A0A087Y506_POEFO Loading...

IKAROS family zinc finger 1 (Ikaros)

AlphaFold DB , UniProt , Accession A0A087Y506, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 508 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.7	Very low	37.3	Very low	207 Å²	207	149.6 Å²	149.6	100%	1.02	77%	0.774	S	S	*	*				0	57.9	0	-49.6	-158.6	-42	0	0	108.5
2	E	35.8	Very low	36.8	Very low	161 Å²	161	151.4 Å²	151.4	75%	0.752	78%	0.78	S	S	*	*				89.3	133.2	65.8	-78.1	137.2	-126.9	0	0	110
3	T	39.1	Very low	37.1	Very low	104 Å²	104	149.3 Å²	149.3	64%	0.638	78%	0.781	S	S	*	*			cis	-162.5	143.5	-17.6	13.1	0	0	0	0	104.6
4	E	42.5	Very low	36.6	Very low	171 Å²	171	143.6 Å²	143.6	80%	0.799	78%	0.776	S	S	*	*				48.7	129.3	107.4	-51.2	176.2	148.9	0	0	113.3
5	E	40.4	Very low	36.1	Very low	189 Å²	189	149.3 Å²	149.3	88%	0.883	78%	0.783	S	S	*	*			cis	-145.1	142	35.1	-66.3	169.5	123.2	0	0	108.4
6	A	40.9	Very low	35.5	Very low	86 Å²	86	149.8 Å²	149.8	71%	0.711	78%	0.78	S	S	*	*			cis	62.3	108	31.8	0	0	0	0	0	112.8
7	Q	38	Very low	35.6	Very low	168 Å²	168	147.8 Å²	147.8	79%	0.785	78%	0.781	S	S	*	*				172.9	164.4	82.5	-86.6	-168.5	-59.7	0	0	109.2
8	E	40.4	Very low	36.1	Very low	127 Å²	127	146.1 Å²	146.1	59%	0.593	78%	0.78	S	S	*	*			cis	-162.3	154.6	-31.7	-121.9	-175	105.3	0	0	109.3
9	M	35.2	Very low	36.2	Very low	162 Å²	162	145.3 Å²	145.3	80%	0.798	78%	0.784	S	S	*	*			trans	11.5	162.6	141.3	-62.4	-175	-135.1	0	0	122.2
10	A	33.7	Very low	36	Very low	74 Å²	74	142.5 Å²	142.5	61%	0.612	78%	0.781	S	S	*	*			cis	172.8	146	-24	0	0	0	0	0	107.1
11	Q	31.3	Very low	35.9	Very low	197 Å²	197	142.2 Å²	142.2	92%	0.921	78%	0.779	S	S	*	*			trans	-165.6	127	153.9	-112.2	139.9	93.6	0	0	114.3
12	M	31.1	Very low	35.8	Very low	171 Å²	171	140.1 Å²	140.1	84%	0.842	77%	0.767	S	S	*	*			trans	-98.1	171.1	161.5	-71.2	-77.2	-76.5	0	0	107.3
13	P	41.2	Very low	35.5	Very low	124 Å²	124	136.9 Å²	136.9	81%	0.805	77%	0.767	S	S	*	*			cis	-139.6	-168.2	27	38.8	-15.5	0	0	0	115.8
14	G	29.8	Very low	35.1	Very low	69 Å²	69	136.9 Å²	136.9	71%	0.711	77%	0.771	S	S	*	*			trans	-95.6	-140.9	-171.8	0	0	0	0	0	116.7
15	R	29.2	Very low	34.6	Very low	230 Å²	230	137 Å²	137	87%	0.868	77%	0.772	S	S	*	*			trans	77.8	145.6	-168.1	-102.7	-174.4	-178.9	-146.1	12.7	112.8
16	E	26.3	Very low	34.1	Very low	157 Å²	157	136.4 Å²	136.4	73%	0.734	77%	0.769	S	S	*	*			cis	-140.3	177.9	12.1	-61.2	-161	132.5	0	0	114.1
17	S	37.5	Very low	33.5	Very low	115 Å²	115	137 Å²	137	80%	0.804	78%	0.775	S	S	*	*			trans	-77.1	174.5	174.3	-53.8	0	0	0	0	112.6
18	P	44.7	Very low	33.1	Very low	117 Å²	117	137.7 Å²	137.7	76%	0.76	78%	0.778	S	S	*	*			trans	-83.1	159.8	-169.8	35.5	-34.7	0	0	0	113.2
19	P	37.7	Very low	32.5	Very low	132 Å²	132	140.1 Å²	140.1	86%	0.857	79%	0.789	S	S	*	*			trans	-80.9	132.9	174.7	32.3	-33	0	0	0	112.3
20	A	32	Very low	32.8	Very low	89 Å²	89	137 Å²	137	74%	0.736	78%	0.781	S	S	*	*			trans	-128.8	142.5	151.5	0	0	0	0	0	107.4
21	N	33.8	Very low	32.5	Very low	136 Å²	136	142.2 Å²	142.2	73%	0.727	80%	0.795	S	S	*	*			trans	151.3	149.6	168	-89.3	16.3	0	0	0	108.5
22	E	31.7	Very low	32.2	Very low	164 Å²	164	137 Å²	137	77%	0.766	79%	0.785	S	S	*	*			cis	-167.5	168.9	-7.9	-112.3	161.2	180	0	0	107.3
23	A	29.5	Very low	32.4	Very low	92 Å²	92	134.6 Å²	134.6	76%	0.76	78%	0.78	S	S	*	*				-170.8	131.8	-54.2	0	0	0	0	0	108.5
24	S	29.2	Very low	32.1	Very low	104 Å²	104	134.6 Å²	134.6	73%	0.727	78%	0.78	S	S	*	*			trans	-159.8	121.3	171.2	60.5	0	0	0	0	114.4
25	E	32.2	Very low	32.1	Very low	175 Å²	175	139.5 Å²	139.5	82%	0.818	78%	0.784	S	S	*	*			trans	56.4	138.2	133.8	-61.2	164.4	-178.5	0	0	119.1
26	E	30.8	Very low	32.1	Very low	175 Å²	175	135 Å²	135	82%	0.818	78%	0.778	S	S	*	*			cis	-166	164.9	3.7	-125.6	-177.7	-174.2	0	0	111.4
27	A	29.3	Very low	32.2	Very low	100 Å²	100	134.4 Å²	134.4	83%	0.826	78%	0.779	S	S	*	*			trans	69.5	162.2	152.1	0	0	0	0	0	123
28	E	29.3	Very low	31.7	Very low	181 Å²	181	133.9 Å²	133.9	85%	0.846	78%	0.775	S	S	*	*			trans	-114.2	153.7	-159.2	-54.7	-176.4	136.8	0	0	115.4
29	E	27.3	Very low	30.8	Very low	179 Å²	179	133.2 Å²	133.2	84%	0.836	78%	0.78	S	S	*	*			trans	49.9	175.6	146.3	-69.3	-151.2	152.8	0	0	121.2
30	P	41.8	Very low	30.2	Very low	97 Å²	97	130.8 Å²	130.8	63%	0.63	78%	0.779	S	S	*	*				-134.1	171.9	-62.4	40.7	-25.9	0	0	0	115
31	M	27	Very low	29.9	Very low	182 Å²	182	131.4 Å²	131.4	90%	0.897	78%	0.778	S	S	*	*			trans	66.3	147	146.7	-73.1	-93.8	-83.8	0	0	123.3
32	A	25.7	Very low	29.5	Very low	87 Å²	87	130.8 Å²	130.8	72%	0.719	78%	0.779	S	S	*	*			trans	86.1	116.8	151.4	0	0	0	0	0	122.5
33	V	34.9	Very low	29.2	Very low	122 Å²	122	130.8 Å²	130.8	74%	0.739	78%	0.778	S	S	*	*				26.7	143.3	129.4	-158.1	0	0	0	0	120.3
34	P	34.6	Very low	29	Very low	124 Å²	124	132.6 Å²	132.6	81%	0.805	77%	0.771	S	S	*	*				-130.7	136.3	129.4	37.2	-28	0	0	0	114.8
35	E	29.6	Very low	28.8	Very low	171 Å²	171	134.3 Å²	134.3	80%	0.799	77%	0.768	S	S	*	*			trans	-70.1	172.3	150.8	-61.4	174.5	129.6	0	0	107.6
36	D	28.8	Very low	28.4	Very low	136 Å²	136	131.8 Å²	131.8	73%	0.727	76%	0.76	S	S	*	*			cis	-178.6	-178	44	-158.3	-7.9	0	0	0	110.5
37	L	28.7	Very low	28.1	Very low	145 Å²	145	129.6 Å²	129.6	76%	0.759	75%	0.754	S	S	*	*			trans	132.1	80.6	145.9	-64.8	-173.3	0	0	0	117.9
38	S	26.5	Very low	28	Very low	103 Å²	103	136.5 Å²	136.5	72%	0.72	76%	0.759	S	S	*	*				58.3	121.9	115.9	71.7	0	0	0	0	123.5
39	A	26.6	Very low	27.7	Very low	104 Å²	104	131.7 Å²	131.7	86%	0.86	76%	0.757	S	S	*	*				160.5	117.5	123.9	0	0	0	0	0	109.3
40	G	25.5	Very low	27.6	Very low	81 Å²	81	129.1 Å²	129.1	84%	0.835	75%	0.749	S	S	*	*				84.3	130	82.8	0	0	0	0	0	110.4
41	S	24.8	Very low	26.9	Very low	102 Å²	102	133.1 Å²	133.1	71%	0.713	76%	0.757	S	S	*	*			cis	177.5	168.4	12.8	162.5	0	0	0	0	106.6
42	T	25.8	Very low	26.8	Very low	123 Å²	123	129.4 Å²	129.4	76%	0.755	76%	0.755	S	S	*	*			trans	67.3	99.9	153.3	33.8	0	0	0	0	122.5
43	H	25.4	Very low	26.8	Very low	163 Å²	163	130.9 Å²	130.9	76%	0.755	76%	0.759	S	S	*	*				65.2	127.2	111.8	-113.4	7.9	0	0	0	124.4
44	Q	24.5	Very low	26.2	Very low	130 Å²	130	132.8 Å²	132.8	61%	0.607	77%	0.765	S	S	*	*			trans	83.1	113.8	135.9	-80.4	-176.4	18.8	0	0	122.7
45	Q	25.8	Very low	25.8	Very low	140 Å²	140	134.6 Å²	134.6	65%	0.654	77%	0.766	S	S	*	*				85.4	117.8	123.9	-77.9	-177.5	24.3	0	0	122.1
46	N	24.3	Very low	25.5	Very low	122 Å²	122	133.9 Å²	133.9	65%	0.652	76%	0.76	S	S	*	*				91.6	125	123.7	-69	-13.5	0	0	0	121.8
47	N	24.9	Very low	25.2	Very low	130 Å²	130	133.3 Å²	133.3	70%	0.695	76%	0.762	S	S	*	*			trans	85.4	114.5	138.1	-69.3	-27.6	0	0	0	121.8
48	R	25.7	Very low	24.9	Very low	245 Å²	245	133.6 Å²	133.6	93%	0.925	76%	0.759	S	S	*	*				46.3	124.4	126.5	-66.9	177.6	167.4	173.3	-3.5	119.3
49	G	24.5	Very low	24.8	Very low	79 Å²	79	133 Å²	133	81%	0.814	76%	0.76	S	S	*	*			trans	172.6	84.9	157.4	0	0	0	0	0	116.4
50	D	25.1	Very low	24.6	Very low	126 Å²	126	139 Å²	139	67%	0.674	76%	0.76	S	S	*	*			trans	-1.9	134.1	151.4	-85	-0.6	0	0	0	121.6
51	K	26.6	Very low	24.5	Very low	180 Å²	180	139.3 Å²	139.3	78%	0.783	75%	0.75	S	S	*	*			trans	64.8	114.1	135.6	-57.6	162.2	-171.7	144.6	0	119.6
52	A	23.7	Very low	24.4	Very low	104 Å²	104	140.1 Å²	140.1	86%	0.86	75%	0.746	S	S	*	*				174.5	153	100	0	0	0	0	0	111.7
53	C	25.9	Very low	24.7	Very low	118 Å²	118	142.2 Å²	142.2	80%	0.797	75%	0.748	S	S	*	*			trans	-74	153.1	177.9	-58.5	0	0	0	0	112.5
54	N	23.9	Very low	24.9	Very low	162 Å²	162	142.3 Å²	142.3	87%	0.866	75%	0.748	S	S	*	*			trans	-172.6	89.1	136.2	-94.1	-18.1	0	0	0	110.6	K56	N54-K56 PolarHBondContact O-N 2.65Å
55	I	25.1	Very low	25.2	Very low	163 Å²	163	141.6 Å²	141.6	84%	0.836	76%	0.758	S	S	*	*			trans	-87.1	101.7	163.1	-60.8	178	0	0	0	106.9	V57	I55-V57 HydrophobicContact CG2-CG2 3.84Å
56	K	22.8	Very low	25.2	Very low	155 Å²	155	138.2 Å²	138.2	67%	0.674	76%	0.76	S	S	*	*			trans	-85.5	111.8	166.7	-167.2	-175.5	-167.3	-150.7	0	107.8	N54 E58	N54-K56 PolarHBondContact O-N 2.65Å; K56-E58 WeakPolarHBondContact CE-OE1 3.31Å; K56-E58 VanDerWaalsContact CE-OE2 3.31Å; K56-E58 WeakPolarHBondContact CE-OE2 3.14Å; K56-E58 IonicContact NZ-OE1 2.65Å; K56-E58 PolarHBondContact NZ-OE1 2.82Å; K56-E58 IonicContact NZ-OE2 2.74Å; K56-E58 PolarHBondContact NZ-OE2 3.45Å
57	V	23.3	Very low	25.5	Very low	125 Å²	125	140.9 Å²	140.9	76%	0.758	77%	0.774	S	S	*	*			trans	-98.5	108.9	167.4	-175.6	0	0	0	0	107.6	I55	I55-V57 HydrophobicContact CG2-CG2 3.84Å
58	E	23.3	Very low	25.5	Very low	150 Å²	150	138.6 Å²	138.6	70%	0.701	77%	0.772	S	S	*	*			trans	-116.5	135.2	159.9	-84.1	170	172	0	0	107.5	K56	K56-E58 WeakPolarHBondContact CE-OE1 3.31Å; K56-E58 VanDerWaalsContact CE-OE2 3.31Å; K56-E58 WeakPolarHBondContact CE-OE2 3.14Å; K56-E58 IonicContact NZ-OE1 2.65Å; K56-E58 PolarHBondContact NZ-OE1 2.82Å; K56-E58 IonicContact NZ-OE2 2.74Å; K56-E58 PolarHBondContact NZ-OE2 3.45Å
59	A	23.4	Very low	25.6	Very low	90 Å²	90	133 Å²	133	74%	0.744	77%	0.77	S	S	*	*			trans	-100.2	156.3	-170.3	0	0	0	0	0	112.5
60	R	22.2	Very low	25.7	Very low	230 Å²	230	136.5 Å²	136.5	87%	0.868	77%	0.77	S	S	*	*			trans	-163.5	117.6	146.5	-97.5	151.8	-176.6	-132	-6.3	104.7
61	S	22.7	Very low	26	Very low	88 Å²	88	139.1 Å²	139.1	62%	0.615	78%	0.78	S	S	*	*				65.9	136.3	75.6	89.8	0	0	0	0	110.2
62	D	24.5	Very low	26.3	Very low	119 Å²	119	138.7 Å²	138.7	64%	0.636	78%	0.783	S	S	*	*			cis	-135.6	147.6	27.2	-47.2	-59.2	0	0	0	110.2
63	E	30.6	Very low	26.4	Very low	168 Å²	168	140.1 Å²	140.1	79%	0.785	78%	0.776	S	S	*	*				74.1	150.5	95.8	-64.9	175.7	-170.9	0	0	115.2
64	E	30.9	Very low	26.5	Very low	164 Å²	164	138 Å²	138	77%	0.766	77%	0.774	S	S	*	*			cis	-164.1	147.2	-18.2	167.4	177.9	153.8	0	0	108.7
65	S	30.3	Very low	26.6	Very low	116 Å²	116	137.3 Å²	137.3	81%	0.811	78%	0.775	S	S	*	*			trans	160.2	105	147.2	43.6	0	0	0	0	107.3
66	G	25.8	Very low	26.8	Very low	68 Å²	68	138.4 Å²	138.4	70%	0.701	78%	0.777	S	S	*	*				95.5	108	59.1	0	0	0	0	0	106.2
67	L	30.6	Very low	27.7	Very low	179 Å²	179	140.1 Å²	140.1	94%	0.937	79%	0.787	S	S	*	*				-132	130.2	61.1	-66.4	163	0	0	0	113.1
68	A	24.5	Very low	27.9	Very low	81 Å²	81	143.2 Å²	143.2	67%	0.669	79%	0.793	S	S	*	*			trans	-83.7	153.9	160.3	0	0	0	0	0	110.4
69	C	28	Very low	28.4	Very low	128 Å²	128	144.4 Å²	144.4	87%	0.865	80%	0.799	S	S	*	*			trans	-127.8	125.5	153.8	-67	0	0	0	0	106.6
70	D	25.4	Very low	28.6	Very low	153 Å²	153	146.4 Å²	146.4	82%	0.818	81%	0.806	S	S	*	*			trans	-70.1	165	-160.7	-68.9	-72.6	0	0	0	116.6
71	M	32.8	Very low	29.4	Very low	181 Å²	181	139.9 Å²	139.9	89%	0.892	80%	0.802	S	S	*	*			trans	-69.7	145	170.6	-57.1	-165.9	-173.4	0	0	111.4
72	M	31.7	Very low	30.1	Very low	171 Å²	171	143.5 Å²	143.5	84%	0.842	81%	0.809	S	S	*	*			trans	-119.8	100	151.7	-97.1	-77.1	-168.5	0	0	108.1
73	N	27.1	Very low	30.6	Very low	134 Å²	134	141.7 Å²	141.7	72%	0.717	80%	0.799	S	S	*	*			trans	44.2	114.4	141.6	-58.8	-26.5	0	0	0	119.6
74	G	28.3	Very low	31	Very low	73 Å²	73	138.1 Å²	138.1	75%	0.753	79%	0.785	S	S	*	*				64.8	90	101.7	0	0	0	0	0	116.9
75	V	25.8	Very low	31.4	Very low	147 Å²	147	139 Å²	139	89%	0.891	78%	0.781	S	S	*	*			trans	-124.4	105.7	139.9	-174.6	0	0	0	0	105.5
76	E	29.2	Very low	31.6	Very low	187 Å²	187	138.9 Å²	138.9	87%	0.874	78%	0.775	S	S	*	*			trans	-71.6	158.2	166.5	-71.4	-176.6	138.1	0	0	109.7
77	E	41.1	Very low	32.1	Very low	191 Å²	191	140.5 Å²	140.5	89%	0.893	77%	0.771	S	S	*	*			trans	-47.8	134.6	-168	-52	175.7	145.2	0	0	115.3
78	E	28	Very low	31.9	Very low	189 Å²	189	137.6 Å²	137.6	88%	0.883	76%	0.757	S	S	*	*			trans	-156	167.7	134.7	-122.3	174.5	-163.4	0	0	112.9
79	E	33.9	Very low	32.3	Very low	176 Å²	176	140.1 Å²	140.1	82%	0.822	77%	0.766	S	S	*	*			trans	-58.2	137.5	-156.8	-62	177.8	115.8	0	0	117.9
80	C	27.8	Very low	32.7	Very low	131 Å²	131	138.1 Å²	138.1	89%	0.885	75%	0.754	S	S	*	*			trans	-160.1	52.8	141.7	-101.2	0	0	0	0	110.6
81	A	37.5	Very low	33	Very low	94 Å²	94	135.2 Å²	135.2	78%	0.777	76%	0.76	S	S	*	*			trans	-102.9	39.3	176.2	0	0	0	0	0	112.3	D83	A81-D83 PolarHBondContact O-N 3.33Å
82	E	38.3	Very low	32.8	Very low	164 Å²	164	131 Å²	131	77%	0.766	75%	0.753	S	S	*	*			trans	-59.3	128.7	178.4	-81.1	-90.4	128.5	0	0	112.6
83	D	34.1	Very low	32.7	Very low	81 Å²	81	132.7 Å²	132.7	43%	0.433	76%	0.756	S	S	.	*			trans	51.1	63.3	161.1	-95.8	26.2	0	0	0	118.7	A81 R85	A81-D83 PolarHBondContact O-N 3.33Å; D83-R85 VanDerWaalsContact C-N 3.32Å; D83-R85 PolarHBondContact O-N 3.1Å; D83-R85 IonicContact OD2-CZ 3.19Å; D83-R85 VanDerWaalsContact OD2-CZ 3.25Å; D83-R85 IonicContact OD2-NE 2.86Å; D83-R85 PolarHBondContact OD2-NE 3.01Å; D83-R85 IonicContact OD2-NH2 2.71Å; D83-R85 PolarHBondContact OD2-NH2 3.16Å
84	L	40.5	Very low	32.8	Very low	92 Å²	92	134.1 Å²	134.1	48%	0.482	76%	0.763	S	S	.	*			trans	-71.3	81.8	155.7	-83	167.1	0	0	0	111.4	V86 L162 I166	L84-V86 PolarHBondContact O-N 3.13Å; L84-L162 HydrophobicContact CD2-CD2 3.8Å; L84-I166 HydrophobicContact CD2-CD1 4.47Å
85	R	38.2	Very low	32.7	Very low	182 Å²	182	138.8 Å²	138.8	69%	0.687	77%	0.771	S	S	*	*			trans	-75.9	118.7	173	-62.7	-172.5	-172.2	174.3	6.1	111.5	D83	D83-R85 VanDerWaalsContact C-N 3.32Å; D83-R85 PolarHBondContact O-N 3.1Å; D83-R85 IonicContact OD2-CZ 3.19Å; D83-R85 VanDerWaalsContact OD2-CZ 3.25Å; D83-R85 IonicContact OD2-NE 2.86Å; D83-R85 PolarHBondContact OD2-NE 3.01Å; D83-R85 IonicContact OD2-NH2 2.71Å; D83-R85 PolarHBondContact OD2-NH2 3.16Å
86	V	35.4	Very low	32.8	Very low	115 Å²	115	135.1 Å²	135.1	70%	0.697	76%	0.763	S	S	*	*			trans	-83.5	118.4	158.8	-179.9	0	0	0	0	106.5	L84	L84-V86 PolarHBondContact O-N 3.13Å
87	V	35.1	Very low	33.3	Very low	102 Å²	102	132.3 Å²	132.3	62%	0.618	76%	0.764	S	S	*	*			trans	-92.5	108.2	175.3	-178.3	0	0	0	0	108.5
88	D	27.8	Very low	32.6	Very low	117 Å²	117	131.8 Å²	131.8	63%	0.626	76%	0.761	S	S	*	*			trans	-90.9	145.5	160	-132.4	-25.9	0	0	0	108.4	S90	D88-S90 PolarHBondContact O-N 2.91Å
89	P	31.6	Very low	32.6	Very low	135 Å²	135	128.4 Å²	128.4	88%	0.877	76%	0.756	S	S	*	*	S	Bend	trans	-67.4	2.4	-178.1	-21.9	35	0	0	0	115.8
90	S	37	Very low	32.2	Very low	86 Å²	86	122.8 Å²	122.8	60%	0.601	74%	0.736	S	S	*	*	S	Bend	trans	-126	106.9	178.2	46.3	0	0	0	0	109.7	D88 A92	D88-S90 PolarHBondContact O-N 2.91Å; S90-A92 PolarHBondContact O-N 3.37Å
91	G	31.5	Very low	32.5	Very low	91 Å²	91	121.7 Å²	121.7	94%	0.938	73%	0.727	S	S	*	*			trans	-69.2	100.3	-167.9	0	0	0	0	0	114.9
92	A	28.7	Very low	32.2	Very low	92 Å²	92	125.2 Å²	125.2	76%	0.76	73%	0.728	S	S	*	*			trans	-132.3	133.2	165.5	0	0	0	0	0	110.5	S90	S90-A92 PolarHBondContact O-N 3.37Å
93	K	29.8	Very low	32	Very low	207 Å²	207	121.9 Å²	121.9	90%	0.9	73%	0.728	S	S	*	*			trans	-86.1	133.5	175.5	-73.3	-179.1	174.9	-178.4	0	110.4
94	L	29.1	Very low	31.9	Very low	164 Å²	164	126.6 Å²	126.6	86%	0.859	75%	0.745	S	S	*	*			trans	-139.1	124.7	163.4	-68.5	176	0	0	0	110.3
95	N	26.7	Very low	31.5	Very low	171 Å²	171	125.7 Å²	125.7	91%	0.914	75%	0.75	S	S	*	*			trans	-94.1	148.4	169	-84.4	-3.9	0	0	0	109.8
96	G	28.2	Very low	31.4	Very low	70 Å²	70	126.6 Å²	126.6	72%	0.722	76%	0.76	S	S	*	*	S	Bend	trans	89.7	92.9	160	0	0	0	0	0	117	Q98	G96-Q98 PolarHBondContact O-N 2.84Å
97	S	39.3	Very low	31.4	Very low	128 Å²	128	126.3 Å²	126.3	90%	0.895	76%	0.763	S	S	*	*	S	Bend	trans	38.3	49.3	134.1	-53.7	0	0	0	0	121.4
98	Q	26	Very low	31.9	Very low	180 Å²	180	126.3 Å²	126.3	84%	0.841	77%	0.767	S	S	*	*			trans	-146.9	149	142.7	-80.2	-151.7	-46.2	0	0	110.6	G96 S100	G96-Q98 PolarHBondContact O-N 2.84Å; Q98-S100 PolarHBondContact O-N 3.41Å
99	P	27.7	Very low	33.1	Very low	118 Å²	118	122.4 Å²	122.4	77%	0.766	75%	0.751	S	S	*	*			trans	-67.6	132	172.3	28.7	-33.1	0	0	0	110.3
100	S	25.2	Very low	34.4	Very low	59 Å²	59	117.5 Å²	117.5	41%	0.413	73%	0.725	S	S	.	*			trans	-54.1	139.5	174.8	169.5	0	0	0	0	111.2	Q98 E102	Q98-S100 PolarHBondContact O-N 3.41Å; S100-E102 PolarHBondContact O-N 3.19Å; S100-E102 PolarHBondContact OG-N 3.42Å
101	P	34.3	Very low	35.7	Very low	107 Å²	107	114.7 Å²	114.7	70%	0.695	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-3.8	175.6	-20.6	33.2	0	0	0	115.1	A103	P101-A103 VanDerWaalsContact C-N 3.33Å
102	E	31.1	Very low	37.8	Very low	169 Å²	169	114.9 Å²	114.9	79%	0.79	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	3.6	-175.4	-62.6	178.9	144.2	0	0	113.8	S100 K104	S100-E102 PolarHBondContact O-N 3.19Å; S100-E102 PolarHBondContact OG-N 3.42Å; E102-K104 PolarHBondContact O-N 3.17Å
103	A	35.1	Very low	40.2	Very low	94 Å²	94	119.8 Å²	119.8	78%	0.777	69%	0.687	S	S	*	*			trans	-66.6	23.5	161.9	0	0	0	0	0	113.7	P101 A105	P101-A103 VanDerWaalsContact C-N 3.33Å; A103-A105 PolarHBondContact O-N 3.05Å
104	K	31.3	Very low	42.5	Very low	179 Å²	179	112.1 Å²	112.1	78%	0.778	66%	0.656	S	S	*	*			trans	-76.8	103.7	175.5	-80.9	176.4	-179	175.5	0	110	E102	E102-K104 PolarHBondContact O-N 3.17Å
105	A	32.8	Very low	44.6	Very low	73 Å²	73	111 Å²	111	60%	0.603	66%	0.658	S	S	*	*			trans	72.1	55.4	158.8	0	0	0	0	0	118.6	A103 S107	A103-A105 PolarHBondContact O-N 3.05Å; A105-S107 WeakPolarHBondContact CA-OG 3.49Å; A105-S107 WeakPolarHBondContact CB-OG 3.29Å; A105-S107 PolarHBondContact O-N 2.99Å
106	F	35.3	Very low	47.1	Very low	202 Å²	202	107.7 Å²	107.7	89%	0.886	64%	0.641	S	S	*	*			trans	-73.4	53.6	136.9	-96.2	-86.9	0	0	0	110.5	S108	F106-S108 PolarHBondContact O-N 2.95Å
107	S	36.5	Very low	49.4	Very low	109 Å²	109	106.4 Å²	106.4	76%	0.762	63%	0.627	S	S	*	*			trans	-78.1	6.3	-170.8	-69.1	0	0	0	0	114.4	A105	A105-S107 WeakPolarHBondContact CA-OG 3.49Å; A105-S107 WeakPolarHBondContact CB-OG 3.29Å; A105-S107 PolarHBondContact O-N 2.99Å
108	S	45.8	Very low	51.5	Low	102 Å²	102	104.7 Å²	104.7	71%	0.713	60%	0.604	S	S	*	*			trans	-134.2	88.6	177.1	47.2	0	0	0	0	109.6	F106 G110	F106-S108 PolarHBondContact O-N 2.95Å; S108-G110 PolarHBondContact O-N 2.75Å
109	A	53.1	Low	54.4	Low	35 Å²	35	97.2 Å²	97.2	29%	0.289	57%	0.57	S	S	.	*			trans	-65.7	17.7	177.5	0	0	0	0	0	114.7	G111 L134 K138	A109-G111 PolarHBondContact O-N 3.14Å; A109-G111 VanDerWaalsContact O-N 3.14Å; A109-L134 HydrophobicContact CB-CD2 4.29Å; A109-L134 WeakPolarHBondContact O-CD2 3.19Å; A109-K138 WeakPolarHBondContact O-CE 3.28Å
110	G	58.3	Low	57.1	Low	32 Å²	32	95.4 Å²	95.4	33%	0.33	55%	0.549	S	S	.	.	S	Bend	trans	51.3	35.1	-177.1	0	0	0	0	0	113.4	S108 D122 K138	S108-G110 PolarHBondContact O-N 2.75Å; G110-D122 WeakPolarHBondContact O-CB 3.47Å; G110-K138 WeakPolarHBondContact O-CE 3.49Å; G110-K138 PolarHBondContact O-NZ 3.18Å; G110-K138 VanDerWaalsContact O-NZ 3.14Å
111	G	64.4	Low	60.1	Low	27 Å²	27	92.6 Å²	92.6	28%	0.278	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	132	-178.3	0	0	0	0	0	111.3	A109 R113 K120	A109-G111 PolarHBondContact O-N 3.14Å; A109-G111 VanDerWaalsContact O-N 3.14Å; G111-R113 PolarHBondContact O-N 2.77Å; G111-K120 CarbonylContact C-O 3.53Å; G111-K120 WeakPolarHBondContact CA-O 3.46Å
112	I	74.6	Confident	62.5	Low	94 Å²	94	91.3 Å²	91.3	48%	0.482	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	110.7	168.3	-57.9	171	0	0	0	106.8	L114 K120	I112-L114 PolarHBondContact O-N 3.43Å; I112-K120 HydrophobicContact CB-CB 4.23Å; I112-K120 PolarHBondContact N-O 3.06Å; I112-K120 WeakPolarHBondContact O-CB 3.43Å; I112-K120 PolarHBondContact O-N 2.82Å
113	R	78.9	Confident	65.1	Low	196 Å²	196	88 Å²	88	74%	0.74	50%	0.504	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.6	120.8	179.8	-170.1	170.1	-173.1	154.7	0.7	109.8	G111 L119	G111-R113 PolarHBondContact O-N 2.77Å; R113-L119 HydrophobicContact CB-CD2 3.95Å; R113-L119 HydrophobicContact CG-CD2 3.99Å
114	L	79.9	Confident	67.5	Low	46 Å²	46	86.3 Å²	86.3	24%	0.241	49%	0.486	C	S	.	.			trans	-85.2	156.6	178.7	-64.7	-179.5	0	0	0	111.1	I112 N116 G117 K118 K120 V127	I112-L114 PolarHBondContact O-N 3.43Å; L114-N116 VanDerWaalsContact CB-OD1 3.28Å; L114-N116 WeakPolarHBondContact CB-OD1 3.37Å; L114-N116 PolarHBondContact O-N 2.87Å; L114-N116 VanDerWaalsContact O-N 3.1Å; L114-G117 PolarHBondContact O-N 2.95Å; L114-K118 WeakPolarHBondContact CB-O 3.45Å; L114-K118 PolarHBondContact N-O 3.42Å; L114-K120 HydrophobicContact CD1-CB 4.17Å; L114-K120 HydrophobicContact CD2-CB 4.23Å; L114-K120 HydrophobicContact CD2-CD 4.45Å; L114-K120 HydrophobicContact CG-CB 4.06Å; L114-V127 HydrophobicContact CD1-CB 4.45Å; L114-V127 HydrophobicContact CD1-CG1 3.79Å; L114-V127 HydrophobicContact CD1-CG2 3.76Å
115	P	72.4	Confident	69.9	Low	140 Å²	140	79 Å²	79	91%	0.909	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-25.7	179.8	-25.3	34.7	0	0	0	114.1	G117	P115-G117 PolarHBondContact O-N 3.22Å
116	N	79.5	Confident	72.6	Confident	102 Å²	102	80 Å²	80	55%	0.545	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	13	177.7	64.3	11.8	0	0	0	114	L114 K118	L114-N116 VanDerWaalsContact CB-OD1 3.28Å; L114-N116 WeakPolarHBondContact CB-OD1 3.37Å; L114-N116 PolarHBondContact O-N 2.87Å; L114-N116 VanDerWaalsContact O-N 3.1Å; N116-K118 PolarHBondContact O-N 3.14Å; N116-K118 VanDerWaalsContact O-N 3.16Å; N116-K118 VanDerWaalsContact OD1-CB 3.29Å; N116-K118 WeakPolarHBondContact OD1-CB 3.46Å; N116-K118 WeakPolarHBondContact OD1-CG 3.39Å; N116-K118 PolarHBondContact OD1-N 2.83Å; N116-K118 VanDerWaalsContact OD1-N 3.13Å
117	G	76.9	Confident	75	Confident	43 Å²	43	73.7 Å²	73.7	44%	0.443	43%	0.434	S	S	.	.	S	Bend	trans	76.4	-8.3	179.5	0	0	0	0	0	115.4	L114 P115	L114-G117 PolarHBondContact O-N 2.95Å; P115-G117 PolarHBondContact O-N 3.22Å
118	K	83.3	Confident	77.3	Confident	92 Å²	92	68.8 Å²	68.8	40%	0.4	40%	0.4	S	S	.	.			trans	-75.6	158.8	174.5	-56.7	-177.9	-177.2	179.6	0	110.7	L114 N116 V127	L114-K118 WeakPolarHBondContact CB-O 3.45Å; L114-K118 PolarHBondContact N-O 3.42Å; N116-K118 PolarHBondContact O-N 3.14Å; N116-K118 VanDerWaalsContact O-N 3.16Å; N116-K118 VanDerWaalsContact OD1-CB 3.29Å; N116-K118 WeakPolarHBondContact OD1-CB 3.46Å; N116-K118 WeakPolarHBondContact OD1-CG 3.39Å; N116-K118 PolarHBondContact OD1-N 2.83Å; N116-K118 VanDerWaalsContact OD1-N 3.13Å; K118-V127 HydrophobicContact CB-CG1 3.51Å; K118-V127 HydrophobicContact CD-CG1 3.76Å; K118-V127 HydrophobicContact CG-CG1 4.25Å
119	L	86.4	Confident	79.2	Confident	23 Å²	23	70.8 Å²	70.8	12%	0.12	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	120.1	179.9	-64.5	173.2	0	0	0	109.9	R113 C128 P131 L134	R113-L119 HydrophobicContact CB-CD2 3.95Å; R113-L119 HydrophobicContact CG-CD2 3.99Å; L119-C128 PolarHBondContact N-O 3.13Å; L119-C128 WeakPolarHBondContact O-CA 3.21Å; L119-C128 WeakPolarHBondContact O-CB 3.15Å; L119-C128 PolarHBondContact O-N 3.1Å; L119-P131 HydrophobicContact CD1-CB 3.82Å; L119-P131 HydrophobicContact CD1-CG 4.47Å; L119-L134 HydrophobicContact CB-CD2 3.93Å; L119-L134 HydrophobicContact CD1-CD2 4.33Å
120	K	85	Confident	80.7	Confident	79 Å²	79	70 Å²	70	34%	0.343	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	133.6	174.3	177.5	177.2	179.2	-174.5	0	109.8	G111 I112 L114 D122 G125 I126 V127	G111-K120 CarbonylContact C-O 3.53Å; G111-K120 WeakPolarHBondContact CA-O 3.46Å; I112-K120 HydrophobicContact CB-CB 4.23Å; I112-K120 PolarHBondContact N-O 3.06Å; I112-K120 WeakPolarHBondContact O-CB 3.43Å; I112-K120 PolarHBondContact O-N 2.82Å; L114-K120 HydrophobicContact CD1-CB 4.17Å; L114-K120 HydrophobicContact CD2-CB 4.23Å; L114-K120 HydrophobicContact CD2-CD 4.45Å; L114-K120 HydrophobicContact CG-CB 4.06Å; K120-D122 PolarHBondContact O-N 2.8Å; K120-G125 WeakPolarHBondContact CG-O 3.32Å; K120-I126 CarbonylContact C-O 3.59Å; K120-I126 WeakPolarHBondContact CA-O 3.5Å; K120-V127 HydrophobicContact CB-CG2 4.45Å
121	C	87.5	Confident	81.8	Confident	1 Å²	1	72 Å²	72	1%	0.007	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	128.5	168.9	-177.8	0	0	0	0	110	I123 G125 I126 L134	C121-I123 PolarHBondContact SG-N 3.24Å; C121-I123 VanDerWaalsContact SG-N 3.4Å; C121-G125 WeakPolarHBondContact O-CA 3.46Å; C121-G125 PolarHBondContact O-N 2.83Å; C121-I126 PolarHBondContact N-O 2.88Å; C121-L134 HydrophobicContact CB-CD1 3.73Å
122	D	84.9	Confident	82.6	Confident	79 Å²	79	76.5 Å²	76.5	42%	0.422	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-40.5	170.6	52.4	-12.9	0	0	0	113.5	G110 K120 K138	G110-D122 WeakPolarHBondContact O-CB 3.47Å; K120-D122 PolarHBondContact O-N 2.8Å; D122-K138 WeakPolarHBondContact OD1-CE 3.44Å; D122-K138 IonicContact OD1-NZ 2.82Å; D122-K138 PolarHBondContact OD1-NZ 3.28Å; D122-K138 IonicContact OD2-NZ 2.82Å; D122-K138 PolarHBondContact OD2-NZ 3.36Å
123	I	85.1	Confident	83.1	Confident	99 Å²	99	75.9 Å²	75.9	51%	0.508	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	-49.9	-174.4	-61.7	164.9	0	0	0	112.5	C121 H141	C121-I123 PolarHBondContact SG-N 3.24Å; C121-I123 VanDerWaalsContact SG-N 3.4Å; I123-H141 HydrophobicContact CD1-CB 3.68Å; I123-H141 HydrophobicContact CG2-CB 4.29Å
124	C	85.3	Confident	83.3	Confident	59 Å²	59	66.5 Å²	66.5	40%	0.399	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.8	2.3	-172.9	71.6	0	0	0	0	115	I126 H137 H141	C124-I126 PolarHBondContact O-N 3.27Å; C124-H137 VanDerWaalsContact SG-CE1 3.6Å; C124-H137 PolarHBondContact SG-NE2 2.85Å; C124-H141 PolarHBondContact SG-NE2 3.04Å; C124-H141 VanDerWaalsContact SG-NE2 3.38Å
125	G	83.1	Confident	83.5	Confident	27 Å²	27	68.5 Å²	68.5	28%	0.278	40%	0.395	S	S	.	.			trans	73.4	2	176.5	0	0	0	0	0	117	K120 C121	K120-G125 WeakPolarHBondContact CG-O 3.32Å; C121-G125 WeakPolarHBondContact O-CA 3.46Å; C121-G125 PolarHBondContact O-N 2.83Å
126	I	87.4	Confident	84	Confident	92 Å²	92	63.9 Å²	63.9	47%	0.472	36%	0.364	S	S	.	.			trans	-62	134.8	176.1	-70.9	175.8	0	0	0	110.6	K120 C121 C124	K120-I126 CarbonylContact C-O 3.59Å; K120-I126 WeakPolarHBondContact CA-O 3.5Å; C121-I126 PolarHBondContact N-O 2.88Å; C124-I126 PolarHBondContact O-N 3.27Å
127	V	86.6	Confident	84.2	Confident	70 Å²	70	60.6 Å²	60.6	42%	0.424	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	107.6	-179.9	-177.3	0	0	0	0	110.6	L114 K118 K120	L114-V127 HydrophobicContact CD1-CB 4.45Å; L114-V127 HydrophobicContact CD1-CG1 3.79Å; L114-V127 HydrophobicContact CD1-CG2 3.76Å; K118-V127 HydrophobicContact CB-CG1 3.51Å; K118-V127 HydrophobicContact CD-CG1 3.76Å; K118-V127 HydrophobicContact CG-CG1 4.25Å; K120-V127 HydrophobicContact CB-CG2 4.45Å
128	C	85.1	Confident	84.4	Confident	7 Å²	7	60.5 Å²	60.5	5%	0.047	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	144.3	176.3	-58.5	0	0	0	0	111.5	L119 G130 V133 L134	L119-C128 PolarHBondContact N-O 3.13Å; L119-C128 WeakPolarHBondContact O-CA 3.21Å; L119-C128 WeakPolarHBondContact O-CB 3.15Å; L119-C128 PolarHBondContact O-N 3.1Å; C128-G130 VanDerWaalsContact C-N 3.3Å; C128-G130 PolarHBondContact O-N 3.4Å; C128-V133 HydrophobicContact CB-CB 4.22Å; C128-V133 HydrophobicContact CB-CG1 4.03Å; C128-L134 HydrophobicContact CB-CB 3.91Å
129	I	85.6	Confident	84.4	Confident	144 Å²	144	58.3 Å²	58.3	74%	0.738	32%	0.322	S	S	*	.	S	Bend	trans	-73.1	-22.1	-176.5	-58.2	170.8	0	0	0	112
130	G	84.2	Confident	84.2	Confident	18 Å²	18	61 Å²	61	19%	0.186	34%	0.343	C	S	.	.	S	Bend	trans	-167.4	174.6	178.1	0	0	0	0	0	113.6	C128 N132 V133 L134	C128-G130 VanDerWaalsContact C-N 3.3Å; C128-G130 PolarHBondContact O-N 3.4Å; G130-N132 PolarHBondContact O-N 2.82Å; G130-V133 PolarHBondContact O-N 2.67Å; G130-L134 PolarHBondContact O-N 3.19Å
131	P	81.4	Confident	84.1	Confident	74 Å²	74	60.7 Å²	60.7	48%	0.481	34%	0.343	S	S	.	.	H	α-helix	trans	-64.7	-38.2	-169.7	23.3	-33.2	0	0	0	113.4	L119 V133 L134 M135	L119-P131 HydrophobicContact CD1-CB 3.82Å; L119-P131 HydrophobicContact CD1-CG 4.47Å; P131-V133 VanDerWaalsContact C-N 3.32Å; P131-V133 PolarHBondContact O-N 3.25Å; P131-L134 PolarHBondContact O-N 3.5Å; P131-M135 WeakPolarHBondContact O-CB 3.36Å; P131-M135 PolarHBondContact O-N 2.99Å
132	N	82.4	Confident	83.8	Confident	122 Å²	122	64.5 Å²	64.5	65%	0.652	37%	0.366	S	S	*	.	H	α-helix	trans	-64.5	-37.2	176.8	-66.2	-7.9	0	0	0	112	G130 V136	G130-N132 PolarHBondContact O-N 2.82Å; N132-V136 WeakPolarHBondContact O-CB 3.49Å; N132-V136 WeakPolarHBondContact O-CG2 3.42Å; N132-V136 PolarHBondContact O-N 3.28Å
133	V	83.7	Confident	83.5	Confident	80 Å²	80	63.1 Å²	63.1	49%	0.485	37%	0.37	S	S	.	.	H	α-helix	trans	-67.9	-42.1	175.7	-178.5	0	0	0	0	110.2	C128 G130 P131 H137	C128-V133 HydrophobicContact CB-CB 4.22Å; C128-V133 HydrophobicContact CB-CG1 4.03Å; G130-V133 PolarHBondContact O-N 2.67Å; P131-V133 VanDerWaalsContact C-N 3.32Å; P131-V133 PolarHBondContact O-N 3.25Å; V133-H137 WeakPolarHBondContact O-CB 3.5Å; V133-H137 PolarHBondContact O-N 3.43Å
134	L	83.1	Confident	83.4	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-64.4	-42.6	175.5	177.9	61	0	0	0	112.3	A109 L119 C121 C128 G130 P131 H137 K138	A109-L134 HydrophobicContact CB-CD2 4.29Å; A109-L134 WeakPolarHBondContact O-CD2 3.19Å; L119-L134 HydrophobicContact CB-CD2 3.93Å; L119-L134 HydrophobicContact CD1-CD2 4.33Å; C121-L134 HydrophobicContact CB-CD1 3.73Å; C128-L134 HydrophobicContact CB-CB 3.91Å; G130-L134 PolarHBondContact O-N 3.19Å; P131-L134 PolarHBondContact O-N 3.5Å; L134-H137 CarbonylContact O-C 3.6Å; L134-H137 WeakPolarHBondContact O-CB 3.2Å; L134-H137 PolarHBondContact O-N 3.35Å; L134-K138 HydrophobicContact CD1-CG 4.24Å; L134-K138 PolarHBondContact O-N 3.16Å
135	M	84.7	Confident	83.3	Confident	87 Å²	87	67.2 Å²	67.2	43%	0.429	38%	0.375	S	S	.	.	H	α-helix	trans	-60	-49.4	177	-178.3	-163.9	-67	0	0	111.2	P131 H137 K138 R139	P131-M135 WeakPolarHBondContact O-CB 3.36Å; P131-M135 PolarHBondContact O-N 2.99Å; M135-H137 VanDerWaalsContact C-N 3.29Å; M135-H137 PolarHBondContact O-N 3.34Å; M135-K138 PolarHBondContact O-N 3.08Å; M135-R139 PolarHBondContact O-N 3.33Å
136	V	83.6	Confident	83.3	Confident	44 Å²	44	68.4 Å²	68.4	27%	0.267	38%	0.378	S	S	.	.	H	α-helix	trans	-65.4	-34.5	177.3	170.7	0	0	0	0	111.7	N132 Q158	N132-V136 WeakPolarHBondContact O-CB 3.49Å; N132-V136 WeakPolarHBondContact O-CG2 3.42Å; N132-V136 PolarHBondContact O-N 3.28Å; V136-Q158 HydrophobicContact CG1-CG 3.66Å; V136-Q158 VanDerWaalsContact CG1-NE2 3.26Å; V136-Q158 HydrophobicContact CG2-CG 4.49Å
137	H	83.8	Confident	83.3	Confident	33 Å²	33	66.5 Å²	66.5	15%	0.153	37%	0.366	C	S	.	.	H	α-helix	trans	-66.3	-43.1	172.8	171.6	56.3	0	0	0	112	C124 V133 L134 M135 R139 S140 H141	C124-H137 VanDerWaalsContact SG-CE1 3.6Å; C124-H137 PolarHBondContact SG-NE2 2.85Å; V133-H137 WeakPolarHBondContact O-CB 3.5Å; V133-H137 PolarHBondContact O-N 3.43Å; L134-H137 CarbonylContact O-C 3.6Å; L134-H137 WeakPolarHBondContact O-CB 3.2Å; L134-H137 PolarHBondContact O-N 3.35Å; M135-H137 VanDerWaalsContact C-N 3.29Å; M135-H137 PolarHBondContact O-N 3.34Å; H137-R139 PolarHBondContact O-N 2.68Å; H137-R139 VanDerWaalsContact O-N 3.16Å; H137-S140 WeakPolarHBondContact O-CB 3.05Å; H137-S140 PolarHBondContact O-N 3.38Å; H137-S140 PolarHBondContact O-OG 3.21Å; H137-H141 AromaticContact CE1-CE1 3.97Å; H137-H141 AromaticContact CE1-NE2 3.34Å; H137-H141 PolarHBondContact CE1-NE2 3.28Å; H137-H141 VanDerWaalsContact CE1-NE2 3.34Å; H137-H141 AromaticContact NE2-CD2 3.94Å; H137-H141 AromaticContact NE2-NE2 3.1Å; H137-H141 PolarHBondContact NE2-NE2 2.89Å
138	K	79.9	Confident	83.2	Confident	41 Å²	41	67.2 Å²	67.2	18%	0.178	37%	0.365	C	S	.	.	H	α-helix	trans	-58.5	-30	177.7	-82.2	-173.8	168.3	-122.6	0	113.3	A109 G110 D122 L134 M135 S140 H141 T142	A109-K138 WeakPolarHBondContact O-CE 3.28Å; G110-K138 WeakPolarHBondContact O-CE 3.49Å; G110-K138 PolarHBondContact O-NZ 3.18Å; G110-K138 VanDerWaalsContact O-NZ 3.14Å; D122-K138 WeakPolarHBondContact OD1-CE 3.44Å; D122-K138 IonicContact OD1-NZ 2.82Å; D122-K138 PolarHBondContact OD1-NZ 3.28Å; D122-K138 IonicContact OD2-NZ 2.82Å; D122-K138 PolarHBondContact OD2-NZ 3.36Å; L134-K138 HydrophobicContact CD1-CG 4.24Å; L134-K138 PolarHBondContact O-N 3.16Å; M135-K138 PolarHBondContact O-N 3.08Å; K138-S140 PolarHBondContact O-N 2.92Å; K138-H141 WeakPolarHBondContact O-CB 3.48Å; K138-H141 PolarHBondContact O-N 3.19Å; K138-T142 PolarHBondContact O-N 3Å; K138-T142 VanDerWaalsContact O-N 3.08Å
139	R	84.4	Confident	83.2	Confident	45 Å²	45	67 Å²	67	17%	0.17	36%	0.363	C	S	.	.	H	α-helix	trans	-61.7	-18.8	171.9	-64.4	-172.8	176.7	145.1	6.1	114.5	M135 H137 H141 G143 E144 T157	M135-R139 PolarHBondContact O-N 3.33Å; H137-R139 PolarHBondContact O-N 2.68Å; H137-R139 VanDerWaalsContact O-N 3.16Å; R139-H141 VanDerWaalsContact C-N 3.29Å; R139-G143 WeakPolarHBondContact O-CA 3.46Å; R139-G143 PolarHBondContact O-N 3.47Å; R139-E144 HydrophobicContact CB-CB 4.32Å; R139-E144 HydrophobicContact CG-CB 4Å; R139-E144 IonicContact NE-OE2 2.67Å; R139-T157 HydrophobicContact CB-CG2 4.2Å; R139-T157 PolarHBondContact NH1-O 2.93Å
140	S	82	Confident	83	Confident	81 Å²	81	64 Å²	64	57%	0.566	36%	0.356	S	S	*	.	H	α-helix	trans	-75	-20.2	170.6	73.8	0	0	0	0	113.1	H137 K138	H137-S140 WeakPolarHBondContact O-CB 3.05Å; H137-S140 PolarHBondContact O-N 3.38Å; H137-S140 PolarHBondContact O-OG 3.21Å; K138-S140 PolarHBondContact O-N 2.92Å
141	H	81.1	Confident	82.8	Confident	72 Å²	72	68.6 Å²	68.6	33%	0.333	37%	0.372	S	S	.	.	H	α-helix	trans	-92.4	-40.5	176.1	-56.7	-56.2	0	0	0	111.7	I123 C124 H137 K138 R139	I123-H141 HydrophobicContact CD1-CB 3.68Å; I123-H141 HydrophobicContact CG2-CB 4.29Å; C124-H141 PolarHBondContact SG-NE2 3.04Å; C124-H141 VanDerWaalsContact SG-NE2 3.38Å; H137-H141 AromaticContact CE1-CE1 3.97Å; H137-H141 AromaticContact CE1-NE2 3.34Å; H137-H141 PolarHBondContact CE1-NE2 3.28Å; H137-H141 VanDerWaalsContact CE1-NE2 3.34Å; H137-H141 AromaticContact NE2-CD2 3.94Å; H137-H141 AromaticContact NE2-NE2 3.1Å; H137-H141 PolarHBondContact NE2-NE2 2.89Å; K138-H141 WeakPolarHBondContact O-CB 3.48Å; K138-H141 PolarHBondContact O-N 3.19Å; R139-H141 VanDerWaalsContact C-N 3.29Å
142	T	81.3	Confident	82.7	Confident	80 Å²	80	67.3 Å²	67.3	49%	0.491	37%	0.365	S	S	.	.	H	α-helix	trans	-81.5	-14.7	178.2	64.7	0	0	0	0	113.9	K138 E144	K138-T142 PolarHBondContact O-N 3Å; K138-T142 VanDerWaalsContact O-N 3.08Å; T142-E144 WeakPolarHBondContact CB-OE1 3.35Å; T142-E144 PolarHBondContact O-N 3.07Å; T142-E144 VanDerWaalsContact OG1-CD 3.25Å; T142-E144 WeakPolarHBondContact OG1-CG 3.42Å; T142-E144 PolarHBondContact OG1-OE1 2.86Å
143	G	79	Confident	82.6	Confident	50 Å²	50	63.2 Å²	63.2	52%	0.515	35%	0.351	S	S	.	.			trans	73.2	4	-176.2	0	0	0	0	0	114.5	R139 R145	R139-G143 WeakPolarHBondContact O-CA 3.46Å; R139-G143 PolarHBondContact O-N 3.47Å; G143-R145 WeakPolarHBondContact O-CG 3.44Å; G143-R145 PolarHBondContact O-N 3.41Å
144	E	82.9	Confident	82.3	Confident	103 Å²	103	61 Å²	61	48%	0.481	34%	0.341	S	S	.	.			trans	-59.2	120.4	179.9	-81.2	166.2	-129.1	0	0	112.8	R139 T142 P146	R139-E144 HydrophobicContact CB-CB 4.32Å; R139-E144 HydrophobicContact CG-CB 4Å; R139-E144 IonicContact NE-OE2 2.67Å; T142-E144 WeakPolarHBondContact CB-OE1 3.35Å; T142-E144 PolarHBondContact O-N 3.07Å; T142-E144 VanDerWaalsContact OG1-CD 3.25Å; T142-E144 WeakPolarHBondContact OG1-CG 3.42Å; T142-E144 PolarHBondContact OG1-OE1 2.86Å; E144-P146 WeakPolarHBondContact O-CD 3.49Å
145	R	83.3	Confident	82.3	Confident	142 Å²	142	62.7 Å²	62.7	54%	0.536	35%	0.353	S	S	.	.			trans	-126.9	71	-179.3	-68.2	168.2	82.3	131.2	1.5	110.2	G143 F147 S155 F156 T157	G143-R145 WeakPolarHBondContact O-CG 3.44Å; G143-R145 PolarHBondContact O-N 3.41Å; R145-F147 PolarHBondContact O-N 3.25Å; R145-F147 VanDerWaalsContact O-N 3.13Å; R145-S155 PolarHBondContact NE-O 3.06Å; R145-S155 PolarHBondContact NH2-O 3.3Å; R145-S155 WeakPolarHBondContact O-CB 3.44Å; R145-F156 CarbonylContact C-O 3.18Å; R145-F156 VanDerWaalsContact CA-O 3.31Å; R145-F156 WeakPolarHBondContact CA-O 3.47Å; R145-T157 HydrophobicContact CG-CG2 3.9Å
146	P	84.6	Confident	82.2	Confident	51 Å²	51	60.2 Å²	60.2	33%	0.331	34%	0.34	S	S	.	.			trans	-71.9	-4.7	-168.7	28.6	-36.2	0	0	0	115.4	E144	E144-P146 WeakPolarHBondContact O-CD 3.49Å
147	F	85.6	Confident	82.1	Confident	52 Å²	52	59.9 Å²	59.9	23%	0.228	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	100.7	-179.2	-57.5	-75.5	0	0	0	110.4	R145 S155 F156 Q158 K159 L162	R145-F147 PolarHBondContact O-N 3.25Å; R145-F147 VanDerWaalsContact O-N 3.13Å; F147-S155 CarbonylContact O-C 3.49Å; F147-S155 WeakPolarHBondContact O-CA 3.38Å; F147-F156 HydrophobicContact CB-CB 4.34Å; F147-F156 PolarHBondContact N-O 3.21Å; F147-F156 VanDerWaalsContact N-O 3.12Å; F147-F156 PolarHBondContact O-N 3.35Å; F147-Q158 VanDerWaalsContact CD2-CA 3.5Å; F147-K159 HydrophobicContact CD1-CB 3.88Å; F147-K159 HydrophobicContact CD1-CG 4.36Å; F147-K159 VanDerWaalsContact CD2-N 3.28Å; F147-K159 HydrophobicContact CE1-CB 3.72Å; F147-K159 HydrophobicContact CE1-CG 4.37Å; F147-K159 HydrophobicContact CE2-CB 4.46Å; F147-K159 HydrophobicContact CG-CB 4.33Å; F147-K159 HydrophobicContact CZ-CB 4.02Å; F147-L162 HydrophobicContact CB-CB 4.08Å; F147-L162 HydrophobicContact CB-CD2 3.87Å
148	Q	84.8	Confident	82.2	Confident	86 Å²	86	62.2 Å²	62.2	40%	0.402	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	143.3	-178.5	-164.7	171.3	23	0	0	112.5	G153 A154 L162	Q148-G153 WeakPolarHBondContact CG-O 3.49Å; Q148-G153 PolarHBondContact NE2-O 3.1Å; Q148-A154 CarbonylContact C-O 3.58Å; Q148-L162 WeakPolarHBondContact O-CD2 3.37Å
149	C	85.8	Confident	82.4	Confident	1 Å²	1	65.7 Å²	65.7	1%	0.007	36%	0.364	C	S	.	.			trans	-81.1	123.1	169.3	-174.6	0	0	0	0	110.4	Q151 G153 A154 L162 H169	C149-Q151 VanDerWaalsContact C-N 3.26Å; C149-Q151 PolarHBondContact O-N 3.22Å; C149-G153 VanDerWaalsContact O-CA 3.22Å; C149-G153 WeakPolarHBondContact O-CA 3.5Å; C149-G153 PolarHBondContact O-N 2.97Å; C149-A154 HydrophobicContact CB-CB 4.44Å; C149-A154 PolarHBondContact N-O 2.86Å; C149-L162 HydrophobicContact CB-CD1 3.65Å; C149-H169 PolarHBondContact SG-NE2 2.85Å
150	S	81.3	Confident	82.3	Confident	83 Å²	83	65.6 Å²	65.6	58%	0.58	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-30.2	175.5	45.7	0	0	0	0	113.2
151	Q	79.4	Confident	82.3	Confident	114 Å²	114	63.6 Å²	63.6	53%	0.533	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-24	-172.8	-60.1	-179.2	4	0	0	114.5	C149 H169	C149-Q151 VanDerWaalsContact C-N 3.26Å; C149-Q151 PolarHBondContact O-N 3.22Å; Q151-H169 PolarHBondContact OE1-CD2 3.14Å
152	C	80	Confident	82.4	Confident	47 Å²	47	60.3 Å²	60.3	32%	0.318	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.7	3.7	-179.1	70.8	0	0	0	0	115.1	A154 H165	C152-A154 PolarHBondContact O-N 3.22Å; C152-A154 VanDerWaalsContact SG-CB 3.5Å; C152-H165 VanDerWaalsContact SG-CE1 3.55Å; C152-H165 PolarHBondContact SG-NE2 2.93Å
153	G	80.4	Confident	82.4	Confident	36 Å²	36	60.3 Å²	60.3	37%	0.371	34%	0.341	S	S	.	.			trans	71.3	2	-179.3	0	0	0	0	0	115.3	Q148 C149 S155	Q148-G153 WeakPolarHBondContact CG-O 3.49Å; Q148-G153 PolarHBondContact NE2-O 3.1Å; C149-G153 VanDerWaalsContact O-CA 3.22Å; C149-G153 WeakPolarHBondContact O-CA 3.5Å; C149-G153 PolarHBondContact O-N 2.97Å; G153-S155 PolarHBondContact O-N 3.35Å
154	A	77.7	Confident	82.4	Confident	33 Å²	33	62.9 Å²	62.9	27%	0.273	34%	0.335	S	S	.	.			trans	-67.8	123.7	-178.6	0	0	0	0	0	112.1	Q148 C149 C152 F156	Q148-A154 CarbonylContact C-O 3.58Å; C149-A154 HydrophobicContact CB-CB 4.44Å; C149-A154 PolarHBondContact N-O 2.86Å; C152-A154 PolarHBondContact O-N 3.22Å; C152-A154 VanDerWaalsContact SG-CB 3.5Å; A154-F156 HydrophobicContact CB-CE2 3.88Å; A154-F156 HydrophobicContact CB-CZ 3.99Å; A154-F156 WeakPolarHBondContact O-CD2 3.43Å; A154-F156 WeakPolarHBondContact O-CE2 3.49Å
155	S	83	Confident	82.3	Confident	35 Å²	35	58.8 Å²	58.8	25%	0.245	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	147.1	-178.3	-50.1	0	0	0	0	113	R145 F147 G153	R145-S155 PolarHBondContact NE-O 3.06Å; R145-S155 PolarHBondContact NH2-O 3.3Å; R145-S155 WeakPolarHBondContact O-CB 3.44Å; F147-S155 CarbonylContact O-C 3.49Å; F147-S155 WeakPolarHBondContact O-CA 3.38Å; G153-S155 PolarHBondContact O-N 3.35Å
156	F	82.5	Confident	82.1	Confident	36 Å²	36	54.3 Å²	54.3	16%	0.158	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	150.9	-175.7	-59.7	-85.5	0	0	0	112.2	R145 F147 A154 Q158 N161 L162 H165	R145-F156 CarbonylContact C-O 3.18Å; R145-F156 VanDerWaalsContact CA-O 3.31Å; R145-F156 WeakPolarHBondContact CA-O 3.47Å; F147-F156 HydrophobicContact CB-CB 4.34Å; F147-F156 PolarHBondContact N-O 3.21Å; F147-F156 VanDerWaalsContact N-O 3.12Å; F147-F156 PolarHBondContact O-N 3.35Å; A154-F156 HydrophobicContact CB-CE2 3.88Å; A154-F156 HydrophobicContact CB-CZ 3.99Å; A154-F156 WeakPolarHBondContact O-CD2 3.43Å; A154-F156 WeakPolarHBondContact O-CE2 3.49Å; F156-Q158 VanDerWaalsContact C-N 3.32Å; F156-N161 HydrophobicContact CB-CB 4.3Å; F156-N161 HydrophobicContact CD1-CB 4Å; F156-N161 HydrophobicContact CG-CB 4.36Å; F156-L162 HydrophobicContact CB-CB 4.42Å; F156-L162 HydrophobicContact CD2-CB 3.88Å; F156-L162 HydrophobicContact CD2-CD1 3.89Å; F156-L162 HydrophobicContact CD2-CG 4.49Å; F156-L162 HydrophobicContact CE2-CD1 4.03Å; F156-L162 HydrophobicContact CG-CB 4.34Å; F156-H165 HydrophobicContact CE1-CB 4.09Å; F156-H165 HydrophobicContact CE2-CB 3.87Å; F156-H165 AromaticContact CE2-CD2 3.52Å; F156-H165 AromaticContact CE2-CG 3.63Å; F156-H165 HydrophobicContact CZ-CB 3.48Å; F156-H165 VanDerWaalsContact CZ-CB 3.48Å; F156-H165 AromaticContact CZ-CD2 3.65Å; F156-H165 AromaticContact CZ-CG 3.28Å; F156-H165 AromaticContact CZ-ND1 3.59Å
157	T	82.1	Confident	81.7	Confident	36 Å²	36	58.4 Å²	58.4	22%	0.221	32%	0.315	C	S	.	.	S	Bend	trans	-76.3	-16.5	177.1	56	0	0	0	0	113.8	R139 R145	R139-T157 HydrophobicContact CB-CG2 4.2Å; R139-T157 PolarHBondContact NH1-O 2.93Å; R145-T157 HydrophobicContact CG-CG2 3.9Å
158	Q	84.8	Confident	81.2	Confident	83 Å²	83	59 Å²	59	39%	0.388	32%	0.32	S	S	.	.	S	Bend	trans	-141.8	137.5	-174.8	-58.5	177.5	30.2	0	0	112.3	V136 F147 F156 G160 N161 L162	V136-Q158 HydrophobicContact CG1-CG 3.66Å; V136-Q158 VanDerWaalsContact CG1-NE2 3.26Å; V136-Q158 HydrophobicContact CG2-CG 4.49Å; F147-Q158 VanDerWaalsContact CD2-CA 3.5Å; F156-Q158 VanDerWaalsContact C-N 3.32Å; Q158-G160 VanDerWaalsContact C-N 3.3Å; Q158-G160 PolarHBondContact O-N 3.19Å; Q158-N161 PolarHBondContact O-N 3.3Å; Q158-L162 PolarHBondContact O-N 3.06Å
159	K	83.6	Confident	80.8	Confident	113 Å²	113	58.5 Å²	58.5	49%	0.491	32%	0.318	S	S	.	.	H	α-helix	trans	-55.1	-40.2	176.6	-171.5	174.7	-179.6	176.5	0	113.2	F147 N161 L162 L163	F147-K159 HydrophobicContact CD1-CB 3.88Å; F147-K159 HydrophobicContact CD1-CG 4.36Å; F147-K159 VanDerWaalsContact CD2-N 3.28Å; F147-K159 HydrophobicContact CE1-CB 3.72Å; F147-K159 HydrophobicContact CE1-CG 4.37Å; F147-K159 HydrophobicContact CE2-CB 4.46Å; F147-K159 HydrophobicContact CG-CB 4.33Å; F147-K159 HydrophobicContact CZ-CB 4.02Å; K159-N161 VanDerWaalsContact C-N 3.26Å; K159-N161 PolarHBondContact O-N 3.32Å; K159-L162 WeakPolarHBondContact O-CB 3.35Å; K159-L162 PolarHBondContact O-N 2.97Å; K159-L163 HydrophobicContact CG-CD1 4.29Å; K159-L163 HydrophobicContact CG-CG 4.45Å; K159-L163 WeakPolarHBondContact O-CG 3.31Å; K159-L163 PolarHBondContact O-N 2.82Å
160	G	83.1	Confident	80.1	Confident	43 Å²	43	61.5 Å²	61.5	44%	0.443	34%	0.339	S	S	.	.	H	α-helix	trans	-64.8	-27	178.8	0	0	0	0	0	114.2	Q158 R164	Q158-G160 VanDerWaalsContact C-N 3.3Å; Q158-G160 PolarHBondContact O-N 3.19Å; G160-R164 WeakPolarHBondContact O-CB 3.42Å; G160-R164 PolarHBondContact O-N 3.42Å
161	N	81.4	Confident	79.5	Confident	39 Å²	39	59.5 Å²	59.5	21%	0.209	33%	0.331	C	S	.	.	H	α-helix	trans	-77.3	-39	173.7	-69.9	-27	0	0	0	111.1	F156 Q158 K159 R164 H165	F156-N161 HydrophobicContact CB-CB 4.3Å; F156-N161 HydrophobicContact CD1-CB 4Å; F156-N161 HydrophobicContact CG-CB 4.36Å; Q158-N161 PolarHBondContact O-N 3.3Å; K159-N161 VanDerWaalsContact C-N 3.26Å; K159-N161 PolarHBondContact O-N 3.32Å; N161-R164 PolarHBondContact O-N 3.46Å; N161-R164 PolarHBondContact OD1-NH1 3.33Å; N161-R164 PolarHBondContact OD1-NH2 3.15Å; N161-H165 WeakPolarHBondContact O-CB 3.4Å; N161-H165 PolarHBondContact O-N 2.88Å
162	L	83.6	Confident	79.2	Confident	4 Å²	4	60.3 Å²	60.3	2%	0.021	34%	0.335	C	S	.	.	H	α-helix	trans	-59.8	-50.1	171.7	172.2	60.2	0	0	0	111.6	L84 F147 Q148 C149 F156 Q158 K159 R164 H165 I166	L84-L162 HydrophobicContact CD2-CD2 3.8Å; F147-L162 HydrophobicContact CB-CB 4.08Å; F147-L162 HydrophobicContact CB-CD2 3.87Å; Q148-L162 WeakPolarHBondContact O-CD2 3.37Å; C149-L162 HydrophobicContact CB-CD1 3.65Å; F156-L162 HydrophobicContact CB-CB 4.42Å; F156-L162 HydrophobicContact CD2-CB 3.88Å; F156-L162 HydrophobicContact CD2-CD1 3.89Å; F156-L162 HydrophobicContact CD2-CG 4.49Å; F156-L162 HydrophobicContact CE2-CD1 4.03Å; F156-L162 HydrophobicContact CG-CB 4.34Å; Q158-L162 PolarHBondContact O-N 3.06Å; K159-L162 WeakPolarHBondContact O-CB 3.35Å; K159-L162 PolarHBondContact O-N 2.97Å; L162-R164 VanDerWaalsContact C-N 3.27Å; L162-R164 PolarHBondContact O-N 2.86Å; L162-H165 CarbonylContact O-C 3.59Å; L162-H165 WeakPolarHBondContact O-CA 3.32Å; L162-H165 WeakPolarHBondContact O-CB 3.07Å; L162-H165 PolarHBondContact O-N 3.5Å; L162-I166 HydrophobicContact CD1-CD1 3.9Å; L162-I166 HydrophobicContact CD1-CG1 4.01Å; L162-I166 HydrophobicContact CG-CD1 3.91Å; L162-I166 HydrophobicContact CG-CG1 4.46Å; L162-I166 WeakPolarHBondContact O-CG1 3.3Å; L162-I166 PolarHBondContact O-N 3.12Å
163	L	81.9	Confident	79	Confident	79 Å²	79	63.6 Å²	63.6	41%	0.414	34%	0.344	S	S	.	.	H	α-helix	trans	-60	-36.9	178	-69.2	173.9	0	0	0	112.5	K159 K167	K159-L163 HydrophobicContact CG-CD1 4.29Å; K159-L163 HydrophobicContact CG-CG 4.45Å; K159-L163 WeakPolarHBondContact O-CG 3.31Å; K159-L163 PolarHBondContact O-N 2.82Å; L163-K167 PolarHBondContact O-N 2.75Å
164	R	78	Confident	78.9	Confident	105 Å²	105	66 Å²	66	40%	0.396	35%	0.353	S	S	.	.	H	α-helix	trans	-66.6	-37.8	173.5	-170.1	-168.4	-56.1	133.8	10.7	112.1	G160 N161 L162	G160-R164 WeakPolarHBondContact O-CB 3.42Å; G160-R164 PolarHBondContact O-N 3.42Å; N161-R164 PolarHBondContact O-N 3.46Å; N161-R164 PolarHBondContact OD1-NH1 3.33Å; N161-R164 PolarHBondContact OD1-NH2 3.15Å; L162-R164 VanDerWaalsContact C-N 3.27Å; L162-R164 PolarHBondContact O-N 2.86Å
165	H	81.8	Confident	79.1	Confident	16 Å²	16	67.2 Å²	67.2	7%	0.074	35%	0.352	C	S	.	.	H	α-helix	trans	-71.2	-38.2	178.2	165.5	83.9	0	0	0	112.2	C152 F156 N161 L162 K167 L168 H169	C152-H165 VanDerWaalsContact SG-CE1 3.55Å; C152-H165 PolarHBondContact SG-NE2 2.93Å; F156-H165 HydrophobicContact CE1-CB 4.09Å; F156-H165 HydrophobicContact CE2-CB 3.87Å; F156-H165 AromaticContact CE2-CD2 3.52Å; F156-H165 AromaticContact CE2-CG 3.63Å; F156-H165 HydrophobicContact CZ-CB 3.48Å; F156-H165 VanDerWaalsContact CZ-CB 3.48Å; F156-H165 AromaticContact CZ-CD2 3.65Å; F156-H165 AromaticContact CZ-CG 3.28Å; F156-H165 AromaticContact CZ-ND1 3.59Å; N161-H165 WeakPolarHBondContact O-CB 3.4Å; N161-H165 PolarHBondContact O-N 2.88Å; L162-H165 CarbonylContact O-C 3.59Å; L162-H165 WeakPolarHBondContact O-CA 3.32Å; L162-H165 WeakPolarHBondContact O-CB 3.07Å; L162-H165 PolarHBondContact O-N 3.5Å; H165-K167 PolarHBondContact O-N 3.13Å; H165-L168 HydrophobicContact CB-CD1 4.46Å; H165-L168 WeakPolarHBondContact O-CA 3.42Å; H165-L168 WeakPolarHBondContact O-CB 3.35Å; H165-L168 VanDerWaalsContact O-CG 3.31Å; H165-L168 WeakPolarHBondContact O-CG 3.45Å; H165-L168 PolarHBondContact O-N 2.91Å; H165-H169 AromaticContact CE1-NE2 3.88Å; H165-H169 AromaticContact NE2-NE2 3.37Å; H165-H169 PolarHBondContact NE2-NE2 3.32Å
166	I	78.6	Confident	78.8	Confident	48 Å²	48	73.1 Å²	73.1	25%	0.246	37%	0.373	C	S	.	.	H	α-helix	trans	-58.7	-36.9	174.7	-67.7	164.6	0	0	0	111.1	L84 L162 L168 H169	L84-I166 HydrophobicContact CD2-CD1 4.47Å; L162-I166 HydrophobicContact CD1-CD1 3.9Å; L162-I166 HydrophobicContact CD1-CG1 4.01Å; L162-I166 HydrophobicContact CG-CD1 3.91Å; L162-I166 HydrophobicContact CG-CG1 4.46Å; L162-I166 WeakPolarHBondContact O-CG1 3.3Å; L162-I166 PolarHBondContact O-N 3.12Å; I166-L168 PolarHBondContact O-N 3.23Å; I166-L168 VanDerWaalsContact O-N 3.08Å; I166-H169 WeakPolarHBondContact O-CB 3.28Å; I166-H169 PolarHBondContact O-N 3.42Å
167	K	76.5	Confident	78.5	Confident	137 Å²	137	72 Å²	72	60%	0.596	37%	0.37	S	S	*	.	H	α-helix	trans	-64.5	-7.3	171.7	-63.5	-170.7	-179.8	-155	0	114.8	L163 H165 S170 R185	L163-K167 PolarHBondContact O-N 2.75Å; H165-K167 PolarHBondContact O-N 3.13Å; K167-S170 PolarHBondContact O-OG 3.33Å; K167-R185 WeakPolarHBondContact O-CD 2.91Å
168	L	75.9	Confident	78.3	Confident	65 Å²	65	77.6 Å²	77.6	34%	0.34	39%	0.393	S	S	.	.	H	α-helix	trans	-77.2	-36.7	170.2	-56.8	173.5	0	0	0	111.2	H165 I166 G171 R185	H165-L168 HydrophobicContact CB-CD1 4.46Å; H165-L168 WeakPolarHBondContact O-CA 3.42Å; H165-L168 WeakPolarHBondContact O-CB 3.35Å; H165-L168 VanDerWaalsContact O-CG 3.31Å; H165-L168 WeakPolarHBondContact O-CG 3.45Å; H165-L168 PolarHBondContact O-N 2.91Å; I166-L168 PolarHBondContact O-N 3.23Å; I166-L168 VanDerWaalsContact O-N 3.08Å; L168-G171 PolarHBondContact O-N 2.99Å; L168-R185 VanDerWaalsContact CA-NH1 3.35Å; L168-R185 VanDerWaalsContact O-CZ 3.3Å; L168-R185 PolarHBondContact O-NH1 3.43Å; L168-R185 VanDerWaalsContact O-NH1 3.16Å; L168-R185 PolarHBondContact O-NH2 3.46Å
169	H	75.8	Confident	77.3	Confident	76 Å²	76	77.7 Å²	77.7	35%	0.352	40%	0.396	S	S	.	.	H	α-helix	trans	-70.2	-33.2	180	-61.9	-56.1	0	0	0	112.6	C149 Q151 H165 I166 G171	C149-H169 PolarHBondContact SG-NE2 2.85Å; Q151-H169 PolarHBondContact OE1-CD2 3.14Å; H165-H169 AromaticContact CE1-NE2 3.88Å; H165-H169 AromaticContact NE2-NE2 3.37Å; H165-H169 PolarHBondContact NE2-NE2 3.32Å; I166-H169 WeakPolarHBondContact O-CB 3.28Å; I166-H169 PolarHBondContact O-N 3.42Å; H169-G171 PolarHBondContact O-N 2.66Å
170	S	71.8	Confident	76.6	Confident	64 Å²	64	73.6 Å²	73.6	45%	0.448	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-9	176	67.7	0	0	0	0	114.4	K167 E172	K167-S170 PolarHBondContact O-OG 3.33Å; S170-E172 PolarHBondContact O-N 2.78Å
171	G	67.3	Low	76	Confident	40 Å²	40	77 Å²	77	41%	0.412	40%	0.398	S	S	.	.			trans	77.7	-36.5	178.4	0	0	0	0	0	114.4	L168 H169 R185	L168-G171 PolarHBondContact O-N 2.99Å; H169-G171 PolarHBondContact O-N 2.66Å; G171-R185 VanDerWaalsContact C-NH2 3.3Å; G171-R185 VanDerWaalsContact CA-NH2 3.28Å; G171-R185 PolarHBondContact O-NE 3.05Å; G171-R185 PolarHBondContact O-NH2 3.27Å
172	E	72.8	Confident	75.3	Confident	131 Å²	131	79.6 Å²	79.6	61%	0.612	41%	0.406	S	S	*	.			trans	-47	149.9	-171.3	-61.7	-176.9	164.2	0	0	115	S170 R185	S170-E172 PolarHBondContact O-N 2.78Å; E172-R185 WeakPolarHBondContact O-CG 3.47Å; E172-R185 PolarHBondContact O-NE 3.27Å
173	K	76.2	Confident	74.9	Confident	117 Å²	117	80.8 Å²	80.8	51%	0.509	42%	0.416	S	S	.	.			trans	-137.9	70.7	176.3	-69.2	174.2	179.8	175.5	0	110.3	F175 A183 C184 R185	K173-F175 VanDerWaalsContact C-N 3.27Å; K173-F175 PolarHBondContact O-N 3.28Å; K173-A183 HydrophobicContact CB-CB 3.86Å; K173-A183 HydrophobicContact CD-CB 4.37Å; K173-C184 CarbonylContact C-O 3.6Å; K173-C184 WeakPolarHBondContact CA-O 3.41Å; K173-R185 HydrophobicContact CG-CG 4.4Å
174	P	78.6	Confident	74.8	Confident	86 Å²	86	77.5 Å²	77.5	56%	0.558	40%	0.399	S	S	*	.			trans	-66.2	-23.7	-172.2	24.2	-34	0	0	0	114.1	K176	P174-K176 PolarHBondContact O-N 3.29Å
175	F	81	Confident	74.8	Confident	59 Å²	59	76.3 Å²	76.3	26%	0.259	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	92.6	-178	-56.9	-78.6	0	0	0	110.8	K173 A183 C184 R185 R187 L190	K173-F175 VanDerWaalsContact C-N 3.27Å; K173-F175 PolarHBondContact O-N 3.28Å; F175-A183 CarbonylContact O-C 3.44Å; F175-A183 WeakPolarHBondContact O-CA 3.45Å; F175-C184 WeakPolarHBondContact CB-O 3.48Å; F175-C184 PolarHBondContact N-O 2.87Å; F175-C184 PolarHBondContact O-N 3.24Å; F175-R185 VanDerWaalsContact CD2-C 3.49Å; F175-R185 WeakPolarHBondContact CE2-O 3.41Å; F175-R187 HydrophobicContact CD1-CB 4.05Å; F175-R187 HydrophobicContact CE1-CB 3.78Å; F175-R187 HydrophobicContact CE1-CG 4.38Å; F175-R187 HydrophobicContact CZ-CB 4.09Å; F175-L190 HydrophobicContact CB-CB 4.13Å; F175-L190 HydrophobicContact CB-CD2 3.96Å
176	K	77.4	Confident	74.6	Confident	159 Å²	159	79.2 Å²	79.2	69%	0.691	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	146	176.1	-60.7	178.2	-177.2	174.1	0	111.2	P174 A183 L190	P174-K176 PolarHBondContact O-N 3.29Å; K176-A183 HydrophobicContact CG-CB 3.99Å; K176-L190 WeakPolarHBondContact O-CD2 3.47Å
177	C	76.6	Confident	74.6	Confident	13 Å²	13	85.6 Å²	85.6	9%	0.088	43%	0.426	C	S	.	.			trans	-81.5	138	169.5	-172.7	0	0	0	0	110.2	L179 Y182 L190 H193	C177-L179 VanDerWaalsContact C-N 3.31Å; C177-L179 PolarHBondContact SG-N 3.35Å; C177-L179 VanDerWaalsContact SG-N 3.41Å; C177-Y182 WeakPolarHBondContact CB-O 3.33Å; C177-Y182 PolarHBondContact N-O 3.48Å; C177-L190 HydrophobicContact CB-CD1 3.9Å; C177-H193 VanDerWaalsContact SG-CD2 3.53Å; C177-H193 PolarHBondContact SG-NE2 3.37Å
178	H	77.5	Confident	74.7	Confident	152 Å²	152	83.4 Å²	83.4	70%	0.704	42%	0.421	S	S	*	.	S	Bend	trans	-85.8	-3.5	175.4	67.9	87.1	0	0	0	113.1
179	L	64.2	Low	74.8	Confident	86 Å²	86	82 Å²	82	45%	0.45	42%	0.419	S	S	.	.	S	Bend	trans	-108.3	-12.5	-179.1	-60	176.7	0	0	0	113.6	C177 L194 H197	C177-L179 VanDerWaalsContact C-N 3.31Å; C177-L179 PolarHBondContact SG-N 3.35Å; C177-L179 VanDerWaalsContact SG-N 3.41Å; L179-L194 HydrophobicContact CD1-CD2 4.4Å; L179-H197 HydrophobicContact CD1-CB 3.52Å
180	C	68.4	Low	75	Confident	26 Å²	26	79.5 Å²	79.5	18%	0.176	41%	0.408	C	S	.	.	S	Bend	trans	-164.9	173.3	174.2	66	0	0	0	0	111.7	Y182 H193 C208	C180-Y182 PolarHBondContact O-N 3.02Å; C180-H193 PolarHBondContact SG-NE2 3.47Å; C180-H193 VanDerWaalsContact SG-NE2 3.41Å; C180-C208 WeakPolarHBondContact CB-O 3Å; C180-C208 PolarHBondContact SG-O 3.41Å; C180-C208 VanDerWaalsContact SG-O 3.36Å
181	S	71.3	Confident	75.3	Confident	116 Å²	116	79.6 Å²	79.6	81%	0.811	41%	0.406	S	S	*	.	S	Bend	trans	-66.6	8.1	179.7	54.1	0	0	0	0	115.9	A183	S181-A183 PolarHBondContact O-N 2.81Å
182	Y	66.8	Low	75.5	Confident	93 Å²	93	79.1 Å²	79.1	37%	0.365	40%	0.401	S	S	.	.			trans	-70.1	128.2	177.7	-178	-98.9	0	0	0	111.5	C177 C180 C184 H193	C177-Y182 WeakPolarHBondContact CB-O 3.33Å; C177-Y182 PolarHBondContact N-O 3.48Å; C180-Y182 PolarHBondContact O-N 3.02Å; Y182-C184 HydrophobicContact CE1-CB 3.81Å; Y182-H193 VanDerWaalsContact CB-CE1 3.43Å; Y182-H193 WeakPolarHBondContact CB-CE1 3.39Å; Y182-H193 HydrophobicContact CD1-CB 3.98Å; Y182-H193 AromaticContact CD1-CD2 3.67Å; Y182-H193 AromaticContact CD1-CE1 3.67Å; Y182-H193 AromaticContact CD1-CG 3.39Å; Y182-H193 AromaticContact CD1-ND1 3.4Å; Y182-H193 WeakPolarHBondContact CD1-ND1 3.35Å; Y182-H193 AromaticContact CD1-NE2 3.85Å; Y182-H193 HydrophobicContact CE1-CB 3.76Å; Y182-H193 AromaticContact CE1-CG 3.69Å; Y182-H193 AromaticContact CE1-ND1 3.81Å; Y182-H193 AromaticContact CG-CE1 3.49Å; Y182-H193 VanDerWaalsContact CG-CE1 3.49Å; Y182-H193 AromaticContact CG-ND1 3.53Å; Y182-H193 AromaticContact CG-NE2 3.95Å
183	A	75.4	Confident	75.7	Confident	29 Å²	29	73.7 Å²	73.7	24%	0.24	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	146.6	174	0	0	0	0	0	110.9	K173 F175 K176 S181	K173-A183 HydrophobicContact CB-CB 3.86Å; K173-A183 HydrophobicContact CD-CB 4.37Å; F175-A183 CarbonylContact O-C 3.44Å; F175-A183 WeakPolarHBondContact O-CA 3.45Å; K176-A183 HydrophobicContact CG-CB 3.99Å; S181-A183 PolarHBondContact O-N 2.81Å
184	C	78.3	Confident	75.4	Confident	9 Å²	9	70.3 Å²	70.3	6%	0.061	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	169.7	-176.3	70.4	0	0	0	0	113.1	K173 F175 Y182 R186 A189	K173-C184 CarbonylContact C-O 3.6Å; K173-C184 WeakPolarHBondContact CA-O 3.41Å; F175-C184 WeakPolarHBondContact CB-O 3.48Å; F175-C184 PolarHBondContact N-O 2.87Å; F175-C184 PolarHBondContact O-N 3.24Å; Y182-C184 HydrophobicContact CE1-CB 3.81Å; C184-R186 PolarHBondContact SG-O 2.86Å; C184-A189 HydrophobicContact CB-CB 4.41Å
185	R	78.4	Confident	75.1	Confident	81 Å²	81	75 Å²	75	31%	0.306	37%	0.37	S	S	.	.	S	Bend	trans	-87.3	-7.4	-177.6	-77.7	166.4	-167.2	160.8	1.4	115	K167 L168 G171 E172 K173 F175	K167-R185 WeakPolarHBondContact O-CD 2.91Å; L168-R185 VanDerWaalsContact CA-NH1 3.35Å; L168-R185 VanDerWaalsContact O-CZ 3.3Å; L168-R185 PolarHBondContact O-NH1 3.43Å; L168-R185 VanDerWaalsContact O-NH1 3.16Å; L168-R185 PolarHBondContact O-NH2 3.46Å; G171-R185 VanDerWaalsContact C-NH2 3.3Å; G171-R185 VanDerWaalsContact CA-NH2 3.28Å; G171-R185 PolarHBondContact O-NE 3.05Å; G171-R185 PolarHBondContact O-NH2 3.27Å; E172-R185 WeakPolarHBondContact O-CG 3.47Å; E172-R185 PolarHBondContact O-NE 3.27Å; K173-R185 HydrophobicContact CG-CG 4.4Å; F175-R185 VanDerWaalsContact CD2-C 3.49Å; F175-R185 WeakPolarHBondContact CE2-O 3.41Å
186	R	77.6	Confident	74.4	Confident	76 Å²	76	74.3 Å²	74.3	29%	0.287	37%	0.37	S	S	.	.			trans	-138.3	135.2	-172.2	-50.9	164.1	54.4	154.8	-4.6	112.3	C184 D188 A189 L190	C184-R186 PolarHBondContact SG-O 2.86Å; R186-D188 VanDerWaalsContact C-N 3.3Å; R186-D188 WeakPolarHBondContact CB-OD1 3.46Å; R186-D188 IonicContact CZ-OD1 2.7Å; R186-D188 IonicContact CZ-OD2 2.9Å; R186-D188 IonicContact NE-OD1 3.99Å; R186-D188 PolarHBondContact NE-OD1 3.29Å; R186-D188 IonicContact NE-OD2 3.9Å; R186-D188 IonicContact NH2-OD1 2.75Å; R186-D188 PolarHBondContact NH2-OD1 3.41Å; R186-D188 IonicContact NH2-OD2 3.74Å; R186-D188 PolarHBondContact NH2-OD2 3.37Å; R186-D188 PolarHBondContact O-N 2.82Å; R186-A189 HydrophobicContact CB-CB 4.1Å; R186-A189 WeakPolarHBondContact O-CB 3.43Å; R186-A189 PolarHBondContact O-N 3.02Å; R186-L190 PolarHBondContact O-N 2.93Å; R186-L190 VanDerWaalsContact O-N 3.1Å
187	R	79.8	Confident	73.9	Confident	183 Å²	183	67.4 Å²	67.4	69%	0.691	34%	0.34	S	S	*	.	H	α-helix	trans	-58.4	-39.4	176.8	-173.6	177.7	-73.6	170	-4	112.7	F175 L190 T191	F175-R187 HydrophobicContact CD1-CB 4.05Å; F175-R187 HydrophobicContact CE1-CB 3.78Å; F175-R187 HydrophobicContact CE1-CG 4.38Å; F175-R187 HydrophobicContact CZ-CB 4.09Å; R187-L190 WeakPolarHBondContact O-CB 3.13Å; R187-L190 PolarHBondContact O-N 2.82Å; R187-T191 PolarHBondContact O-N 3.24Å; R187-T191 PolarHBondContact O-OG1 2.97Å
188	D	78.6	Confident	73.3	Confident	91 Å²	91	70.3 Å²	70.3	49%	0.487	36%	0.361	S	S	.	.	H	α-helix	trans	-69.2	-35	179.3	67.2	-46.6	0	0	0	112.9	R186 T191 G192	R186-D188 VanDerWaalsContact C-N 3.3Å; R186-D188 WeakPolarHBondContact CB-OD1 3.46Å; R186-D188 IonicContact CZ-OD1 2.7Å; R186-D188 IonicContact CZ-OD2 2.9Å; R186-D188 IonicContact NE-OD1 3.99Å; R186-D188 PolarHBondContact NE-OD1 3.29Å; R186-D188 IonicContact NE-OD2 3.9Å; R186-D188 IonicContact NH2-OD1 2.75Å; R186-D188 PolarHBondContact NH2-OD1 3.41Å; R186-D188 IonicContact NH2-OD2 3.74Å; R186-D188 PolarHBondContact NH2-OD2 3.37Å; R186-D188 PolarHBondContact O-N 2.82Å; D188-T191 PolarHBondContact O-N 3.37Å; D188-G192 PolarHBondContact O-N 3.04Å
189	A	77.2	Confident	72.2	Confident	35 Å²	35	69.6 Å²	69.6	29%	0.289	37%	0.367	S	S	.	.	H	α-helix	trans	-64.4	-40.7	170.8	0	0	0	0	0	111.5	C184 R186 G192 H193	C184-A189 HydrophobicContact CB-CB 4.41Å; R186-A189 HydrophobicContact CB-CB 4.1Å; R186-A189 WeakPolarHBondContact O-CB 3.43Å; R186-A189 PolarHBondContact O-N 3.02Å; A189-G192 PolarHBondContact O-N 3.49Å; A189-H193 VanDerWaalsContact O-CB 3.32Å; A189-H193 WeakPolarHBondContact O-CB 3.31Å; A189-H193 PolarHBondContact O-N 3.37Å
190	L	79.6	Confident	71.8	Confident	24 Å²	24	68.5 Å²	68.5	13%	0.126	38%	0.377	C	S	.	.	H	α-helix	trans	-63.5	-45	171.7	179.7	61	0	0	0	111.4	F175 K176 C177 R186 R187 G192 H193 L194	F175-L190 HydrophobicContact CB-CB 4.13Å; F175-L190 HydrophobicContact CB-CD2 3.96Å; K176-L190 WeakPolarHBondContact O-CD2 3.47Å; C177-L190 HydrophobicContact CB-CD1 3.9Å; R186-L190 PolarHBondContact O-N 2.93Å; R186-L190 VanDerWaalsContact O-N 3.1Å; R187-L190 WeakPolarHBondContact O-CB 3.13Å; R187-L190 PolarHBondContact O-N 2.82Å; L190-G192 VanDerWaalsContact C-N 3.34Å; L190-G192 PolarHBondContact O-N 3.12Å; L190-H193 CarbonylContact O-C 3.56Å; L190-H193 WeakPolarHBondContact O-CB 3.45Å; L190-H193 PolarHBondContact O-N 2.81Å; L190-H193 VanDerWaalsContact O-N 3.15Å; L190-L194 HydrophobicContact CD1-CG 4.27Å; L190-L194 HydrophobicContact CG-CD1 4.18Å; L190-L194 HydrophobicContact CG-CG 4.41Å; L190-L194 WeakPolarHBondContact O-CG 3.43Å; L190-L194 PolarHBondContact O-N 3.21Å
191	T	78.2	Confident	71.3	Confident	65 Å²	65	70.6 Å²	70.6	40%	0.399	38%	0.383	S	S	.	.	H	α-helix	trans	-60.9	-41.8	177.2	-54.1	0	0	0	0	111.8	R187 D188 L194 R195	R187-T191 PolarHBondContact O-N 3.24Å; R187-T191 PolarHBondContact O-OG1 2.97Å; D188-T191 PolarHBondContact O-N 3.37Å; T191-L194 PolarHBondContact O-N 2.8Å; T191-R195 PolarHBondContact O-N 2.83Å
192	G	70.7	Confident	70.9	Confident	31 Å²	31	70 Å²	70	32%	0.32	38%	0.376	S	S	.	.	H	α-helix	trans	-63.6	-40.8	172.8	0	0	0	0	0	112.6	D188 A189 L190 R195	D188-G192 PolarHBondContact O-N 3.04Å; A189-G192 PolarHBondContact O-N 3.49Å; L190-G192 VanDerWaalsContact C-N 3.34Å; L190-G192 PolarHBondContact O-N 3.12Å; G192-R195 WeakPolarHBondContact O-CB 3.4Å; G192-R195 PolarHBondContact O-N 3.1Å
193	H	78	Confident	71.1	Confident	16 Å²	16	68.2 Å²	68.2	7%	0.074	37%	0.371	C	S	.	.	H	α-helix	trans	-62.8	-40.2	173.3	171.6	87.2	0	0	0	112.6	C177 C180 Y182 A189 L190 R195 T196 H197	C177-H193 VanDerWaalsContact SG-CD2 3.53Å; C177-H193 PolarHBondContact SG-NE2 3.37Å; C180-H193 PolarHBondContact SG-NE2 3.47Å; C180-H193 VanDerWaalsContact SG-NE2 3.41Å; Y182-H193 VanDerWaalsContact CB-CE1 3.43Å; Y182-H193 WeakPolarHBondContact CB-CE1 3.39Å; Y182-H193 HydrophobicContact CD1-CB 3.98Å; Y182-H193 AromaticContact CD1-CD2 3.67Å; Y182-H193 AromaticContact CD1-CE1 3.67Å; Y182-H193 AromaticContact CD1-CG 3.39Å; Y182-H193 AromaticContact CD1-ND1 3.4Å; Y182-H193 WeakPolarHBondContact CD1-ND1 3.35Å; Y182-H193 AromaticContact CD1-NE2 3.85Å; Y182-H193 HydrophobicContact CE1-CB 3.76Å; Y182-H193 AromaticContact CE1-CG 3.69Å; Y182-H193 AromaticContact CE1-ND1 3.81Å; Y182-H193 AromaticContact CG-CE1 3.49Å; Y182-H193 VanDerWaalsContact CG-CE1 3.49Å; Y182-H193 AromaticContact CG-ND1 3.53Å; Y182-H193 AromaticContact CG-NE2 3.95Å; A189-H193 VanDerWaalsContact O-CB 3.32Å; A189-H193 WeakPolarHBondContact O-CB 3.31Å; A189-H193 PolarHBondContact O-N 3.37Å; L190-H193 CarbonylContact O-C 3.56Å; L190-H193 WeakPolarHBondContact O-CB 3.45Å; L190-H193 PolarHBondContact O-N 2.81Å; L190-H193 VanDerWaalsContact O-N 3.15Å; H193-R195 VanDerWaalsContact C-N 3.26Å; H193-R195 PolarHBondContact O-N 3.38Å; H193-T196 WeakPolarHBondContact O-CA 3.19Å; H193-T196 VanDerWaalsContact O-CB 3.3Å; H193-T196 WeakPolarHBondContact O-CB 3.42Å; H193-T196 PolarHBondContact O-N 3.37Å; H193-T196 PolarHBondContact O-OG1 3.34Å; H193-H197 AromaticContact CD2-CD2 3.98Å; H193-H197 AromaticContact CD2-NE2 3.77Å; H193-H197 AromaticContact CE1-NE2 3.66Å; H193-H197 AromaticContact NE2-CD2 3.64Å; H193-H197 AromaticContact NE2-NE2 2.97Å; H193-H197 PolarHBondContact NE2-NE2 2.9Å
194	L	70	Confident	70.7	Confident	46 Å²	46	72.8 Å²	72.8	24%	0.241	39%	0.385	C	S	.	.	H	α-helix	trans	-62.5	-31.7	177.8	-71.6	170.4	0	0	0	112.2	L179 L190 T191 T196 H197 S198	L179-L194 HydrophobicContact CD1-CD2 4.4Å; L190-L194 HydrophobicContact CD1-CG 4.27Å; L190-L194 HydrophobicContact CG-CD1 4.18Å; L190-L194 HydrophobicContact CG-CG 4.41Å; L190-L194 WeakPolarHBondContact O-CG 3.43Å; L190-L194 PolarHBondContact O-N 3.21Å; T191-L194 PolarHBondContact O-N 2.8Å; L194-T196 PolarHBondContact O-N 3.18Å; L194-T196 VanDerWaalsContact O-N 3.14Å; L194-H197 WeakPolarHBondContact O-CB 3.44Å; L194-H197 PolarHBondContact O-N 3.21Å; L194-S198 PolarHBondContact O-N 2.93Å
195	R	72.1	Confident	70.3	Confident	186 Å²	186	72.4 Å²	72.4	70%	0.702	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-10.7	169.5	-58.6	172.9	-167.2	166.2	2.5	114	T191 G192 H193	T191-R195 PolarHBondContact O-N 2.83Å; G192-R195 WeakPolarHBondContact O-CB 3.4Å; G192-R195 PolarHBondContact O-N 3.1Å; H193-R195 VanDerWaalsContact C-N 3.26Å; H193-R195 PolarHBondContact O-N 3.38Å
196	T	66.5	Low	69.6	Low	44 Å²	44	73.2 Å²	73.2	27%	0.27	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-13.6	171	76.2	0	0	0	0	113.3	H193 L194 S211	H193-T196 WeakPolarHBondContact O-CA 3.19Å; H193-T196 VanDerWaalsContact O-CB 3.3Å; H193-T196 WeakPolarHBondContact O-CB 3.42Å; H193-T196 PolarHBondContact O-N 3.37Å; H193-T196 PolarHBondContact O-OG1 3.34Å; L194-T196 PolarHBondContact O-N 3.18Å; L194-T196 VanDerWaalsContact O-N 3.14Å; T196-S211 VanDerWaalsContact O-CB 3.28Å; T196-S211 WeakPolarHBondContact O-CB 3.39Å; T196-S211 PolarHBondContact O-N 3.16Å; T196-S211 PolarHBondContact O-OG 2.86Å
197	H	67.5	Low	68.6	Low	13 Å²	13	76.4 Å²	76.4	6%	0.06	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-29.1	171.6	-65.7	-77.2	0	0	0	112.6	L179 H193 L194 G209	L179-H197 HydrophobicContact CD1-CB 3.52Å; H193-H197 AromaticContact CD2-CD2 3.98Å; H193-H197 AromaticContact CD2-NE2 3.77Å; H193-H197 AromaticContact CE1-NE2 3.66Å; H193-H197 AromaticContact NE2-CD2 3.64Å; H193-H197 AromaticContact NE2-NE2 2.97Å; H193-H197 PolarHBondContact NE2-NE2 2.9Å; L194-H197 WeakPolarHBondContact O-CB 3.44Å; L194-H197 PolarHBondContact O-N 3.21Å; H197-G209 PolarHBondContact ND1-O 2.74Å
198	S	62.2	Low	67.7	Low	75 Å²	75	68.8 Å²	68.8	52%	0.524	39%	0.394	S	S	.	.	S	Bend	trans	-100.7	129	-175.1	-57.2	0	0	0	0	113.4	L194	L194-S198 PolarHBondContact O-N 2.93Å
199	V	55.6	Low	66.8	Low	136 Å²	136	65.2 Å²	65.2	82%	0.824	38%	0.379	S	S	*	.	S	Bend	trans	80.6	126.4	166.8	-164.6	0	0	0	0	117.7	K201	V199-K201 PolarHBondContact O-N 2.81Å
200	G	56.1	Low	65.9	Low	64 Å²	64	69.5 Å²	69.5	66%	0.66	39%	0.388	S	S	*	.	S	Bend	trans	76.8	20.8	157.3	0	0	0	0	0	117.2
201	K	58	Low	65.3	Low	70 Å²	70	68.6 Å²	68.6	30%	0.304	38%	0.384	S	S	.	.			trans	-141.9	90	-171.1	-67.7	-164	-172.3	-179.6	0	111.7	V199 H203 S211 Y212 K213	V199-K201 PolarHBondContact O-N 2.81Å; K201-H203 PolarHBondContact O-N 3.36Å; K201-S211 VanDerWaalsContact CD-C 3.43Å; K201-S211 WeakPolarHBondContact CD-O 3.39Å; K201-S211 PolarHBondContact NZ-O 3.02Å; K201-Y212 CarbonylContact C-O 3.58Å; K201-Y212 WeakPolarHBondContact CA-O 3.49Å; K201-Y212 WeakPolarHBondContact CB-O 3.46Å; K201-K213 HydrophobicContact CD-CG 4.22Å; K201-K213 HydrophobicContact CG-CG 3.81Å
202	P	63.2	Low	64.9	Low	102 Å²	102	67.3 Å²	67.3	66%	0.662	37%	0.372	S	S	*	.			trans	-71.7	-15	-172.6	27.4	-33.5	0	0	0	113.9
203	H	70.2	Confident	64.8	Low	57 Å²	57	73.4 Å²	73.4	26%	0.264	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	96.5	-174.5	-58.7	-60.5	0	0	0	111	K201 Y212 R215 L218	K201-H203 PolarHBondContact O-N 3.36Å; H203-Y212 PolarHBondContact N-O 3.45Å; H203-Y212 PolarHBondContact O-N 3.36Å; H203-R215 PolarHBondContact CD2-N 2.9Å; H203-R215 PolarHBondContact NE2-N 3.03Å; H203-L218 HydrophobicContact CB-CB 4.06Å; H203-L218 HydrophobicContact CB-CD2 3.8Å
204	K	67.3	Low	64.3	Low	124 Å²	124	78.3 Å²	78.3	54%	0.539	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	141.5	176.9	-56.6	-158.9	173.2	-173.1	0	111.9	R210 S211 L218	K204-R210 WeakPolarHBondContact CA-O 3.38Å; K204-S211 WeakPolarHBondContact CE-OG 3.33Å; K204-S211 WeakPolarHBondContact CG-OG 3.49Å; K204-L218 WeakPolarHBondContact O-CD2 3.27Å
205	C	69.1	Low	64.5	Low	2 Å²	2	84.8 Å²	84.8	1%	0.014	43%	0.434	C	S	.	.			trans	-80.7	119.2	171.2	-173.7	0	0	0	0	110.5	Y207 G209 R210 Y212 L218 H221 H226	C205-Y207 PolarHBondContact O-N 3.04Å; C205-G209 VanDerWaalsContact O-CA 3.27Å; C205-G209 WeakPolarHBondContact O-CA 3.4Å; C205-G209 PolarHBondContact O-N 3.5Å; C205-R210 PolarHBondContact N-O 2.85Å; C205-Y212 HydrophobicContact CB-CE2 4.41Å; C205-L218 HydrophobicContact CB-CD1 3.52Å; C205-H221 PolarHBondContact SG-NE2 3.39Å; C205-H221 VanDerWaalsContact SG-NE2 3.43Å; C205-H226 PolarHBondContact SG-CD2 3.16Å
206	A	64	Low	64.3	Low	98 Å²	98	79.3 Å²	79.3	81%	0.81	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-28.9	179.3	0	0	0	0	0	113.3
207	Y	56.8	Low	64.5	Low	142 Å²	142	79.2 Å²	79.2	56%	0.557	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-26.6	-175	-58.3	-70.3	0	0	0	114.6	C205 H226	C205-Y207 PolarHBondContact O-N 3.04Å; Y207-H226 HydrophobicContact CD2-CB 4Å; Y207-H226 HydrophobicContact CG-CB 4.48Å
208	C	60	Low	64.8	Low	23 Å²	23	79.1 Å²	79.1	16%	0.155	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-136	4.9	-176.6	75.1	0	0	0	0	115.2	C180 R210 H221 H226	C180-C208 WeakPolarHBondContact CB-O 3Å; C180-C208 PolarHBondContact SG-O 3.41Å; C180-C208 VanDerWaalsContact SG-O 3.36Å; C208-R210 PolarHBondContact O-N 3.38Å; C208-H221 PolarHBondContact SG-NE2 3.08Å; C208-H226 PolarHBondContact SG-NE2 3.37Å; C208-H226 VanDerWaalsContact SG-NE2 3.38Å
209	G	59.9	Low	65	Low	17 Å²	17	79 Å²	79	18%	0.175	42%	0.416	C	S	.	.			trans	71.6	-12.8	178.4	0	0	0	0	0	116.1	H197 C205 S211	H197-G209 PolarHBondContact ND1-O 2.74Å; C205-G209 VanDerWaalsContact O-CA 3.27Å; C205-G209 WeakPolarHBondContact O-CA 3.4Å; C205-G209 PolarHBondContact O-N 3.5Å; G209-S211 PolarHBondContact O-N 3.08Å
210	R	58	Low	65.4	Low	124 Å²	124	77.2 Å²	77.2	47%	0.468	40%	0.399	S	S	.	.			trans	-56.2	134.1	-178.5	-86.3	-175.6	163.6	163.1	-6.9	111.8	K204 C205 C208 Y212	K204-R210 WeakPolarHBondContact CA-O 3.38Å; C205-R210 PolarHBondContact N-O 2.85Å; C208-R210 PolarHBondContact O-N 3.38Å; R210-Y212 HydrophobicContact CB-CE2 3.59Å; R210-Y212 WeakPolarHBondContact CD-OH 3.41Å; R210-Y212 WeakPolarHBondContact O-CD2 3.09Å; R210-Y212 WeakPolarHBondContact O-CE2 3.49Å
211	S	67.9	Low	66	Low	5 Å²	5	74.9 Å²	74.9	4%	0.035	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	140.6	178.6	-49.6	0	0	0	0	111.5	T196 K201 K204 G209	T196-S211 VanDerWaalsContact O-CB 3.28Å; T196-S211 WeakPolarHBondContact O-CB 3.39Å; T196-S211 PolarHBondContact O-N 3.16Å; T196-S211 PolarHBondContact O-OG 2.86Å; K201-S211 VanDerWaalsContact CD-C 3.43Å; K201-S211 WeakPolarHBondContact CD-O 3.39Å; K201-S211 PolarHBondContact NZ-O 3.02Å; K204-S211 WeakPolarHBondContact CE-OG 3.33Å; K204-S211 WeakPolarHBondContact CG-OG 3.49Å; G209-S211 PolarHBondContact O-N 3.08Å
212	Y	69.9	Low	66	Low	38 Å²	38	74.2 Å²	74.2	15%	0.149	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	143.7	-175.4	-65.3	-92.5	0	0	0	111.9	K201 H203 C205 R210 Q214 S217 L218 H221	K201-Y212 CarbonylContact C-O 3.58Å; K201-Y212 WeakPolarHBondContact CA-O 3.49Å; K201-Y212 WeakPolarHBondContact CB-O 3.46Å; H203-Y212 PolarHBondContact N-O 3.45Å; H203-Y212 PolarHBondContact O-N 3.36Å; C205-Y212 HydrophobicContact CB-CE2 4.41Å; R210-Y212 HydrophobicContact CB-CE2 3.59Å; R210-Y212 WeakPolarHBondContact CD-OH 3.41Å; R210-Y212 WeakPolarHBondContact O-CD2 3.09Å; R210-Y212 WeakPolarHBondContact O-CE2 3.49Å; Y212-Q214 VanDerWaalsContact C-N 3.34Å; Y212-S217 WeakPolarHBondContact CD1-O 3.22Å; Y212-S217 WeakPolarHBondContact CE1-O 3.27Å; Y212-L218 HydrophobicContact CD2-CB 3.95Å; Y212-L218 HydrophobicContact CD2-CD1 3.77Å; Y212-L218 HydrophobicContact CD2-CG 4.46Å; Y212-L218 HydrophobicContact CE2-CD1 4.05Å; Y212-L218 HydrophobicContact CG-CB 4.02Å; Y212-H221 HydrophobicContact CE1-CB 3.89Å; Y212-H221 HydrophobicContact CE2-CB 4.25Å; Y212-H221 AromaticContact CE2-CD2 3.41Å; Y212-H221 VanDerWaalsContact CE2-CD2 3.41Å; Y212-H221 WeakPolarHBondContact CE2-CD2 3.45Å; Y212-H221 AromaticContact CE2-CG 3.96Å; Y212-H221 AromaticContact CZ-CD2 3.42Å; Y212-H221 VanDerWaalsContact CZ-CD2 3.42Å; Y212-H221 AromaticContact CZ-CG 3.47Å; Y212-H221 VanDerWaalsContact CZ-CG 3.47Å; Y212-H221 WeakPolarHBondContact OH-CB 3.36Å; Y212-H221 PolarHBondContact OH-CD2 2.92Å; Y212-H221 PolarHBondContact OH-ND1 3.22Å
213	K	67.5	Low	65.7	Low	160 Å²	160	74 Å²	74	70%	0.696	36%	0.358	S	S	*	.	S	Bend	trans	-68.8	-32.9	179.2	-72.5	-172.9	175.4	-173.2	0	112.2	K201	K201-K213 HydrophobicContact CD-CG 4.22Å; K201-K213 HydrophobicContact CG-CG 3.81Å
214	Q	68.8	Low	64.9	Low	119 Å²	119	80 Å²	80	56%	0.556	38%	0.378	S	S	*	.	S	Bend	trans	-130	150.9	-176.5	-64	179.2	-3.1	0	0	110.4	Y212 S216 S217 L218	Y212-Q214 VanDerWaalsContact C-N 3.34Å; Q214-S216 VanDerWaalsContact C-N 3.32Å; Q214-S216 WeakPolarHBondContact CB-OG 3.43Å; Q214-S216 PolarHBondContact O-N 3.45Å; Q214-S216 PolarHBondContact OE1-OG 3.16Å; Q214-S217 PolarHBondContact O-N 3.09Å; Q214-L218 PolarHBondContact O-N 3.18Å
215	R	73.1	Confident	64.2	Low	181 Å²	181	77 Å²	77	68%	0.683	37%	0.373	S	S	*	.	H	α-helix	trans	-64.6	-36.5	179.8	-163.3	178.4	-169.4	161.1	3.7	112.1	H203 S217 L218 E219	H203-R215 PolarHBondContact CD2-N 2.9Å; H203-R215 PolarHBondContact NE2-N 3.03Å; R215-S217 PolarHBondContact O-N 2.86Å; R215-L218 WeakPolarHBondContact O-CB 3.5Å; R215-L218 PolarHBondContact O-N 3.29Å; R215-E219 PolarHBondContact O-N 3.38Å
216	S	68.6	Low	63.8	Low	71 Å²	71	78 Å²	78	50%	0.497	38%	0.377	S	S	.	.	H	α-helix	trans	-54.6	-49.5	173.9	43.4	0	0	0	0	112.4	Q214 L218 E219 E220	Q214-S216 VanDerWaalsContact C-N 3.32Å; Q214-S216 WeakPolarHBondContact CB-OG 3.43Å; Q214-S216 PolarHBondContact O-N 3.45Å; Q214-S216 PolarHBondContact OE1-OG 3.16Å; S216-L218 VanDerWaalsContact C-N 3.3Å; S216-L218 PolarHBondContact O-N 3.43Å; S216-E219 PolarHBondContact O-N 3.42Å; S216-E219 VanDerWaalsContact O-N 3.16Å; S216-E220 WeakPolarHBondContact O-CB 3.49Å; S216-E220 PolarHBondContact O-N 2.96Å
217	S	70.4	Confident	63.2	Low	43 Å²	43	76.5 Å²	76.5	30%	0.301	36%	0.355	S	S	.	.	H	α-helix	trans	-68.8	-27	179.3	-44.4	0	0	0	0	113.4	Y212 Q214 R215 H221	Y212-S217 WeakPolarHBondContact CD1-O 3.22Å; Y212-S217 WeakPolarHBondContact CE1-O 3.27Å; Q214-S217 PolarHBondContact O-N 3.09Å; R215-S217 PolarHBondContact O-N 2.86Å; S217-H221 VanDerWaalsContact O-CB 3.27Å; S217-H221 WeakPolarHBondContact O-CB 3.47Å; S217-H221 PolarHBondContact O-N 3.45Å
218	L	73.6	Confident	62.6	Low	11 Å²	11	77.3 Å²	77.3	6%	0.058	36%	0.358	C	S	.	.	H	α-helix	trans	-70.1	-44.6	169.7	169.6	61.8	0	0	0	110.6	H203 K204 C205 Y212 Q214 R215 S216 H221 K222	H203-L218 HydrophobicContact CB-CB 4.06Å; H203-L218 HydrophobicContact CB-CD2 3.8Å; K204-L218 WeakPolarHBondContact O-CD2 3.27Å; C205-L218 HydrophobicContact CB-CD1 3.52Å; Y212-L218 HydrophobicContact CD2-CB 3.95Å; Y212-L218 HydrophobicContact CD2-CD1 3.77Å; Y212-L218 HydrophobicContact CD2-CG 4.46Å; Y212-L218 HydrophobicContact CE2-CD1 4.05Å; Y212-L218 HydrophobicContact CG-CB 4.02Å; Q214-L218 PolarHBondContact O-N 3.18Å; R215-L218 WeakPolarHBondContact O-CB 3.5Å; R215-L218 PolarHBondContact O-N 3.29Å; S216-L218 VanDerWaalsContact C-N 3.3Å; S216-L218 PolarHBondContact O-N 3.43Å; L218-H221 WeakPolarHBondContact O-CB 3.47Å; L218-H221 PolarHBondContact O-N 3.47Å; L218-K222 HydrophobicContact CD1-CG 4.32Å; L218-K222 HydrophobicContact CG-CD 4.49Å; L218-K222 WeakPolarHBondContact O-CG 3.16Å; L218-K222 PolarHBondContact O-N 3.35Å
219	E	66.6	Low	61.7	Low	71 Å²	71	81.4 Å²	81.4	33%	0.332	38%	0.378	S	S	.	.	H	α-helix	trans	-68.9	-44.6	-177.9	-137.9	62.8	-151.9	0	0	111.4	R215 S216 H221 K222 E223	R215-E219 PolarHBondContact O-N 3.38Å; S216-E219 PolarHBondContact O-N 3.42Å; S216-E219 VanDerWaalsContact O-N 3.16Å; E219-H221 PolarHBondContact O-N 3.09Å; E219-K222 CarbonylContact O-C 3.4Å; E219-K222 WeakPolarHBondContact O-CB 3.45Å; E219-K222 PolarHBondContact O-N 3.29Å; E219-K222 VanDerWaalsContact OE1-CD 3.3Å; E219-K222 WeakPolarHBondContact OE1-CD 3.45Å; E219-K222 IonicContact OE1-NZ 3.63Å; E219-K222 PolarHBondContact OE1-NZ 3.23Å; E219-K222 IonicContact OE2-NZ 3.86Å; E219-K222 PolarHBondContact OE2-NZ 2.7Å; E219-E223 WeakPolarHBondContact O-CB 3.45Å; E219-E223 WeakPolarHBondContact O-CG 3.3Å; E219-E223 PolarHBondContact O-N 3.06Å
220	E	64.6	Low	60.9	Low	99 Å²	99	85.8 Å²	85.8	46%	0.463	39%	0.394	S	S	.	.	H	α-helix	trans	-56.7	-38.2	171.2	-177	-174.6	-173	0	0	111.9	S216 R224	S216-E220 WeakPolarHBondContact O-CB 3.49Å; S216-E220 PolarHBondContact O-N 2.96Å; E220-R224 VanDerWaalsContact O-CB 3.25Å; E220-R224 WeakPolarHBondContact O-CB 3.35Å; E220-R224 PolarHBondContact O-N 2.75Å; E220-R224 IonicContact OE1-CZ 2.75Å; E220-R224 IonicContact OE1-NH1 3.16Å; E220-R224 PolarHBondContact OE1-NH1 3.5Å; E220-R224 IonicContact OE1-NH2 3.53Å
221	H	68	Low	60	Low	16 Å²	16	82.7 Å²	82.7	7%	0.074	39%	0.391	C	S	.	.	H	α-helix	trans	-67.7	-41.5	174.2	160.9	55.6	0	0	0	112.5	C205 C208 Y212 S217 L218 E219 C225 H226	C205-H221 PolarHBondContact SG-NE2 3.39Å; C205-H221 VanDerWaalsContact SG-NE2 3.43Å; C208-H221 PolarHBondContact SG-NE2 3.08Å; Y212-H221 HydrophobicContact CE1-CB 3.89Å; Y212-H221 HydrophobicContact CE2-CB 4.25Å; Y212-H221 AromaticContact CE2-CD2 3.41Å; Y212-H221 VanDerWaalsContact CE2-CD2 3.41Å; Y212-H221 WeakPolarHBondContact CE2-CD2 3.45Å; Y212-H221 AromaticContact CE2-CG 3.96Å; Y212-H221 AromaticContact CZ-CD2 3.42Å; Y212-H221 VanDerWaalsContact CZ-CD2 3.42Å; Y212-H221 AromaticContact CZ-CG 3.47Å; Y212-H221 VanDerWaalsContact CZ-CG 3.47Å; Y212-H221 WeakPolarHBondContact OH-CB 3.36Å; Y212-H221 PolarHBondContact OH-CD2 2.92Å; Y212-H221 PolarHBondContact OH-ND1 3.22Å; S217-H221 VanDerWaalsContact O-CB 3.27Å; S217-H221 WeakPolarHBondContact O-CB 3.47Å; S217-H221 PolarHBondContact O-N 3.45Å; L218-H221 WeakPolarHBondContact O-CB 3.47Å; L218-H221 PolarHBondContact O-N 3.47Å; E219-H221 PolarHBondContact O-N 3.09Å; H221-C225 PolarHBondContact ND1-SG 3.16Å; H221-C225 VanDerWaalsContact ND1-SG 3.42Å; H221-C225 WeakPolarHBondContact O-CA 3.39Å; H221-C225 WeakPolarHBondContact O-CB 3.25Å; H221-C225 PolarHBondContact O-N 3.23Å; H221-H226 AromaticContact CE1-CD2 3.62Å; H221-H226 AromaticContact CE1-NE2 3.3Å; H221-H226 PolarHBondContact CE1-NE2 2.84Å; H221-H226 VanDerWaalsContact CE1-NE2 3.3Å; H221-H226 AromaticContact NE2-CD2 3.47Å; H221-H226 PolarHBondContact NE2-CD2 2.89Å; H221-H226 AromaticContact NE2-NE2 3.23Å; H221-H226 PolarHBondContact NE2-NE2 3.39Å
222	K	59.2	Low	58.5	Low	55 Å²	55	85.6 Å²	85.6	24%	0.239	41%	0.405	C	S	.	.	H	α-helix	trans	-62.8	-49.2	172.9	-69	166.7	179.1	169.6	0	110.1	L218 E219 R224 C225 H226 N227	L218-K222 HydrophobicContact CD1-CG 4.32Å; L218-K222 HydrophobicContact CG-CD 4.49Å; L218-K222 WeakPolarHBondContact O-CG 3.16Å; L218-K222 PolarHBondContact O-N 3.35Å; E219-K222 CarbonylContact O-C 3.4Å; E219-K222 WeakPolarHBondContact O-CB 3.45Å; E219-K222 PolarHBondContact O-N 3.29Å; E219-K222 VanDerWaalsContact OE1-CD 3.3Å; E219-K222 WeakPolarHBondContact OE1-CD 3.45Å; E219-K222 IonicContact OE1-NZ 3.63Å; E219-K222 PolarHBondContact OE1-NZ 3.23Å; E219-K222 IonicContact OE2-NZ 3.86Å; E219-K222 PolarHBondContact OE2-NZ 2.7Å; K222-R224 VanDerWaalsContact C-N 3.29Å; K222-R224 PolarHBondContact O-N 3.4Å; K222-C225 PolarHBondContact O-N 3.3Å; K222-H226 CarbonylContact O-C 3.58Å; K222-H226 WeakPolarHBondContact O-CA 3.46Å; K222-H226 PolarHBondContact O-N 3.24Å; K222-N227 PolarHBondContact O-N 3.23Å
223	E	57	Low	57.2	Low	98 Å²	98	85.7 Å²	85.7	46%	0.458	42%	0.417	S	S	.	.	H	α-helix	trans	-57	-39.7	179.5	-74.7	174.5	-176.5	0	0	112.3	E219 N227	E219-E223 WeakPolarHBondContact O-CB 3.45Å; E219-E223 WeakPolarHBondContact O-CG 3.3Å; E219-E223 PolarHBondContact O-N 3.06Å; E223-N227 WeakPolarHBondContact O-CB 3.42Å
224	R	52.5	Low	55.9	Low	183 Å²	183	82 Å²	82	69%	0.691	40%	0.404	S	S	*	.	H	α-helix	trans	-90.7	-23.8	-179.1	-168.1	177.8	-88.2	116.8	-14.2	114.7	E220 K222	E220-R224 VanDerWaalsContact O-CB 3.25Å; E220-R224 WeakPolarHBondContact O-CB 3.35Å; E220-R224 PolarHBondContact O-N 2.75Å; E220-R224 IonicContact OE1-CZ 2.75Å; E220-R224 IonicContact OE1-NH1 3.16Å; E220-R224 PolarHBondContact OE1-NH1 3.5Å; E220-R224 IonicContact OE1-NH2 3.53Å; K222-R224 VanDerWaalsContact C-N 3.29Å; K222-R224 PolarHBondContact O-N 3.4Å
225	C	52.4	Low	54.2	Low	62 Å²	62	81.6 Å²	81.6	42%	0.419	40%	0.403	S	S	.	.	H	α-helix	trans	-121.6	-18.3	-172.7	-54.4	0	0	0	0	115.7	H221 K222	H221-C225 PolarHBondContact ND1-SG 3.16Å; H221-C225 VanDerWaalsContact ND1-SG 3.42Å; H221-C225 WeakPolarHBondContact O-CA 3.39Å; H221-C225 WeakPolarHBondContact O-CB 3.25Å; H221-C225 PolarHBondContact O-N 3.23Å; K222-C225 PolarHBondContact O-N 3.3Å
226	H	60.5	Low	52.4	Low	21 Å²	21	77.8 Å²	77.8	10%	0.097	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.3	-15.6	-175.3	-63	-54.4	0	0	0	113.9	C205 Y207 C208 H221 K222 Y228 L229 Q230	C205-H226 PolarHBondContact SG-CD2 3.16Å; Y207-H226 HydrophobicContact CD2-CB 4Å; Y207-H226 HydrophobicContact CG-CB 4.48Å; C208-H226 PolarHBondContact SG-NE2 3.37Å; C208-H226 VanDerWaalsContact SG-NE2 3.38Å; H221-H226 AromaticContact CE1-CD2 3.62Å; H221-H226 AromaticContact CE1-NE2 3.3Å; H221-H226 PolarHBondContact CE1-NE2 2.84Å; H221-H226 VanDerWaalsContact CE1-NE2 3.3Å; H221-H226 AromaticContact NE2-CD2 3.47Å; H221-H226 PolarHBondContact NE2-CD2 2.89Å; H221-H226 AromaticContact NE2-NE2 3.23Å; H221-H226 PolarHBondContact NE2-NE2 3.39Å; K222-H226 CarbonylContact O-C 3.58Å; K222-H226 WeakPolarHBondContact O-CA 3.46Å; K222-H226 PolarHBondContact O-N 3.24Å; H226-Y228 PolarHBondContact O-N 2.71Å; H226-L229 WeakPolarHBondContact O-CA 3.43Å; H226-L229 WeakPolarHBondContact O-CB 3.36Å; H226-L229 PolarHBondContact O-N 3.16Å; H226-Q230 PolarHBondContact O-N 2.86Å
227	N	51.5	Low	50.8	Low	68 Å²	68	76.9 Å²	76.9	36%	0.364	39%	0.39	S	S	.	.	H	α-helix	trans	-59.2	-31.6	170.9	-152	-1.1	0	0	0	110.9	K222 E223 Q230 C231	K222-N227 PolarHBondContact O-N 3.23Å; E223-N227 WeakPolarHBondContact O-CB 3.42Å; N227-Q230 CarbonylContact O-C 3.56Å; N227-Q230 PolarHBondContact O-N 3.45Å; N227-C231 VanDerWaalsContact O-CB 3.27Å; N227-C231 WeakPolarHBondContact O-CB 3.46Å; N227-C231 PolarHBondContact O-N 3.03Å; N227-C231 PolarHBondContact O-SG 3.26Å
228	Y	43.7	Very low	49.2	Very low	158 Å²	158	78.4 Å²	78.4	62%	0.62	39%	0.394	S	S	*	.	H	α-helix	trans	-60.3	-43.2	169	-177.4	-104.4	0	0	0	112.8	H226 Q230 C231 M232	H226-Y228 PolarHBondContact O-N 2.71Å; Y228-Q230 VanDerWaalsContact C-N 3.34Å; Y228-Q230 PolarHBondContact O-N 2.77Å; Y228-C231 PolarHBondContact O-N 2.86Å; Y228-M232 HydrophobicContact CD1-CG 4.22Å; Y228-M232 HydrophobicContact CE1-CG 3.84Å; Y228-M232 HydrophobicContact CE1-SD 4.47Å; Y228-M232 HydrophobicContact CE2-CG 4.16Å; Y228-M232 HydrophobicContact CE2-SD 4.23Å; Y228-M232 WeakPolarHBondContact O-CB 3.22Å; Y228-M232 WeakPolarHBondContact O-CG 3.39Å; Y228-M232 PolarHBondContact O-N 2.89Å
229	L	41.3	Very low	47.3	Very low	110 Å²	110	84.9 Å²	84.9	58%	0.576	42%	0.418	S	S	*	.	H	α-helix	trans	-66.9	-35.4	174.1	-80	120.8	0	0	0	112.3	H226 M232 G233	H226-L229 WeakPolarHBondContact O-CA 3.43Å; H226-L229 WeakPolarHBondContact O-CB 3.36Å; H226-L229 PolarHBondContact O-N 3.16Å; L229-M232 PolarHBondContact O-N 2.75Å; L229-G233 PolarHBondContact O-N 3.04Å
230	Q	44.4	Very low	45.8	Very low	109 Å²	109	84.8 Å²	84.8	51%	0.509	42%	0.423	S	S	.	.	H	α-helix	trans	-70.9	-39.2	177	-161.8	164.6	-4.3	0	0	111.5	H226 N227 Y228 G233 L234	H226-Q230 PolarHBondContact O-N 2.86Å; N227-Q230 CarbonylContact O-C 3.56Å; N227-Q230 PolarHBondContact O-N 3.45Å; Y228-Q230 VanDerWaalsContact C-N 3.34Å; Y228-Q230 PolarHBondContact O-N 2.77Å; Q230-G233 PolarHBondContact O-N 3.5Å; Q230-L234 WeakPolarHBondContact O-CB 3.04Å; Q230-L234 VanDerWaalsContact O-CG 3.22Å; Q230-L234 WeakPolarHBondContact O-CG 3.46Å; Q230-L234 PolarHBondContact O-N 3.04Å
231	C	37.5	Very low	44.4	Very low	58 Å²	58	82.9 Å²	82.9	39%	0.392	42%	0.418	S	S	.	.	H	α-helix	trans	-66.7	-39	170.9	-72.8	0	0	0	0	112.5	N227 Y228 L234 Q235	N227-C231 VanDerWaalsContact O-CB 3.27Å; N227-C231 WeakPolarHBondContact O-CB 3.46Å; N227-C231 PolarHBondContact O-N 3.03Å; N227-C231 PolarHBondContact O-SG 3.26Å; Y228-C231 PolarHBondContact O-N 2.86Å; C231-L234 CarbonylContact O-C 3.58Å; C231-L234 PolarHBondContact O-N 3.32Å; C231-Q235 WeakPolarHBondContact O-CB 3.37Å; C231-Q235 WeakPolarHBondContact O-CG 3.42Å; C231-Q235 PolarHBondContact O-N 2.76Å
232	M	36.9	Very low	42.9	Very low	67 Å²	67	86 Å²	86	33%	0.33	44%	0.438	S	S	.	.	H	α-helix	trans	-66.2	-39	172.8	-72.7	-64.6	-61.7	0	0	111.5	Y228 L229 Q235 N236	Y228-M232 HydrophobicContact CD1-CG 4.22Å; Y228-M232 HydrophobicContact CE1-CG 3.84Å; Y228-M232 HydrophobicContact CE1-SD 4.47Å; Y228-M232 HydrophobicContact CE2-CG 4.16Å; Y228-M232 HydrophobicContact CE2-SD 4.23Å; Y228-M232 WeakPolarHBondContact O-CB 3.22Å; Y228-M232 WeakPolarHBondContact O-CG 3.39Å; Y228-M232 PolarHBondContact O-N 2.89Å; L229-M232 PolarHBondContact O-N 2.75Å; M232-Q235 PolarHBondContact O-N 2.99Å; M232-Q235 PolarHBondContact SD-OE1 3.45Å; M232-Q235 VanDerWaalsContact SD-OE1 3.37Å; M232-N236 WeakPolarHBondContact O-CB 3.37Å; M232-N236 VanDerWaalsContact O-CG 3.3Å; M232-N236 PolarHBondContact O-N 3.27Å
233	G	44	Very low	41.7	Very low	40 Å²	40	88.5 Å²	88.5	41%	0.412	45%	0.448	S	S	.	.	H	α-helix	trans	-64.5	-40.2	172.3	0	0	0	0	0	112.7	L229 Q230 S237	L229-G233 PolarHBondContact O-N 3.04Å; Q230-G233 PolarHBondContact O-N 3.5Å; G233-S237 WeakPolarHBondContact O-CB 3.32Å; G233-S237 PolarHBondContact O-N 3.31Å
234	L	39.9	Very low	40.9	Very low	81 Å²	81	89.1 Å²	89.1	42%	0.424	45%	0.451	S	S	.	.	H	α-helix	trans	-68.9	-37.9	173.4	-73.4	166	0	0	0	112.1	Q230 C231 S237 I238	Q230-L234 WeakPolarHBondContact O-CB 3.04Å; Q230-L234 VanDerWaalsContact O-CG 3.22Å; Q230-L234 WeakPolarHBondContact O-CG 3.46Å; Q230-L234 PolarHBondContact O-N 3.04Å; C231-L234 CarbonylContact O-C 3.58Å; C231-L234 PolarHBondContact O-N 3.32Å; L234-S237 PolarHBondContact O-N 2.79Å; L234-I238 VanDerWaalsContact O-CB 3.31Å; L234-I238 WeakPolarHBondContact O-CB 3.27Å; L234-I238 WeakPolarHBondContact O-CD1 3.37Å; L234-I238 WeakPolarHBondContact O-CG1 3.22Å; L234-I238 PolarHBondContact O-N 3.43Å
235	Q	32.5	Very low	40.4	Very low	112 Å²	112	85 Å²	85	52%	0.523	44%	0.44	S	S	.	.	H	α-helix	trans	-65.4	-42.9	174.1	-83	-179.8	-29.9	0	0	111.1	C231 M232 I238 Y239	C231-Q235 WeakPolarHBondContact O-CB 3.37Å; C231-Q235 WeakPolarHBondContact O-CG 3.42Å; C231-Q235 PolarHBondContact O-N 2.76Å; M232-Q235 PolarHBondContact O-N 2.99Å; M232-Q235 PolarHBondContact SD-OE1 3.45Å; M232-Q235 VanDerWaalsContact SD-OE1 3.37Å; Q235-I238 PolarHBondContact O-N 3.13Å; Q235-Y239 VanDerWaalsContact O-CB 3.24Å; Q235-Y239 WeakPolarHBondContact O-CB 3.05Å; Q235-Y239 PolarHBondContact O-N 3.35Å
236	N	35.2	Very low	39.9	Very low	101 Å²	101	84.7 Å²	84.7	54%	0.54	44%	0.438	S	S	.	.	H	α-helix	trans	-62.7	-42.5	173.3	-73.8	-12.6	0	0	0	111.3	M232 Y239 T240	M232-N236 WeakPolarHBondContact O-CB 3.37Å; M232-N236 VanDerWaalsContact O-CG 3.3Å; M232-N236 PolarHBondContact O-N 3.27Å; N236-Y239 PolarHBondContact O-N 2.86Å; N236-T240 WeakPolarHBondContact O-CG2 3.35Å; N236-T240 PolarHBondContact O-N 3.01Å; N236-T240 PolarHBondContact O-OG1 2.82Å
237	S	35	Very low	39.1	Very low	52 Å²	52	87.4 Å²	87.4	36%	0.364	45%	0.454	S	S	.	.	H	α-helix	trans	-67.4	-35.6	175.8	175	0	0	0	0	113.3	G233 L234 T240 V241	G233-S237 WeakPolarHBondContact O-CB 3.32Å; G233-S237 PolarHBondContact O-N 3.31Å; L234-S237 PolarHBondContact O-N 2.79Å; S237-T240 WeakPolarHBondContact CA-OG1 3.49Å; S237-T240 PolarHBondContact O-OG1 3.22Å; S237-V241 WeakPolarHBondContact O-CB 3.37Å; S237-V241 VanDerWaalsContact O-CG2 3.27Å; S237-V241 WeakPolarHBondContact O-CG2 3.34Å; S237-V241 PolarHBondContact O-N 3.27Å; S237-V241 VanDerWaalsContact O-N 3.08Å
238	I	36.3	Very low	38.7	Very low	75 Å²	75	89.8 Å²	89.8	39%	0.385	46%	0.463	S	S	.	.	H	α-helix	trans	-69.3	-42.1	173.2	-71.6	161.6	0	0	0	109.4	L234 Q235 V241 V242	L234-I238 VanDerWaalsContact O-CB 3.31Å; L234-I238 WeakPolarHBondContact O-CB 3.27Å; L234-I238 WeakPolarHBondContact O-CD1 3.37Å; L234-I238 WeakPolarHBondContact O-CG1 3.22Å; L234-I238 PolarHBondContact O-N 3.43Å; Q235-I238 PolarHBondContact O-N 3.13Å; I238-V241 PolarHBondContact O-N 2.9Å; I238-V242 HydrophobicContact CG2-CG2 4.14Å; I238-V242 VanDerWaalsContact O-CB 3.3Å; I238-V242 WeakPolarHBondContact O-CB 3.13Å; I238-V242 VanDerWaalsContact O-CG2 3.23Å; I238-V242 WeakPolarHBondContact O-CG2 3.31Å; I238-V242 PolarHBondContact O-N 3.19Å
239	Y	33.8	Very low	38.7	Very low	147 Å²	147	86.4 Å²	86.4	58%	0.576	46%	0.455	S	S	*	.	H	α-helix	trans	-64	-40.6	176.9	-178.6	-96.4	0	0	0	112.1	Q235 N236 K243	Q235-Y239 VanDerWaalsContact O-CB 3.24Å; Q235-Y239 WeakPolarHBondContact O-CB 3.05Å; Q235-Y239 PolarHBondContact O-N 3.35Å; N236-Y239 PolarHBondContact O-N 2.86Å; Y239-K243 HydrophobicContact CE1-CD 4.06Å; Y239-K243 WeakPolarHBondContact O-CB 3.15Å; Y239-K243 PolarHBondContact O-N 3.5Å
240	T	35.7	Very low	38.9	Very low	68 Å²	68	86.9 Å²	86.9	42%	0.417	46%	0.455	S	S	.	.	H	α-helix	trans	-65.9	-44.2	173.9	54.4	0	0	0	0	111.8	N236 S237 K243 E244	N236-T240 WeakPolarHBondContact O-CG2 3.35Å; N236-T240 PolarHBondContact O-N 3.01Å; N236-T240 PolarHBondContact O-OG1 2.82Å; S237-T240 WeakPolarHBondContact CA-OG1 3.49Å; S237-T240 PolarHBondContact O-OG1 3.22Å; T240-K243 PolarHBondContact O-N 3.12Å; T240-E244 WeakPolarHBondContact O-CB 3.33Å; T240-E244 VanDerWaalsContact O-CG 3.3Å; T240-E244 WeakPolarHBondContact O-CG 3.37Å; T240-E244 PolarHBondContact O-N 2.9Å
241	V	36	Very low	38.9	Very low	60 Å²	60	89.2 Å²	89.2	36%	0.364	47%	0.466	S	S	.	.	H	α-helix	trans	-64.3	-44.8	177.3	170.4	0	0	0	0	111.5	S237 I238 K243 E244 E245	S237-V241 WeakPolarHBondContact O-CB 3.37Å; S237-V241 VanDerWaalsContact O-CG2 3.27Å; S237-V241 WeakPolarHBondContact O-CG2 3.34Å; S237-V241 PolarHBondContact O-N 3.27Å; S237-V241 VanDerWaalsContact O-N 3.08Å; I238-V241 PolarHBondContact O-N 2.9Å; V241-K243 VanDerWaalsContact C-N 3.29Å; V241-K243 PolarHBondContact O-N 2.82Å; V241-E244 PolarHBondContact O-N 3.37Å; V241-E245 HydrophobicContact CG1-CG 4.46Å; V241-E245 WeakPolarHBondContact O-CB 3.34Å; V241-E245 WeakPolarHBondContact O-CG 3.19Å; V241-E245 PolarHBondContact O-N 3.4Å
242	V	34.9	Very low	39.4	Very low	81 Å²	81	92.9 Å²	92.9	49%	0.491	47%	0.471	S	S	.	.	H	α-helix	trans	-64.3	-34.4	176.5	169.3	0	0	0	0	111.3	I238 S246	I238-V242 HydrophobicContact CG2-CG2 4.14Å; I238-V242 VanDerWaalsContact O-CB 3.3Å; I238-V242 WeakPolarHBondContact O-CB 3.13Å; I238-V242 VanDerWaalsContact O-CG2 3.23Å; I238-V242 WeakPolarHBondContact O-CG2 3.31Å; I238-V242 PolarHBondContact O-N 3.19Å; V242-S246 VanDerWaalsContact O-CB 3.27Å; V242-S246 WeakPolarHBondContact O-CB 3.33Å; V242-S246 PolarHBondContact O-N 3.09Å
243	K	35.7	Very low	39.7	Very low	107 Å²	107	97.1 Å²	97.1	47%	0.465	49%	0.49	S	S	.	.	H	α-helix	trans	-72.8	-37.7	175.3	-171.5	169.3	-174.6	169.8	0	112.3	Y239 T240 V241 S246 N247	Y239-K243 HydrophobicContact CE1-CD 4.06Å; Y239-K243 WeakPolarHBondContact O-CB 3.15Å; Y239-K243 PolarHBondContact O-N 3.5Å; T240-K243 PolarHBondContact O-N 3.12Å; V241-K243 VanDerWaalsContact C-N 3.29Å; V241-K243 PolarHBondContact O-N 2.82Å; K243-S246 PolarHBondContact O-N 2.93Å; K243-N247 WeakPolarHBondContact O-CB 3.33Å; K243-N247 PolarHBondContact O-N 2.74Å; K243-N247 PolarHBondContact O-OD1 3.44Å
244	E	39.7	Very low	39.6	Very low	111 Å²	111	102.7 Å²	102.7	52%	0.519	51%	0.51	S	S	.	.	H	α-helix	trans	-66.5	-41.3	172.2	-74.6	167.2	-169	0	0	111.6	T240 V241 Q248	T240-E244 WeakPolarHBondContact O-CB 3.33Å; T240-E244 VanDerWaalsContact O-CG 3.3Å; T240-E244 WeakPolarHBondContact O-CG 3.37Å; T240-E244 PolarHBondContact O-N 2.9Å; V241-E244 PolarHBondContact O-N 3.37Å; E244-Q248 WeakPolarHBondContact O-CB 3.47Å; E244-Q248 VanDerWaalsContact O-CG 3.23Å; E244-Q248 WeakPolarHBondContact O-CG 3.27Å; E244-Q248 PolarHBondContact O-N 3.24Å; E244-Q248 PolarHBondContact O-NE2 2.81Å
245	E	40.8	Very low	39.8	Very low	96 Å²	96	105.7 Å²	105.7	45%	0.449	53%	0.526	S	S	.	.	H	α-helix	trans	-68.5	-37.3	173.8	-73.5	-173.3	148.8	0	0	112.1	V241 Q248 N249	V241-E245 HydrophobicContact CG1-CG 4.46Å; V241-E245 WeakPolarHBondContact O-CB 3.34Å; V241-E245 WeakPolarHBondContact O-CG 3.19Å; V241-E245 PolarHBondContact O-N 3.4Å; E245-Q248 PolarHBondContact O-N 3.49Å; E245-N249 WeakPolarHBondContact O-CB 3.16Å; E245-N249 PolarHBondContact O-N 3.1Å
246	S	42.6	Very low	40.4	Very low	56 Å²	56	105.6 Å²	105.6	39%	0.392	54%	0.538	S	S	.	.	H	α-helix	trans	-61.8	-49.4	172.8	-165.3	0	0	0	0	111.1	V242 K243 Q248 N249 E250	V242-S246 VanDerWaalsContact O-CB 3.27Å; V242-S246 WeakPolarHBondContact O-CB 3.33Å; V242-S246 PolarHBondContact O-N 3.09Å; K243-S246 PolarHBondContact O-N 2.93Å; S246-Q248 PolarHBondContact O-N 3.35Å; S246-N249 PolarHBondContact O-N 3.28Å; S246-N249 VanDerWaalsContact O-N 3.09Å; S246-E250 WeakPolarHBondContact O-CG 3.44Å; S246-E250 PolarHBondContact O-N 3.31Å
247	N	44	Very low	40.7	Very low	79 Å²	79	108.8 Å²	108.8	42%	0.422	55%	0.55	S	S	.	.	H	α-helix	trans	-62.3	-30.7	176.8	-66.4	-2.1	0	0	0	112.3	K243 Q251	K243-N247 WeakPolarHBondContact O-CB 3.33Å; K243-N247 PolarHBondContact O-N 2.74Å; K243-N247 PolarHBondContact O-OD1 3.44Å; N247-Q251 WeakPolarHBondContact O-CG 3.27Å; N247-Q251 PolarHBondContact O-N 3.05Å
248	Q	43.3	Very low	41.3	Very low	117 Å²	117	112.9 Å²	112.9	55%	0.547	57%	0.573	S	S	.	*	H	α-helix	trans	-78.4	-30.3	174.3	-74.3	171	40.8	0	0	112.9	E244 E245 S246 Q251 R252	E244-Q248 WeakPolarHBondContact O-CB 3.47Å; E244-Q248 VanDerWaalsContact O-CG 3.23Å; E244-Q248 WeakPolarHBondContact O-CG 3.27Å; E244-Q248 PolarHBondContact O-N 3.24Å; E244-Q248 PolarHBondContact O-NE2 2.81Å; E245-Q248 PolarHBondContact O-N 3.49Å; S246-Q248 PolarHBondContact O-N 3.35Å; Q248-Q251 PolarHBondContact O-N 3.44Å; Q248-R252 PolarHBondContact O-N 2.67Å
249	N	43.2	Very low	41.8	Very low	87 Å²	87	112.4 Å²	112.4	47%	0.465	59%	0.586	S	S	.	*	H	α-helix	trans	-72.2	-41.4	173	-105.4	21.4	0	0	0	111.6	E245 S246 Q251 R252 E253	E245-N249 WeakPolarHBondContact O-CB 3.16Å; E245-N249 PolarHBondContact O-N 3.1Å; S246-N249 PolarHBondContact O-N 3.28Å; S246-N249 VanDerWaalsContact O-N 3.09Å; N249-Q251 PolarHBondContact O-N 3.45Å; N249-R252 CarbonylContact O-C 3.35Å; N249-R252 WeakPolarHBondContact O-CA 3.48Å; N249-R252 WeakPolarHBondContact O-CB 3.47Å; N249-R252 PolarHBondContact O-N 2.82Å; N249-E253 PolarHBondContact O-N 3.36Å
250	E	46.4	Very low	42.4	Very low	121 Å²	121	109.4 Å²	109.4	57%	0.565	59%	0.587	S	S	*	*	H	α-helix	trans	-57.4	-32.8	171.9	-73	169.3	-162.3	0	0	111.5	S246 R252	S246-E250 WeakPolarHBondContact O-CG 3.44Å; S246-E250 PolarHBondContact O-N 3.31Å; E250-R252 VanDerWaalsContact C-N 3.34Å
251	Q	44.1	Very low	42.9	Very low	158 Å²	158	109.2 Å²	109.2	74%	0.738	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-10.3	171.7	-71	179.5	-1.8	0	0	114.7	N247 Q248 N249	N247-Q251 WeakPolarHBondContact O-CG 3.27Å; N247-Q251 PolarHBondContact O-N 3.05Å; Q248-Q251 PolarHBondContact O-N 3.44Å; N249-Q251 PolarHBondContact O-N 3.45Å
252	R	46.6	Very low	43.2	Very low	134 Å²	134	115.9 Å²	115.9	51%	0.506	60%	0.602	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.6	-24	177.7	-108	-171.1	-178.9	-127.5	3.6	113.8	Q248 N249 E250 D254 L255 D261	Q248-R252 PolarHBondContact O-N 2.67Å; N249-R252 CarbonylContact O-C 3.35Å; N249-R252 WeakPolarHBondContact O-CA 3.48Å; N249-R252 WeakPolarHBondContact O-CB 3.47Å; N249-R252 PolarHBondContact O-N 2.82Å; E250-R252 VanDerWaalsContact C-N 3.34Å; R252-D254 PolarHBondContact O-N 3.35Å; R252-L255 PolarHBondContact O-N 2.79Å; R252-D261 IonicContact CZ-OD1 2.91Å; R252-D261 IonicContact CZ-OD2 3.5Å; R252-D261 IonicContact NH1-OD1 2.68Å; R252-D261 PolarHBondContact NH1-OD1 3.4Å; R252-D261 IonicContact NH1-OD2 3.25Å; R252-D261 PolarHBondContact NH1-OD2 2.9Å
253	E	43.9	Very low	43.7	Very low	156 Å²	156	115.1 Å²	115.1	73%	0.729	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	-16.4	-178.8	-75.5	-176.9	168.8	0	0	113.5	N249 L255	N249-E253 PolarHBondContact O-N 3.36Å; E253-L255 PolarHBondContact O-N 3.34Å
254	D	41.2	Very low	44.3	Very low	157 Å²	157	113.6 Å²	113.6	84%	0.84	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	-8.9	166.8	-95.2	-14.7	0	0	0	114.1	R252	R252-D254 PolarHBondContact O-N 3.35Å
255	L	45.2	Very low	44.6	Very low	144 Å²	144	112.1 Å²	112.1	75%	0.754	60%	0.599	S	S	*	*	S	Bend	trans	-121.1	82.7	179.8	-78.8	163.2	0	0	0	111.2	R252 E253 Q257	R252-L255 PolarHBondContact O-N 2.79Å; E253-L255 PolarHBondContact O-N 3.34Å; L255-Q257 PolarHBondContact O-N 2.95Å
256	S	45.8	Very low	44.8	Very low	111 Å²	111	112.7 Å²	112.7	78%	0.776	61%	0.605	S	S	*	*			trans	-63.4	98.7	-179.1	62.4	0	0	0	0	113.5
257	Q	40.9	Very low	44.9	Very low	168 Å²	168	114.4 Å²	114.4	79%	0.785	61%	0.61	S	S	*	*			trans	-147.3	103	157.8	-159.3	64.9	54.3	0	0	111.6	L255	L255-Q257 PolarHBondContact O-N 2.95Å
258	T	47	Very low	45	Very low	138 Å²	138	117.2 Å²	117.2	85%	0.847	61%	0.614	S	S	*	*			trans	-81.1	143.1	-171.7	44.7	0	0	0	0	113.3
259	G	46.5	Very low	45	Very low	64 Å²	64	116.9 Å²	116.9	66%	0.66	62%	0.615	S	S	*	*	S	Bend	trans	126.2	-54.2	166.8	0	0	0	0	0	115.1
260	S	47	Very low	45	Very low	85 Å²	85	115.4 Å²	115.4	59%	0.594	62%	0.615	S	S	*	*	H	α-helix	trans	-71.5	-35.4	-170.6	-172.7	0	0	0	0	114.1	R262 A263	S260-R262 PolarHBondContact O-N 3.35Å; S260-A263 PolarHBondContact O-N 2.88Å
261	D	46.3	Very low	44.8	Very low	63 Å²	63	113.8 Å²	113.8	34%	0.337	61%	0.611	S	S	.	*	H	α-helix	trans	-70.7	-29.1	-171.8	-74.8	-26.2	0	0	0	114.2	R252 A263 L264 V265	R252-D261 IonicContact CZ-OD1 2.91Å; R252-D261 IonicContact CZ-OD2 3.5Å; R252-D261 IonicContact NH1-OD1 2.68Å; R252-D261 PolarHBondContact NH1-OD1 3.4Å; R252-D261 IonicContact NH1-OD2 3.25Å; R252-D261 PolarHBondContact NH1-OD2 2.9Å; D261-A263 VanDerWaalsContact C-N 3.28Å; D261-A263 PolarHBondContact O-N 2.72Å; D261-L264 PolarHBondContact O-N 3.34Å; D261-L264 VanDerWaalsContact O-N 3.15Å; D261-V265 WeakPolarHBondContact O-CG2 3.48Å; D261-V265 PolarHBondContact O-N 2.86Å
262	R	42.6	Very low	44.6	Very low	200 Å²	200	110.2 Å²	110.2	76%	0.755	60%	0.597	S	S	*	*	H	α-helix	trans	-65	-33.4	-178.9	-164.6	175.7	-177.4	110.8	-3.5	112	S260 L266	S260-R262 PolarHBondContact O-N 3.35Å; R262-L266 WeakPolarHBondContact O-CD1 3.23Å; R262-L266 VanDerWaalsContact O-CG 3.3Å; R262-L266 WeakPolarHBondContact O-CG 3.3Å; R262-L266 PolarHBondContact O-N 3.37Å
263	A	45.1	Very low	44.4	Very low	66 Å²	66	107.5 Å²	107.5	55%	0.545	60%	0.595	S	S	.	*	H	α-helix	trans	-71.1	-40.3	173.8	0	0	0	0	0	111.9	S260 D261 L266 D267	S260-A263 PolarHBondContact O-N 2.88Å; D261-A263 VanDerWaalsContact C-N 3.28Å; D261-A263 PolarHBondContact O-N 2.72Å; A263-L266 PolarHBondContact O-N 3.02Å; A263-D267 WeakPolarHBondContact O-CB 3.24Å; A263-D267 PolarHBondContact O-N 2.77Å
264	L	48.2	Very low	44.1	Very low	74 Å²	74	102.7 Å²	102.7	39%	0.387	58%	0.582	S	S	.	*	H	α-helix	trans	-67	-36.8	178.9	-70.1	171.3	0	0	0	112.9	D261 R268	D261-L264 PolarHBondContact O-N 3.34Å; D261-L264 VanDerWaalsContact O-N 3.15Å; L264-R268 WeakPolarHBondContact O-CB 3.4Å; L264-R268 WeakPolarHBondContact O-CG 3.48Å; L264-R268 PolarHBondContact O-N 3.31Å
265	V	45.7	Very low	44	Very low	81 Å²	81	102.7 Å²	102.7	49%	0.491	57%	0.574	S	S	.	*	H	α-helix	trans	-65.4	-44.8	173.7	172.6	0	0	0	0	110.8	D261 R268 L269	D261-V265 WeakPolarHBondContact O-CG2 3.48Å; D261-V265 PolarHBondContact O-N 2.86Å; V265-R268 PolarHBondContact O-N 3.05Å; V265-L269 VanDerWaalsContact O-CB 3.31Å; V265-L269 WeakPolarHBondContact O-CB 3.34Å; V265-L269 PolarHBondContact O-N 2.91Å
266	L	45.3	Very low	43.6	Very low	107 Å²	107	101.7 Å²	101.7	56%	0.56	56%	0.56	S	S	*	*	H	α-helix	trans	-64.9	-39.5	177.7	-71.1	170.6	0	0	0	112.5	R262 A263 L269 A270	R262-L266 WeakPolarHBondContact O-CD1 3.23Å; R262-L266 VanDerWaalsContact O-CG 3.3Å; R262-L266 WeakPolarHBondContact O-CG 3.3Å; R262-L266 PolarHBondContact O-N 3.37Å; A263-L266 PolarHBondContact O-N 3.02Å; L266-L269 PolarHBondContact O-N 3.24Å; L266-A270 WeakPolarHBondContact O-CB 3.47Å; L266-A270 PolarHBondContact O-N 2.93Å
267	D	45.1	Very low	43.1	Very low	93 Å²	93	103.5 Å²	103.5	50%	0.497	55%	0.554	S	S	.	*	H	α-helix	trans	-69.5	-40.3	177.3	-172.6	67.8	0	0	0	112.4	A263 L269 A270 N271	A263-D267 WeakPolarHBondContact O-CB 3.24Å; A263-D267 PolarHBondContact O-N 2.77Å; D267-L269 VanDerWaalsContact C-N 3.34Å; D267-L269 PolarHBondContact O-N 3.46Å; D267-A270 PolarHBondContact O-N 3.25Å; D267-N271 WeakPolarHBondContact O-CB 3.5Å; D267-N271 PolarHBondContact O-N 3.03Å; D267-N271 PolarHBondContact O-ND2 3.28Å; D267-N271 PolarHBondContact OD2-ND2 3.38Å
268	R	45.7	Very low	42.8	Very low	137 Å²	137	100.2 Å²	100.2	52%	0.517	55%	0.55	S	S	.	*	H	α-helix	trans	-64.1	-38.3	171.6	-73.1	-180	-159.7	161.2	9.1	112.2	L264 V265 N272	L264-R268 WeakPolarHBondContact O-CB 3.4Å; L264-R268 WeakPolarHBondContact O-CG 3.48Å; L264-R268 PolarHBondContact O-N 3.31Å; V265-R268 PolarHBondContact O-N 3.05Å; R268-N272 WeakPolarHBondContact O-CB 3.48Å; R268-N272 PolarHBondContact O-N 2.91Å; R268-N272 PolarHBondContact O-ND2 3.43Å
269	L	42.5	Very low	42.2	Very low	110 Å²	110	99 Å²	99	58%	0.576	54%	0.543	S	S	*	.	H	α-helix	trans	-65.7	-45.4	176.4	-171	65.1	0	0	0	110.7	V265 L266 D267 N271 N272 V273	V265-L269 VanDerWaalsContact O-CB 3.31Å; V265-L269 WeakPolarHBondContact O-CB 3.34Å; V265-L269 PolarHBondContact O-N 2.91Å; L266-L269 PolarHBondContact O-N 3.24Å; D267-L269 VanDerWaalsContact C-N 3.34Å; D267-L269 PolarHBondContact O-N 3.46Å; L269-N271 PolarHBondContact O-N 3.26Å; L269-N272 PolarHBondContact O-N 3.17Å; L269-V273 WeakPolarHBondContact O-CG2 3.41Å; L269-V273 PolarHBondContact O-N 2.93Å
270	A	43.3	Very low	41.3	Very low	56 Å²	56	102.2 Å²	102.2	46%	0.463	54%	0.542	S	S	.	.	H	α-helix	trans	-60	-45.9	175.4	0	0	0	0	0	112.2	L266 D267 N272 V273 A274	L266-A270 WeakPolarHBondContact O-CB 3.47Å; L266-A270 PolarHBondContact O-N 2.93Å; D267-A270 PolarHBondContact O-N 3.25Å; A270-N272 PolarHBondContact O-N 3.5Å; A270-V273 PolarHBondContact O-N 2.9Å; A270-A274 WeakPolarHBondContact O-CB 3.37Å; A270-A274 PolarHBondContact O-N 3.13Å
271	N	43.8	Very low	40.5	Very low	88 Å²	88	103.1 Å²	103.1	47%	0.471	55%	0.546	S	S	.	.	H	α-helix	trans	-64.6	-36.7	177.2	-80.6	-59.8	0	0	0	112.9	D267 L269 A274 K275	D267-N271 WeakPolarHBondContact O-CB 3.5Å; D267-N271 PolarHBondContact O-N 3.03Å; D267-N271 PolarHBondContact O-ND2 3.28Å; D267-N271 PolarHBondContact OD2-ND2 3.38Å; L269-N271 PolarHBondContact O-N 3.26Å; N271-A274 PolarHBondContact O-N 3.01Å; N271-K275 WeakPolarHBondContact O-CB 3.41Å; N271-K275 PolarHBondContact O-N 3.44Å
272	N	39.9	Very low	39.8	Very low	82 Å²	82	108.7 Å²	108.7	44%	0.439	57%	0.57	S	S	.	*	H	α-helix	trans	-70.3	-38.5	173.7	-83.3	-67.1	0	0	0	112.7	R268 L269 A270 K275 R276	R268-N272 WeakPolarHBondContact O-CB 3.48Å; R268-N272 PolarHBondContact O-N 2.91Å; R268-N272 PolarHBondContact O-ND2 3.43Å; L269-N272 PolarHBondContact O-N 3.17Å; A270-N272 PolarHBondContact O-N 3.5Å; N272-K275 PolarHBondContact O-N 2.88Å; N272-R276 WeakPolarHBondContact O-CG 3.48Å; N272-R276 PolarHBondContact O-N 3.3Å
273	V	41.1	Very low	39.4	Very low	77 Å²	77	108.8 Å²	108.8	47%	0.467	58%	0.576	S	S	.	*	H	α-helix	trans	-64.1	-40.4	172.6	169.7	0	0	0	0	110.9	L269 A270 R276 K277	L269-V273 WeakPolarHBondContact O-CG2 3.41Å; L269-V273 PolarHBondContact O-N 2.93Å; A270-V273 PolarHBondContact O-N 2.9Å; V273-R276 PolarHBondContact O-N 3.01Å; V273-K277 PolarHBondContact O-N 2.88Å
274	A	37.9	Very low	38.6	Very low	55 Å²	55	113.6 Å²	113.6	46%	0.455	59%	0.585	S	S	.	*	H	α-helix	trans	-63.5	-46	174.7	0	0	0	0	0	112.3	A270 N271 R276 K277 S278	A270-A274 WeakPolarHBondContact O-CB 3.37Å; A270-A274 PolarHBondContact O-N 3.13Å; N271-A274 PolarHBondContact O-N 3.01Å; A274-R276 PolarHBondContact O-N 3.3Å; A274-K277 PolarHBondContact O-N 3.42Å; A274-S278 PolarHBondContact O-N 3.09Å
275	K	39.4	Very low	38	Very low	157 Å²	157	115.4 Å²	115.4	68%	0.683	60%	0.598	S	S	*	*	H	α-helix	trans	-60.5	-29.5	173.7	-102	-178.6	175.4	175.7	0	113.7	N271 N272 S278	N271-K275 WeakPolarHBondContact O-CB 3.41Å; N271-K275 PolarHBondContact O-N 3.44Å; N272-K275 PolarHBondContact O-N 2.88Å; K275-S278 PolarHBondContact O-OG 3.32Å
276	R	37.6	Very low	37.3	Very low	123 Å²	123	114.6 Å²	114.6	46%	0.464	61%	0.606	S	S	.	*	H	α-helix	trans	-83.7	-32.6	177.1	-70.5	176.6	-176.4	-163.7	1.4	112.4	N272 V273 A274 S278 T279	N272-R276 WeakPolarHBondContact O-CG 3.48Å; N272-R276 PolarHBondContact O-N 3.3Å; V273-R276 PolarHBondContact O-N 3.01Å; A274-R276 PolarHBondContact O-N 3.3Å; R276-S278 VanDerWaalsContact C-N 3.34Å; R276-S278 PolarHBondContact O-N 3.35Å; R276-T279 PolarHBondContact O-N 3.08Å; R276-T279 PolarHBondContact O-OG1 3.34Å
277	K	33.7	Very low	36.8	Very low	150 Å²	150	116.7 Å²	116.7	65%	0.652	62%	0.618	S	S	*	*	H	α-helix	trans	-60.9	-38	171.5	-85.6	-173.6	173.7	-178.5	0	112.9	V273 A274 T279 M280	V273-K277 PolarHBondContact O-N 2.88Å; A274-K277 PolarHBondContact O-N 3.42Å; K277-T279 PolarHBondContact O-N 2.8Å; K277-M280 PolarHBondContact O-N 3.34Å
278	S	34.2	Very low	36.3	Very low	99 Å²	99	121.1 Å²	121.1	69%	0.692	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	-15.4	178.6	60.1	0	0	0	0	114.3	A274 K275 R276	A274-S278 PolarHBondContact O-N 3.09Å; K275-S278 PolarHBondContact O-OG 3.32Å; R276-S278 VanDerWaalsContact C-N 3.34Å; R276-S278 PolarHBondContact O-N 3.35Å
279	T	34.8	Very low	35.7	Very low	113 Å²	113	124 Å²	124	69%	0.693	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	1	177.1	54	0	0	0	0	114.5	R276 K277	R276-T279 PolarHBondContact O-N 3.08Å; R276-T279 PolarHBondContact O-OG1 3.34Å; K277-T279 PolarHBondContact O-N 2.8Å
280	M	28.7	Very low	35.3	Very low	131 Å²	131	126 Å²	126	65%	0.645	66%	0.655	S	S	*	*	S	Bend	trans	-95.7	138.3	-173.2	-156.5	172.6	-169.5	0	0	111.8	K277 Q282	K277-M280 PolarHBondContact O-N 3.34Å; M280-Q282 PolarHBondContact O-N 2.78Å
281	P	29.4	Very low	35.1	Very low	103 Å²	103	127.5 Å²	127.5	67%	0.669	66%	0.661	S	S	*	*			trans	-61.9	127.6	178.9	-23.7	34.2	0	0	0	112.8	K283	P281-K283 PolarHBondContact O-N 3.33Å
282	Q	32.7	Very low	34.7	Very low	180 Å²	180	128.9 Å²	128.9	84%	0.841	67%	0.669	S	S	*	*	G	3₁₀ helix	trans	-58.5	-7.3	-169.3	-87.7	-175.4	-25.5	0	0	117.6	M280 F284	M280-Q282 PolarHBondContact O-N 2.78Å; Q282-F284 VanDerWaalsContact C-N 3.26Å; Q282-F284 PolarHBondContact O-N 2.95Å
283	K	32.8	Very low	34.5	Very low	203 Å²	203	131.9 Å²	131.9	88%	0.883	68%	0.684	S	S	*	*	G	3₁₀ helix	trans	-77.6	-1.4	-174.4	-72.9	-165.7	173.5	-170.3	0	115.8	P281	P281-K283 PolarHBondContact O-N 3.33Å
284	F	29.8	Very low	33.9	Very low	167 Å²	167	134.2 Å²	134.2	73%	0.732	70%	0.704	S	S	*	*	G	3₁₀ helix	trans	-113.5	18.8	175.6	-79.7	-80.1	0	0	0	114	Q282 G286	Q282-F284 VanDerWaalsContact C-N 3.26Å; Q282-F284 PolarHBondContact O-N 2.95Å; F284-G286 PolarHBondContact O-N 3.48Å
285	V	34.3	Very low	33.8	Very low	111 Å²	111	140.2 Å²	140.2	67%	0.673	72%	0.716	S	S	*	*			trans	-90.5	95.5	166.6	-174.1	0	0	0	0	108.5
286	G	30.5	Very low	33.5	Very low	64 Å²	64	140.5 Å²	140.5	66%	0.66	73%	0.725	S	S	*	*			trans	-72	136.4	162.1	0	0	0	0	0	109.7	F284 K288	F284-G286 PolarHBondContact O-N 3.48Å; G286-K288 VanDerWaalsContact C-N 3.27Å; G286-K288 PolarHBondContact O-N 2.9Å
287	D	35.2	Very low	33.3	Very low	152 Å²	152	137.9 Å²	137.9	81%	0.813	74%	0.736	S	S	*	*	S	Bend	trans	-70.1	77	-177.5	-76	-50.3	0	0	0	112.8
288	K	35.1	Very low	33	Very low	186 Å²	186	133 Å²	133	81%	0.809	73%	0.729	S	S	*	*			trans	-128.7	102.7	155.7	-72.3	-166.8	175.8	-172.8	0	108.4	G286	G286-K288 VanDerWaalsContact C-N 3.27Å; G286-K288 PolarHBondContact O-N 2.9Å
289	R	34.2	Very low	33.4	Very low	196 Å²	196	134.7 Å²	134.7	74%	0.74	74%	0.74	S	S	*	*			trans	-78.3	150.1	175.7	-74.3	178.4	159.2	-162.7	-6.6	108.9	S291 D292	R289-S291 WeakPolarHBondContact CB-OG 3.3Å; R289-S291 PolarHBondContact O-N 3.3Å; R289-D292 PolarHBondContact O-N 3.44Å
290	L	33.2	Very low	33.8	Very low	154 Å²	154	133.1 Å²	133.1	81%	0.806	75%	0.746	S	S	*	*	G	3₁₀ helix	trans	-62.8	-5.8	172.1	-98.9	83.6	0	0	0	113.7	D292	L290-D292 PolarHBondContact O-N 3.3Å
291	S	37.8	Very low	34	Very low	86 Å²	86	134.9 Å²	134.9	60%	0.601	75%	0.753	S	S	*	*	G	3₁₀ helix	trans	-70.3	-12.4	175.3	50.2	0	0	0	0	114.6	R289 L293	R289-S291 WeakPolarHBondContact CB-OG 3.3Å; R289-S291 PolarHBondContact O-N 3.3Å; S291-L293 VanDerWaalsContact C-N 3.29Å; S291-L293 PolarHBondContact O-N 2.97Å
292	D	35.6	Very low	34.5	Very low	117 Å²	117	137.6 Å²	137.6	63%	0.626	76%	0.761	S	S	*	*	G	3₁₀ helix	trans	-87.9	0.7	-173.1	-55.2	-10.5	0	0	0	112.7	R289 L290	R289-D292 PolarHBondContact O-N 3.44Å; L290-D292 PolarHBondContact O-N 3.3Å
293	L	35.9	Very low	34.7	Very low	146 Å²	146	134.9 Å²	134.9	76%	0.764	75%	0.751	S	S	*	*	S	Bend	trans	-88.6	100.3	168.4	-67.2	175	0	0	0	109.1	S291 Y295	S291-L293 VanDerWaalsContact C-N 3.29Å; S291-L293 PolarHBondContact O-N 2.97Å; L293-Y295 PolarHBondContact O-N 3.47Å; L293-Y295 VanDerWaalsContact O-N 3.12Å
294	S	30	Very low	34.9	Very low	125 Å²	125	130.1 Å²	130.1	87%	0.874	73%	0.732	S	S	*	*			trans	-66	107.9	175.5	55.9	0	0	0	0	111
295	Y	35.5	Very low	35.3	Very low	181 Å²	181	126.4 Å²	126.4	71%	0.71	73%	0.725	S	S	*	*			trans	-110.5	104.9	168.6	179.3	-102.7	0	0	0	108.6	L293 G298	L293-Y295 PolarHBondContact O-N 3.47Å; L293-Y295 VanDerWaalsContact O-N 3.12Å; Y295-G298 PolarHBondContact OH-O 3.37Å
296	D	31.9	Very low	35.4	Very low	164 Å²	164	126.7 Å²	126.7	88%	0.877	72%	0.718	S	S	*	*			trans	-81.5	133.3	166.9	-123	-23.9	0	0	0	108.4
297	G	35	Very low	36	Very low	68 Å²	68	126.9 Å²	126.9	70%	0.701	71%	0.707	S	S	*	*			trans	-81.9	150.6	-152.6	0	0	0	0	0	116.8
298	G	26.8	Very low	36.4	Very low	48 Å²	48	123.1 Å²	123.1	50%	0.495	69%	0.686	S	S	.	*			trans	-156.7	115.7	164.9	0	0	0	0	0	111.2	Y295 G300	Y295-G298 PolarHBondContact OH-O 3.37Å; G298-G300 PolarHBondContact O-N 2.85Å
299	S	41.6	Very low	36.6	Very low	133 Å²	133	118.7 Å²	118.7	93%	0.93	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	122	-177.9	54.3	0	0	0	0	112.4
300	G	43.7	Very low	36.9	Very low	80 Å²	80	115.5 Å²	115.5	83%	0.825	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	120.8	5.4	156.5	0	0	0	0	0	118.5	G298	G298-G300 PolarHBondContact O-N 2.85Å
301	E	32.4	Very low	37.4	Very low	169 Å²	169	111 Å²	111	79%	0.79	65%	0.65	S	S	*	*			trans	-96.9	143.5	178.1	-65.7	-163.5	144.9	0	0	113.5
302	L	41.3	Very low	37.6	Very low	160 Å²	160	110.5 Å²	110.5	84%	0.838	64%	0.639	S	S	*	*			trans	-59.6	141.4	173.7	-80.4	89.5	0	0	0	110.4	Q304	L302-Q304 PolarHBondContact O-N 3.31Å
303	I	35.5	Very low	37.8	Very low	123 Å²	123	108.6 Å²	108.6	63%	0.631	63%	0.629	S	S	*	*			trans	-55.5	114.6	172.8	-56.4	174.8	0	0	0	108.4	V307 I308	I303-V307 HydrophobicContact CG2-CB 4.04Å; I303-V307 HydrophobicContact CG2-CG1 4.3Å; I303-I308 HydrophobicContact CB-CD1 4.34Å; I303-I308 HydrophobicContact CB-CG1 4.46Å; I303-I308 HydrophobicContact CG2-CD1 4.17Å; I303-I308 HydrophobicContact CG2-CG1 3.76Å
304	Q	38.1	Very low	38.2	Very low	102 Å²	102	104.8 Å²	104.8	48%	0.477	62%	0.615	S	S	.	*			trans	-58.9	135	-176.1	-70.2	-70.9	-19.2	0	0	110.3	L302 H306 V307	L302-Q304 PolarHBondContact O-N 3.31Å; Q304-H306 VanDerWaalsContact CB-CE1 3.43Å; Q304-H306 WeakPolarHBondContact CB-CE1 3.13Å; Q304-H306 WeakPolarHBondContact CB-ND1 3.41Å; Q304-H306 PolarHBondContact O-N 2.97Å; Q304-V307 HydrophobicContact CB-CG2 4.41Å; Q304-V307 WeakPolarHBondContact O-CB 3.43Å; Q304-V307 PolarHBondContact O-N 3.24Å
305	P	38.2	Very low	38.7	Very low	89 Å²	89	101 Å²	101	58%	0.578	59%	0.591	S	S	*	*	H	α-helix	trans	-52.6	-34.3	-171	-30.6	35.5	0	0	0	114.9	V307 I308 D309	P305-V307 VanDerWaalsContact C-N 3.27Å; P305-V307 PolarHBondContact O-N 2.86Å; P305-I308 WeakPolarHBondContact O-CB 3.42Å; P305-I308 PolarHBondContact O-N 3.32Å; P305-I308 VanDerWaalsContact O-N 3.15Å; P305-D309 PolarHBondContact O-N 3.36Å
306	H	36.8	Very low	38.9	Very low	117 Å²	117	93.7 Å²	93.7	54%	0.542	56%	0.564	S	S	.	*	H	α-helix	trans	-61.1	-31.7	178.5	72.5	-94.5	0	0	0	113.6	Q304 Q310	Q304-H306 VanDerWaalsContact CB-CE1 3.43Å; Q304-H306 WeakPolarHBondContact CB-CE1 3.13Å; Q304-H306 WeakPolarHBondContact CB-ND1 3.41Å; Q304-H306 PolarHBondContact O-N 2.97Å; H306-Q310 VanDerWaalsContact O-CB 3.27Å; H306-Q310 WeakPolarHBondContact O-CB 3.36Å; H306-Q310 PolarHBondContact O-N 3.14Å
307	V	41.5	Very low	39.3	Very low	68 Å²	68	90.9 Å²	90.9	41%	0.412	56%	0.557	S	S	.	*	H	α-helix	trans	-72.3	-35.9	178.3	-173.9	0	0	0	0	110.6	I303 Q304 P305 Q310 A311	I303-V307 HydrophobicContact CG2-CB 4.04Å; I303-V307 HydrophobicContact CG2-CG1 4.3Å; Q304-V307 HydrophobicContact CB-CG2 4.41Å; Q304-V307 WeakPolarHBondContact O-CB 3.43Å; Q304-V307 PolarHBondContact O-N 3.24Å; P305-V307 VanDerWaalsContact C-N 3.27Å; P305-V307 PolarHBondContact O-N 2.86Å; V307-Q310 PolarHBondContact O-N 2.98Å; V307-A311 WeakPolarHBondContact O-CB 3.35Å; V307-A311 PolarHBondContact O-N 3.44Å
308	I	43.3	Very low	39.3	Very low	74 Å²	74	97.7 Å²	97.7	38%	0.379	56%	0.563	S	S	.	*	H	α-helix	trans	-68.5	-46.9	176.4	-59.9	175.2	0	0	0	109.5	I303 P305 Q310 A311 I312	I303-I308 HydrophobicContact CB-CD1 4.34Å; I303-I308 HydrophobicContact CB-CG1 4.46Å; I303-I308 HydrophobicContact CG2-CD1 4.17Å; I303-I308 HydrophobicContact CG2-CG1 3.76Å; P305-I308 WeakPolarHBondContact O-CB 3.42Å; P305-I308 PolarHBondContact O-N 3.32Å; P305-I308 VanDerWaalsContact O-N 3.15Å; I308-Q310 VanDerWaalsContact C-N 3.32Å; I308-Q310 PolarHBondContact O-N 3.24Å; I308-A311 PolarHBondContact O-N 3.31Å; I308-I312 HydrophobicContact CG2-CD1 3.77Å; I308-I312 HydrophobicContact CG2-CG1 4.45Å; I308-I312 WeakPolarHBondContact O-CB 3.46Å; I308-I312 VanDerWaalsContact O-CG1 3.3Å; I308-I312 WeakPolarHBondContact O-CG1 3.31Å; I308-I312 PolarHBondContact O-N 3.48Å
309	D	39.7	Very low	39.9	Very low	92 Å²	92	101.7 Å²	101.7	49%	0.492	57%	0.572	S	S	.	*	H	α-helix	trans	-61.3	-38.9	174.1	-83.8	-11.8	0	0	0	112.2	P305 A311 I312 N313	P305-D309 PolarHBondContact O-N 3.36Å; D309-A311 PolarHBondContact O-N 2.86Å; D309-I312 PolarHBondContact O-N 3.1Å; D309-N313 VanDerWaalsContact O-CB 3.27Å; D309-N313 WeakPolarHBondContact O-CB 3.35Å; D309-N313 VanDerWaalsContact O-CG 3.26Å; D309-N313 PolarHBondContact O-N 3.39Å; D309-N313 PolarHBondContact O-ND2 3.32Å
310	Q	42	Very low	39.7	Very low	129 Å²	129	98.5 Å²	98.5	60%	0.603	56%	0.561	S	S	*	*	H	α-helix	trans	-67.2	-36.1	177.8	-164	167.2	19.3	0	0	112	H306 V307 I308 S314	H306-Q310 VanDerWaalsContact O-CB 3.27Å; H306-Q310 WeakPolarHBondContact O-CB 3.36Å; H306-Q310 PolarHBondContact O-N 3.14Å; V307-Q310 PolarHBondContact O-N 2.98Å; I308-Q310 VanDerWaalsContact C-N 3.32Å; I308-Q310 PolarHBondContact O-N 3.24Å; Q310-S314 VanDerWaalsContact O-CB 3.29Å; Q310-S314 WeakPolarHBondContact O-CB 3.47Å; Q310-S314 PolarHBondContact O-N 2.89Å; Q310-S314 PolarHBondContact O-OG 3Å
311	A	41.8	Very low	39.4	Very low	61 Å²	61	96.2 Å²	96.2	50%	0.504	53%	0.534	S	S	.	.	H	α-helix	trans	-69	-42	172.1	0	0	0	0	0	112.6	V307 I308 D309 S314 A315	V307-A311 WeakPolarHBondContact O-CB 3.35Å; V307-A311 PolarHBondContact O-N 3.44Å; I308-A311 PolarHBondContact O-N 3.31Å; D309-A311 PolarHBondContact O-N 2.86Å; A311-S314 PolarHBondContact O-N 3.42Å; A311-A315 WeakPolarHBondContact O-CB 3.34Å; A311-A315 PolarHBondContact O-N 3.05Å
312	I	42.1	Very low	39.8	Very low	74 Å²	74	96 Å²	96	38%	0.379	53%	0.533	S	S	.	.	H	α-helix	trans	-64.9	-48.6	176.8	-71.2	169.8	0	0	0	110.7	I308 D309 S314 A315 I316	I308-I312 HydrophobicContact CG2-CD1 3.77Å; I308-I312 HydrophobicContact CG2-CG1 4.45Å; I308-I312 WeakPolarHBondContact O-CB 3.46Å; I308-I312 VanDerWaalsContact O-CG1 3.3Å; I308-I312 WeakPolarHBondContact O-CG1 3.31Å; I308-I312 PolarHBondContact O-N 3.48Å; D309-I312 PolarHBondContact O-N 3.1Å; I312-S314 VanDerWaalsContact C-N 3.29Å; I312-S314 PolarHBondContact O-N 3.27Å; I312-A315 CarbonylContact O-C 3.53Å; I312-A315 WeakPolarHBondContact O-CA 3.48Å; I312-A315 WeakPolarHBondContact O-CB 3.48Å; I312-A315 PolarHBondContact O-N 3.47Å; I312-I316 HydrophobicContact CG2-CD1 3.65Å; I312-I316 HydrophobicContact CG2-CG1 4.28Å; I312-I316 WeakPolarHBondContact O-CG1 3.32Å; I312-I316 PolarHBondContact O-N 3.26Å
313	N	41.1	Very low	39.7	Very low	77 Å²	77	94.1 Å²	94.1	41%	0.412	53%	0.533	S	S	.	.	H	α-helix	trans	-63.3	-34.9	177.6	-72.1	-47.6	0	0	0	112.1	D309 S317	D309-N313 VanDerWaalsContact O-CB 3.27Å; D309-N313 WeakPolarHBondContact O-CB 3.35Å; D309-N313 VanDerWaalsContact O-CG 3.26Å; D309-N313 PolarHBondContact O-N 3.39Å; D309-N313 PolarHBondContact O-ND2 3.32Å; N313-S317 WeakPolarHBondContact O-CB 3.29Å; N313-S317 PolarHBondContact O-N 3.27Å; N313-S317 PolarHBondContact O-OG 3.27Å
314	S	44.4	Very low	39.7	Very low	67 Å²	67	93.6 Å²	93.6	47%	0.469	53%	0.531	S	S	.	.	H	α-helix	trans	-65.2	-38.7	171.5	-60.9	0	0	0	0	112.2	Q310 A311 I312 Y318	Q310-S314 VanDerWaalsContact O-CB 3.29Å; Q310-S314 WeakPolarHBondContact O-CB 3.47Å; Q310-S314 PolarHBondContact O-N 2.89Å; Q310-S314 PolarHBondContact O-OG 3Å; A311-S314 PolarHBondContact O-N 3.42Å; I312-S314 VanDerWaalsContact C-N 3.29Å; I312-S314 PolarHBondContact O-N 3.27Å; S314-Y318 WeakPolarHBondContact O-CB 3.27Å; S314-Y318 PolarHBondContact O-N 3.4Å; S314-Y318 VanDerWaalsContact O-N 3.14Å
315	A	39.3	Very low	39.6	Very low	45 Å²	45	98.7 Å²	98.7	37%	0.372	55%	0.546	S	S	.	.	H	α-helix	trans	-71.3	-40.2	175.8	0	0	0	0	0	112.8	A311 I312 Y318 L319	A311-A315 WeakPolarHBondContact O-CB 3.34Å; A311-A315 PolarHBondContact O-N 3.05Å; I312-A315 CarbonylContact O-C 3.53Å; I312-A315 WeakPolarHBondContact O-CA 3.48Å; I312-A315 WeakPolarHBondContact O-CB 3.48Å; I312-A315 PolarHBondContact O-N 3.47Å; A315-Y318 PolarHBondContact O-N 3.02Å; A315-L319 WeakPolarHBondContact O-CB 3.23Å; A315-L319 WeakPolarHBondContact O-CG 3.43Å; A315-L319 PolarHBondContact O-N 2.82Å
316	I	41.1	Very low	39.5	Very low	28 Å²	28	99.5 Å²	99.5	14%	0.144	55%	0.552	C	S	.	*	H	α-helix	trans	-61.5	-45.3	174.7	-68.9	168.4	0	0	0	109.9	I312 Y318 L319 G320	I312-I316 HydrophobicContact CG2-CD1 3.65Å; I312-I316 HydrophobicContact CG2-CG1 4.28Å; I312-I316 WeakPolarHBondContact O-CG1 3.32Å; I312-I316 PolarHBondContact O-N 3.26Å; I316-Y318 VanDerWaalsContact C-N 3.29Å; I316-Y318 PolarHBondContact O-N 2.9Å; I316-L319 PolarHBondContact O-N 2.81Å; I316-G320 PolarHBondContact O-N 2.85Å
317	S	39.7	Very low	39.4	Very low	104 Å²	104	102 Å²	102	73%	0.727	57%	0.568	S	S	*	*	H	α-helix	trans	-65.2	-29.3	177.1	-59.2	0	0	0	0	113.4	N313	N313-S317 WeakPolarHBondContact O-CB 3.29Å; N313-S317 PolarHBondContact O-N 3.27Å; N313-S317 PolarHBondContact O-OG 3.27Å
318	Y	35.7	Very low	38.8	Very low	212 Å²	212	104.8 Å²	104.8	83%	0.831	59%	0.585	S	S	*	*	H	α-helix	trans	-84.5	-22.5	177	-107	-89	0	0	0	114.6	S314 A315 I316	S314-Y318 WeakPolarHBondContact O-CB 3.27Å; S314-Y318 PolarHBondContact O-N 3.4Å; S314-Y318 VanDerWaalsContact O-N 3.14Å; A315-Y318 PolarHBondContact O-N 3.02Å; I316-Y318 VanDerWaalsContact C-N 3.29Å; I316-Y318 PolarHBondContact O-N 2.9Å
319	L	38.6	Very low	38.4	Very low	131 Å²	131	110.4 Å²	110.4	69%	0.686	61%	0.61	S	S	*	*	H	α-helix	trans	-115.8	-10.8	-173	-66.2	170.7	0	0	0	114.4	A315 I316 A321	A315-L319 WeakPolarHBondContact O-CB 3.23Å; A315-L319 WeakPolarHBondContact O-CG 3.43Å; A315-L319 PolarHBondContact O-N 2.82Å; I316-L319 PolarHBondContact O-N 2.81Å; L319-A321 VanDerWaalsContact C-N 3.28Å; L319-A321 PolarHBondContact O-N 3.22Å
320	G	37.5	Very low	37.7	Very low	67 Å²	67	112 Å²	112	69%	0.691	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	64.8	28.6	178.1	0	0	0	0	0	114.1	I316	I316-G320 PolarHBondContact O-N 2.85Å
321	A	38.2	Very low	37.1	Very low	32 Å²	32	111.4 Å²	111.4	26%	0.264	63%	0.633	S	S	.	*			trans	-112.2	78.5	-171	0	0	0	0	0	112.2	L319 S323 L324	L319-A321 VanDerWaalsContact C-N 3.28Å; L319-A321 PolarHBondContact O-N 3.22Å; A321-S323 PolarHBondContact O-N 3.49Å; A321-L324 HydrophobicContact CB-CD1 4.08Å; A321-L324 HydrophobicContact CB-CG 4.33Å; A321-L324 PolarHBondContact O-N 3.28Å
322	E	39.3	Very low	36.6	Very low	163 Å²	163	114.2 Å²	114.2	76%	0.762	65%	0.646	S	S	*	*	G	3₁₀ helix	trans	-67.8	-13.1	176.2	-68.3	178.8	126.3	0	0	113.5	L324	E322-L324 PolarHBondContact O-N 3.07Å; E322-L324 VanDerWaalsContact O-N 3.12Å
323	S	40	Very low	36.1	Very low	121 Å²	121	115 Å²	115	85%	0.846	66%	0.664	S	S	*	*	G	3₁₀ helix	trans	-71.5	3.1	176.1	-167.8	0	0	0	0	114.6	A321 R325	A321-S323 PolarHBondContact O-N 3.49Å; S323-R325 VanDerWaalsContact C-N 3.33Å; S323-R325 PolarHBondContact O-N 2.98Å
324	L	34.4	Very low	35.8	Very low	112 Å²	112	116.7 Å²	116.7	59%	0.586	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-91.4	24.1	-179.6	-69	175.4	0	0	0	114.2	A321 E322 P326	A321-L324 HydrophobicContact CB-CD1 4.08Å; A321-L324 HydrophobicContact CB-CG 4.33Å; A321-L324 PolarHBondContact O-N 3.28Å; E322-L324 PolarHBondContact O-N 3.07Å; E322-L324 VanDerWaalsContact O-N 3.12Å; L324-P326 WeakPolarHBondContact O-CD 3.41Å
325	R	36.4	Very low	35	Very low	210 Å²	210	118.3 Å²	118.3	79%	0.792	69%	0.69	S	S	*	*			trans	-107.8	88.9	169.3	-71.2	-170.9	-179.8	-167.9	2	112.6	S323 L327	S323-R325 VanDerWaalsContact C-N 3.33Å; S323-R325 PolarHBondContact O-N 2.98Å; R325-L327 PolarHBondContact O-N 3Å
326	P	35.5	Very low	34.4	Very low	106 Å²	106	123.3 Å²	123.3	69%	0.688	71%	0.71	S	S	*	*			trans	-77.2	117.4	163.8	-12.6	29.2	0	0	0	111.2	L324	L324-P326 WeakPolarHBondContact O-CD 3.41Å
327	L	35.2	Very low	33.8	Very low	169 Å²	169	128.6 Å²	128.6	89%	0.885	74%	0.743	S	S	*	*			trans	34.8	89.9	135.5	-62.2	165	0	0	0	117.5	R325	R325-L327 PolarHBondContact O-N 3Å
328	V	28.9	Very low	33.1	Very low	127 Å²	127	127 Å²	127	77%	0.77	74%	0.744	S	S	*	*			trans	-116.8	85.8	155.4	-176.9	0	0	0	0	109
329	Q	35.7	Very low	32.7	Very low	192 Å²	192	125.4 Å²	125.4	90%	0.897	75%	0.748	S	S	*	*			trans	-95.6	94.7	156.2	-85.3	-170.2	-10.5	0	0	108.4
330	T	25.7	Very low	32.1	Very low	125 Å²	125	122.4 Å²	122.4	77%	0.767	75%	0.749	S	S	*	*			trans	-142.3	104	164.2	54.1	0	0	0	0	109.9
331	S	28.6	Very low	31.6	Very low	117 Å²	117	124.4 Å²	124.4	82%	0.818	75%	0.752	S	S	*	*			trans	-114.1	130.2	148.6	-166.1	0	0	0	0	105
332	P	31.9	Very low	31.1	Very low	120 Å²	120	130.3 Å²	130.3	78%	0.779	78%	0.778	S	S	*	*				-139.5	166.6	81.9	36.6	-21.1	0	0	0	115.1
333	A	31.1	Very low	30.4	Very low	91 Å²	91	132.9 Å²	132.9	75%	0.752	78%	0.782	S	S	*	*			trans	-84.4	162.4	167.4	0	0	0	0	0	112.1
334	P	34.1	Very low	30.3	Very low	112 Å²	112	131.7 Å²	131.7	73%	0.727	77%	0.771	S	S	*	*			trans	-141.8	147.3	135.8	37.1	-23.3	0	0	0	115.8
335	S	28.8	Very low	29.8	Very low	100 Å²	100	132.8 Å²	132.8	70%	0.699	78%	0.777	S	S	*	*			trans	31.1	144.3	145.9	55.2	0	0	0	0	121.8
336	D	26.2	Very low	29.4	Very low	151 Å²	151	129.8 Å²	129.8	81%	0.807	77%	0.772	S	S	*	*			cis	-140.6	176.3	20.5	-85.8	-51.5	0	0	0	110.4
337	V	28.2	Very low	29	Very low	138 Å²	138	133 Å²	133	84%	0.836	78%	0.775	S	S	*	*			cis	-153.1	146.2	32.5	176.5	0	0	0	0	109.5
338	G	24.8	Very low	29.2	Very low	71 Å²	71	130.7 Å²	130.7	73%	0.732	77%	0.77	S	S	*	*			trans	170.6	58.9	168.8	0	0	0	0	0	120.5
339	I	28.2	Very low	29.1	Very low	178 Å²	178	129.1 Å²	129.1	91%	0.913	77%	0.77	S	S	*	*			trans	23	121.4	151.2	-50.3	174	0	0	0	118.9
340	G	25.5	Very low	30	Very low	69 Å²	69	125.4 Å²	125.4	71%	0.711	76%	0.763	S	S	*	*			trans	158.6	89.7	148.6	0	0	0	0	0	120.5
341	S	26.3	Very low	30	Very low	108 Å²	108	128.6 Å²	128.6	76%	0.755	77%	0.769	S	S	*	*			trans	62.8	117.9	143.8	-78.2	0	0	0	0	124.3
342	I	28.5	Very low	29.9	Very low	157 Å²	157	126.5 Å²	126.5	81%	0.805	77%	0.766	S	S	*	*				84.9	109.1	128.3	-57.9	165.2	0	0	0	119.7
343	Y	24.9	Very low	29.6	Very low	216 Å²	216	129 Å²	129	85%	0.847	77%	0.767	S	S	*	*			trans	-50.1	173.9	158.9	-82.1	-104.6	0	0	0	115.7
344	P	38.5	Very low	29.4	Very low	96 Å²	96	131.2 Å²	131.2	62%	0.623	77%	0.77	S	S	*	*			cis	-152.6	-169.4	-41.2	43.7	-24.6	0	0	0	116.4
345	L	23.8	Very low	29	Very low	136 Å²	136	129.3 Å²	129.3	71%	0.712	77%	0.772	S	S	*	*			trans	81.3	133.3	144.5	-108.4	79.6	0	0	0	122.7
346	H	26.6	Very low	28.8	Very low	147 Å²	147	128.9 Å²	128.9	68%	0.681	77%	0.774	S	S	*	*			trans	65.8	152.5	147.8	-80.2	-159.1	0	0	0	118.7
347	K	28	Very low	28.8	Very low	173 Å²	173	127.9 Å²	127.9	75%	0.752	77%	0.773	S	S	*	*			cis	-157.4	171.2	-18.6	-118.7	-171	179.9	-175.7	0	107.2
348	P	39.9	Very low	28.6	Very low	121 Å²	121	128.8 Å²	128.8	79%	0.786	77%	0.772	S	S	*	*			trans	-97.5	-172.2	-164.9	41.3	-39.9	0	0	0	114.5
349	A	26.3	Very low	28.6	Very low	94 Å²	94	130.7 Å²	130.7	78%	0.777	77%	0.774	S	S	*	*			trans	122.4	155.5	156.8	0	0	0	0	0	114.8
350	P	53.8	Low	28.4	Very low	113 Å²	113	126.2 Å²	126.2	73%	0.734	76%	0.764	S	S	*	*			trans	-130.1	-137.3	-138.9	42.8	-23.8	0	0	0	114
351	E	26.3	Very low	28.4	Very low	192 Å²	192	131 Å²	131	90%	0.897	77%	0.765	S	S	*	*			trans	76.4	139.9	-177.3	-51.5	174.9	-171.6	0	0	113
352	G	25.3	Very low	28.3	Very low	73 Å²	73	131.8 Å²	131.8	75%	0.753	76%	0.761	S	S	*	*			cis	-175.6	-165.5	5.5	0	0	0	0	0	104.8
353	H	27.5	Very low	28.3	Very low	173 Å²	173	130.1 Å²	130.1	80%	0.801	76%	0.764	S	S	*	*			cis	-170.9	140.6	-3.3	-136.9	-42.8	0	0	0	106.9
354	V	26.5	Very low	28.3	Very low	137 Å²	137	124.4 Å²	124.4	83%	0.83	76%	0.761	S	S	*	*			trans	60.5	149.4	157.6	-160.6	0	0	0	0	119.4
355	G	25.9	Very low	27.7	Very low	73 Å²	73	124.4 Å²	124.4	75%	0.753	77%	0.769	S	S	*	*			trans	142.7	82.4	143.4	0	0	0	0	0	118.2
356	A	24.9	Very low	28	Very low	91 Å²	91	125.6 Å²	125.6	75%	0.752	77%	0.771	S	S	*	*			trans	-62.6	144.4	178.9	0	0	0	0	0	117.1
357	V	25.1	Very low	28.1	Very low	129 Å²	129	123.8 Å²	123.8	78%	0.782	77%	0.766	S	S	*	*				83.3	135	123.6	163.5	0	0	0	0	121.7
358	L	24.3	Very low	28.2	Very low	157 Å²	157	122.3 Å²	122.3	82%	0.822	77%	0.765	S	S	*	*			trans	82.2	105.1	169.9	-60.3	-169.4	0	0	0	122
359	S	25	Very low	27.6	Very low	111 Å²	111	122.8 Å²	122.8	78%	0.776	76%	0.761	S	S	*	*				52.5	123.9	110	-157.4	0	0	0	0	122.5
360	A	24.6	Very low	27.6	Very low	84 Å²	84	124.8 Å²	124.8	69%	0.694	76%	0.758	S	S	*	*			trans	89	121.2	141.9	0	0	0	0	0	121.7
361	K	24.7	Very low	26.2	Very low	170 Å²	170	126 Å²	126	74%	0.739	76%	0.757	S	S	*	*			trans	95.9	117.7	130.5	-82.4	173.4	150.5	-80.9	0	122.5
362	D	24.1	Very low	26.1	Very low	124 Å²	124	120.8 Å²	120.8	66%	0.663	74%	0.742	S	S	*	*				91.9	147.5	124.2	-62.5	-18.5	0	0	0	122.3
363	S	28	Very low	26.1	Very low	123 Å²	123	126.9 Å²	126.9	86%	0.86	75%	0.748	S	S	*	*			trans	80.6	138.6	168.8	-58.7	0	0	0	0	118.3
364	A	25.5	Very low	26	Very low	96 Å²	96	124.3 Å²	124.3	79%	0.793	75%	0.749	S	S	*	*			cis	-156.2	151.5	-13.7	0	0	0	0	0	107.6
365	A	26.5	Very low	26	Very low	95 Å²	95	122.1 Å²	122.1	79%	0.785	75%	0.746	S	S	*	*				151.6	159.7	86.2	0	0	0	0	0	105.4
366	E	29.9	Very low	26.6	Very low	162 Å²	162	124.2 Å²	124.2	76%	0.757	75%	0.746	S	S	*	*			cis	-160.6	161.4	7.7	-138	-173.3	-171.2	0	0	110.5
367	N	28.7	Very low	26.6	Very low	108 Å²	108	124.7 Å²	124.7	58%	0.578	74%	0.744	S	S	*	*			trans	61.1	109.4	151.1	-65.7	-29.5	0	0	0	121.2
368	L	28.8	Very low	26.6	Very low	142 Å²	142	125.2 Å²	125.2	74%	0.743	74%	0.742	S	S	*	*				77.7	130.2	83.7	-76.6	179.9	0	0	0	112.7
369	L	27.3	Very low	26.7	Very low	131 Å²	131	125.6 Å²	125.6	69%	0.686	74%	0.737	S	S	*	*			cis	-150.1	137.2	13.5	-88.8	140.1	0	0	0	109.2
370	L	27.2	Very low	26.6	Very low	137 Å²	137	127.4 Å²	127.4	72%	0.717	74%	0.738	S	S	*	*				58.9	139.6	107.5	-62.7	-168.6	0	0	0	117
371	L	24.3	Very low	26.7	Very low	137 Å²	137	127.2 Å²	127.2	72%	0.717	74%	0.744	S	S	*	*			cis	-155.9	136.5	11.5	-115.3	159	0	0	0	112.2
372	S	24.6	Very low	26.7	Very low	84 Å²	84	124.7 Å²	124.7	59%	0.587	75%	0.748	S	S	*	*			trans	50.8	120.3	134.5	64.7	0	0	0	0	122.1
373	K	24.7	Very low	27.5	Very low	201 Å²	201	124 Å²	124	87%	0.874	75%	0.751	S	S	*	*				67.2	136.3	91.7	-63.2	173.9	177.4	-178.9	0	113.4
374	S	24.9	Very low	27.4	Very low	118 Å²	118	122.9 Å²	122.9	83%	0.825	74%	0.742	S	S	*	*				-166.7	158	56.5	42	0	0	0	0	115.3
375	A	27	Very low	27.5	Very low	91 Å²	91	126.3 Å²	126.3	75%	0.752	74%	0.742	S	S	*	*			trans	-104.9	173.7	143.2	0	0	0	0	0	107.1
376	P	38.8	Very low	27.5	Very low	118 Å²	118	126.8 Å²	126.8	77%	0.766	74%	0.739	S	S	*	*			cis	-145.2	-144.3	18.6	44.1	-21.4	0	0	0	114.1
377	S	24.2	Very low	27.3	Very low	101 Å²	101	122.1 Å²	122.1	71%	0.706	74%	0.735	S	S	*	*			trans	80.4	151.8	171.3	91.4	0	0	0	0	115.8
378	D	25.1	Very low	27.4	Very low	139 Å²	139	125.6 Å²	125.6	74%	0.743	75%	0.747	S	S	*	*			cis	-158.3	153.8	-17.1	-120.8	-36	0	0	0	110
379	K	27.2	Very low	27.1	Very low	166 Å²	166	124.7 Å²	124.7	72%	0.722	74%	0.743	S	S	*	*			trans	37.7	143	147.1	-76.3	-172.8	170.7	-155.1	0	125.9
380	D	23.5	Very low	27.1	Very low	149 Å²	149	123.4 Å²	123.4	80%	0.797	75%	0.745	S	S	*	*			trans	65.6	129.2	141.8	-57.5	-25.4	0	0	0	120.4
381	G	26	Very low	27.2	Very low	79 Å²	79	122.2 Å²	122.2	81%	0.814	74%	0.744	S	S	*	*			trans	154.4	68.6	170.2	0	0	0	0	0	117.2
382	S	25.1	Very low	27.1	Very low	118 Å²	118	122.3 Å²	122.3	83%	0.825	75%	0.745	S	S	*	*			trans	-99.8	165.1	144.5	-60.6	0	0	0	0	107.5
383	P	39.8	Very low	27.4	Very low	110 Å²	110	124.1 Å²	124.1	71%	0.714	75%	0.753	S	S	*	*			cis	-142.1	-173.4	11.7	42.5	-23.5	0	0	0	115.9
384	S	25.8	Very low	27.3	Very low	98 Å²	98	123.1 Å²	123.1	69%	0.685	75%	0.751	S	S	*	*			trans	90.2	139.6	135	-74.1	0	0	0	0	123.6
385	H	27.8	Very low	27.4	Very low	168 Å²	168	122.8 Å²	122.8	78%	0.778	75%	0.749	S	S	*	*			trans	95.6	116.8	138.6	-92.3	-63.3	0	0	0	121
386	S	25.9	Very low	27.4	Very low	105 Å²	105	124.9 Å²	124.9	73%	0.734	75%	0.747	S	S	*	*			trans	48.5	127.8	142.7	52	0	0	0	0	119.2
387	G	25.8	Very low	26.7	Very low	64 Å²	64	125.7 Å²	125.7	66%	0.66	75%	0.745	S	S	*	*			cis	118.8	164.3	12.8	0	0	0	0	0	110.8
388	Q	31.8	Very low	26.9	Very low	181 Å²	181	128 Å²	128	85%	0.846	75%	0.75	S	S	*	*			trans	64.4	147.9	-180	-56.7	-168.4	-68.7	0	0	113.2
389	D	21.7	Very low	27	Very low	124 Å²	124	127.3 Å²	127.3	66%	0.663	75%	0.746	S	S	*	*			cis	168.7	157.5	-15.5	-105	-43.2	0	0	0	101.5
390	S	28.3	Very low	27	Very low	104 Å²	104	128.8 Å²	128.8	73%	0.727	75%	0.747	S	S	*	*			trans	68.7	147.1	163.4	-50.3	0	0	0	0	115.5
391	T	28.4	Very low	27.1	Very low	112 Å²	112	128.5 Å²	128.5	69%	0.687	75%	0.751	S	S	*	*			cis	-162	147.1	-5.3	14	0	0	0	0	107.4
392	D	22.3	Very low	27.1	Very low	138 Å²	138	128.5 Å²	128.5	74%	0.738	75%	0.751	S	S	*	*			trans	33.1	157.1	134.1	-51.5	-25.7	0	0	0	123.3
393	T	30.3	Very low	27.1	Very low	123 Å²	123	128.3 Å²	128.3	76%	0.755	76%	0.756	S	S	*	*			trans	73.3	106.2	170.3	63.2	0	0	0	0	115.3
394	E	24	Very low	26.3	Very low	180 Å²	180	127.9 Å²	127.9	84%	0.841	76%	0.763	S	S	*	*				81.7	145.8	59.6	-73.8	-164	128.7	0	0	114.3
395	S	27.2	Very low	26.3	Very low	111 Å²	111	130.6 Å²	130.6	78%	0.776	78%	0.775	S	S	*	*			trans	70.3	141.3	180	74.7	0	0	0	0	116.7
396	N	25.3	Very low	26	Very low	134 Å²	134	125.8 Å²	125.8	72%	0.717	77%	0.771	S	S	*	*			cis	170.2	124.3	-29.7	-108.1	-22.8	0	0	0	104.8
397	N	25.8	Very low	25.9	Very low	135 Å²	135	129.1 Å²	129.1	72%	0.722	78%	0.779	S	S	*	*			trans	60.9	161.6	151	-48.2	-23.2	0	0	0	118.1
398	D	27.5	Very low	25.7	Very low	150 Å²	150	133 Å²	133	80%	0.802	78%	0.783	S	S	*	*			cis	-123.1	-179.2	0.6	-52.5	-86.1	0	0	0	109.2
399	D	26.8	Very low	25.2	Very low	124 Å²	124	134.1 Å²	134.1	66%	0.663	78%	0.781	S	S	*	*			cis	-159.5	169.8	6.7	-158	-3.6	0	0	0	110.8
400	R	26.8	Very low	25.3	Very low	198 Å²	198	135.8 Å²	135.8	75%	0.747	79%	0.79	S	S	*	*			trans	86.1	95.3	149.6	-83.7	163.3	-164	-147.5	-7.5	123.5
401	T	26.3	Very low	25	Very low	142 Å²	142	136.4 Å²	136.4	87%	0.871	79%	0.789	S	S	*	*				85.2	116.2	120.7	47.5	0	0	0	0	121.5
402	G	25.7	Very low	25.1	Very low	80 Å²	80	138.5 Å²	138.5	83%	0.825	80%	0.796	S	S	*	*			trans	169.1	81.9	164.9	0	0	0	0	0	110.6
403	A	25.4	Very low	25.2	Very low	113 Å²	113	141.2 Å²	141.2	93%	0.934	80%	0.804	S	S	*	*			trans	-71.8	138.7	-162.9	0	0	0	0	0	115.2
404	A	23.2	Very low	25.1	Very low	102 Å²	102	144.3 Å²	144.3	84%	0.843	81%	0.812	S	S	*	*			trans	-118.4	134.3	161.2	0	0	0	0	0	109.3
405	T	26.6	Very low	25	Very low	155 Å²	155	139.5 Å²	139.5	95%	0.951	81%	0.81	S	S	*	*			trans	-80.8	147.5	-178.4	25.5	0	0	0	0	112.5
406	G	21	Very low	25.2	Very low	66 Å²	66	143.2 Å²	143.2	68%	0.68	82%	0.818	S	S	*	*			trans	-145.2	155.4	172.8	0	0	0	0	0	113.3
407	L	23.1	Very low	25.2	Very low	176 Å²	176	148.5 Å²	148.5	92%	0.921	83%	0.828	S	S	*	*			trans	68.5	156.5	169.3	-47	169	0	0	0	113.7
408	I	22.4	Very low	25.4	Very low	145 Å²	145	150.3 Å²	150.3	74%	0.744	84%	0.837	S	S	*	*			cis	-148.4	151.4	27.8	-75.5	175.1	0	0	0	110.4
409	Y	21.2	Very low	25.3	Very low	204 Å²	204	146.8 Å²	146.8	80%	0.8	84%	0.837	S	S	*	*			trans	14.3	144.3	156.4	-81.8	-119.7	0	0	0	122
410	L	23.3	Very low	25.4	Very low	160 Å²	160	147.8 Å²	147.8	84%	0.838	85%	0.847	S	S	*	*				-171.3	162.2	100.9	-97.9	170.4	0	0	0	115.4
411	T	23.3	Very low	25.6	Very low	117 Å²	117	144.3 Å²	144.3	72%	0.718	84%	0.842	S	S	*	*			trans	-66.7	161.9	-169.7	37.2	0	0	0	0	118.5
412	N	28.8	Very low	25.9	Very low	156 Å²	156	143.5 Å²	143.5	83%	0.834	84%	0.84	S	S	*	*			trans	-44.1	146.3	169.3	-70.3	-30.4	0	0	0	115.7
413	H	24.8	Very low	26.1	Very low	195 Å²	195	145.7 Å²	145.7	90%	0.903	83%	0.832	S	S	*	*			trans	-145.4	143.8	148.2	-117.9	-87.4	0	0	0	111.9
414	M	28.6	Very low	26.5	Very low	188 Å²	188	144.2 Å²	144.2	93%	0.926	81%	0.811	S	S	*	*			trans	-80.6	145.5	178.6	-66.6	-94.3	-98.2	0	0	111.5
415	G	22.1	Very low	26.9	Very low	78 Å²	78	148 Å²	148	80%	0.804	81%	0.808	S	S	*	*			trans	-178.9	118.5	169.3	0	0	0	0	0	114.4
416	M	30.9	Very low	27.2	Very low	190 Å²	190	147 Å²	147	94%	0.936	79%	0.793	S	S	*	*			trans	-80.9	140.5	169.3	-68.1	-161	178.1	0	0	111.4
417	R	25.5	Very low	27.7	Very low	244 Å²	244	150.3 Å²	150.3	92%	0.921	79%	0.791	S	S	*	*			trans	-170.2	147.9	138	-110.9	165.1	179.5	179.7	-1.2	113.4
418	N	30	Very low	28.1	Very low	173 Å²	173	146.6 Å²	146.6	93%	0.925	77%	0.769	S	S	*	*			trans	-66.7	140.3	175.7	-60.5	-25.7	0	0	0	111.3
419	G	25.7	Very low	28.6	Very low	76 Å²	76	146.5 Å²	146.5	78%	0.784	77%	0.765	S	S	*	*			trans	-156.3	131.4	170.8	0	0	0	0	0	110.1
420	V	28	Very low	29	Very low	146 Å²	146	145.1 Å²	145.1	89%	0.885	76%	0.758	S	S	*	*			trans	-83.4	149.4	-175.7	173.8	0	0	0	0	111
421	L	31.5	Very low	29.4	Very low	124 Å²	124	145.6 Å²	145.6	65%	0.649	75%	0.75	S	S	*	*			trans	-47.5	156	-177.2	-68.2	151.7	0	0	0	115.7	V424	L421-V424 HydrophobicContact CD1-CG2 3.56Å; L421-V424 HydrophobicContact CD2-CG2 3.85Å; L421-V424 HydrophobicContact CG-CG2 4.2Å
422	P	33	Very low	29.8	Very low	125 Å²	125	143 Å²	143	81%	0.812	73%	0.732	S	S	*	*				-143.4	89.1	109.3	36.3	-20.9	0	0	0	114.3
423	L	30.1	Very low	30	Very low	127 Å²	127	138.3 Å²	138.3	67%	0.665	72%	0.715	S	S	*	*			trans	-136.8	-2.6	169.3	-79.4	176.6	0	0	0	115.6	K425	L423-K425 PolarHBondContact O-N 3Å
424	V	32.7	Very low	30.3	Very low	81 Å²	81	134.4 Å²	134.4	49%	0.491	70%	0.699	S	S	.	*	H	α-helix	trans	-76.1	-17.3	-169.5	-173.7	0	0	0	0	114.3	L421 Q428	L421-V424 HydrophobicContact CD1-CG2 3.56Å; L421-V424 HydrophobicContact CD2-CG2 3.85Å; L421-V424 HydrophobicContact CG-CG2 4.2Å; V424-Q428 WeakPolarHBondContact O-CB 3.43Å; V424-Q428 PolarHBondContact O-N 2.9Å
425	K	32.6	Very low	30.4	Very low	182 Å²	182	134.3 Å²	134.3	79%	0.791	69%	0.689	S	S	*	*	H	α-helix	trans	-77.2	-36.3	-172.6	-70.8	-171.7	175.7	-176.7	0	114.1	L423 Q429	L423-K425 PolarHBondContact O-N 3Å; K425-Q429 WeakPolarHBondContact O-CG 3.27Å; K425-Q429 PolarHBondContact O-N 3.39Å
426	E	32.7	Very low	30.7	Very low	133 Å²	133	138 Å²	138	62%	0.621	69%	0.685	S	S	*	*	H	α-helix	trans	-80.6	-34.3	-179.7	-67.3	-175	145.6	0	0	112.7	R430	E426-R430 PolarHBondContact O-N 3.48Å; E426-R430 VanDerWaalsContact O-N 3.09Å
427	E	32.2	Very low	30.8	Very low	137 Å²	137	134 Å²	134	64%	0.64	67%	0.671	S	S	*	*	H	α-helix	trans	-68.7	-38	174.5	-72.2	-167.6	130.8	0	0	112.2	R430 Y431	E427-R430 PolarHBondContact O-N 3.46Å; E427-Y431 PolarHBondContact O-N 2.89Å
428	Q	31.3	Very low	31.2	Very low	97 Å²	97	126.1 Å²	126.1	45%	0.453	66%	0.658	S	S	.	*	H	α-helix	trans	-66.3	-42.7	176.6	-171.1	60	51.9	0	0	111.6	V424 R430 Y431 D432	V424-Q428 WeakPolarHBondContact O-CB 3.43Å; V424-Q428 PolarHBondContact O-N 2.9Å; Q428-R430 VanDerWaalsContact C-N 3.33Å; Q428-R430 PolarHBondContact O-N 3.5Å; Q428-Y431 PolarHBondContact O-N 2.93Å; Q428-Y431 VanDerWaalsContact O-N 3.13Å; Q428-D432 PolarHBondContact NE2-OD1 3.12Å; Q428-D432 PolarHBondContact NE2-OD2 2.95Å; Q428-D432 PolarHBondContact O-N 3.46Å
429	Q	31.6	Very low	31.5	Very low	144 Å²	144	121.3 Å²	121.3	67%	0.673	64%	0.642	S	S	*	*	H	α-helix	trans	-63.3	-35.7	174.7	-77.2	-178	-33.2	0	0	112.9	K425 A433	K425-Q429 WeakPolarHBondContact O-CG 3.27Å; K425-Q429 PolarHBondContact O-N 3.39Å; Q429-A433 VanDerWaalsContact O-CB 3.27Å; Q429-A433 WeakPolarHBondContact O-CB 3.44Å; Q429-A433 PolarHBondContact O-N 2.92Å
430	R	30.7	Very low	32.1	Very low	174 Å²	174	124 Å²	124	66%	0.657	64%	0.638	S	S	*	*	H	α-helix	trans	-66.1	-42	170.5	-76.9	-179.9	177	157.3	3.4	112	E426 E427 Q428 I434	E426-R430 PolarHBondContact O-N 3.48Å; E426-R430 VanDerWaalsContact O-N 3.09Å; E427-R430 PolarHBondContact O-N 3.46Å; Q428-R430 VanDerWaalsContact C-N 3.33Å; Q428-R430 PolarHBondContact O-N 3.5Å; R430-I434 WeakPolarHBondContact O-CB 3.33Å; R430-I434 WeakPolarHBondContact O-CD1 3.45Å; R430-I434 WeakPolarHBondContact O-CG1 3.33Å; R430-I434 PolarHBondContact O-N 2.84Å
431	Y	31.3	Very low	32.8	Very low	170 Å²	170	117.8 Å²	117.8	67%	0.667	60%	0.604	S	S	*	*	H	α-helix	trans	-62.3	-44.6	177.2	-113.6	-86.4	0	0	0	112.3	E427 Q428 I434 R435	E427-Y431 PolarHBondContact O-N 2.89Å; Q428-Y431 PolarHBondContact O-N 2.93Å; Q428-Y431 VanDerWaalsContact O-N 3.13Å; Y431-I434 PolarHBondContact O-N 3.38Å; Y431-R435 WeakPolarHBondContact O-CB 3.3Å; Y431-R435 PolarHBondContact O-N 2.88Å
432	D	32	Very low	33.4	Very low	64 Å²	64	119.1 Å²	119.1	34%	0.342	61%	0.605	S	S	.	*	H	α-helix	trans	-70.9	-38.4	-179.6	-68.4	-43.5	0	0	0	111.8	Q428 R435 E436	Q428-D432 PolarHBondContact NE2-OD1 3.12Å; Q428-D432 PolarHBondContact NE2-OD2 2.95Å; Q428-D432 PolarHBondContact O-N 3.46Å; D432-R435 WeakPolarHBondContact O-CB 3.47Å; D432-R435 PolarHBondContact O-N 3.05Å; D432-R435 VanDerWaalsContact O-N 3.17Å; D432-E436 PolarHBondContact O-N 2.81Å
433	A	31.9	Very low	33.8	Very low	56 Å²	56	120 Å²	120	46%	0.463	60%	0.596	S	S	.	*	H	α-helix	trans	-64.8	-38.9	172.3	0	0	0	0	0	113.1	Q429 R435 E436 V437	Q429-A433 VanDerWaalsContact O-CB 3.27Å; Q429-A433 WeakPolarHBondContact O-CB 3.44Å; Q429-A433 PolarHBondContact O-N 2.92Å; A433-R435 VanDerWaalsContact C-N 3.29Å; A433-R435 PolarHBondContact O-N 2.96Å; A433-E436 PolarHBondContact O-N 3.38Å; A433-V437 WeakPolarHBondContact O-CG2 3.49Å; A433-V437 PolarHBondContact O-N 2.69Å
434	I	31.8	Very low	34.5	Very low	114 Å²	114	117.4 Å²	117.4	59%	0.585	59%	0.585	S	S	*	*	H	α-helix	trans	-67.2	-33.1	173.2	-70.1	165.3	0	0	0	110.6	R430 Y431 V437 A438	R430-I434 WeakPolarHBondContact O-CB 3.33Å; R430-I434 WeakPolarHBondContact O-CD1 3.45Å; R430-I434 WeakPolarHBondContact O-CG1 3.33Å; R430-I434 PolarHBondContact O-N 2.84Å; Y431-I434 PolarHBondContact O-N 3.38Å; I434-V437 PolarHBondContact O-N 2.88Å; I434-A438 WeakPolarHBondContact O-CB 3.27Å; I434-A438 PolarHBondContact O-N 3.02Å
435	R	31.2	Very low	34.9	Very low	185 Å²	185	117.8 Å²	117.8	70%	0.698	59%	0.588	S	S	*	*	H	α-helix	trans	-71.3	-31.3	178.6	-156.3	179.4	72.3	161.4	4.7	113	Y431 D432 A433 A439	Y431-R435 WeakPolarHBondContact O-CB 3.3Å; Y431-R435 PolarHBondContact O-N 2.88Å; D432-R435 WeakPolarHBondContact O-CB 3.47Å; D432-R435 PolarHBondContact O-N 3.05Å; D432-R435 VanDerWaalsContact O-N 3.17Å; A433-R435 VanDerWaalsContact C-N 3.29Å; A433-R435 PolarHBondContact O-N 2.96Å; R435-A439 PolarHBondContact O-N 3.36Å
436	E	28.9	Very low	35.4	Very low	156 Å²	156	111.7 Å²	111.7	73%	0.729	57%	0.566	S	S	*	*	H	α-helix	trans	-70.6	-43	170.5	-68.4	-156.2	145.1	0	0	112	D432 A433 A438 A439	D432-E436 PolarHBondContact O-N 2.81Å; A433-E436 PolarHBondContact O-N 3.38Å; E436-A438 PolarHBondContact O-N 2.88Å; E436-A439 WeakPolarHBondContact O-CB 3.4Å; E436-A439 PolarHBondContact O-N 3.36Å; E436-A439 VanDerWaalsContact O-N 3.1Å
437	V	33	Very low	35.6	Very low	107 Å²	107	110.5 Å²	110.5	65%	0.648	58%	0.579	S	S	*	*	H	α-helix	trans	-65.6	-25.5	176.3	178.5	0	0	0	0	112.4	A433 I434	A433-V437 WeakPolarHBondContact O-CG2 3.49Å; A433-V437 PolarHBondContact O-N 2.69Å; I434-V437 PolarHBondContact O-N 2.88Å
438	A	32.7	Very low	36	Very low	78 Å²	78	110.9 Å²	110.9	65%	0.645	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	-5	175.7	0	0	0	0	0	114.7	I434 E436	I434-A438 WeakPolarHBondContact O-CB 3.27Å; I434-A438 PolarHBondContact O-N 3.02Å; E436-A438 PolarHBondContact O-N 2.88Å
439	A	36.5	Very low	36.3	Very low	71 Å²	71	108.6 Å²	108.6	59%	0.587	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-28.5	-178.1	0	0	0	0	0	113.4	R435 E436 G441	R435-A439 PolarHBondContact O-N 3.36Å; E436-A439 WeakPolarHBondContact O-CB 3.4Å; E436-A439 PolarHBondContact O-N 3.36Å; E436-A439 VanDerWaalsContact O-N 3.1Å; A439-G441 PolarHBondContact O-N 3.43Å
440	D	39.3	Very low	36.7	Very low	132 Å²	132	108.2 Å²	108.2	71%	0.706	59%	0.586	S	S	*	*	S	Bend	trans	-87.6	104.2	179.2	-85.1	-24.2	0	0	0	111.8	F442	D440-F442 PolarHBondContact O-N 3.06Å
441	G	42.8	Very low	37.4	Very low	16 Å²	16	106 Å²	106	17%	0.165	58%	0.583	C	S	.	*	P	Polyproline II helix	trans	-63.1	121.3	169.2	0	0	0	0	0	110.9	A439 K443 A454	A439-G441 PolarHBondContact O-N 3.43Å; G441-K443 PolarHBondContact O-N 3.12Å; G441-A454 WeakPolarHBondContact CA-O 3.43Å
442	F	44.1	Very low	37.9	Very low	152 Å²	152	99.3 Å²	99.3	67%	0.667	56%	0.56	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-65.8	129.7	-177.3	-61.1	-83.7	0	0	0	110.4	D440 V444 A454	D440-F442 PolarHBondContact O-N 3.06Å; F442-V444 PolarHBondContact O-N 2.81Å; F442-A454 PolarHBondContact N-O 2.82Å; F442-A454 PolarHBondContact O-N 3.49Å
443	K	41.3	Very low	38.3	Very low	143 Å²	143	102 Å²	102	62%	0.622	57%	0.565	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-76.5	119.8	178.1	-66.8	-176.6	170.8	-165.8	0	110.4	G441 R453	G441-K443 PolarHBondContact O-N 3.12Å; K443-R453 HydrophobicContact CG-CG 4.49Å
444	V	43.3	Very low	38.7	Very low	73 Å²	73	99.9 Å²	99.9	44%	0.442	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	130.5	170.8	-175.8	0	0	0	0	107.7	F442 V452 A454	F442-V444 PolarHBondContact O-N 2.81Å; V444-V452 PolarHBondContact N-O 2.97Å; V444-V452 PolarHBondContact O-N 3.18Å; V444-A454 HydrophobicContact CG2-CB 3.9Å
445	V	41.1	Very low	39.1	Very low	90 Å²	90	99 Å²	99	55%	0.545	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	124.1	174.8	-169.5	0	0	0	0	107.9	E450 Q451	V445-E450 WeakPolarHBondContact CA-O 3.47Å; V445-Q451 HydrophobicContact CG2-CG 4.32Å
446	T	44.6	Very low	39.4	Very low	53 Å²	53	98.2 Å²	98.2	33%	0.325	54%	0.535	S	S	.	.			trans	-71	165	173.3	60.7	0	0	0	0	110.6	D448 G449 E450 V452	T446-D448 PolarHBondContact O-N 3.01Å; T446-G449 PolarHBondContact O-N 3.48Å; T446-E450 PolarHBondContact N-O 3.28Å; T446-E450 PolarHBondContact OG1-N 3.49Å; T446-E450 PolarHBondContact OG1-O 3.29Å; T446-V452 HydrophobicContact CG2-CG2 4.08Å
447	A	37.1	Very low	39.7	Very low	109 Å²	109	92.8 Å²	92.8	90%	0.901	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-22.7	178	0	0	0	0	0	113.1	G449	A447-G449 VanDerWaalsContact C-N 3.35Å
448	D	40.4	Very low	39.8	Very low	145 Å²	145	93.5 Å²	93.5	78%	0.775	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-0.7	-178.8	-42.4	-55.9	0	0	0	112.8	T446	T446-D448 PolarHBondContact O-N 3.01Å
449	G	37.5	Very low	39.8	Very low	49 Å²	49	95.7 Å²	95.7	51%	0.505	52%	0.518	S	S	.	.	S	Bend	trans	93.1	0.5	174.8	0	0	0	0	0	115.8	T446 A447	T446-G449 PolarHBondContact O-N 3.48Å; A447-G449 VanDerWaalsContact C-N 3.35Å
450	E	39.3	Very low	39.7	Very low	135 Å²	135	96.1 Å²	96.1	63%	0.631	52%	0.516	S	S	*	.			trans	-77.4	134.2	180	-62.3	-168.7	140.2	0	0	111.9	V445 T446	V445-E450 WeakPolarHBondContact CA-O 3.47Å; T446-E450 PolarHBondContact N-O 3.28Å; T446-E450 PolarHBondContact OG1-N 3.49Å; T446-E450 PolarHBondContact OG1-O 3.29Å
451	Q	44.4	Very low	39.5	Very low	128 Å²	128	100.1 Å²	100.1	60%	0.598	52%	0.521	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.9	109.6	176.6	-67.8	-178.5	28.7	0	0	110.4	V445	V445-Q451 HydrophobicContact CG2-CG 4.32Å
452	V	41.8	Very low	39.1	Very low	29 Å²	29	101.4 Å²	101.4	18%	0.176	53%	0.525	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	134.1	177.5	-168.4	0	0	0	0	109.3	V444 T446 L465 D466	V444-V452 PolarHBondContact N-O 2.97Å; V444-V452 PolarHBondContact O-N 3.18Å; T446-V452 HydrophobicContact CG2-CG2 4.08Å; V452-L465 HydrophobicContact CB-CD2 4.11Å; V452-L465 HydrophobicContact CG1-CB 3.96Å; V452-L465 HydrophobicContact CG1-CD2 3.65Å; V452-L465 HydrophobicContact CG1-CG 4.39Å; V452-D466 HydrophobicContact CG1-CB 4.09Å
453	R	40.3	Very low	38.6	Very low	120 Å²	120	100.4 Å²	100.4	45%	0.453	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	136.3	172.7	-76.9	172.8	-69.2	-123.5	-8.9	110.4	K443 Y455 D466	K443-R453 HydrophobicContact CG-CG 4.49Å; R453-Y455 HydrophobicContact CB-CE2 4.01Å; R453-D466 IonicContact CZ-OD2 3.9Å; R453-D466 IonicContact NE-OD2 2.77Å; R453-D466 PolarHBondContact NE-OD2 3.46Å; R453-D466 IonicContact NH2-OD2 3.86Å; R453-D466 PolarHBondContact NH2-OD2 2.91Å; R453-D466 PolarHBondContact O-N 3.42Å
454	A	41.3	Very low	38.6	Very low	12 Å²	12	98.6 Å²	98.6	10%	0.099	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	134.8	175.4	0	0	0	0	0	111.8	G441 F442 V444 F464 L465	G441-A454 WeakPolarHBondContact CA-O 3.43Å; F442-A454 PolarHBondContact N-O 2.82Å; F442-A454 PolarHBondContact O-N 3.49Å; V444-A454 HydrophobicContact CG2-CB 3.9Å; A454-F464 WeakPolarHBondContact CA-O 3.49Å; A454-L465 HydrophobicContact CB-CD2 3.93Å
455	Y	40.2	Very low	38.2	Very low	97 Å²	97	100.1 Å²	100.1	38%	0.38	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	136.7	179	-59.1	-85.5	0	0	0	110.6	R453 L463 F464	R453-Y455 HydrophobicContact CB-CE2 4.01Å; Y455-L463 WeakPolarHBondContact O-CA 3.38Å; Y455-F464 PolarHBondContact N-O 3.49Å; Y455-F464 PolarHBondContact O-N 3.01Å
456	R	37.3	Very low	38	Very low	167 Å²	167	98 Å²	98	63%	0.63	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.6	118.7	179.8	173.6	176.3	164	151	-8.8	110.5	E458 L463	R456-E458 IonicContact CZ-OE1 3.39Å; R456-E458 IonicContact NE-OE1 2.92Å; R456-E458 PolarHBondContact NE-OE1 3.46Å; R456-E458 IonicContact NH2-OE1 2.95Å; R456-E458 PolarHBondContact NH2-OE1 3.31Å; R456-E458 PolarHBondContact O-N 3.45Å; R456-L463 HydrophobicContact CB-CD2 4.02Å
457	C	35.9	Very low	37.4	Very low	43 Å²	43	103.7 Å²	103.7	29%	0.291	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	98.7	173.3	-175.8	0	0	0	0	110.2	C460 R461 V462 F464	C457-C460 HydrophobicContact CB-CB 4.32Å; C457-C460 CarbonylContact O-C 3.59Å; C457-C460 PolarHBondContact O-N 3.34Å; C457-R461 PolarHBondContact O-N 3.25Å; C457-V462 PolarHBondContact N-O 2.83Å; C457-F464 HydrophobicContact CB-CE2 3.82Å
458	E	35.1	Very low	37.1	Very low	121 Å²	121	102.7 Å²	102.7	57%	0.565	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.8	-46.2	179.7	-86.1	-75.6	106.8	0	0	114.5	R456 C460	R456-E458 IonicContact CZ-OE1 3.39Å; R456-E458 IonicContact NE-OE1 2.92Å; R456-E458 PolarHBondContact NE-OE1 3.46Å; R456-E458 IonicContact NH2-OE1 2.95Å; R456-E458 PolarHBondContact NH2-OE1 3.31Å; R456-E458 PolarHBondContact O-N 3.45Å; E458-C460 PolarHBondContact O-N 2.96Å; E458-C460 VanDerWaalsContact O-N 3.12Å
459	P	32.6	Very low	36.4	Very low	124 Å²	124	103.7 Å²	103.7	81%	0.805	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-21.8	177	-26.5	35	0	0	0	115.5
460	C	33	Very low	36.2	Very low	81 Å²	81	106.3 Å²	106.3	55%	0.547	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117	-16.5	-171.8	-58.4	0	0	0	0	113.3	C457 E458 V462	C457-C460 HydrophobicContact CB-CB 4.32Å; C457-C460 CarbonylContact O-C 3.59Å; C457-C460 PolarHBondContact O-N 3.34Å; E458-C460 PolarHBondContact O-N 2.96Å; E458-C460 VanDerWaalsContact O-N 3.12Å; C460-V462 HydrophobicContact CB-CB 4.41Å; C460-V462 HydrophobicContact CB-CG2 4.03Å; C460-V462 PolarHBondContact O-N 2.91Å
461	R	35.9	Very low	35.6	Very low	216 Å²	216	105 Å²	105	82%	0.815	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	31.4	-168.4	-65.4	-177.8	172.3	173.9	-3.5	114.2	C457	C457-R461 PolarHBondContact O-N 3.25Å
462	V	34.4	Very low	34.9	Very low	43 Å²	43	103.7 Å²	103.7	26%	0.261	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	138.7	175.5	179.8	0	0	0	0	110.1	C457 C460 F464 I472	C457-V462 PolarHBondContact N-O 2.83Å; C460-V462 HydrophobicContact CB-CB 4.41Å; C460-V462 HydrophobicContact CB-CG2 4.03Å; C460-V462 PolarHBondContact O-N 2.91Å; V462-F464 HydrophobicContact CB-CE2 4.15Å; V462-F464 HydrophobicContact CB-CZ 4.09Å; V462-F464 HydrophobicContact CG1-CE1 4.01Å; V462-F464 HydrophobicContact CG1-CE2 3.99Å; V462-F464 HydrophobicContact CG1-CZ 3.71Å; V462-I472 HydrophobicContact CG1-CD1 4.37Å; V462-I472 HydrophobicContact CG2-CD1 4.37Å
463	L	33.8	Very low	34.2	Very low	130 Å²	130	110.6 Å²	110.6	68%	0.681	54%	0.539	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100	135.8	171	-76.2	162.4	0	0	0	109.9	Y455 R456	Y455-L463 WeakPolarHBondContact O-CA 3.38Å; R456-L463 HydrophobicContact CB-CD2 4.02Å
464	F	40.7	Very low	33.6	Very low	106 Å²	106	113.3 Å²	113.3	47%	0.465	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.4	151.7	176.3	-56.1	-88	0	0	0	109.8	A454 Y455 C457 V462	A454-F464 WeakPolarHBondContact CA-O 3.49Å; Y455-F464 PolarHBondContact N-O 3.49Å; Y455-F464 PolarHBondContact O-N 3.01Å; C457-F464 HydrophobicContact CB-CE2 3.82Å; V462-F464 HydrophobicContact CB-CE2 4.15Å; V462-F464 HydrophobicContact CB-CZ 4.09Å; V462-F464 HydrophobicContact CG1-CE1 4.01Å; V462-F464 HydrophobicContact CG1-CE2 3.99Å; V462-F464 HydrophobicContact CG1-CZ 3.71Å
465	L	35	Very low	32.9	Very low	104 Å²	104	116.1 Å²	116.1	55%	0.545	59%	0.589	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-128.2	143.1	174.7	-74.7	164.7	0	0	0	109.1	V452 A454 H467	V452-L465 HydrophobicContact CB-CD2 4.11Å; V452-L465 HydrophobicContact CG1-CB 3.96Å; V452-L465 HydrophobicContact CG1-CD2 3.65Å; V452-L465 HydrophobicContact CG1-CG 4.39Å; A454-L465 HydrophobicContact CB-CD2 3.93Å; L465-H467 PolarHBondContact O-N 3Å
466	D	36.4	Very low	32.6	Very low	47 Å²	47	117 Å²	117	25%	0.251	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-51.9	127.4	-176.3	-91.8	-13	0	0	0	112.3	V452 R453	V452-D466 HydrophobicContact CG1-CB 4.09Å; R453-D466 IonicContact CZ-OD2 3.9Å; R453-D466 IonicContact NE-OD2 2.77Å; R453-D466 PolarHBondContact NE-OD2 3.46Å; R453-D466 IonicContact NH2-OD2 3.86Å; R453-D466 PolarHBondContact NH2-OD2 2.91Å; R453-D466 PolarHBondContact O-N 3.42Å
467	H	32.6	Very low	32.2	Very low	172 Å²	172	116.4 Å²	116.4	80%	0.796	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	81.1	8.7	166.5	-50.9	-53.3	0	0	0	122	L465	L465-H467 PolarHBondContact O-N 3Å
468	V	30.4	Very low	32	Very low	88 Å²	88	121 Å²	121	53%	0.533	63%	0.634	S	S	.	*			trans	-132.1	111.1	164.1	-173.3	0	0	0	0	113	Y470 I487	V468-Y470 HydrophobicContact CG1-CD2 4.28Å; V468-Y470 HydrophobicContact CG1-CE2 3.72Å; V468-Y470 PolarHBondContact O-N 3.15Å; V468-I487 HydrophobicContact CB-CD1 4.46Å; V468-I487 HydrophobicContact CG1-CD1 4.44Å; V468-I487 HydrophobicContact CG2-CD1 4.49Å
469	M	27.2	Very low	31.8	Very low	165 Å²	165	122.5 Å²	122.5	81%	0.813	64%	0.641	S	S	*	*			trans	-78.4	108.1	175.3	-76.7	-174.1	66.5	0	0	112.5
470	Y	31.6	Very low	32	Very low	104 Å²	104	123.8 Å²	123.8	41%	0.408	63%	0.629	S	S	.	*			trans	-85.5	115.6	161.6	-79.6	-74.1	0	0	0	111.8	V468 I472 N486 I487	V468-Y470 HydrophobicContact CG1-CD2 4.28Å; V468-Y470 HydrophobicContact CG1-CE2 3.72Å; V468-Y470 PolarHBondContact O-N 3.15Å; Y470-I472 PolarHBondContact O-N 2.88Å; Y470-N486 HydrophobicContact CE1-CB 3.97Å; Y470-I487 HydrophobicContact CE2-CD1 3.71Å; Y470-I487 HydrophobicContact CE2-CG1 3.67Å; Y470-I487 WeakPolarHBondContact OH-CG1 3.43Å
471	T	28.5	Very low	32.1	Very low	107 Å²	107	125.3 Å²	125.3	66%	0.656	63%	0.632	S	S	*	*			trans	-78.9	94.9	173.7	34.8	0	0	0	0	111.4	H473	T471-H473 PolarHBondContact O-N 3.42Å; T471-H473 VanDerWaalsContact O-N 3.13Å
472	I	29.1	Very low	32.1	Very low	101 Å²	101	119.2 Å²	119.2	52%	0.518	62%	0.621	S	S	.	*			trans	-74.5	100.7	170.6	-56	177.4	0	0	0	109.3	V462 Y470 M474	V462-I472 HydrophobicContact CG1-CD1 4.37Å; V462-I472 HydrophobicContact CG2-CD1 4.37Å; Y470-I472 PolarHBondContact O-N 2.88Å; I472-M474 PolarHBondContact O-N 3.24Å
473	H	26.3	Very low	32.3	Very low	175 Å²	175	123.1 Å²	123.1	81%	0.81	63%	0.634	S	S	*	*			trans	-77	100.6	172.9	-85.6	-66.4	0	0	0	111.6	T471 G475	T471-H473 PolarHBondContact O-N 3.42Å; T471-H473 VanDerWaalsContact O-N 3.13Å; H473-G475 VanDerWaalsContact C-N 3.34Å; H473-G475 PolarHBondContact O-N 3.46Å
474	M	28.1	Very low	32.5	Very low	177 Å²	177	120.8 Å²	120.8	87%	0.872	62%	0.62	S	S	*	*			trans	-73.1	86.2	166.9	-70.2	-62.3	-75.7	0	0	110.9	I472	I472-M474 PolarHBondContact O-N 3.24Å
475	G	27.5	Very low	32.3	Very low	70 Å²	70	117.3 Å²	117.3	72%	0.722	61%	0.608	S	S	*	*			trans	-89	122.1	171	0	0	0	0	0	111.7	H473	H473-G475 VanDerWaalsContact C-N 3.34Å; H473-G475 PolarHBondContact O-N 3.46Å
476	C	33.9	Very low	32.2	Very low	116 Å²	116	118.6 Å²	118.6	78%	0.784	62%	0.616	S	S	*	*			trans	-65.7	143.1	172.7	-61.4	0	0	0	0	112.2
477	H	28.1	Very low	32	Very low	155 Å²	155	121.9 Å²	121.9	72%	0.718	63%	0.632	S	S	*	*	S	Bend	trans	108	97	166.1	-64.7	-71.2	0	0	0	119	H479	H477-H479 PolarHBondContact O-N 2.88Å
478	D	31.6	Very low	32	Very low	140 Å²	140	118 Å²	118	75%	0.749	62%	0.623	S	S	*	*	S	Bend		68	4.4	129.5	-55.7	-48	0	0	0	121.3
479	H	31	Very low	32.1	Very low	152 Å²	152	116.1 Å²	116.1	70%	0.704	62%	0.622	S	S	*	*			trans	-129.9	121.7	167.9	-66.5	-36.8	0	0	0	112.1	H477	H477-H479 PolarHBondContact O-N 2.88Å
480	R	36.9	Very low	32.5	Very low	150 Å²	150	114.6 Å²	114.6	57%	0.566	61%	0.613	S	S	*	*			trans	-95.3	102.9	177.3	-59.9	-176.8	-168.4	158.1	4.3	109.3	Y496 F498	R480-Y496 WeakPolarHBondContact CD-O 3.3Å; R480-Y496 VanDerWaalsContact CZ-O 3.3Å; R480-Y496 PolarHBondContact NE-O 3.09Å; R480-Y496 PolarHBondContact NH1-O 2.92Å; R480-Y496 VanDerWaalsContact NH1-O 3.1Å; R480-F498 PolarHBondContact NH2-O 2.77Å
481	D	34.2	Very low	32.7	Very low	113 Å²	113	115.4 Å²	115.4	60%	0.604	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-92.8	145.5	166.8	-69.2	-39.6	0	0	0	109.5
482	P	37.5	Very low	33.3	Very low	89 Å²	89	112.2 Å²	112.2	58%	0.578	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-69.1	142.5	175	28.8	-33.6	0	0	0	111.1
483	F	38.5	Very low	33.7	Very low	124 Å²	124	116.3 Å²	116.3	54%	0.544	61%	0.614	S	S	.	*	P	Polyproline II helix	trans	-82.6	135.9	179.9	-175.8	-96.7	0	0	0	110.9	C485 R491 S492	F483-C485 HydrophobicContact CE1-CB 4.23Å; F483-R491 WeakPolarHBondContact O-CA 3.49Å; F483-S492 PolarHBondContact O-N 2.68Å; F483-S492 PolarHBondContact O-OG 3.15Å
484	E	36.5	Very low	34.1	Very low	81 Å²	81	113.5 Å²	113.5	38%	0.379	61%	0.605	S	S	.	*	B	Isolated β-bridge	trans	-119.6	123.4	174.2	-173	164	-169.7	0	0	108.7	N486 R491	E484-N486 PolarHBondContact O-N 3.46Å; E484-R491 HydrophobicContact CB-CG 3.94Å; E484-R491 VanDerWaalsContact CD-NE 3.27Å; E484-R491 HydrophobicContact CG-CG 3.74Å; E484-R491 IonicContact OE1-NE 2.82Å; E484-R491 IonicContact OE1-NH2 2.68Å; E484-R491 IonicContact OE2-CZ 3.52Å; E484-R491 IonicContact OE2-NE 2.67Å; E484-R491 PolarHBondContact OE2-NE 3.4Å; E484-R491 IonicContact OE2-NH2 3.45Å; E484-R491 PolarHBondContact OE2-NH2 2.82Å
485	C	38	Very low	34.2	Very low	33 Å²	33	115.9 Å²	115.9	22%	0.223	60%	0.604	C	S	.	*			trans	-81.3	115.4	179.9	-179.4	0	0	0	0	110.8	F483 I487 C488 G489 H490	F483-C485 HydrophobicContact CE1-CB 4.23Å; C485-I487 PolarHBondContact O-N 3.33Å; C485-I487 VanDerWaalsContact O-N 3.1Å; C485-C488 VanDerWaalsContact CB-SG 3.6Å; C485-C488 PolarHBondContact O-N 3.29Å; C485-C488 VanDerWaalsContact SG-SG 3.6Å; C485-G489 WeakPolarHBondContact O-CA 3.45Å; C485-G489 PolarHBondContact O-N 3.01Å; C485-H490 PolarHBondContact N-O 3.01Å
486	N	33.1	Very low	34.4	Very low	132 Å²	132	120.1 Å²	120.1	71%	0.706	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-3.8	-176.9	-66.9	-18.8	0	0	0	115.3	Y470 E484	Y470-N486 HydrophobicContact CE1-CB 3.97Å; E484-N486 PolarHBondContact O-N 3.46Å
487	I	31	Very low	33.9	Very low	116 Å²	116	122.5 Å²	122.5	60%	0.595	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	-52.6	169.3	-58.6	-164.7	0	0	0	111.2	V468 Y470 C485	V468-I487 HydrophobicContact CB-CD1 4.46Å; V468-I487 HydrophobicContact CG1-CD1 4.44Å; V468-I487 HydrophobicContact CG2-CD1 4.49Å; Y470-I487 HydrophobicContact CE2-CD1 3.71Å; Y470-I487 HydrophobicContact CE2-CG1 3.67Å; Y470-I487 WeakPolarHBondContact OH-CG1 3.43Å; C485-I487 PolarHBondContact O-N 3.33Å; C485-I487 VanDerWaalsContact O-N 3.1Å
488	C	33.8	Very low	33.7	Very low	89 Å²	89	123.6 Å²	123.6	60%	0.601	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	0.4	-169.1	63.3	0	0	0	0	114.8	C485 H490	C485-C488 VanDerWaalsContact CB-SG 3.6Å; C485-C488 PolarHBondContact O-N 3.29Å; C485-C488 VanDerWaalsContact SG-SG 3.6Å; C488-H490 PolarHBondContact O-N 2.93Å; C488-H490 VanDerWaalsContact O-N 3.09Å
489	G	31.7	Very low	33.3	Very low	50 Å²	50	121.3 Å²	121.3	52%	0.515	60%	0.597	S	S	.	*			trans	65.9	8.6	-179.1	0	0	0	0	0	114.5	C485 R491	C485-G489 WeakPolarHBondContact O-CA 3.45Å; C485-G489 PolarHBondContact O-N 3.01Å; G489-R491 PolarHBondContact O-N 3.43Å
490	H	35.1	Very low	33	Very low	133 Å²	133	119.9 Å²	119.9	62%	0.616	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-78.9	121.9	-176	-163.5	69.3	0	0	0	111	C485 C488	C485-H490 PolarHBondContact N-O 3.01Å; C488-H490 PolarHBondContact O-N 2.93Å; C488-H490 VanDerWaalsContact O-N 3.09Å
491	R	37.3	Very low	32.4	Very low	121 Å²	121	120 Å²	120	46%	0.457	61%	0.611	S	S	.	*	B	Isolated β-bridge	trans	-93.3	121	170.9	-76.1	-174.1	168.6	-173.5	-1.1	110.4	F483 E484 G489 Q493	F483-R491 WeakPolarHBondContact O-CA 3.49Å; E484-R491 HydrophobicContact CB-CG 3.94Å; E484-R491 VanDerWaalsContact CD-NE 3.27Å; E484-R491 HydrophobicContact CG-CG 3.74Å; E484-R491 IonicContact OE1-NE 2.82Å; E484-R491 IonicContact OE1-NH2 2.68Å; E484-R491 IonicContact OE2-CZ 3.52Å; E484-R491 IonicContact OE2-NE 2.67Å; E484-R491 PolarHBondContact OE2-NE 3.4Å; E484-R491 IonicContact OE2-NH2 3.45Å; E484-R491 PolarHBondContact OE2-NH2 2.82Å; G489-R491 PolarHBondContact O-N 3.43Å; R491-Q493 PolarHBondContact O-N 3.23Å
492	S	40.7	Very low	32.3	Very low	40 Å²	40	122.8 Å²	122.8	28%	0.28	62%	0.624	S	S	.	*	P	Polyproline II helix	trans	-68.7	120.9	171.8	65	0	0	0	0	110.2	F483 D494	F483-S492 PolarHBondContact O-N 2.68Å; F483-S492 PolarHBondContact O-OG 3.15Å; S492-D494 VanDerWaalsContact C-N 3.34Å
493	Q	37.2	Very low	31.7	Very low	187 Å²	187	124.1 Å²	124.1	87%	0.874	63%	0.631	S	S	*	*			trans	-79.4	-16.8	175.2	-75.6	-179.6	-18	0	0	113.3	R491 R495	R491-Q493 PolarHBondContact O-N 3.23Å; Q493-R495 PolarHBondContact O-N 3.25Å
494	D	33.8	Very low	31	Very low	116 Å²	116	130.5 Å²	130.5	62%	0.62	65%	0.651	S	S	*	*			trans	-78.2	121.6	-173	-69.1	-42.9	0	0	0	113.8	S492 Y496	S492-D494 VanDerWaalsContact C-N 3.34Å; D494-Y496 HydrophobicContact CB-CE2 4.24Å; D494-Y496 PolarHBondContact O-N 2.96Å; D494-Y496 VanDerWaalsContact O-N 3.16Å
495	R	30.9	Very low	30.4	Very low	227 Å²	227	129.9 Å²	129.9	86%	0.857	67%	0.666	S	S	*	*			trans	-79.8	88.9	173.6	-64.7	179.5	-177.9	171.8	4.7	110	Q493 E497	Q493-R495 PolarHBondContact O-N 3.25Å; R495-E497 PolarHBondContact O-N 3.24Å
496	Y	31.4	Very low	29.8	Very low	159 Å²	159	136.7 Å²	136.7	62%	0.624	70%	0.695	S	S	*	*			trans	-62.3	125	172.4	-71.5	-72.5	0	0	0	111.9	R480 D494	R480-Y496 WeakPolarHBondContact CD-O 3.3Å; R480-Y496 VanDerWaalsContact CZ-O 3.3Å; R480-Y496 PolarHBondContact NE-O 3.09Å; R480-Y496 PolarHBondContact NH1-O 2.92Å; R480-Y496 VanDerWaalsContact NH1-O 3.1Å; D494-Y496 HydrophobicContact CB-CE2 4.24Å; D494-Y496 PolarHBondContact O-N 2.96Å; D494-Y496 VanDerWaalsContact O-N 3.16Å
497	E	23.4	Very low	29.3	Very low	165 Å²	165	137.9 Å²	137.9	77%	0.771	70%	0.696	S	S	*	*			trans	-87.7	113	167.8	-92.4	-172.3	163.2	0	0	111.1	R495	R495-E497 PolarHBondContact O-N 3.24Å
498	F	24.8	Very low	29.2	Very low	179 Å²	179	147 Å²	147	79%	0.785	72%	0.723	S	S	*	*			trans	-100.9	112.5	153.9	-70.8	-81.8	0	0	0	107.7	R480	R480-F498 PolarHBondContact NH2-O 2.77Å
499	S	22.8	Very low	28.9	Very low	91 Å²	91	150 Å²	150	64%	0.636	73%	0.729	S	S	*	*			trans	-96.2	139.5	162.8	66.1	0	0	0	0	108.5	H501	S499-H501 PolarHBondContact O-N 3Å
500	S	24.5	Very low	28.8	Very low	123 Å²	123	155.2 Å²	155.2	86%	0.86	74%	0.74	S	S	*	*			trans	-87	78.8	176.3	59	0	0	0	0	110.2
501	H	24.3	Very low	28.4	Very low	151 Å²	151	156.4 Å²	156.4	70%	0.699	75%	0.747	S	S	*	*			trans	-103.5	103.1	167.2	-83.2	-79.3	0	0	0	111	S499 T503	S499-H501 PolarHBondContact O-N 3Å; H501-T503 VanDerWaalsContact C-N 3.35Å; H501-T503 PolarHBondContact O-N 3.33Å; H501-T503 VanDerWaalsContact O-N 3.16Å
502	I	31.6	Very low	27.9	Very low	173 Å²	173	158.5 Å²	158.5	89%	0.887	76%	0.764	S	S	*	*			trans	-77.3	92	160.3	-61.7	175.9	0	0	0	107.3
503	T	24.7	Very low	27.1	Very low	117 Å²	117	165.9 Å²	165.9	72%	0.718	79%	0.794	S	S	*	*			trans	-144	127	156	34.6	0	0	0	0	108.4	H501	H501-T503 VanDerWaalsContact C-N 3.35Å; H501-T503 PolarHBondContact O-N 3.33Å; H501-T503 VanDerWaalsContact O-N 3.16Å
504	R	24.6	Very low	26.4	Very low	258 Å²	258	164.5 Å²	164.5	97%	0.974	79%	0.789	S	S	*	*			trans	-60.8	148	172.4	-71.8	171.7	157.6	127.2	-9	110.3
505	G	23.3	Very low	25.9	Very low	67 Å²	67	168 Å²	168	69%	0.691	80%	0.801	S	S	*	*			trans	137.8	101.5	162.8	0	0	0	0	0	113.1
506	E	25.9	Very low	25.5	Very low	176 Å²	176	163.5 Å²	163.5	82%	0.822	80%	0.797	S	S	*	*			trans	42.8	118.6	138	-59.6	174.6	178.4	0	0	119.7
507	H	23.4	Very low	25	Very low	158 Å²	158	163.8 Å²	163.8	73%	0.731	81%	0.811	S	S	*	*				179.8	119.5	118.4	-97.7	-73	0	0	0	108.1
508	R	27.4	Very low	25.2	Very low	308 Å²	308	163.7 Å²	163.7	100%	1.162	82%	0.815	S	S	*	*				64.6	0	102.6	-85.1	-165.5	174.7	172.7	-1.5	113.7

Retrieved 508 of 508 residues in 457.2 ms (Link to these results)

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