.14 23 A E E 9.64 24.15 15.24 39.11 124.37 -162.19 -119.40 139.22 45.18 54.23 0.58 41.02 2.79 0.73 0.19 0.42 0.00 51.63 3.22 24 S C C 59.53 7.17 21.63 29.20 115.92 -160.30 -107.70 141.81 71.50 27.53 0.97 40.16 22.15 10.39 0.15 1.00 0.00 24.53 1.62 25 G C S 40.47 4.88 19.54 25.24 125.35 25.25 113.10 -169.86 84.89 14.00 1.11 22.37 47.33 15.49 0.12 1.13 0.00 12.05 1.51 26 S C C 64.99 6.85 18.03 25.66 115.57 -51.16 -94.55 135.06 86.56 11.70 1.74 60.62 19.21 6.58 0.33 1.76 0.00 8.55 2.96 27 L C C 65.57 15.55 13.46 28.28 103.75 -154.80 -86.65 17.11 86.50 9.55 3.96 41.64 27.00 18.50 0.63 3.60 0.00 6.15 2.47 28 S C C 63.68 7.99 17.31 25.89 103.67 98.42 -88.47 -0.71 85.80 9.70 4.49 34.59 30.72 21.44 0.68 3.88 0.01 6.30 2.38 29 T C C 73.49 7.89 17.98 26.38 110.02 57.30 -94.07 85.79 86.14 9.70 4.17 57.50 18.59 9.85 0.88 3.62 0.00 7.06 2.51 30 I C C 60.86 14.53 16.63 30.89 109.02 67.78 -94.55 86.11 84.08 13.31 2.61 42.42 32.45 9.93 0.52 2.09 0.00 10.74 1.84 31 K C S 81.71 12.87 20.81 33.03 105.26 110.14 -94.88 13.21 75.93 23.03 1.04 25.78 42.30 7.21 0.13 0.88 0.00 22.72 0.99 32 A E E 22.35 15.07 24.14 39.17 130.16 37.31 -130.48 147.43 25.26 74.24 0.50 20.56 3.68 0.92 0.08 0.39 0.00 73.90 0.47 33 L E E 3.95 25.86 21.49 47.43 127.78 -166.62 -124.85 140.96 3.08 96.90 0.01 2.77 0.19 0.02 0.00 0.01 0.00 96.89 0.13 34 G E E 4.75 19.14 27.72 46.51 136.79 -172.55 -137.61 161.68 0.85 99.14 0.00 0.75 0.04 0.00 0.00 0.00 0.00 99.20 0.01 35 W E E 5.64 25.41 23.60 48.96 129.56 -139.12 -125.73 145.13 0.59 99.41 0.00 0.52 0.02 0.00 0.00 0.00 0.00 99.45 0.01 36 Y E E 23.46 18.46 25.41 43.35 133.69 -172.57 -133.18 150.78 0.48 99.52 0.00 0.43 0.01 0.00 0.00 0.00 0.00 99.54 0.01 37 R E E 38.82 18.31 21.77 39.44 126.88 -160.12 -123.35 140.28 1.19 98.80 0.00 1.02 0.07 0.00 0.00 0.00 0.00 98.88 0.03 38 R E E 77.06 12.72 19.28 32.32 117.21 -136.65 -98.61 130.62 10.78 89.21 0.01 10.01 0.49 0.02 0.00 0.01 0.00 88.80 0.67 39 A C C 25.77 12.15 14.08 27.64 118.95 -132.80 -80.21 154.00 96.85 3.12 0.03 95.86 1.01 0.19 0.00 0.02 0.00 2.56 0.35 40 P C T 89.34 6.18 12.95 20.70 109.77 -74.86 -59.13 135.59 99.61 0.11 0.28 0.36 3.42 95.83 0.00 0.29 0.00 0.07 0.02 41 G C T 68.21 0.37 13.54 11.55 96.25 17.82 82.94 -2.39 99.62 0.08 0.30 0.48 3.25 95.86 0.01 0.34 0.00 0.05 0.01 42 R C S 121.41 5.35 9.66 17.12 127.73 95.67 -116.47 160.97 96.78 2.77 0.46 40.81 54.57 1.70 0.07 0.39 0.00 1.19 1.28 43 E C C 139.82 1.67 16.93 18.28 115.50 -96.32 -74.07 148.90 95.42 4.52 0.06 87.67 7.56 0.29 0.01 0.06 0.00 3.92 0.50 44 R C C 93.88 15.88 11.85 27.05 114.71 -104.74 -72.40 137.96 55.44 44.51 0.05 53.63 1.15 0.09 0.00 0.04 0.00 44.65 0.43 45 E E E 61.79 11.36 19.91 32.07 125.00 -166.53 -123.23 136.77 5.44 94.54 0.02 4.82 0.43 0.03 0.00 0.01 0.00 94.50 0.20 46 L E E 55.93 15.24 21.41 36.26 111.04 -116.25 -73.93 128.63 1.67 98.33 0.00 1.60 0.04 0.00 0.00 0.00 0.00 98.33 0.03 47 V E E 7.04 22.44 21.88 44.54 102.28 174.88 -101.21 -30.03 8.63 91.37 0.00 4.39 3.30 0.03 0.00 0.00 0.00 92.27 0.01 48 A E E 2.68 22.82 23.50 46.50 142.77 -2.14 -156.15 156.20 0.81 99.19 0.00 0.58 0.09 0.00 0.00 0.00 0.00 99.32 0.00 49 S E E 13.09 18.59 25.93 43.87 135.03 -163.46 -140.28 149.15 0.41 99.59 0.00 0.37 0.01 0.00 0.00 0.00 0.00 99.61 0.00 50 I E E 14.03 20.53 20.04 40.74 119.26 -152.58 -115.54 127.44 0.44 99.56 0.00 0.42 0.01 0.00 0.00 0.00 0.00 99.43 0.14 51 T C C 31.34 10.60 19.75 31.39 127.39 -154.86 -95.51 170.28 62.67 37.28 0.05 61.36 0.91 0.11 0.01 0.04 0.00 36.60 0.97 52 S C T 68.79 10.03 14.66 25.54 90.88 -97.98 -63.96 -20.66 98.65 0.69 0.66 0.72 4.93 93.10 0.02 0.64 0.00 0.52 0.08 53 A C T 85.11 1.46 17.52 18.03 92.54 58.41 -85.56 -3.02 99.15 0.13 0.72 0.40 4.49 94.29 0.02 0.70 0.00 0.07 0.03 54 G C S 34.66 10.51 13.55 24.59 98.21 -103.43 88.36 5.24 98.32 0.76 0.93 16.33 79.34 2.84 0.09 0.70 0.00 0.37 0.32 55 E C C 101.83 3.95 20.44 25.20 117.55 138.06 -81.32 142.75 93.38 6.60 0.02 92.08 1.57 0.10 0.01 0.01 0.00 5.80 0.43 56 T E E 40.65 20.52 12.75 32.04 124.69 -153.19 -115.97 138.90 4.13 95.86 0.01 4.08 0.15 0.01 0.00 0.00 0.00 94.70 1.06 57 N E E 65.67 8.29 24.19 32.95 130.10 -172.96 -131.15 143.02 2.65 97.34 0.01 2.34 0.17 0.01 0.00 0.00 0.00 97.34 0.13 58 Y E E 73.55 19.19 16.00 34.00 127.75 -159.21 -117.77 144.67 16.37 83.58 0.05 15.35 0.88 0.06 0.02 0.03 0.00 82.11 1.55 59 A C C 19.02 15.77 13.94 30.37 115.35 -111.87 -70.81 148.72 93.55 6.20 0.24 90.84 2.50 0.33 0.06 0.16 0.00 5.65 0.47 60 D H G 118.06 1.78 18.53 20.52 92.64 -109.20 -59.03 -34.74 45.71 0.48 53.81 2.18 5.90 35.56 1.92 53.98 0.00 0.28 0.19 61 S H G 63.98 6.48 17.71 25.32 90.76 59.29 -69.67 -18.55 45.23 0.18 54.60 0.69 3.01 39.76 1.49 54.90 0.00 0.09 0.07 62 A H G 5.03 23.32 10.66 34.11 96.33 49.11 -97.78 -4.41 44.32 0.68 55.00 2.29 4.58 35.30 1.91 55.23 0.00 0.41 0.27 63 K C T 120.44 7.51 15.32 25.15 110.45 122.03 -61.07 131.32 93.02 2.39 4.59 3.04 4.21 86.30 0.98 2.89 0.01 1.18 1.39 64 G C T 61.21 1.37 19.29 19.80 93.65 13.61 80.61 -2.70 95.56 0.37 4.07 0.66 3.38 92.06 0.30 3.26 0.00 0.22 0.12 65 R C T 80.51 13.39 17.40 30.86 99.74 78.27 -100.15 -20.04 95.05 1.15 3.80 5.89 19.29 69.84 0.30 3.53 0.00 0.91 0.23 66 F E E 7.41 24.72 12.68 37.83 134.16 37.85 -134.04 151.74 17.73 82.17 0.09 14.10 3.81 0.21 0.03 0.07 0.00 80.17 1.62 67 T E E 62.66 6.49 26.89 34.06 126.57 -161.06 -123.55 141.61 1.93 98.07 0.00 1.79 0.07 0.00 0.00 0.00 0.00 98.06 0.08 68 V E E 20.74 24.06 14.78 38.49 123.55 -160.74 -119.87 131.68 1.34 98.65 0.00 1.30 0.03 0.00 0.00 0.00 0.00 98.65 0.02 69 S E E 46.57 6.94 25.58 32.78 129.45 -174.98 -129.06 149.54 3.26 96.74 0.00 3.03 0.08 0.00 0.00 0.00 0.00 96.85 0.04 70 T E E 48.19 18.88 13.69 31.54 123.51 -154.37 -118.14 133.66 6.46 93.52 0.03 5.67 0.53 0.05 0.00 0.02 0.00 93.46 0.28 71 D E E 57.91 6.94 17.54 25.97 110.04 -160.54 -110.66 106.35 21.00 78.88 0.12 19.82 1.05 0.16 0.05 0.08 0.00 76.87 1.98 72 N C T 95.70 7.91 12.86 22.48 93.62 -170.01 -68.29 -27.09 83.86 0.65 15.49 2.23 6.99 71.57 0.37 18.22 0.00 0.43 0.18 73 A C T 88.49 1.35 15.67 16.44 92.83 56.30 -69.10 -35.04 83.75 0.85 15.40 1.17 6.20 73.93 0.33 17.54 0.00 0.52 0.30 74 K C T 113.92 4.17 16.33 21.16 98.39 33.18 -97.15 -4.01 87.42 0.17 12.42 1.24 6.23 77.24 0.25 14.87 0.00 0.09 0.07 75 N C T 55.46 13.41 15.43 29.71 95.22 -127.31 57.10 41.72 99.45 0.20 0.35 5.18 5.54 88.79 0.05 0.25 0.00 0.15 0.03 76 T E E 27.54 12.24 21.79 35.17 132.40 132.91 -130.62 151.70 9.36 90.62 0.02 7.84 1.05 0.07 0.01 0.01 0.00 87.47 3.55 77 V E E 5.18 24.54 18.87 43.91 122.76 -155.49 -119.28 132.30 3.28 96.71 0.00 3.10 0.10 0.01 0.00 0.00 0.00 96.61 0.18 78 D E E 30.44 12.89 27.21 40.74 121.42 -161.16 -114.78 133.00 6.22 93.78 0.00 5.47 0.19 0.01 0.00 0.00 0.00 94.31 0.01 79 L E E 2.98 26.31 19.76 46.85 120.08 -161.57 -113.63 129.73 0.67 99.33 0.00 0.64 0.01 0.00 0.00 0.00 0.00 99.35 0.01 80 R E E 77.62 11.10 27.41 38.89 120.34 -163.92 -113.67 128.92 0.17 99.83 0.00 0.16 0.00 0.00 0.00 0.00 0.00 99.82 0.01 81 M E E 8.75 24.34 17.04 41.64 119.04 -169.07 -115.48 126.07 11.32 88.68 0.00 11.63 0.08 0.00 0.00 0.00 0.00 87.51 0.77 82 N C C 65.26 8.07 22.66 30.94 121.93 -156.71 -99.42 153.01 97.18 2.79 0.03 51.03 42.04 3.74 0.00 0.06 0.00 2.97 0.17 83 S C S 66.66 4.72 23.93 28.78 96.46 9.29 59.19 49.62 99.46 0.51 0.02 9.53 85.76 4.23 0.00 0.03 0.00 0.38 0.08 84 L C C 15.42 24.20 10.40 34.15 115.27 -159.33 -72.34 137.45 99.40 0.59 0.01 97.91 1.54 0.02 0.00 0.00 0.00 0.17 0.36 85 K C C 93.96 4.61 24.22 28.74 129.66 -171.94 -124.13 156.49 99.90 0.09 0.01 99.55 0.37 0.01 0.00 0.00 0.00 0.02 0.06 86 P H G 71.68 12.35 15.83 28.39 91.15 -103.44 -58.94 -32.32 4.31 0.03 95.65 0.33 0.30 2.55 0.23 96.56 0.00 0.02 0.00 87 E H G 117.45 4.60 21.54 27.00 89.93 62.70 -70.59 -16.05 3.44 0.05 96.52 0.17 0.23 2.22 0.18 97.16 0.00 0.04 0.00 88 D H G 11.59 21.47 16.46 38.40 93.60 65.85 -83.55 -1.66 4.58 0.07 95.35 0.81 0.50 1.68 0.28 96.67 0.00 0.06 0.00 89 T C C 31.36 16.69 21.24 38.08 116.51 106.31 -78.55 136.87 88.37 11.45 0.18 86.29 2.32 0.11 0.03 0.13 0.00 10.72 0.41 90 A E E 10.91 18.46 23.58 41.47 145.32 151.92 -157.56 168.01 3.24 96.72 0.03 3.09 0.16 0.01 0.01 0.02 0.00 96.20 0.51 91 V E E 29.96 15.99 25.91 41.81 117.94 -100.85 -99.53 132.37 0.98 98.99 0.03 0.96 0.03 0.01 0.01 0.01 0.00 98.94 0.04 92 Y E E 6.62 25.19 21.19 46.41 122.76 -162.82 -113.57 137.10 1.53 98.34 0.13 1.36 0.09 0.02 0.03 0.04 0.00 98.40 0.04 93 Y E E 30.28 17.47 27.42 44.32 130.10 -169.96 -125.99 147.01 3.99 95.74 0.27 3.45 0.32 0.08 0.07 0.11 0.00 95.78 0.19 94 C E E 3.03 25.39 21.76 47.34 125.06 -159.75 -117.85 137.51 10.31 89.15 0.54 8.44 1.40 0.32 0.18 0.23 0.00 88.99 0.44 95 Y E E 43.36 14.20 26.50 40.84 127.56 -168.13 -124.07 141.68 13.07 85.99 0.94 11.31 1.42 0.50 0.43 0.40 0.00 84.69 1.26 96 A E E 9.95 21.30 17.67 38.81 121.72 -158.44 -112.74 135.61 34.60 63.07 2.33 28.42 5.21 1.85 0.99 1.26 0.00 60.62 1.67 97 E C E 82.42 9.16 20.11 29.70 118.14 -151.31 -103.41 136.14 54.11 42.05 3.84 33.77 15.51 7.13 1.04 2.61 0.02 38.22 1.70 98 S C C 52.81 9.83 14.73 25.31 114.18 -142.70 -96.08 132.08 73.22 21.72 5.07 38.50 22.04 14.19 1.12 3.64 0.01 18.80 1.70 99 F C C 116.74 7.08 12.80 21.06 105.00 -153.53 -89.40 14.70 82.11 11.24 6.65 39.20 25.28 19.00 1.74 4.51 0.02 8.30 1.95 100 V C C 98.10 4.08 12.67 18.03 107.45 48.44 -90.41 75.92 86.22 5.34 8.44 33.95 27.94 25.47 2.39 5.40 0.01 3.37 1.47 101 L C C 103.97 5.20 12.62 19.10 108.16 16.96 -90.55 74.63 85.46 5.22 9.32 29.88 28.48 28.28 2.49 6.09 0.01 3.45 1.31 102 N C C 89.53 7.45 14.72 23.04 113.39 -102.27 -100.01 119.39 75.08 16.63 8.29 39.61 20.11 16.95 2.19 5.51 0.03 13.63 1.97 103 I C C 67.73 12.16 15.36 28.05 117.00 -151.68 -100.38 130.22 60.13 33.79 6.08 45.34 9.11 5.97 1.94 3.87 0.01 31.16 2.59 104 Y E E 77.97 13.81 18.10 31.98 119.58 -166.50 -110.12 133.41 37.71 58.42 3.86 28.66 5.94 3.87 1.88 2.20 0.03 51.48 5.95 105 W E E 67.62 17.24 18.55 35.04 116.55 -154.73 -98.70 124.16 42.99 54.35 2.65 29.06 8.45 7.40 1.22 1.73 0.03 45.85 6.25 106 G C C 19.42 16.35 20.03 35.25 116.68 -147.95 -72.90 -43.20 73.26 25.40 1.34 42.50 19.46 12.11 0.26 1.16 0.00 22.55 1.97 107 Q C C 86.93 10.82 23.46 33.80 99.86 -56.22 -83.70 -3.42 80.06 18.78 1.16 48.45 22.91 8.91 0.19 1.08 0.00 16.86 1.59 108 G C C 12.77 19.02 19.70 37.26 126.31 -137.07 85.02 174.07 73.10 26.53 0.38 54.07 14.05 3.94 0.05 0.39 0.00 26.36 1.15 109 T E E 18.59 20.43 20.99 40.72 124.31 -98.21 -109.47 141.69 27.07 72.87 0.06 23.92 2.51 0.17 0.01 0.05 0.00 72.27 1.07 110 Q E E 78.01 11.59 25.18 36.58 117.37 -139.01 -96.10 128.89 5.09 94.90 0.01 4.74 0.26 0.01 0.00 0.00 0.00 94.72 0.26 111 V E E 9.47 24.14 16.86 40.99 122.35 -167.91 -116.19 131.74 2.58 97.42 0.00 2.55 0.06 0.00 0.00 0.00 0.00 97.32 0.06 112 T E E 55.10 8.61 26.01 35.05 120.44 -157.71 -109.36 133.65 1.60 98.39 0.00 1.58 0.06 0.01 0.00 0.00 0.00 98.27 0.08 113 V E E 16.12 23.07 14.67 37.33 121.57 -163.07 -112.58 132.12 4.09 95.89 0.01 3.80 0.22 0.02 0.00 0.01 0.00 95.68 0.26 114 S E E 51.14 7.59 20.29 28.36 128.22 -169.17 -117.49 155.57 20.54 79.39 0.07 18.09 1.82 0.21 0.02 0.05 0.00 78.58 1.24 115 S C C 66.59 9.26 13.36 23.44 106.67 -124.01 -89.04 58.88 76.12 23.79 0.09 73.45 1.48 0.44 0.02 0.06 0.00 23.62 0.94 116 G C C 50.03 4.41 16.19 21.66 107.24 -107.47 66.31 27.79 99.91 0.08 0.00 99.74 0.16 0.04 0.00 0.00 0.00 0.05 0.00