A0A096M6T2_POEFO Loading...

Guanylate cyclase soluble subunit alpha-1

AlphaFold DB , UniProt , Accession A0A096M6T2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 678 aa.

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(Predicted Aligned Error values between residue pairs)

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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	41.1	Very low	33.4	Very low	239 Å²	239	180.5 Å²	180.5	100%	1.177	91%	0.909	S	S	*	*				0	66.7	0	-80.6	-161.5	-89	0	0	111.4
2	F	29.9	Very low	33.2	Very low	213 Å²	213	174.4 Å²	174.4	93%	0.934	90%	0.896	S	S	*	*			trans	-156	31.3	170.6	-111.2	-79.7	0	0	0	111.6
3	C	30.7	Very low	33.8	Very low	136 Å²	136	167 Å²	167	92%	0.919	89%	0.889	S	S	*	*	S	Bend	trans	-134.7	18.6	-178.8	-83.1	0	0	0	0	114
4	A	32.2	Very low	33.5	Very low	100 Å²	100	168.6 Å²	168.6	83%	0.826	89%	0.889	S	S	*	*	S	Bend	trans	-116.8	11.7	-176.3	0	0	0	0	0	115.2
5	K	34.3	Very low	33.2	Very low	209 Å²	209	164.4 Å²	164.4	91%	0.909	88%	0.877	S	S	*	*	S	Bend	trans	-119.1	16.9	-177.2	-95.9	-169.6	175.7	-174.4	0	116.1
6	L	34.9	Very low	33.2	Very low	161 Å²	161	161.3 Å²	161.3	84%	0.843	87%	0.869	S	S	*	*	S	Bend	trans	-107.8	11.3	179	-99.5	154.4	0	0	0	114.3
7	K	32.1	Very low	33.1	Very low	204 Å²	204	162.8 Å²	162.8	89%	0.887	87%	0.866	S	S	*	*	S	Bend	trans	-106.8	4.2	-178	-94.7	-173.7	175.4	-176.9	0	116.1
8	E	32.8	Very low	33.1	Very low	186 Å²	186	160.3 Å²	160.3	87%	0.869	86%	0.863	S	S	*	*			trans	-128	66.7	175.9	-71.3	-171.4	161.4	0	0	111.8
9	L	30.6	Very low	32.8	Very low	155 Å²	155	155.9 Å²	155.9	81%	0.812	86%	0.86	S	S	*	*			trans	-117.2	82.8	159.4	-92	155.3	0	0	0	107.5	L11	L9-L11 PolarHBondContact O-N 2.94Å
10	K	30.7	Very low	32.6	Very low	199 Å²	199	153.9 Å²	153.9	87%	0.865	86%	0.857	S	S	*	*			trans	-67.3	119	158.3	-85.3	179.3	174.2	176.5	0	106.7	S12	K10-S12 VanDerWaalsContact C-N 3.31Å; K10-S12 PolarHBondContact O-N 2.9Å
11	L	37.8	Very low	32.5	Very low	183 Å²	183	150.6 Å²	150.6	96%	0.958	85%	0.85	S	S	*	*			trans	-63.7	91.7	165	-82.8	143.7	0	0	0	108.6	L9	L9-L11 PolarHBondContact O-N 2.94Å
12	S	31	Very low	31.8	Very low	108 Å²	108	149.1 Å²	149.1	76%	0.755	84%	0.837	S	S	*	*			trans	-96.7	106.5	155	52.9	0	0	0	0	106.8	K10 E14	K10-S12 VanDerWaalsContact C-N 3.31Å; K10-S12 PolarHBondContact O-N 2.9Å; S12-E14 PolarHBondContact O-N 3.11Å
13	G	41.7	Very low	31.7	Very low	78 Å²	78	145.8 Å²	145.8	80%	0.804	83%	0.829	S	S	*	*			trans	-73.2	112.3	172.9	0	0	0	0	0	109.9
14	E	28.7	Very low	31.5	Very low	189 Å²	189	146.2 Å²	146.2	88%	0.883	82%	0.822	S	S	*	*			trans	-136.6	130.7	154.7	-74.2	-169.1	162.4	0	0	108.6	S12	S12-E14 PolarHBondContact O-N 3.11Å
15	C	30.2	Very low	31.3	Very low	106 Å²	106	149.6 Å²	149.6	72%	0.716	82%	0.821	S	S	*	*			trans	-80.8	131.2	-175	-147.3	0	0	0	0	108.8	F17	C15-F17 PolarHBondContact O-N 3.39Å; C15-F17 VanDerWaalsContact O-N 3.13Å
16	P	31.9	Very low	31.1	Very low	114 Å²	114	148.2 Å²	148.2	74%	0.74	82%	0.823	S	S	*	*	S	Bend	trans	-82.3	16.1	-174.1	33.3	-34.5	0	0	0	114.3
17	F	32.8	Very low	30.7	Very low	188 Å²	188	144 Å²	144	83%	0.825	82%	0.817	S	S	*	*			trans	-122.6	74.6	-179.5	-67.4	-73.6	0	0	0	111.8	C15	C15-F17 PolarHBondContact O-N 3.39Å; C15-F17 VanDerWaalsContact O-N 3.13Å
18	S	32.8	Very low	30.4	Very low	117 Å²	117	141.7 Å²	141.7	82%	0.818	82%	0.815	S	S	*	*			trans	-160.6	115.1	156	54.3	0	0	0	0	110.3
19	G	27.8	Very low	30	Very low	78 Å²	78	143 Å²	143	80%	0.804	82%	0.818	S	S	*	*			trans	176.2	52.5	-178.2	0	0	0	0	0	115.8
20	S	28.8	Very low	29.8	Very low	115 Å²	115	145 Å²	145	80%	0.804	82%	0.823	S	S	*	*			trans	27.3	116	145.8	177.7	0	0	0	0	122
21	A	29.7	Very low	29.7	Very low	85 Å²	85	144 Å²	144	70%	0.702	82%	0.821	S	S	*	*				64.6	125	126.8	0	0	0	0	0	122.2
22	K	26.2	Very low	29.1	Very low	207 Å²	207	147.1 Å²	147.1	90%	0.9	82%	0.821	S	S	*	*				-179.4	148.5	104.1	-95.5	174.1	-179.3	-176.9	0	112.4
23	N	28.7	Very low	28.8	Very low	144 Å²	144	145.9 Å²	145.9	77%	0.77	81%	0.812	S	S	*	*			trans	-47.3	145.7	172.6	-56	-19	0	0	0	113.3
24	D	26.8	Very low	28	Very low	144 Å²	144	150 Å²	150	77%	0.77	82%	0.815	S	S	*	*				173.2	156.4	88.8	-105.3	-28.3	0	0	0	111.8
25	E	27.5	Very low	27.9	Very low	172 Å²	172	147.7 Å²	147.7	80%	0.804	81%	0.809	S	S	*	*			trans	78.8	93	157.2	-69.5	179.1	178.2	0	0	122
26	L	29.5	Very low	27.7	Very low	180 Å²	180	147.2 Å²	147.2	94%	0.942	81%	0.812	S	S	*	*				23.3	123.8	123.6	-70.4	151.8	0	0	0	120.1
27	G	26.3	Very low	27.3	Very low	71 Å²	71	146.2 Å²	146.2	73%	0.732	81%	0.813	S	S	*	*			trans	-171	114.5	158.7	0	0	0	0	0	111.8
28	D	25.4	Very low	26.9	Very low	157 Å²	157	143.9 Å²	143.9	84%	0.84	81%	0.809	S	S	*	*			trans	-52.7	139.7	-169.9	-69	-49.9	0	0	0	116.6
29	F	24.7	Very low	26.6	Very low	213 Å²	213	145.9 Å²	145.9	93%	0.934	81%	0.81	S	S	*	*			trans	-125.6	107.9	153.7	-98.7	-87.6	0	0	0	108.8
30	E	27.6	Very low	26.4	Very low	196 Å²	196	147.1 Å²	147.1	92%	0.916	81%	0.807	S	S	*	*			trans	-68.6	127.2	170.6	-86.7	-171	148.4	0	0	111.1
31	E	27.9	Very low	27.2	Very low	178 Å²	178	146.7 Å²	146.7	83%	0.832	80%	0.801	S	S	*	*			trans	-85.3	136.6	170.9	-155.8	174.5	-155.9	0	0	109.1
32	R	24.8	Very low	26.8	Very low	249 Å²	249	150.4 Å²	150.4	94%	0.94	81%	0.807	S	S	*	*			trans	-135.7	95.9	152.5	-102	-173.6	-172.6	178.4	4.3	110.4
33	S	25	Very low	26.9	Very low	83 Å²	83	145 Å²	145	58%	0.58	80%	0.796	S	S	*	*			trans	-38	150.2	150.1	52.4	0	0	0	0	114.1
34	L	25.1	Very low	26.7	Very low	164 Å²	164	148 Å²	148	86%	0.859	80%	0.802	S	S	*	*				-168.5	121.3	116.9	-95.1	155.5	0	0	0	111.3
35	D	26.5	Very low	26.6	Very low	141 Å²	141	148.2 Å²	148.2	75%	0.754	80%	0.803	S	S	*	*			trans	-27.4	135.7	164.6	-65.1	-47.7	0	0	0	116.9
36	A	25.6	Very low	26.5	Very low	95 Å²	95	145.4 Å²	145.4	79%	0.785	80%	0.798	S	S	*	*				72.2	112.7	75.2	0	0	0	0	0	114.5
37	A	25.1	Very low	26.3	Very low	93 Å²	93	145.8 Å²	145.8	77%	0.769	79%	0.794	S	S	*	*			trans	173.5	146.7	133.3	0	0	0	0	0	112.7
38	D	24.5	Very low	26.2	Very low	139 Å²	139	146 Å²	146	74%	0.743	80%	0.796	S	S	*	*			trans	88.7	95	152.7	-63.6	-15.4	0	0	0	122.9
39	L	26.3	Very low	26.1	Very low	159 Å²	159	148.1 Å²	148.1	83%	0.832	80%	0.798	S	S	*	*				49.5	115.2	111.9	-66	163.3	0	0	0	119.6
40	S	22.5	Very low	26.3	Very low	105 Å²	105	146.4 Å²	146.4	73%	0.734	80%	0.797	S	S	*	*			trans	-51.4	-173.6	166	60.5	0	0	0	0	117
41	P	45.4	Very low	26.2	Very low	106 Å²	106	142.5 Å²	142.5	69%	0.688	79%	0.791	S	S	*	*			cis	-129.4	-174.4	-39.8	27.4	-5.5	0	0	0	111
42	I	22.7	Very low	26.1	Very low	162 Å²	162	142.5 Å²	142.5	83%	0.831	79%	0.791	S	S	*	*			trans	152.2	131.4	138.1	-75.9	156.6	0	0	0	112.8
43	S	26.4	Very low	26.3	Very low	94 Å²	94	135.9 Å²	135.9	66%	0.657	78%	0.783	S	S	*	*			trans	-50.1	145.7	168.5	166.3	0	0	0	0	115.4
44	K	25.4	Very low	26.5	Very low	206 Å²	206	137.6 Å²	137.6	90%	0.896	79%	0.789	S	S	*	*				-175.2	143.5	118.4	-100	172.4	-174.5	-178.1	0	113.9
45	D	24.1	Very low	26.9	Very low	150 Å²	150	132.4 Å²	132.4	80%	0.802	77%	0.765	S	S	*	*			trans	-72.5	159.5	-179.2	-96.5	-43	0	0	0	115.8
46	V	27	Very low	27.5	Very low	113 Å²	113	136.7 Å²	136.7	69%	0.685	77%	0.771	S	S	*	*			trans	69.5	113.9	152.2	-165.4	0	0	0	0	118.3
47	H	24.4	Very low	28.4	Very low	187 Å²	187	140 Å²	140	87%	0.866	77%	0.77	S	S	*	*				-168.7	130.7	109.7	-98.4	64.9	0	0	0	110.3
48	G	24.4	Very low	29.5	Very low	75 Å²	75	141.6 Å²	141.6	77%	0.773	76%	0.76	S	S	*	*			trans	-73.6	158.5	-170.9	0	0	0	0	0	114.9
49	K	23.8	Very low	30.5	Very low	203 Å²	203	140.7 Å²	140.7	88%	0.883	76%	0.76	S	S	*	*			trans	-146.1	120.1	149	-102.9	176	-175.7	177.6	0	109.4	S51	K49-S51 PolarHBondContact O-N 3.46Å
50	I	29	Very low	31.5	Very low	176 Å²	176	138.1 Å²	138.1	90%	0.903	76%	0.755	S	S	*	*			trans	-51.1	123.5	169.2	-65.5	158	0	0	0	108.8
51	S	25.4	Very low	32.8	Very low	114 Å²	114	144.7 Å²	144.7	80%	0.797	76%	0.764	S	S	*	*			trans	-136.6	125.4	161.1	48.3	0	0	0	0	108.9	K49	K49-S51 PolarHBondContact O-N 3.46Å
52	Q	25.8	Very low	33.4	Very low	179 Å²	179	142.3 Å²	142.3	84%	0.836	75%	0.753	S	S	*	*			trans	-72.2	145.3	178.7	-73.8	171.1	-31.7	0	0	111.3
53	S	29.2	Very low	35.3	Very low	109 Å²	109	143.3 Å²	143.3	76%	0.762	75%	0.751	S	S	*	*			trans	61.4	113.6	150.5	65.2	0	0	0	0	120.2
54	V	27.7	Very low	37.5	Very low	119 Å²	119	142 Å²	142	72%	0.721	74%	0.739	S	S	*	*				-169.2	138.5	101.3	175.7	0	0	0	0	106.9	R56	V54-R56 PolarHBondContact O-N 3.25Å
55	P	34.9	Very low	40.1	Very low	55 Å²	55	136.5 Å²	136.5	36%	0.357	72%	0.72	S	S	.	*			trans	-65	107.7	172.4	-7	21.4	0	0	0	108.8	Q57 E154	P55-Q57 PolarHBondContact O-N 2.98Å; P55-E154 HydrophobicContact CB-CG 4.25Å
56	R	39.2	Very low	42.6	Very low	231 Å²	231	134.1 Å²	134.1	87%	0.872	71%	0.706	S	S	*	*			trans	-70.7	116.5	173.9	-80.7	-176.3	172	-177.8	-2	108.7	V54 K58	V54-R56 PolarHBondContact O-N 3.25Å; R56-K58 PolarHBondContact O-N 3.32Å; R56-K58 VanDerWaalsContact O-N 3.07Å
57	Q	42.6	Very low	45.1	Very low	164 Å²	164	134.8 Å²	134.8	77%	0.766	70%	0.702	S	S	*	*			trans	-53.2	111.4	172.5	-152.7	174.2	31.8	0	0	109.2	P55 T59	P55-Q57 PolarHBondContact O-N 2.98Å; Q57-T59 PolarHBondContact O-N 2.99Å
58	K	49.4	Very low	47.9	Very low	128 Å²	128	127.9 Å²	127.9	56%	0.557	67%	0.673	S	S	*	*			trans	-67.4	121.2	175.2	-74.5	178.2	-178.2	170	0	108	R56	R56-K58 PolarHBondContact O-N 3.32Å; R56-K58 VanDerWaalsContact O-N 3.07Å
59	T	44.3	Very low	50.7	Low	120 Å²	120	125.1 Å²	125.1	74%	0.736	64%	0.64	S	S	*	*			trans	-60.8	138.4	-176.5	47.4	0	0	0	0	111.4	Q57 R61 A62	Q57-T59 PolarHBondContact O-N 2.99Å; T59-R61 PolarHBondContact O-N 3Å; T59-A62 PolarHBondContact O-N 2.94Å
60	S	47.9	Very low	53.4	Low	105 Å²	105	115.4 Å²	115.4	73%	0.734	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58	10.2	-169.9	-176.5	0	0	0	0	117.5
61	R	50.6	Low	55.9	Low	243 Å²	243	109 Å²	109	92%	0.917	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.5	2.2	-177.2	-83.5	-176.1	168.4	176.3	-3.1	114.4	T59	T59-R61 PolarHBondContact O-N 3Å
62	A	58.2	Low	58.7	Low	56 Å²	56	103.7 Å²	103.7	46%	0.463	53%	0.528	S	S	.	.	S	Bend	trans	-69.5	133.4	174.7	0	0	0	0	0	110.5	T59 V64	T59-A62 PolarHBondContact O-N 2.94Å; A62-V64 PolarHBondContact O-N 2.94Å
63	K	62.8	Low	61.5	Low	183 Å²	183	95.1 Å²	95.1	80%	0.796	49%	0.488	S	S	*	.			trans	-56.9	128	171.2	-73.7	178.9	176.9	177.5	0	108.9	N65	K63-N65 PolarHBondContact O-N 2.65Å
64	V	71.8	Confident	64	Low	67 Å²	67	94.1 Å²	94.1	41%	0.406	47%	0.468	S	S	.	.			trans	-72.7	115.1	173.5	-179.5	0	0	0	0	107.8	A62 I158	A62-V64 PolarHBondContact O-N 2.94Å; V64-I158 HydrophobicContact CG1-CG1 4.46Å; V64-I158 HydrophobicContact CG1-CG2 4.46Å
65	N	78.9	Confident	66.7	Low	90 Å²	90	90.9 Å²	90.9	48%	0.481	44%	0.444	S	S	.	.			trans	-100.4	150.9	175.5	-66.2	-32	0	0	0	109.6	K63 H67 T68 L69	K63-N65 PolarHBondContact O-N 2.65Å; N65-H67 PolarHBondContact O-N 2.65Å; N65-T68 HydrophobicContact CB-CG2 4.34Å; N65-T68 PolarHBondContact N-OG1 2.77Å; N65-T68 VanDerWaalsContact N-OG1 3.11Å; N65-T68 PolarHBondContact O-N 2.71Å; N65-T68 PolarHBondContact O-OG1 2.79Å; N65-L69 PolarHBondContact O-N 2.99Å
66	L	77.4	Confident	69	Low	99 Å²	99	88.3 Å²	88.3	52%	0.518	43%	0.427	S	S	.	.	H	α-helix	trans	-60.9	-37	177.1	-165.3	63.3	0	0	0	111.9	L69 G70 Q179	L66-L69 PolarHBondContact O-N 3.43Å; L66-G70 PolarHBondContact O-N 3.01Å; L66-Q179 VanDerWaalsContact CG-OE1 3.23Å
67	H	79.8	Confident	70.9	Confident	128 Å²	128	77.8 Å²	77.8	59%	0.593	39%	0.39	S	S	*	.	H	α-helix	trans	-60.8	-47.5	174.8	-174.5	-71	0	0	0	111.9	N65 L69 G70 D71	N65-H67 PolarHBondContact O-N 2.65Å; H67-L69 VanDerWaalsContact C-N 3.25Å; H67-L69 PolarHBondContact O-N 3.18Å; H67-G70 PolarHBondContact O-N 3.39Å; H67-D71 IonicContact CE1-OD1 3.96Å; H67-D71 IonicContact CE1-OD2 3.62Å; H67-D71 PolarHBondContact CE1-OD2 3.04Å; H67-D71 IonicContact CG-OD2 2.86Å; H67-D71 IonicContact ND1-OD1 3.05Å; H67-D71 IonicContact ND1-OD2 3.91Å; H67-D71 PolarHBondContact ND1-OD2 2.91Å; H67-D71 VanDerWaalsContact O-CG 3.23Å; H67-D71 PolarHBondContact O-N 2.84Å
68	T	82.3	Confident	72.5	Confident	41 Å²	41	71.7 Å²	71.7	25%	0.252	37%	0.365	S	S	.	.	H	α-helix	trans	-64.5	-33.8	179.3	49.7	0	0	0	0	111.8	N65 S72	N65-T68 HydrophobicContact CB-CG2 4.34Å; N65-T68 PolarHBondContact N-OG1 2.77Å; N65-T68 VanDerWaalsContact N-OG1 3.11Å; N65-T68 PolarHBondContact O-N 2.71Å; N65-T68 PolarHBondContact O-OG1 2.79Å; T68-S72 PolarHBondContact O-N 2.85Å; T68-S72 VanDerWaalsContact O-N 3.16Å; T68-S72 PolarHBondContact O-OG 2.84Å; T68-S72 VanDerWaalsContact O-OG 3.05Å
69	L	83.3	Confident	74	Confident	17 Å²	17	66.3 Å²	66.3	9%	0.089	34%	0.343	C	S	.	.	H	α-helix	trans	-68.1	-46.8	173.7	176.3	59.7	0	0	0	112.3	N65 L66 H67 D71 S72 I73 I158 V162 L176	N65-L69 PolarHBondContact O-N 2.99Å; L66-L69 PolarHBondContact O-N 3.43Å; H67-L69 VanDerWaalsContact C-N 3.25Å; H67-L69 PolarHBondContact O-N 3.18Å; L69-D71 VanDerWaalsContact C-N 3.3Å; L69-D71 PolarHBondContact O-N 2.93Å; L69-S72 PolarHBondContact O-N 2.96Å; L69-I73 HydrophobicContact CD1-CG1 4.48Å; L69-I73 WeakPolarHBondContact O-CG1 3.29Å; L69-I73 PolarHBondContact O-N 2.89Å; L69-I73 VanDerWaalsContact O-N 3.15Å; L69-I158 VanDerWaalsContact CA-CG2 3.47Å; L69-I158 HydrophobicContact CB-CG2 3.74Å; L69-I158 HydrophobicContact CD1-CG2 3.46Å; L69-I158 VanDerWaalsContact CD1-CG2 3.46Å; L69-I158 HydrophobicContact CG-CG2 4.2Å; L69-V162 HydrophobicContact CD1-CG2 3.37Å; L69-V162 HydrophobicContact CD2-CG2 4.28Å; L69-V162 HydrophobicContact CG-CG2 4.38Å; L69-L176 HydrophobicContact CD1-CD1 4.28Å; L69-L176 HydrophobicContact CD2-CD1 4.11Å; L69-L176 HydrophobicContact CD2-CD2 3.68Å; L69-L176 HydrophobicContact CG-CD1 4.08Å; L69-L176 HydrophobicContact CG-CD2 3.98Å
70	G	81.3	Confident	75.7	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-59	-40.6	175.3	0	0	0	0	0	112.5	L66 H67 I73 R74	L66-G70 PolarHBondContact O-N 3.01Å; H67-G70 PolarHBondContact O-N 3.39Å; G70-I73 PolarHBondContact O-N 3.26Å; G70-R74 WeakPolarHBondContact O-CB 3.22Å; G70-R74 PolarHBondContact O-N 2.84Å
71	D	81.7	Confident	77.3	Confident	42 Å²	42	65.2 Å²	65.2	23%	0.225	32%	0.317	C	S	.	.	H	α-helix	trans	-64.2	-42.8	176.6	-69.3	-27.9	0	0	0	112.5	H67 L69 I73 R74 K75	H67-D71 IonicContact CE1-OD1 3.96Å; H67-D71 IonicContact CE1-OD2 3.62Å; H67-D71 PolarHBondContact CE1-OD2 3.04Å; H67-D71 IonicContact CG-OD2 2.86Å; H67-D71 IonicContact ND1-OD1 3.05Å; H67-D71 IonicContact ND1-OD2 3.91Å; H67-D71 PolarHBondContact ND1-OD2 2.91Å; H67-D71 VanDerWaalsContact O-CG 3.23Å; H67-D71 PolarHBondContact O-N 2.84Å; L69-D71 VanDerWaalsContact C-N 3.3Å; L69-D71 PolarHBondContact O-N 2.93Å; D71-I73 VanDerWaalsContact C-N 3.34Å; D71-I73 PolarHBondContact O-N 2.6Å; D71-R74 WeakPolarHBondContact O-CB 3.37Å; D71-R74 PolarHBondContact O-N 3.46Å; D71-R74 IonicContact OD1-NH1 3.37Å; D71-K75 WeakPolarHBondContact O-CG 3.32Å; D71-K75 PolarHBondContact O-N 2.96Å
72	S	84.8	Confident	78.9	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.007	31%	0.306	C	S	.	.	H	α-helix	trans	-61.3	-43.5	177.1	-59.4	0	0	0	0	111.6	T68 L69 K75 L76 D155	T68-S72 PolarHBondContact O-N 2.85Å; T68-S72 VanDerWaalsContact O-N 3.16Å; T68-S72 PolarHBondContact O-OG 2.84Å; T68-S72 VanDerWaalsContact O-OG 3.05Å; L69-S72 PolarHBondContact O-N 2.96Å; S72-K75 PolarHBondContact O-N 3.44Å; S72-L76 PolarHBondContact O-N 3.3Å; S72-D155 VanDerWaalsContact OG-CB 3.23Å; S72-D155 WeakPolarHBondContact OG-CB 3.48Å; S72-D155 PolarHBondContact OG-OD2 3.11Å
73	I	83.8	Confident	80.1	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-67.4	-36.9	175.8	-60.7	-59.5	0	0	0	111.3	L69 G70 D71 K75 L76 A77 L159 F169 F173 L176 L177	L69-I73 HydrophobicContact CD1-CG1 4.48Å; L69-I73 WeakPolarHBondContact O-CG1 3.29Å; L69-I73 PolarHBondContact O-N 2.89Å; L69-I73 VanDerWaalsContact O-N 3.15Å; G70-I73 PolarHBondContact O-N 3.26Å; D71-I73 VanDerWaalsContact C-N 3.34Å; D71-I73 PolarHBondContact O-N 2.6Å; I73-K75 PolarHBondContact O-N 3.09Å; I73-L76 HydrophobicContact CD1-CD1 4.48Å; I73-L76 WeakPolarHBondContact O-CB 2.86Å; I73-L76 PolarHBondContact O-N 2.68Å; I73-L76 VanDerWaalsContact O-N 3.13Å; I73-A77 PolarHBondContact O-N 2.88Å; I73-L159 HydrophobicContact CD1-CD2 3.8Å; I73-F169 HydrophobicContact CD1-CE2 4.06Å; I73-F169 HydrophobicContact CD1-CZ 4.46Å; I73-F173 HydrophobicContact CG2-CD1 3.82Å; I73-F173 HydrophobicContact CG2-CE1 4.11Å; I73-F173 HydrophobicContact CG2-CG 4.2Å; I73-L176 HydrophobicContact CB-CB 4.3Å; I73-L176 HydrophobicContact CD1-CD1 4.37Å; I73-L176 HydrophobicContact CG1-CB 4.07Å; I73-L176 HydrophobicContact CG1-CD1 3.76Å; I73-L176 HydrophobicContact CG2-CB 4.33Å; I73-L177 HydrophobicContact CG2-CD2 4.01Å; I73-L177 HydrophobicContact CG2-CG 3.95Å
74	R	81.9	Confident	81.2	Confident	87 Å²	87	52 Å²	52	33%	0.328	26%	0.257	S	S	.	.	H	α-helix	trans	-60	-43.9	173.9	179.3	-172.5	-65.7	173.1	-9.5	112.1	G70 D71 L76 A77 C78 L177 S180	G70-R74 WeakPolarHBondContact O-CB 3.22Å; G70-R74 PolarHBondContact O-N 2.84Å; D71-R74 WeakPolarHBondContact O-CB 3.37Å; D71-R74 PolarHBondContact O-N 3.46Å; D71-R74 IonicContact OD1-NH1 3.37Å; R74-L76 PolarHBondContact O-N 3.37Å; R74-A77 PolarHBondContact O-N 2.89Å; R74-C78 CarbonylContact O-C 3.53Å; R74-C78 WeakPolarHBondContact O-CA 3.14Å; R74-C78 PolarHBondContact O-N 3.25Å; R74-L177 HydrophobicContact CB-CD2 4.35Å; R74-S180 PolarHBondContact NE-OG 2.85Å; R74-S180 PolarHBondContact NH2-O 3.03Å; R74-S180 PolarHBondContact NH2-OG 3.16Å
75	K	83.1	Confident	81.8	Confident	52 Å²	52	51.1 Å²	51.1	23%	0.226	25%	0.248	C	C	.	.	H	α-helix	trans	-59.4	-29.2	176.8	-67.8	168.1	-174.5	179.1	0	112.5	D71 S72 I73 P79 E154 D155	D71-K75 WeakPolarHBondContact O-CG 3.32Å; D71-K75 PolarHBondContact O-N 2.96Å; S72-K75 PolarHBondContact O-N 3.44Å; I73-K75 PolarHBondContact O-N 3.09Å; K75-P79 WeakPolarHBondContact O-CA 3.33Å; K75-P79 WeakPolarHBondContact O-CB 3.46Å; K75-E154 IonicContact NZ-OE2 2.8Å; K75-E154 PolarHBondContact NZ-OE2 3.11Å; K75-D155 IonicContact NZ-OD2 2.84Å; K75-D155 PolarHBondContact NZ-OD2 3.32Å
76	L	83.9	Confident	82.1	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-81.4	-42.8	176.8	-67.2	176.1	0	0	0	112.5	S72 I73 R74 I147 F148 C151 L159 F169 F173 F221	S72-L76 PolarHBondContact O-N 3.3Å; I73-L76 HydrophobicContact CD1-CD1 4.48Å; I73-L76 WeakPolarHBondContact O-CB 2.86Å; I73-L76 PolarHBondContact O-N 2.68Å; I73-L76 VanDerWaalsContact O-N 3.13Å; R74-L76 PolarHBondContact O-N 3.37Å; L76-I147 HydrophobicContact CD2-CG2 4.42Å; L76-F148 HydrophobicContact CD1-CD2 3.93Å; L76-F148 HydrophobicContact CD1-CE2 3.85Å; L76-F148 HydrophobicContact CD2-CB 4.34Å; L76-F148 HydrophobicContact CD2-CD2 3.73Å; L76-F148 HydrophobicContact CD2-CE2 4.46Å; L76-F148 HydrophobicContact CD2-CG 4.37Å; L76-C151 HydrophobicContact CD2-CB 3.57Å; L76-C151 HydrophobicContact CG-CB 4.14Å; L76-L159 HydrophobicContact CD1-CD2 4.12Å; L76-F169 HydrophobicContact CD1-CZ 4.35Å; L76-F173 HydrophobicContact CB-CE1 4.46Å; L76-F221 WeakPolarHBondContact O-CE2 3.45Å
77	A	78.6	Confident	82.6	Confident	10 Å²	10	44.6 Å²	44.6	8%	0.083	22%	0.216	C	C	.	.	H	α-helix	trans	-81	-37.3	-176.7	0	0	0	0	0	113.3	I73 R74 F173 L177 T218	I73-A77 PolarHBondContact O-N 2.88Å; R74-A77 PolarHBondContact O-N 2.89Å; A77-F173 HydrophobicContact CB-CD1 4.31Å; A77-F173 HydrophobicContact CB-CE1 4.44Å; A77-L177 HydrophobicContact CB-CD1 3.81Å; A77-L177 HydrophobicContact CB-CD2 3.71Å; A77-L177 HydrophobicContact CB-CG 4.35Å; A77-T218 WeakPolarHBondContact O-CG2 3.39Å; A77-T218 PolarHBondContact O-OG1 3.35Å
78	C	76.4	Confident	82.8	Confident	36 Å²	36	38.6 Å²	38.6	24%	0.243	19%	0.188	C	C	.	.	S	Bend	trans	-136.4	67.9	-176.7	-68.1	0	0	0	0	110.1	R74	R74-C78 CarbonylContact O-C 3.53Å; R74-C78 WeakPolarHBondContact O-CA 3.14Å; R74-C78 PolarHBondContact O-N 3.25Å
79	P	81	Confident	82.9	Confident	14 Å²	14	40.6 Å²	40.6	9%	0.091	20%	0.195	C	C	.	.			trans	-63.9	144.4	176.5	26.1	-33.2	0	0	0	111.5	K75 R83 L84 F221	K75-P79 WeakPolarHBondContact O-CA 3.33Å; K75-P79 WeakPolarHBondContact O-CB 3.46Å; P79-R83 HydrophobicContact CB-CB 4.49Å; P79-L84 HydrophobicContact CB-CD2 4.13Å; P79-L84 HydrophobicContact CB-CG 4.1Å; P79-L84 HydrophobicContact CG-CD1 4.25Å; P79-L84 HydrophobicContact CG-CD2 3.53Å; P79-L84 HydrophobicContact CG-CG 3.83Å; P79-F221 VanDerWaalsContact CD-CZ 3.5Å; P79-F221 HydrophobicContact CG-CE1 3.75Å; P79-F221 HydrophobicContact CG-CE2 4.39Å; P79-F221 HydrophobicContact CG-CZ 3.48Å; P79-F221 VanDerWaalsContact CG-CZ 3.48Å
80	E	81	Confident	83	Confident	144 Å²	144	42.9 Å²	42.9	67%	0.673	20%	0.202	S	C	*	.			trans	-65.2	149.6	169.7	-66.2	173.6	-178.7	0	0	110.7	Q82 R83 L84	E80-Q82 PolarHBondContact O-N 3.49Å; E80-R83 WeakPolarHBondContact O-CA 3.36Å; E80-R83 WeakPolarHBondContact O-CB 3.47Å; E80-R83 PolarHBondContact O-N 3.43Å; E80-L84 PolarHBondContact O-N 3.38Å; E80-L84 VanDerWaalsContact O-N 3.09Å
81	F	81.4	Confident	83.1	Confident	58 Å²	58	43.8 Å²	43.8	25%	0.254	21%	0.207	S	C	.	.	H	α-helix	trans	-54.9	-39.5	-179.4	178.7	-107.7	0	0	0	112.9	R83 L84 H85 E117 L121	F81-R83 VanDerWaalsContact C-N 3.27Å; F81-R83 PolarHBondContact O-N 3.36Å; F81-L84 WeakPolarHBondContact O-CB 3.33Å; F81-L84 PolarHBondContact O-N 3.36Å; F81-H85 WeakPolarHBondContact O-CB 3.43Å; F81-H85 PolarHBondContact O-N 3.24Å; F81-E117 WeakPolarHBondContact CB-OE2 3.43Å; F81-E117 HydrophobicContact CD1-CG 4.46Å; F81-E117 HydrophobicContact CD2-CB 3.72Å; F81-E117 HydrophobicContact CD2-CG 4.46Å; F81-E117 HydrophobicContact CE2-CB 3.96Å; F81-E117 WeakPolarHBondContact CE2-O 3.44Å; F81-E117 HydrophobicContact CG-CB 4.04Å; F81-E117 HydrophobicContact CG-CG 4.3Å; F81-E117 HydrophobicContact CZ-CB 4.45Å; F81-L121 HydrophobicContact CE2-CB 4.47Å; F81-L121 HydrophobicContact CE2-CD1 4.38Å
82	Q	83.2	Confident	83	Confident	147 Å²	147	44.4 Å²	44.4	69%	0.687	21%	0.209	S	C	*	.	H	α-helix	trans	-60.9	-35.8	176.5	-171.7	175.5	4.8	0	0	112.6	E80 T86	E80-Q82 PolarHBondContact O-N 3.49Å; Q82-T86 WeakPolarHBondContact O-CB 3.32Å; Q82-T86 PolarHBondContact O-N 2.79Å; Q82-T86 PolarHBondContact O-OG1 3.05Å
83	R	84.4	Confident	82.5	Confident	48 Å²	48	47.4 Å²	47.4	18%	0.181	23%	0.227	C	C	.	.	H	α-helix	trans	-70.8	-42.3	176.6	-175.6	172.9	-74.8	-114.7	-7.4	110.7	P79 E80 F81 T86 A87 M150 E154	P79-R83 HydrophobicContact CB-CB 4.49Å; E80-R83 WeakPolarHBondContact O-CA 3.36Å; E80-R83 WeakPolarHBondContact O-CB 3.47Å; E80-R83 PolarHBondContact O-N 3.43Å; F81-R83 VanDerWaalsContact C-N 3.27Å; F81-R83 PolarHBondContact O-N 3.36Å; R83-T86 PolarHBondContact O-N 3.32Å; R83-A87 PolarHBondContact O-N 3.26Å; R83-M150 HydrophobicContact CG-CE 3.89Å; R83-E154 IonicContact CZ-OE1 2.77Å; R83-E154 IonicContact CZ-OE2 3.41Å; R83-E154 IonicContact NH1-OE1 2.66Å; R83-E154 PolarHBondContact NH1-OE1 2.91Å; R83-E154 IonicContact NH1-OE2 3.92Å; R83-E154 PolarHBondContact NH1-OE2 3.48Å; R83-E154 VanDerWaalsContact NH2-CD 3.3Å; R83-E154 IonicContact NH2-OE1 2.96Å; R83-E154 PolarHBondContact NH2-OE1 2.84Å; R83-E154 IonicContact NH2-OE2 3.96Å; R83-E154 PolarHBondContact NH2-OE2 3.45Å
84	L	84.5	Confident	81.6	Confident	9 Å²	9	52.7 Å²	52.7	5%	0.047	26%	0.255	C	S	.	.	H	α-helix	trans	-59.3	-47.2	173.3	-70.6	175.1	0	0	0	111.8	P79 E80 F81 T86 A87 L88 L121 I147 F221	P79-L84 HydrophobicContact CB-CD2 4.13Å; P79-L84 HydrophobicContact CB-CG 4.1Å; P79-L84 HydrophobicContact CG-CD1 4.25Å; P79-L84 HydrophobicContact CG-CD2 3.53Å; P79-L84 HydrophobicContact CG-CG 3.83Å; E80-L84 PolarHBondContact O-N 3.38Å; E80-L84 VanDerWaalsContact O-N 3.09Å; F81-L84 WeakPolarHBondContact O-CB 3.33Å; F81-L84 PolarHBondContact O-N 3.36Å; L84-T86 PolarHBondContact O-N 3.44Å; L84-A87 WeakPolarHBondContact O-CB 3.41Å; L84-A87 PolarHBondContact O-N 3.37Å; L84-L88 PolarHBondContact O-N 3.18Å; L84-L121 HydrophobicContact CB-CD1 3.78Å; L84-I147 HydrophobicContact CD2-CD1 3.42Å; L84-I147 VanDerWaalsContact CD2-CD1 3.42Å; L84-I147 HydrophobicContact CD2-CG1 4.27Å; L84-F221 HydrophobicContact CD2-CD1 4Å; L84-F221 HydrophobicContact CD2-CE1 3.83Å
85	H	84.4	Confident	80.5	Confident	50 Å²	50	50.1 Å²	50.1	23%	0.231	25%	0.252	C	S	.	.	H	α-helix	trans	-61.6	-42.3	177.4	-175.8	-85.2	0	0	0	112.1	F81 L88 Q89	F81-H85 WeakPolarHBondContact O-CB 3.43Å; F81-H85 PolarHBondContact O-N 3.24Å; H85-L88 PolarHBondContact O-N 2.93Å; H85-Q89 PolarHBondContact CE1-NE2 3.02Å; H85-Q89 WeakPolarHBondContact O-CG 3.37Å; H85-Q89 PolarHBondContact O-N 2.56Å
86	T	86.1	Confident	79	Confident	51 Å²	51	50.7 Å²	50.7	31%	0.313	26%	0.257	S	S	.	.	H	α-helix	trans	-64.8	-39.8	176.7	-54.9	0	0	0	0	111.6	Q82 R83 L84 Q89 R90 M150	Q82-T86 WeakPolarHBondContact O-CB 3.32Å; Q82-T86 PolarHBondContact O-N 2.79Å; Q82-T86 PolarHBondContact O-OG1 3.05Å; R83-T86 PolarHBondContact O-N 3.32Å; L84-T86 PolarHBondContact O-N 3.44Å; T86-Q89 PolarHBondContact O-N 3.4Å; T86-R90 WeakPolarHBondContact O-CG 3.43Å; T86-R90 PolarHBondContact O-N 3.33Å; T86-M150 HydrophobicContact CG2-SD 4.29Å
87	A	86.8	Confident	77.3	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-59.3	-47.4	174.4	0	0	0	0	0	111.2	R83 L84 Q89 R90 M91 L143 E146 I147 M150	R83-A87 PolarHBondContact O-N 3.26Å; L84-A87 WeakPolarHBondContact O-CB 3.41Å; L84-A87 PolarHBondContact O-N 3.37Å; A87-Q89 VanDerWaalsContact C-N 3.34Å; A87-Q89 PolarHBondContact O-N 3.25Å; A87-R90 PolarHBondContact O-N 3.08Å; A87-M91 WeakPolarHBondContact O-CB 3.35Å; A87-M91 PolarHBondContact O-N 3.28Å; A87-L143 HydrophobicContact CB-CD1 3.75Å; A87-E146 HydrophobicContact CB-CG 4.36Å; A87-I147 HydrophobicContact CB-CG1 3.77Å; A87-M150 HydrophobicContact CB-CE 3.37Å; A87-M150 HydrophobicContact CB-SD 4.48Å
88	L	85	Confident	75.9	Confident	3 Å²	3	62.7 Å²	62.7	2%	0.016	32%	0.322	C	S	.	.	H	α-helix	trans	-61.6	-43.1	179.8	-170.8	72.2	0	0	0	111.3	L84 H85 M91 M92 M124 M125 L143	L84-L88 PolarHBondContact O-N 3.18Å; H85-L88 PolarHBondContact O-N 2.93Å; L88-M91 HydrophobicContact CD1-CE 3.56Å; L88-M91 WeakPolarHBondContact O-CB 3.45Å; L88-M91 PolarHBondContact O-N 2.85Å; L88-M92 HydrophobicContact CG-SD 4.17Å; L88-M92 VanDerWaalsContact O-CG 3.24Å; L88-M92 WeakPolarHBondContact O-CG 3.49Å; L88-M92 PolarHBondContact O-N 2.83Å; L88-M124 HydrophobicContact CD2-CB 3.82Å; L88-M124 HydrophobicContact CD2-CE 3.63Å; L88-M124 HydrophobicContact CD2-SD 4.18Å; L88-M125 HydrophobicContact CD1-CG 3.68Å; L88-M125 HydrophobicContact CD2-CG 4.44Å; L88-L143 HydrophobicContact CB-CD1 4.26Å; L88-L143 HydrophobicContact CD1-CD1 4.38Å
89	Q	84.4	Confident	74.4	Confident	83 Å²	83	69.1 Å²	69.1	39%	0.388	34%	0.342	S	S	.	.	H	α-helix	trans	-63.6	-42.1	175.3	-72.5	-177.2	-37.5	0	0	113	H85 T86 A87 M91 M92 T93	H85-Q89 PolarHBondContact CE1-NE2 3.02Å; H85-Q89 WeakPolarHBondContact O-CG 3.37Å; H85-Q89 PolarHBondContact O-N 2.56Å; T86-Q89 PolarHBondContact O-N 3.4Å; A87-Q89 VanDerWaalsContact C-N 3.34Å; A87-Q89 PolarHBondContact O-N 3.25Å; Q89-M91 VanDerWaalsContact C-N 3.35Å; Q89-M92 PolarHBondContact O-N 3.24Å; Q89-T93 WeakPolarHBondContact O-CB 3.47Å; Q89-T93 WeakPolarHBondContact O-CG2 3.38Å; Q89-T93 PolarHBondContact O-N 2.91Å; Q89-T93 PolarHBondContact O-OG1 2.85Å
90	R	84.6	Confident	72.5	Confident	65 Å²	65	76.4 Å²	76.4	25%	0.245	38%	0.38	C	S	.	.	H	α-helix	trans	-60.6	-44.5	174	-76.5	-171.8	177.1	-161.7	-0.6	111.4	T86 A87 M92 T93 L94 E146 E153	T86-R90 WeakPolarHBondContact O-CG 3.43Å; T86-R90 PolarHBondContact O-N 3.33Å; A87-R90 PolarHBondContact O-N 3.08Å; R90-M92 PolarHBondContact O-N 3.16Å; R90-T93 WeakPolarHBondContact CA-OG1 3.43Å; R90-T93 PolarHBondContact O-N 2.87Å; R90-T93 PolarHBondContact O-OG1 3.43Å; R90-L94 WeakPolarHBondContact O-CB 3.49Å; R90-L94 WeakPolarHBondContact O-CD1 3.47Å; R90-L94 WeakPolarHBondContact O-CG 3.28Å; R90-L94 PolarHBondContact O-N 3.31Å; R90-E146 HydrophobicContact CB-CG 4.02Å; R90-E146 WeakPolarHBondContact CD-OE1 3.5Å; R90-E146 IonicContact NH1-OE1 3.68Å; R90-E153 IonicContact CZ-OE2 3.71Å; R90-E153 IonicContact NH1-OE2 2.97Å; R90-E153 PolarHBondContact NH1-OE2 3.32Å; R90-E153 IonicContact NH2-OE2 3.72Å
91	M	83.8	Confident	70.4	Confident	19 Å²	19	75.3 Å²	75.3	9%	0.094	39%	0.388	C	S	.	.	H	α-helix	trans	-59.7	-47	176.5	-176.6	-166.5	75.3	0	0	111.9	A87 L88 Q89 A95 Y128 L139 A142	A87-M91 WeakPolarHBondContact O-CB 3.35Å; A87-M91 PolarHBondContact O-N 3.28Å; L88-M91 HydrophobicContact CD1-CE 3.56Å; L88-M91 WeakPolarHBondContact O-CB 3.45Å; L88-M91 PolarHBondContact O-N 2.85Å; Q89-M91 VanDerWaalsContact C-N 3.35Å; M91-A95 PolarHBondContact O-N 3.12Å; M91-Y128 HydrophobicContact CE-CD1 4.11Å; M91-Y128 HydrophobicContact CE-CE1 4.09Å; M91-L139 HydrophobicContact CE-CD2 3.78Å; M91-L139 HydrophobicContact SD-CD2 4.18Å; M91-A142 HydrophobicContact CG-CB 4.23Å; M91-A142 HydrophobicContact SD-CB 3.75Å
92	M	80.1	Confident	68.1	Low	54 Å²	54	76 Å²	76	27%	0.266	41%	0.411	S	S	.	.	H	α-helix	trans	-64.3	-42.2	179.5	-67.9	173.3	65.1	0	0	112.2	L88 Q89 R90 D96 Y128	L88-M92 HydrophobicContact CG-SD 4.17Å; L88-M92 VanDerWaalsContact O-CG 3.24Å; L88-M92 WeakPolarHBondContact O-CG 3.49Å; L88-M92 PolarHBondContact O-N 2.83Å; Q89-M92 PolarHBondContact O-N 3.24Å; R90-M92 PolarHBondContact O-N 3.16Å; M92-D96 PolarHBondContact O-N 2.86Å; M92-Y128 HydrophobicContact CB-CE2 4.07Å; M92-Y128 HydrophobicContact CE-CD2 3.6Å; M92-Y128 HydrophobicContact CE-CE2 4.05Å; M92-Y128 HydrophobicContact CE-CG 4.33Å; M92-Y128 HydrophobicContact CG-CD1 4.34Å; M92-Y128 HydrophobicContact CG-CD2 3.82Å; M92-Y128 HydrophobicContact CG-CE1 4.26Å; M92-Y128 HydrophobicContact CG-CE2 3.71Å; M92-Y128 HydrophobicContact CG-CG 4.11Å; M92-Y128 HydrophobicContact SD-CD2 4.21Å; M92-Y128 HydrophobicContact SD-CG 4.46Å
93	T	74.7	Confident	65.9	Low	65 Å²	65	73.9 Å²	73.9	40%	0.399	41%	0.412	S	S	.	.	H	α-helix	trans	-70.8	-36.8	179.5	48.5	0	0	0	0	113.5	Q89 R90 A95 D96 H97	Q89-T93 WeakPolarHBondContact O-CB 3.47Å; Q89-T93 WeakPolarHBondContact O-CG2 3.38Å; Q89-T93 PolarHBondContact O-N 2.91Å; Q89-T93 PolarHBondContact O-OG1 2.85Å; R90-T93 WeakPolarHBondContact CA-OG1 3.43Å; R90-T93 PolarHBondContact O-N 2.87Å; R90-T93 PolarHBondContact O-OG1 3.43Å; T93-A95 VanDerWaalsContact C-N 3.34Å; T93-D96 PolarHBondContact O-N 3.21Å; T93-H97 PolarHBondContact O-N 2.97Å
94	L	64.7	Low	63.7	Low	111 Å²	111	76.1 Å²	76.1	58%	0.581	43%	0.433	S	S	*	.	H	α-helix	trans	-65.3	-36.2	175.7	-82.6	158.5	0	0	0	112.4	R90	R90-L94 WeakPolarHBondContact O-CB 3.49Å; R90-L94 WeakPolarHBondContact O-CD1 3.47Å; R90-L94 WeakPolarHBondContact O-CG 3.28Å; R90-L94 PolarHBondContact O-N 3.31Å
95	A	58	Low	61.3	Low	33 Å²	33	80 Å²	80	27%	0.273	47%	0.467	S	S	.	.	H	α-helix	trans	-73.3	-37.1	177.7	0	0	0	0	0	112.8	M91 T93 H97 S98 Y128	M91-A95 PolarHBondContact O-N 3.12Å; T93-A95 VanDerWaalsContact C-N 3.34Å; A95-H97 VanDerWaalsContact C-N 3.33Å; A95-H97 PolarHBondContact O-N 2.98Å; A95-S98 PolarHBondContact O-N 3.39Å; A95-S98 VanDerWaalsContact O-N 3.17Å; A95-S98 PolarHBondContact O-OG 3.11Å; A95-Y128 WeakPolarHBondContact CB-OH 3.17Å
96	D	52.6	Low	58.9	Low	63 Å²	63	82.1 Å²	82.1	34%	0.337	49%	0.493	S	S	.	.	H	α-helix	trans	-69.7	-26	178.9	-74.3	-18.8	0	0	0	113	M92 T93 S98 R99	M92-D96 PolarHBondContact O-N 2.86Å; T93-D96 PolarHBondContact O-N 3.21Å; D96-S98 PolarHBondContact O-N 2.91Å; D96-R99 PolarHBondContact O-N 3.36Å
97	H	48.3	Very low	56.5	Low	166 Å²	166	84.1 Å²	84.1	77%	0.769	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-10.4	172.1	-72.5	-19.5	0	0	0	114.4	T93 A95	T93-H97 PolarHBondContact O-N 2.97Å; A95-H97 VanDerWaalsContact C-N 3.33Å; A95-H97 PolarHBondContact O-N 2.98Å
98	S	48.1	Very low	54.1	Low	97 Å²	97	88.5 Å²	88.5	68%	0.678	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-8.2	174.1	74.7	0	0	0	0	113.9	A95 D96	A95-S98 PolarHBondContact O-N 3.39Å; A95-S98 VanDerWaalsContact O-N 3.17Å; A95-S98 PolarHBondContact O-OG 3.11Å; D96-S98 PolarHBondContact O-N 2.91Å
99	R	44.9	Very low	51.6	Low	172 Å²	172	93 Å²	93	65%	0.649	58%	0.576	S	S	*	*	S	Bend	trans	-126.1	103.3	178.6	-73.1	-175.6	170.7	175.1	-0.2	109.4	D96	D96-R99 PolarHBondContact O-N 3.36Å
100	D	40.5	Very low	49.4	Very low	167 Å²	167	99.1 Å²	99.1	89%	0.893	60%	0.595	S	S	*	*			trans	-59.4	141.8	177.9	-134.4	-11.6	0	0	0	111.3
101	S	38	Very low	47.3	Very low	121 Å²	121	105.2 Å²	105.2	85%	0.846	62%	0.619	S	S	*	*	S	Bend	trans	82.2	101.5	175.6	75.5	0	0	0	0	119.5
102	G	33.5	Very low	45.1	Very low	72 Å²	72	113.3 Å²	113.3	74%	0.742	66%	0.657	S	S	*	*			trans	147.8	123.2	160.9	0	0	0	0	0	113.2
103	S	36.2	Very low	43.2	Very low	102 Å²	102	118.6 Å²	118.6	71%	0.713	69%	0.686	S	S	*	*			trans	-63.3	133.5	-175.2	54.5	0	0	0	0	113.4	A105	S103-A105 VanDerWaalsContact C-N 3.29Å; S103-A105 PolarHBondContact O-N 3.46Å
104	P	37.8	Very low	41.4	Very low	95 Å²	95	120.1 Å²	120.1	62%	0.617	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	3.8	-175.1	-7.2	24.2	0	0	0	115
105	A	35.1	Very low	40.5	Very low	92 Å²	92	120.5 Å²	120.5	76%	0.76	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.6	-1.2	-158.5	0	0	0	0	0	116.2	S103	S103-A105 VanDerWaalsContact C-N 3.29Å; S103-A105 PolarHBondContact O-N 3.46Å
106	A	34.1	Very low	40.5	Very low	94 Å²	94	123.1 Å²	123.1	78%	0.777	72%	0.72	S	S	*	*	S	Bend	trans	-100.9	-5.9	-166.1	0	0	0	0	0	116.4
107	C	35.6	Very low	41.3	Very low	92 Å²	92	126 Å²	126	62%	0.622	73%	0.731	S	S	*	*	S	Bend	trans	-104.4	-7	-170.2	-144	0	0	0	0	116.1	K131	C107-K131 PolarHBondContact SG-NZ 3.21Å
108	C	36.3	Very low	42.4	Very low	93 Å²	93	120.4 Å²	120.4	63%	0.628	71%	0.707	S	S	*	*	S	Bend	trans	-104.4	11.5	-171	-71.3	0	0	0	0	115.9
109	A	32.2	Very low	43.8	Very low	98 Å²	98	121.1 Å²	121.1	81%	0.81	70%	0.699	S	S	*	*	S	Bend	trans	-103.9	18.6	-173.4	0	0	0	0	0	115.2
110	R	37.7	Very low	45.5	Very low	210 Å²	210	114.8 Å²	114.8	79%	0.792	68%	0.677	S	S	*	*	S	Bend	trans	-130.3	152.5	169.4	-64.5	-176.2	-163.2	174.7	5.8	107.6
111	Y	42.1	Very low	47.4	Very low	193 Å²	193	107 Å²	107	76%	0.757	64%	0.635	S	S	*	*			trans	88.3	80.2	-180	-48.1	-73.1	0	0	0	114.2
112	Q	37.4	Very low	49.6	Very low	190 Å²	190	103.7 Å²	103.7	89%	0.888	61%	0.608	S	S	*	*			trans	-116.7	13.7	174.2	-129.9	167.7	8	0	0	113
113	N	40	Very low	51.9	Low	165 Å²	165	106 Å²	106	88%	0.882	60%	0.6	S	S	*	*			trans	-149.2	92.4	176.9	-81	-30.3	0	0	0	109.9
114	C	36	Very low	54.1	Low	97 Å²	97	103.1 Å²	103.1	66%	0.655	58%	0.575	S	S	*	*			trans	-141.9	141.2	159.6	-143.9	0	0	0	0	109.3	D116	C114-D116 VanDerWaalsContact C-N 3.29Å; C114-D116 PolarHBondContact O-N 3.39Å
115	S	45.8	Very low	56.3	Low	118 Å²	118	98.6 Å²	98.6	83%	0.825	55%	0.546	S	S	*	.	S	Bend	trans	-77.6	-7.9	-168.6	-177.5	0	0	0	0	114.2
116	D	57.7	Low	58.7	Low	88 Å²	88	98.2 Å²	98.2	47%	0.471	53%	0.531	S	S	.	.			trans	-126.9	102.4	-177.1	-96.9	-49.3	0	0	0	111.5	C114 L118 E119 H120	C114-D116 VanDerWaalsContact C-N 3.29Å; C114-D116 PolarHBondContact O-N 3.39Å; D116-L118 PolarHBondContact O-N 2.77Å; D116-E119 HydrophobicContact CB-CB 4.15Å; D116-E119 HydrophobicContact CB-CG 4.01Å; D116-E119 PolarHBondContact O-N 3.34Å; D116-H120 PolarHBondContact O-N 3Å
117	E	70.2	Confident	61	Low	124 Å²	124	96.2 Å²	96.2	58%	0.579	51%	0.511	S	S	*	.	H	α-helix	trans	-59	-31.1	-178.3	-65.5	-177.9	162.7	0	0	112.7	F81 L121	F81-E117 WeakPolarHBondContact CB-OE2 3.43Å; F81-E117 HydrophobicContact CD1-CG 4.46Å; F81-E117 HydrophobicContact CD2-CB 3.72Å; F81-E117 HydrophobicContact CD2-CG 4.46Å; F81-E117 HydrophobicContact CE2-CB 3.96Å; F81-E117 WeakPolarHBondContact CE2-O 3.44Å; F81-E117 HydrophobicContact CG-CB 4.04Å; F81-E117 HydrophobicContact CG-CG 4.3Å; F81-E117 HydrophobicContact CZ-CB 4.45Å; E117-L121 PolarHBondContact O-N 3.42Å
118	L	72	Confident	63.3	Low	48 Å²	48	92.4 Å²	92.4	25%	0.251	48%	0.484	S	S	.	.	H	α-helix	trans	-77.9	-41.7	-178.8	-175.7	64.4	0	0	0	113.2	D116 H120 L121 L122 P216 L220	D116-L118 PolarHBondContact O-N 2.77Å; L118-H120 PolarHBondContact O-N 2.96Å; L118-L121 WeakPolarHBondContact O-CB 3.32Å; L118-L121 PolarHBondContact O-N 2.9Å; L118-L121 VanDerWaalsContact O-N 3.14Å; L118-L122 HydrophobicContact CG-CD1 4.48Å; L118-L122 PolarHBondContact O-N 3.07Å; L118-P216 HydrophobicContact CD2-CB 3.44Å; L118-P216 VanDerWaalsContact CD2-CB 3.44Å; L118-L220 HydrophobicContact CD1-CD1 3.74Å
119	E	77	Confident	65.7	Low	112 Å²	112	88.6 Å²	88.6	52%	0.523	46%	0.459	S	S	.	.	H	α-helix	trans	-60.8	-40.8	176.5	-69.3	-170.4	159.3	0	0	110.2	D116 L121 L122 E123	D116-E119 HydrophobicContact CB-CB 4.15Å; D116-E119 HydrophobicContact CB-CG 4.01Å; D116-E119 PolarHBondContact O-N 3.34Å; E119-L121 VanDerWaalsContact C-N 3.32Å; E119-L121 PolarHBondContact O-N 3.16Å; E119-L122 PolarHBondContact O-N 3.24Å; E119-E123 WeakPolarHBondContact O-CG 3.41Å; E119-E123 PolarHBondContact O-N 3.07Å
120	H	79.8	Confident	68.2	Low	39 Å²	39	89.4 Å²	89.4	18%	0.181	45%	0.454	C	S	.	.	H	α-helix	trans	-60.6	-39	174.9	-174	-90.7	0	0	0	112.9	D116 L118 M124	D116-H120 PolarHBondContact O-N 3Å; L118-H120 PolarHBondContact O-N 2.96Å; H120-M124 WeakPolarHBondContact O-CG 3.47Å; H120-M124 PolarHBondContact O-N 3.19Å; H120-M124 VanDerWaalsContact O-N 3.09Å
121	L	81.1	Confident	70.4	Confident	4 Å²	4	85.8 Å²	85.8	2%	0.021	44%	0.444	C	S	.	.	H	α-helix	trans	-65.5	-43.5	176.1	-168.9	117.2	0	0	0	111.6	F81 L84 E117 L118 E119 M124 M125 L143 L220	F81-L121 HydrophobicContact CE2-CB 4.47Å; F81-L121 HydrophobicContact CE2-CD1 4.38Å; L84-L121 HydrophobicContact CB-CD1 3.78Å; E117-L121 PolarHBondContact O-N 3.42Å; L118-L121 WeakPolarHBondContact O-CB 3.32Å; L118-L121 PolarHBondContact O-N 2.9Å; L118-L121 VanDerWaalsContact O-N 3.14Å; E119-L121 VanDerWaalsContact C-N 3.32Å; E119-L121 PolarHBondContact O-N 3.16Å; L121-M124 PolarHBondContact O-N 2.92Å; L121-M125 HydrophobicContact CD2-SD 3.9Å; L121-M125 WeakPolarHBondContact O-CG 3.33Å; L121-M125 PolarHBondContact O-N 3.03Å; L121-L143 HydrophobicContact CD2-CD2 4.23Å; L121-L220 HydrophobicContact CD2-CD1 4.25Å
122	L	83.6	Confident	72.2	Confident	52 Å²	52	77.4 Å²	77.4	27%	0.272	41%	0.413	S	S	.	.	H	α-helix	trans	-64.5	-40.3	176.8	-72.4	170.6	0	0	0	112.1	L118 E119 M125 N126 M136 L220	L118-L122 HydrophobicContact CG-CD1 4.48Å; L118-L122 PolarHBondContact O-N 3.07Å; E119-L122 PolarHBondContact O-N 3.24Å; L122-M125 PolarHBondContact O-N 3.32Å; L122-N126 WeakPolarHBondContact O-CB 3.36Å; L122-N126 PolarHBondContact O-N 3.44Å; L122-N126 PolarHBondContact O-ND2 2.76Å; L122-N126 VanDerWaalsContact O-ND2 3.11Å; L122-M136 HydrophobicContact CD2-CE 3.87Å; L122-L220 HydrophobicContact CD2-CD1 3.81Å; L122-L220 HydrophobicContact CD2-CD2 3.73Å; L122-L220 HydrophobicContact CD2-CG 4.45Å; L122-L220 HydrophobicContact CG-CD1 4.29Å
123	E	83.3	Confident	74.4	Confident	121 Å²	121	72.8 Å²	72.8	57%	0.565	41%	0.407	S	S	*	.	H	α-helix	trans	-61.5	-44.7	174.7	-76.2	-176.8	173.2	0	0	112.1	E119 N126 S127	E119-E123 WeakPolarHBondContact O-CG 3.41Å; E119-E123 PolarHBondContact O-N 3.07Å; E123-N126 PolarHBondContact O-N 3.23Å; E123-S127 WeakPolarHBondContact O-CB 3.34Å; E123-S127 PolarHBondContact O-N 2.94Å
124	M	81.9	Confident	76.5	Confident	40 Å²	40	67.8 Å²	67.8	20%	0.197	38%	0.38	C	S	.	.	H	α-helix	trans	-62.3	-44.7	175.9	-72.7	-169.9	-62.5	0	0	111.9	L88 H120 L121 S127 Y128	L88-M124 HydrophobicContact CD2-CB 3.82Å; L88-M124 HydrophobicContact CD2-CE 3.63Å; L88-M124 HydrophobicContact CD2-SD 4.18Å; H120-M124 WeakPolarHBondContact O-CG 3.47Å; H120-M124 PolarHBondContact O-N 3.19Å; H120-M124 VanDerWaalsContact O-N 3.09Å; L121-M124 PolarHBondContact O-N 2.92Å; M124-S127 PolarHBondContact O-N 3.23Å; M124-Y128 WeakPolarHBondContact O-CB 3.36Å; M124-Y128 PolarHBondContact O-N 3.03Å
125	M	83.2	Confident	79	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-63	-43.3	177	-73.1	-179	71.7	0	0	111.7	L88 L121 L122 Y128 A129 M136 L139 E140 L143	L88-M125 HydrophobicContact CD1-CG 3.68Å; L88-M125 HydrophobicContact CD2-CG 4.44Å; L121-M125 HydrophobicContact CD2-SD 3.9Å; L121-M125 WeakPolarHBondContact O-CG 3.33Å; L121-M125 PolarHBondContact O-N 3.03Å; L122-M125 PolarHBondContact O-N 3.32Å; M125-Y128 PolarHBondContact O-N 3.26Å; M125-A129 WeakPolarHBondContact O-CB 3.49Å; M125-A129 PolarHBondContact O-N 3.17Å; M125-M136 HydrophobicContact CB-CE 3.76Å; M125-M136 HydrophobicContact CB-SD 4Å; M125-M136 HydrophobicContact CE-CE 3.69Å; M125-M136 HydrophobicContact CE-SD 4.15Å; M125-M136 HydrophobicContact SD-CE 4.03Å; M125-L139 HydrophobicContact CE-CB 3.87Å; M125-E140 HydrophobicContact CE-CG 3.97Å; M125-L143 HydrophobicContact CE-CD2 4.29Å; M125-L143 HydrophobicContact SD-CD2 3.9Å
126	N	85.2	Confident	80.9	Confident	84 Å²	84	63.9 Å²	63.9	45%	0.449	35%	0.347	S	S	.	.	H	α-helix	trans	-63.9	-41.3	176.2	-80.2	-40.8	0	0	0	112.3	L122 E123 Y128 A129 T130	L122-N126 WeakPolarHBondContact O-CB 3.36Å; L122-N126 PolarHBondContact O-N 3.44Å; L122-N126 PolarHBondContact O-ND2 2.76Å; L122-N126 VanDerWaalsContact O-ND2 3.11Å; E123-N126 PolarHBondContact O-N 3.23Å; N126-Y128 VanDerWaalsContact C-N 3.28Å; N126-Y128 PolarHBondContact O-N 3.44Å; N126-A129 PolarHBondContact O-N 2.95Å; N126-T130 WeakPolarHBondContact O-CB 3.35Å; N126-T130 WeakPolarHBondContact O-CG2 3.49Å; N126-T130 PolarHBondContact O-N 3.12Å; N126-T130 PolarHBondContact O-OG1 3.31Å
127	S	83.6	Confident	82.1	Confident	52 Å²	52	65.5 Å²	65.5	36%	0.364	35%	0.352	S	S	.	.	H	α-helix	trans	-62.7	-37.1	174	-170.3	0	0	0	0	111.8	E123 M124 T130 K131	E123-S127 WeakPolarHBondContact O-CB 3.34Å; E123-S127 PolarHBondContact O-N 2.94Å; M124-S127 PolarHBondContact O-N 3.23Å; S127-T130 WeakPolarHBondContact CA-OG1 3.32Å; S127-T130 PolarHBondContact O-OG1 3.04Å; S127-K131 WeakPolarHBondContact O-CD 3.43Å; S127-K131 VanDerWaalsContact O-CG 3.26Å; S127-K131 WeakPolarHBondContact O-CG 3.49Å; S127-K131 PolarHBondContact O-N 3.46Å
128	Y	83.1	Confident	82.8	Confident	12 Å²	12	61.7 Å²	61.7	5%	0.047	34%	0.342	C	S	.	.	H	α-helix	trans	-74	-41.8	177.5	-172.4	-108.6	0	0	0	112.7	M91 M92 A95 M124 M125 N126 T130 K131 T132 L139	M91-Y128 HydrophobicContact CE-CD1 4.11Å; M91-Y128 HydrophobicContact CE-CE1 4.09Å; M92-Y128 HydrophobicContact CB-CE2 4.07Å; M92-Y128 HydrophobicContact CE-CD2 3.6Å; M92-Y128 HydrophobicContact CE-CE2 4.05Å; M92-Y128 HydrophobicContact CE-CG 4.33Å; M92-Y128 HydrophobicContact CG-CD1 4.34Å; M92-Y128 HydrophobicContact CG-CD2 3.82Å; M92-Y128 HydrophobicContact CG-CE1 4.26Å; M92-Y128 HydrophobicContact CG-CE2 3.71Å; M92-Y128 HydrophobicContact CG-CG 4.11Å; M92-Y128 HydrophobicContact SD-CD2 4.21Å; M92-Y128 HydrophobicContact SD-CG 4.46Å; A95-Y128 WeakPolarHBondContact CB-OH 3.17Å; M124-Y128 WeakPolarHBondContact O-CB 3.36Å; M124-Y128 PolarHBondContact O-N 3.03Å; M125-Y128 PolarHBondContact O-N 3.26Å; N126-Y128 VanDerWaalsContact C-N 3.28Å; N126-Y128 PolarHBondContact O-N 3.44Å; Y128-T130 VanDerWaalsContact C-N 3.35Å; Y128-T130 PolarHBondContact O-N 3.4Å; Y128-K131 PolarHBondContact O-N 3.45Å; Y128-T132 HydrophobicContact CD1-CG2 4.36Å; Y128-T132 HydrophobicContact CD2-CG2 4.01Å; Y128-T132 HydrophobicContact CE1-CG2 3.94Å; Y128-T132 HydrophobicContact CE2-CG2 3.56Å; Y128-T132 HydrophobicContact CG-CG2 4.4Å; Y128-T132 WeakPolarHBondContact O-CB 3.48Å; Y128-T132 PolarHBondContact O-N 3.24Å; Y128-T132 PolarHBondContact O-OG1 3.01Å; Y128-L139 HydrophobicContact CD1-CD1 4.18Å; Y128-L139 HydrophobicContact CD1-CD2 3.66Å; Y128-L139 HydrophobicContact CE1-CD2 3.73Å
129	A	86	Confident	83.6	Confident	14 Å²	14	59.6 Å²	59.6	12%	0.116	33%	0.331	C	S	.	.	H	α-helix	trans	-57.7	-47.3	175.9	0	0	0	0	0	111.4	M125 N126 K131 T132 A133 L139	M125-A129 WeakPolarHBondContact O-CB 3.49Å; M125-A129 PolarHBondContact O-N 3.17Å; N126-A129 PolarHBondContact O-N 2.95Å; A129-K131 VanDerWaalsContact C-N 3.34Å; A129-K131 PolarHBondContact O-N 2.91Å; A129-T132 PolarHBondContact O-N 2.71Å; A129-A133 WeakPolarHBondContact O-CA 3.33Å; A129-A133 PolarHBondContact O-N 3.32Å; A129-L139 HydrophobicContact CB-CD1 3.52Å
130	T	85.5	Confident	84	Confident	115 Å²	115	56.6 Å²	56.6	71%	0.706	32%	0.317	S	S	*	.	H	α-helix	trans	-64.5	-35.6	178.3	48.8	0	0	0	0	112.7	N126 S127 Y128	N126-T130 WeakPolarHBondContact O-CB 3.35Å; N126-T130 WeakPolarHBondContact O-CG2 3.49Å; N126-T130 PolarHBondContact O-N 3.12Å; N126-T130 PolarHBondContact O-OG1 3.31Å; S127-T130 WeakPolarHBondContact CA-OG1 3.32Å; S127-T130 PolarHBondContact O-OG1 3.04Å; Y128-T130 VanDerWaalsContact C-N 3.35Å; Y128-T130 PolarHBondContact O-N 3.4Å
131	K	83.9	Confident	84.4	Confident	133 Å²	133	56.6 Å²	56.6	58%	0.578	32%	0.318	S	S	*	.	H	α-helix	trans	-74	-36.2	176.7	-74.8	172.4	-176.6	170.4	0	113.7	C107 S127 Y128 A129	C107-K131 PolarHBondContact SG-NZ 3.21Å; S127-K131 WeakPolarHBondContact O-CD 3.43Å; S127-K131 VanDerWaalsContact O-CG 3.26Å; S127-K131 WeakPolarHBondContact O-CG 3.49Å; S127-K131 PolarHBondContact O-N 3.46Å; Y128-K131 PolarHBondContact O-N 3.45Å; A129-K131 VanDerWaalsContact C-N 3.34Å; A129-K131 PolarHBondContact O-N 2.91Å
132	T	80.7	Confident	84.8	Confident	18 Å²	18	58 Å²	58	11%	0.11	33%	0.33	C	S	.	.	H	α-helix	trans	-99	-11.7	-172.3	56.8	0	0	0	0	114.3	Y128 A129 I134	Y128-T132 HydrophobicContact CD1-CG2 4.36Å; Y128-T132 HydrophobicContact CD2-CG2 4.01Å; Y128-T132 HydrophobicContact CE1-CG2 3.94Å; Y128-T132 HydrophobicContact CE2-CG2 3.56Å; Y128-T132 HydrophobicContact CG-CG2 4.4Å; Y128-T132 WeakPolarHBondContact O-CB 3.48Å; Y128-T132 PolarHBondContact O-N 3.24Å; Y128-T132 PolarHBondContact O-OG1 3.01Å; A129-T132 PolarHBondContact O-N 2.71Å; T132-I134 PolarHBondContact O-N 2.76Å
133	A	83.1	Confident	85.1	Confident	92 Å²	92	55.6 Å²	55.6	76%	0.76	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	23.6	-171.3	0	0	0	0	0	114	A129	A129-A133 WeakPolarHBondContact O-CA 3.33Å; A129-A133 PolarHBondContact O-N 3.32Å
134	I	84.9	Confident	85.4	Confident	60 Å²	60	49.8 Å²	49.8	31%	0.308	29%	0.291	S	S	.	.			trans	-85.8	132.4	174.3	-59.7	173.1	0	0	0	108.6	T132 A138 L139	T132-I134 PolarHBondContact O-N 2.76Å; I134-A138 HydrophobicContact CG2-CB 3.85Å; I134-L139 HydrophobicContact CB-CD2 4.32Å; I134-L139 HydrophobicContact CB-CG 4.34Å; I134-L139 HydrophobicContact CD1-CD2 4.46Å; I134-L139 HydrophobicContact CG2-CD2 3.98Å; I134-L139 HydrophobicContact CG2-CG 3.89Å
135	P	87.4	Confident	85.8	Confident	86 Å²	86	49.3 Å²	49.3	56%	0.558	29%	0.288	S	S	*	.			trans	-58.8	143.7	175.1	-22.8	32.8	0	0	0	112.5	E137 A138 L139	P135-E137 VanDerWaalsContact C-N 3.27Å; P135-E137 PolarHBondContact O-N 3.41Å; P135-A138 WeakPolarHBondContact O-CB 3.26Å; P135-A138 PolarHBondContact O-N 2.8Å; P135-L139 PolarHBondContact O-N 2.81Å
136	M	84.8	Confident	86.2	Confident	47 Å²	47	50.3 Å²	50.3	23%	0.232	29%	0.292	C	S	.	.	H	α-helix	trans	-56	-40.8	-180	-173.4	64.7	-179.6	0	0	112.4	L122 M125 A138 L139 E140	L122-M136 HydrophobicContact CD2-CE 3.87Å; M125-M136 HydrophobicContact CB-CE 3.76Å; M125-M136 HydrophobicContact CB-SD 4Å; M125-M136 HydrophobicContact CE-CE 3.69Å; M125-M136 HydrophobicContact CE-SD 4.15Å; M125-M136 HydrophobicContact SD-CE 4.03Å; M136-A138 VanDerWaalsContact C-N 3.29Å; M136-A138 PolarHBondContact O-N 2.85Å; M136-L139 WeakPolarHBondContact O-CB 3.42Å; M136-L139 PolarHBondContact O-N 3.05Å; M136-E140 HydrophobicContact CE-CG 4.42Å; M136-E140 WeakPolarHBondContact O-CG 3.46Å; M136-E140 PolarHBondContact O-N 3.21Å
137	E	84.3	Confident	86.5	Confident	122 Å²	122	46.3 Å²	46.3	57%	0.57	27%	0.271	S	S	*	.	H	α-helix	trans	-60.6	-35.6	177.5	-171.8	174.6	-165.2	0	0	112.8	P135 I141	P135-E137 VanDerWaalsContact C-N 3.27Å; P135-E137 PolarHBondContact O-N 3.41Å; E137-I141 WeakPolarHBondContact O-CG1 3.19Å; E137-I141 PolarHBondContact O-N 2.73Å; E137-I141 VanDerWaalsContact O-N 3.16Å
138	A	85.4	Confident	86.8	Confident	45 Å²	45	43.9 Å²	43.9	37%	0.372	25%	0.254	S	S	.	.	H	α-helix	trans	-71.9	-33.6	176.1	0	0	0	0	0	111.9	I134 P135 M136 A142	I134-A138 HydrophobicContact CG2-CB 3.85Å; P135-A138 WeakPolarHBondContact O-CB 3.26Å; P135-A138 PolarHBondContact O-N 2.8Å; M136-A138 VanDerWaalsContact C-N 3.29Å; M136-A138 PolarHBondContact O-N 2.85Å; A138-A142 WeakPolarHBondContact O-CB 3.43Å; A138-A142 PolarHBondContact O-N 3.24Å
139	L	86.8	Confident	87.2	Confident	4 Å²	4	45.1 Å²	45.1	2%	0.021	26%	0.261	C	S	.	.	H	α-helix	trans	-70.4	-39	175	-67.5	171.2	0	0	0	111.9	M91 M125 Y128 A129 I134 P135 M136 A142 L143	M91-L139 HydrophobicContact CE-CD2 3.78Å; M91-L139 HydrophobicContact SD-CD2 4.18Å; M125-L139 HydrophobicContact CE-CB 3.87Å; Y128-L139 HydrophobicContact CD1-CD1 4.18Å; Y128-L139 HydrophobicContact CD1-CD2 3.66Å; Y128-L139 HydrophobicContact CE1-CD2 3.73Å; A129-L139 HydrophobicContact CB-CD1 3.52Å; I134-L139 HydrophobicContact CB-CD2 4.32Å; I134-L139 HydrophobicContact CB-CG 4.34Å; I134-L139 HydrophobicContact CD1-CD2 4.46Å; I134-L139 HydrophobicContact CG2-CD2 3.98Å; I134-L139 HydrophobicContact CG2-CG 3.89Å; P135-L139 PolarHBondContact O-N 2.81Å; M136-L139 WeakPolarHBondContact O-CB 3.42Å; M136-L139 PolarHBondContact O-N 3.05Å; L139-A142 PolarHBondContact O-N 2.83Å; L139-L143 VanDerWaalsContact O-CB 3.3Å; L139-L143 WeakPolarHBondContact O-CB 3.43Å; L139-L143 PolarHBondContact O-N 3.43Å
140	E	86.9	Confident	87.4	Confident	49 Å²	49	45 Å²	45	23%	0.229	26%	0.258	C	S	.	.	H	α-helix	trans	-58.3	-47.4	173.5	-81.9	176	-170.3	0	0	112	M125 M136 L143 G144 L220	M125-E140 HydrophobicContact CE-CG 3.97Å; M136-E140 HydrophobicContact CE-CG 4.42Å; M136-E140 WeakPolarHBondContact O-CG 3.46Å; M136-E140 PolarHBondContact O-N 3.21Å; E140-L143 PolarHBondContact O-N 3.37Å; E140-G144 PolarHBondContact O-N 3.49Å; E140-G144 VanDerWaalsContact O-N 3.1Å; E140-L220 WeakPolarHBondContact CB-O 3.24Å; E140-L220 WeakPolarHBondContact CG-O 3.27Å
141	I	88.7	Confident	87.5	Confident	38 Å²	38	39.5 Å²	39.5	20%	0.195	23%	0.225	C	C	.	.	H	α-helix	trans	-63.6	-46.7	175	-66.6	169.1	0	0	0	110.8	E137 L143 G144 E145 P223 G224 K227	E137-I141 WeakPolarHBondContact O-CG1 3.19Å; E137-I141 PolarHBondContact O-N 2.73Å; E137-I141 VanDerWaalsContact O-N 3.16Å; I141-L143 VanDerWaalsContact C-N 3.32Å; I141-L143 PolarHBondContact O-N 2.81Å; I141-G144 PolarHBondContact O-N 3.39Å; I141-E145 HydrophobicContact CG2-CG 4.43Å; I141-E145 WeakPolarHBondContact O-CG 3.36Å; I141-E145 PolarHBondContact O-N 3.2Å; I141-P223 HydrophobicContact CG1-CB 4.38Å; I141-G224 WeakPolarHBondContact O-CA 3.15Å; I141-K227 HydrophobicContact CG2-CD 4.01Å
142	A	88.9	Confident	87.8	Confident	35 Å²	35	34.5 Å²	34.5	29%	0.289	20%	0.203	S	C	.	.	H	α-helix	trans	-62.2	-39.4	-179.8	0	0	0	0	0	112.4	M91 A138 L139 E145 E146	M91-A142 HydrophobicContact CG-CB 4.23Å; M91-A142 HydrophobicContact SD-CB 3.75Å; A138-A142 WeakPolarHBondContact O-CB 3.43Å; A138-A142 PolarHBondContact O-N 3.24Å; L139-A142 PolarHBondContact O-N 2.83Å; A142-E145 PolarHBondContact O-N 3.48Å; A142-E146 PolarHBondContact O-N 2.95Å
143	L	89.6	Confident	88.1	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.9	-45.4	174.4	-179.6	64.2	0	0	0	111.2	A87 L88 L121 M125 L139 E140 I141 E146 I147 F221	A87-L143 HydrophobicContact CB-CD1 3.75Å; L88-L143 HydrophobicContact CB-CD1 4.26Å; L88-L143 HydrophobicContact CD1-CD1 4.38Å; L121-L143 HydrophobicContact CD2-CD2 4.23Å; M125-L143 HydrophobicContact CE-CD2 4.29Å; M125-L143 HydrophobicContact SD-CD2 3.9Å; L139-L143 VanDerWaalsContact O-CB 3.3Å; L139-L143 WeakPolarHBondContact O-CB 3.43Å; L139-L143 PolarHBondContact O-N 3.43Å; E140-L143 PolarHBondContact O-N 3.37Å; I141-L143 VanDerWaalsContact C-N 3.32Å; I141-L143 PolarHBondContact O-N 2.81Å; L143-E146 PolarHBondContact O-N 2.84Å; L143-I147 HydrophobicContact CD1-CD1 4.33Å; L143-I147 HydrophobicContact CG-CD1 4Å; L143-I147 WeakPolarHBondContact O-CD1 3.39Å; L143-I147 VanDerWaalsContact O-CG1 3.26Å; L143-I147 WeakPolarHBondContact O-CG1 3.47Å; L143-I147 PolarHBondContact O-N 2.78Å; L143-F221 HydrophobicContact CD2-CB 4.39Å; L143-F221 HydrophobicContact CG-CB 4.34Å
144	G	89.8	Confident	88.2	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-64.2	-39.9	176.5	0	0	0	0	0	113.7	E140 I141 E146 F148 F221	E140-G144 PolarHBondContact O-N 3.49Å; E140-G144 VanDerWaalsContact O-N 3.1Å; I141-G144 PolarHBondContact O-N 3.39Å; G144-E146 VanDerWaalsContact C-N 3.32Å; G144-E146 PolarHBondContact O-N 3.4Å; G144-F148 PolarHBondContact O-N 2.63Å; G144-F148 VanDerWaalsContact O-N 3.11Å; G144-F221 WeakPolarHBondContact CA-O 3.33Å
145	E	91.1	Very high	88.2	Confident	30 Å²	30	33.1 Å²	33.1	14%	0.14	18%	0.178	C	C	.	.	H	α-helix	trans	-61.1	-42.5	174.8	-70.3	-167.7	-162	0	0	111.2	I141 A142 F148 N149 K227 A228 R231	I141-E145 HydrophobicContact CG2-CG 4.43Å; I141-E145 WeakPolarHBondContact O-CG 3.36Å; I141-E145 PolarHBondContact O-N 3.2Å; A142-E145 PolarHBondContact O-N 3.48Å; E145-F148 PolarHBondContact O-N 2.9Å; E145-N149 PolarHBondContact O-N 2.9Å; E145-N149 PolarHBondContact O-ND2 3.37Å; E145-K227 WeakPolarHBondContact OE1-CD 3.22Å; E145-K227 IonicContact OE1-NZ 2.71Å; E145-A228 HydrophobicContact CB-CB 4.21Å; E145-A228 HydrophobicContact CG-CB 4.13Å; E145-R231 IonicContact OE2-CZ 2.77Å; E145-R231 VanDerWaalsContact OE2-CZ 3.3Å; E145-R231 IonicContact OE2-NH1 3.59Å; E145-R231 PolarHBondContact OE2-NH1 3.23Å; E145-R231 IonicContact OE2-NH2 2.79Å; E145-R231 PolarHBondContact OE2-NH2 3.05Å
146	E	90.7	Very high	88	Confident	20 Å²	20	33.3 Å²	33.3	9%	0.093	17%	0.17	C	C	.	.	H	α-helix	trans	-72.5	-37.3	-178.9	-170.6	55.4	-158.6	0	0	113.1	A87 R90 A142 L143 G144 F148 N149 M150	A87-E146 HydrophobicContact CB-CG 4.36Å; R90-E146 HydrophobicContact CB-CG 4.02Å; R90-E146 WeakPolarHBondContact CD-OE1 3.5Å; R90-E146 IonicContact NH1-OE1 3.68Å; A142-E146 PolarHBondContact O-N 2.95Å; L143-E146 PolarHBondContact O-N 2.84Å; G144-E146 VanDerWaalsContact C-N 3.32Å; G144-E146 PolarHBondContact O-N 3.4Å; E146-F148 VanDerWaalsContact C-N 3.26Å; E146-F148 PolarHBondContact O-N 2.76Å; E146-N149 PolarHBondContact O-N 3.19Å; E146-N149 PolarHBondContact OE2-ND2 3.44Å; E146-N149 VanDerWaalsContact OE2-ND2 3.11Å; E146-M150 WeakPolarHBondContact O-CG 3.3Å; E146-M150 PolarHBondContact O-N 3.48Å
147	I	90.6	Very high	87.7	Confident	1 Å²	1	33 Å²	33	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-57.5	-43.9	171.5	-69.9	162.7	0	0	0	110.3	L76 L84 A87 L143 M150 C151 F221	L76-I147 HydrophobicContact CD2-CG2 4.42Å; L84-I147 HydrophobicContact CD2-CD1 3.42Å; L84-I147 VanDerWaalsContact CD2-CD1 3.42Å; L84-I147 HydrophobicContact CD2-CG1 4.27Å; A87-I147 HydrophobicContact CB-CG1 3.77Å; L143-I147 HydrophobicContact CD1-CD1 4.33Å; L143-I147 HydrophobicContact CG-CD1 4Å; L143-I147 WeakPolarHBondContact O-CD1 3.39Å; L143-I147 VanDerWaalsContact O-CG1 3.26Å; L143-I147 WeakPolarHBondContact O-CG1 3.47Å; L143-I147 PolarHBondContact O-N 2.78Å; I147-M150 HydrophobicContact CG1-CE 4.48Å; I147-C151 PolarHBondContact O-N 3.09Å; I147-C151 VanDerWaalsContact O-N 3.16Å; I147-F221 HydrophobicContact CD1-CB 3.99Å; I147-F221 HydrophobicContact CD1-CD1 3.79Å; I147-F221 HydrophobicContact CD1-CD2 3.73Å; I147-F221 HydrophobicContact CD1-CE1 4.21Å; I147-F221 HydrophobicContact CD1-CE2 4.18Å; I147-F221 HydrophobicContact CD1-CG 3.55Å; I147-F221 HydrophobicContact CD1-CZ 4.41Å
148	F	91.7	Very high	87.5	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-66.8	-43.6	177.2	-169.2	-86.5	0	0	0	111.9	L76 G144 E145 E146 M150 C151 Y152 L159 F169 V225 A228 A229 L232 L233	L76-F148 HydrophobicContact CD1-CD2 3.93Å; L76-F148 HydrophobicContact CD1-CE2 3.85Å; L76-F148 HydrophobicContact CD2-CB 4.34Å; L76-F148 HydrophobicContact CD2-CD2 3.73Å; L76-F148 HydrophobicContact CD2-CE2 4.46Å; L76-F148 HydrophobicContact CD2-CG 4.37Å; G144-F148 PolarHBondContact O-N 2.63Å; G144-F148 VanDerWaalsContact O-N 3.11Å; E145-F148 PolarHBondContact O-N 2.9Å; E146-F148 VanDerWaalsContact C-N 3.26Å; E146-F148 PolarHBondContact O-N 2.76Å; F148-M150 PolarHBondContact O-N 2.84Å; F148-C151 PolarHBondContact O-N 3.13Å; F148-Y152 HydrophobicContact CE1-CD2 4.26Å; F148-Y152 HydrophobicContact CE1-CG 4.48Å; F148-Y152 WeakPolarHBondContact O-CB 3.39Å; F148-Y152 PolarHBondContact O-N 2.9Å; F148-L159 HydrophobicContact CZ-CD1 4.48Å; F148-F169 HydrophobicContact CE2-CE1 4.45Å; F148-F169 HydrophobicContact CE2-CZ 4.05Å; F148-V225 HydrophobicContact CD2-CG1 4.11Å; F148-A228 HydrophobicContact CB-CB 3.62Å; F148-A228 HydrophobicContact CD1-CB 3.7Å; F148-A228 HydrophobicContact CG-CB 3.75Å; F148-A229 HydrophobicContact CD2-CB 4.27Å; F148-A229 HydrophobicContact CE2-CB 3.63Å; F148-A229 HydrophobicContact CZ-CB 3.78Å; F148-L232 HydrophobicContact CD1-CD1 3.67Å; F148-L232 HydrophobicContact CE1-CB 4.03Å; F148-L232 HydrophobicContact CE1-CD1 3.83Å; F148-L232 HydrophobicContact CE1-CG 4.48Å; F148-L233 HydrophobicContact CE1-CG 4.47Å; F148-L233 HydrophobicContact CZ-CD1 3.89Å; F148-L233 HydrophobicContact CZ-CD2 4.36Å; F148-L233 HydrophobicContact CZ-CG 3.92Å
149	N	91.2	Very high	87.3	Confident	38 Å²	38	25.3 Å²	25.3	20%	0.203	12%	0.124	C	C	.	.	H	α-helix	trans	-56.4	-49.1	176.6	-70.3	-26	0	0	0	111.5	E145 E146 C151 Y152 E153 L232	E145-N149 PolarHBondContact O-N 2.9Å; E145-N149 PolarHBondContact O-ND2 3.37Å; E146-N149 PolarHBondContact O-N 3.19Å; E146-N149 PolarHBondContact OE2-ND2 3.44Å; E146-N149 VanDerWaalsContact OE2-ND2 3.11Å; N149-C151 VanDerWaalsContact C-N 3.31Å; N149-C151 PolarHBondContact O-N 3.33Å; N149-Y152 PolarHBondContact O-N 3.24Å; N149-Y152 VanDerWaalsContact O-N 3.1Å; N149-E153 WeakPolarHBondContact O-CG 3.48Å; N149-E153 PolarHBondContact O-N 3.34Å; N149-L232 WeakPolarHBondContact OD1-CD1 3.4Å
150	M	89.3	Confident	87	Confident	11 Å²	11	32.2 Å²	32.2	5%	0.054	15%	0.15	C	C	.	.	H	α-helix	trans	-58.7	-42.2	177.1	-71.3	-168.5	-61.8	0	0	112.1	R83 T86 A87 E146 I147 F148 E154	R83-M150 HydrophobicContact CG-CE 3.89Å; T86-M150 HydrophobicContact CG2-SD 4.29Å; A87-M150 HydrophobicContact CB-CE 3.37Å; A87-M150 HydrophobicContact CB-SD 4.48Å; E146-M150 WeakPolarHBondContact O-CG 3.3Å; E146-M150 PolarHBondContact O-N 3.48Å; I147-M150 HydrophobicContact CG1-CE 4.48Å; F148-M150 PolarHBondContact O-N 2.84Å; M150-E154 WeakPolarHBondContact O-CG 3.24Å; M150-E154 PolarHBondContact O-N 3.2Å
151	C	88.8	Confident	86.8	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-68.2	-36.6	176.5	-164	0	0	0	0	112.1	L76 I147 F148 N149 E154 D155	L76-C151 HydrophobicContact CD2-CB 3.57Å; L76-C151 HydrophobicContact CG-CB 4.14Å; I147-C151 PolarHBondContact O-N 3.09Å; I147-C151 VanDerWaalsContact O-N 3.16Å; F148-C151 PolarHBondContact O-N 3.13Å; N149-C151 VanDerWaalsContact C-N 3.31Å; N149-C151 PolarHBondContact O-N 3.33Å; C151-E154 PolarHBondContact O-N 3.36Å; C151-D155 PolarHBondContact O-N 2.66Å
152	Y	89	Confident	86.3	Confident	29 Å²	29	33 Å²	33	11%	0.114	16%	0.159	C	C	.	.	H	α-helix	trans	-69.3	-38.3	178.2	-171.9	-103.6	0	0	0	112.1	F148 N149 E154 K156 L159 R160 L232 L233	F148-Y152 HydrophobicContact CE1-CD2 4.26Å; F148-Y152 HydrophobicContact CE1-CG 4.48Å; F148-Y152 WeakPolarHBondContact O-CB 3.39Å; F148-Y152 PolarHBondContact O-N 2.9Å; N149-Y152 PolarHBondContact O-N 3.24Å; N149-Y152 VanDerWaalsContact O-N 3.1Å; Y152-E154 VanDerWaalsContact C-N 3.29Å; Y152-E154 PolarHBondContact O-N 2.91Å; Y152-K156 HydrophobicContact CE1-CD 3.9Å; Y152-K156 HydrophobicContact CE1-CG 4.04Å; Y152-K156 HydrophobicContact CE2-CB 4.47Å; Y152-K156 HydrophobicContact CE2-CG 3.94Å; Y152-K156 VanDerWaalsContact O-CA 3.31Å; Y152-K156 WeakPolarHBondContact O-CA 3.39Å; Y152-K156 VanDerWaalsContact O-CB 3.24Å; Y152-K156 WeakPolarHBondContact O-CB 3.4Å; Y152-K156 PolarHBondContact O-N 3.04Å; Y152-K156 WeakPolarHBondContact OH-CE 3.47Å; Y152-L159 HydrophobicContact CD2-CD1 4.39Å; Y152-R160 PolarHBondContact OH-NE 2.91Å; Y152-R160 PolarHBondContact OH-NH2 2.87Å; Y152-L232 HydrophobicContact CD1-CD1 4.34Å; Y152-L232 HydrophobicContact CG-CD1 4.38Å; Y152-L232 PolarHBondContact OH-O 2.97Å; Y152-L233 HydrophobicContact CD2-CD2 3.96Å; Y152-L233 HydrophobicContact CE2-CD2 3.53Å
153	E	88.2	Confident	85.5	Confident	93 Å²	93	33 Å²	33	44%	0.435	16%	0.164	S	C	.	.	H	α-helix	trans	-59	-40.6	173.3	-75.2	176.5	171	0	0	112	R90 N149	R90-E153 IonicContact CZ-OE2 3.71Å; R90-E153 IonicContact NH1-OE2 2.97Å; R90-E153 PolarHBondContact NH1-OE2 3.32Å; R90-E153 IonicContact NH2-OE2 3.72Å; N149-E153 WeakPolarHBondContact O-CG 3.48Å; N149-E153 PolarHBondContact O-N 3.34Å
154	E	85.2	Confident	85	Confident	44 Å²	44	36 Å²	36	21%	0.206	19%	0.194	C	C	.	.	H	α-helix	trans	-74.8	-47.8	179.2	-69.3	174.8	-178.7	0	0	112.7	P55 K75 R83 M150 C151 Y152	P55-E154 HydrophobicContact CB-CG 4.25Å; K75-E154 IonicContact NZ-OE2 2.8Å; K75-E154 PolarHBondContact NZ-OE2 3.11Å; R83-E154 IonicContact CZ-OE1 2.77Å; R83-E154 IonicContact CZ-OE2 3.41Å; R83-E154 IonicContact NH1-OE1 2.66Å; R83-E154 PolarHBondContact NH1-OE1 2.91Å; R83-E154 IonicContact NH1-OE2 3.92Å; R83-E154 PolarHBondContact NH1-OE2 3.48Å; R83-E154 VanDerWaalsContact NH2-CD 3.3Å; R83-E154 IonicContact NH2-OE1 2.96Å; R83-E154 PolarHBondContact NH2-OE1 2.84Å; R83-E154 IonicContact NH2-OE2 3.96Å; R83-E154 PolarHBondContact NH2-OE2 3.45Å; M150-E154 WeakPolarHBondContact O-CG 3.24Å; M150-E154 PolarHBondContact O-N 3.2Å; C151-E154 PolarHBondContact O-N 3.36Å; Y152-E154 VanDerWaalsContact C-N 3.29Å; Y152-E154 PolarHBondContact O-N 2.91Å
155	D	84.2	Confident	84.7	Confident	4 Å²	4	36.5 Å²	36.5	2%	0.021	20%	0.198	C	C	.	.	H	α-helix	trans	-125.3	26.9	-160.9	-63.5	-37.4	0	0	0	113.2	S72 K75 C151 H157 I158 L159	S72-D155 VanDerWaalsContact OG-CB 3.23Å; S72-D155 WeakPolarHBondContact OG-CB 3.48Å; S72-D155 PolarHBondContact OG-OD2 3.11Å; K75-D155 IonicContact NZ-OD2 2.84Å; K75-D155 PolarHBondContact NZ-OD2 3.32Å; C151-D155 PolarHBondContact O-N 2.66Å; D155-H157 VanDerWaalsContact C-N 3.3Å; D155-H157 PolarHBondContact O-N 3.1Å; D155-H157 VanDerWaalsContact O-N 3.1Å; D155-I158 HydrophobicContact CB-CB 4.36Å; D155-I158 HydrophobicContact CB-CD1 4.1Å; D155-I158 WeakPolarHBondContact O-CB 3.24Å; D155-I158 PolarHBondContact O-N 2.98Å; D155-L159 PolarHBondContact O-N 2.85Å; D155-L159 VanDerWaalsContact O-N 3.14Å
156	K	83	Confident	84.4	Confident	89 Å²	89	35.8 Å²	35.8	39%	0.387	20%	0.195	S	C	.	.	H	α-helix	trans	-43.5	-46.7	-178.2	-178.1	167.6	-178.1	176.2	0	115.5	Y152 I158 R160	Y152-K156 HydrophobicContact CE1-CD 3.9Å; Y152-K156 HydrophobicContact CE1-CG 4.04Å; Y152-K156 HydrophobicContact CE2-CB 4.47Å; Y152-K156 HydrophobicContact CE2-CG 3.94Å; Y152-K156 VanDerWaalsContact O-CA 3.31Å; Y152-K156 WeakPolarHBondContact O-CA 3.39Å; Y152-K156 VanDerWaalsContact O-CB 3.24Å; Y152-K156 WeakPolarHBondContact O-CB 3.4Å; Y152-K156 PolarHBondContact O-N 3.04Å; Y152-K156 WeakPolarHBondContact OH-CE 3.47Å; K156-I158 PolarHBondContact O-N 3.48Å; K156-R160 WeakPolarHBondContact O-CG 3.46Å
157	H	78.3	Confident	84.1	Confident	42 Å²	42	35.8 Å²	35.8	19%	0.194	20%	0.195	C	C	.	.	H	α-helix	trans	-73	-19.2	-175.9	63.6	-74.6	0	0	0	112.9	D155 V161	D155-H157 VanDerWaalsContact C-N 3.3Å; D155-H157 PolarHBondContact O-N 3.1Å; D155-H157 VanDerWaalsContact O-N 3.1Å; H157-V161 WeakPolarHBondContact O-CG2 3.5Å
158	I	79.8	Confident	83.8	Confident	5 Å²	5	38.6 Å²	38.6	3%	0.026	21%	0.211	C	C	.	.	H	α-helix	trans	-88.8	-48.4	-178.6	-61.2	168.7	0	0	0	109.7	V64 L69 D155 K156 R160 V161	V64-I158 HydrophobicContact CG1-CG1 4.46Å; V64-I158 HydrophobicContact CG1-CG2 4.46Å; L69-I158 VanDerWaalsContact CA-CG2 3.47Å; L69-I158 HydrophobicContact CB-CG2 3.74Å; L69-I158 HydrophobicContact CD1-CG2 3.46Å; L69-I158 VanDerWaalsContact CD1-CG2 3.46Å; L69-I158 HydrophobicContact CG-CG2 4.2Å; D155-I158 HydrophobicContact CB-CB 4.36Å; D155-I158 HydrophobicContact CB-CD1 4.1Å; D155-I158 WeakPolarHBondContact O-CB 3.24Å; D155-I158 PolarHBondContact O-N 2.98Å; K156-I158 PolarHBondContact O-N 3.48Å; I158-R160 VanDerWaalsContact C-N 3.26Å; I158-R160 PolarHBondContact O-N 3.33Å; I158-V161 WeakPolarHBondContact O-CB 3.25Å; I158-V161 PolarHBondContact O-N 3.39Å; I158-V161 VanDerWaalsContact O-N 3.12Å
159	L	81.3	Confident	83.6	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-65.1	-26.8	-178.1	-68.8	173.3	0	0	0	113.5	I73 L76 F148 Y152 D155 V161 V162 L233	I73-L159 HydrophobicContact CD1-CD2 3.8Å; L76-L159 HydrophobicContact CD1-CD2 4.12Å; F148-L159 HydrophobicContact CZ-CD1 4.48Å; Y152-L159 HydrophobicContact CD2-CD1 4.39Å; D155-L159 PolarHBondContact O-N 2.85Å; D155-L159 VanDerWaalsContact O-N 3.14Å; L159-V161 PolarHBondContact O-N 3.2Å; L159-V162 PolarHBondContact O-N 2.8Å; L159-L233 HydrophobicContact CB-CD2 4.21Å
160	R	81.6	Confident	83.5	Confident	149 Å²	149	36.9 Å²	36.9	56%	0.562	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-13.4	175.4	-76.4	-179.6	177.8	-160.1	-7.9	114.6	Y152 K156 I158 V162 L233	Y152-R160 PolarHBondContact OH-NE 2.91Å; Y152-R160 PolarHBondContact OH-NH2 2.87Å; K156-R160 WeakPolarHBondContact O-CG 3.46Å; I158-R160 VanDerWaalsContact C-N 3.26Å; I158-R160 PolarHBondContact O-N 3.33Å; R160-V162 VanDerWaalsContact C-N 3.3Å; R160-L233 HydrophobicContact CG-CD2 4.34Å
161	V	81.4	Confident	83.3	Confident	94 Å²	94	38.1 Å²	38.1	57%	0.57	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-13.2	179.4	-173.9	0	0	0	0	111.2	H157 I158 L159 G163	H157-V161 WeakPolarHBondContact O-CG2 3.5Å; I158-V161 WeakPolarHBondContact O-CB 3.25Å; I158-V161 PolarHBondContact O-N 3.39Å; I158-V161 VanDerWaalsContact O-N 3.12Å; L159-V161 PolarHBondContact O-N 3.2Å; V161-G163 PolarHBondContact O-N 2.96Å
162	V	78.8	Confident	83.1	Confident	8 Å²	8	39.2 Å²	39.2	5%	0.048	22%	0.216	C	C	.	.	S	Bend	trans	-91.2	97.9	-170.7	-172.4	0	0	0	0	111.4	L69 L159 R160 F169 S172 L176 Y234	L69-V162 HydrophobicContact CD1-CG2 3.37Å; L69-V162 HydrophobicContact CD2-CG2 4.28Å; L69-V162 HydrophobicContact CG-CG2 4.38Å; L159-V162 PolarHBondContact O-N 2.8Å; R160-V162 VanDerWaalsContact C-N 3.3Å; V162-F169 HydrophobicContact CB-CD2 3.98Å; V162-F169 HydrophobicContact CB-CE2 4.43Å; V162-F169 HydrophobicContact CG1-CD2 3.68Å; V162-F169 HydrophobicContact CG1-CE2 4.29Å; V162-S172 WeakPolarHBondContact CG1-OG 3.44Å; V162-L176 HydrophobicContact CG1-CD1 3.94Å; V162-L176 HydrophobicContact CG2-CD1 4.06Å; V162-Y234 PolarHBondContact O-OH 3.11Å
163	G	72.4	Confident	82.6	Confident	37 Å²	37	37.9 Å²	37.9	38%	0.381	21%	0.211	S	C	.	.			trans	78	156.1	171.7	0	0	0	0	0	114.4	V161 D168 Y234	V161-G163 PolarHBondContact O-N 2.96Å; G163-D168 VanDerWaalsContact CA-CB 3.48Å; G163-Y234 PolarHBondContact O-OH 2.98Å
164	G	78.7	Confident	82.1	Confident	61 Å²	61	34 Å²	34	63%	0.629	19%	0.192	S	C	*	.	S	Bend	trans	-88.5	-21.4	175.9	0	0	0	0	0	112.8	D168 Y234	G164-D168 PolarHBondContact N-OD2 2.84Å; G164-Y234 WeakPolarHBondContact O-CE1 3.28Å
165	A	83.4	Confident	81.5	Confident	12 Å²	12	34.2 Å²	34.2	10%	0.099	20%	0.197	C	C	.	.	S	Bend	trans	-142.7	170.6	-179	0	0	0	0	0	112.2	H167 D168 F169 Y234	A165-H167 VanDerWaalsContact C-N 3.27Å; A165-H167 WeakPolarHBondContact CB-ND1 3.34Å; A165-H167 PolarHBondContact O-N 3.49Å; A165-D168 PolarHBondContact N-OD2 3.43Å; A165-D168 WeakPolarHBondContact O-CB 3.32Å; A165-D168 PolarHBondContact O-N 2.82Å; A165-D168 VanDerWaalsContact O-N 3.16Å; A165-F169 PolarHBondContact O-N 3.35Å; A165-F169 VanDerWaalsContact O-N 3.08Å; A165-Y234 VanDerWaalsContact C-CZ 3.43Å; A165-Y234 PolarHBondContact O-OH 3.48Å
166	L	85.2	Confident	81.1	Confident	14 Å²	14	34.7 Å²	34.7	7%	0.073	20%	0.2	C	C	.	.	H	α-helix	trans	-57.4	-37.2	-179.6	-176.1	63.5	0	0	0	113.1	F169 L170 L207 I226 A229 A230 Y234 V238 V264	L166-F169 HydrophobicContact CD1-CD1 4.36Å; L166-F169 WeakPolarHBondContact O-CB 3.43Å; L166-F169 PolarHBondContact O-N 3.4Å; L166-L170 HydrophobicContact CD1-CG 4.5Å; L166-L170 HydrophobicContact CG-CD1 4.29Å; L166-L170 WeakPolarHBondContact O-CG 3.14Å; L166-L170 PolarHBondContact O-N 2.97Å; L166-L207 HydrophobicContact CD2-CD1 4.22Å; L166-I226 HydrophobicContact CD2-CG2 4.22Å; L166-A229 HydrophobicContact CD1-CB 4.3Å; L166-A230 HydrophobicContact CD1-CB 4.25Å; L166-A230 HydrophobicContact CD2-CB 3.9Å; L166-Y234 HydrophobicContact CB-CD2 4.2Å; L166-Y234 HydrophobicContact CB-CE2 4.4Å; L166-Y234 HydrophobicContact CD1-CD2 4.42Å; L166-Y234 HydrophobicContact CD1-CE2 4.44Å; L166-V238 HydrophobicContact CD2-CG1 4.13Å; L166-V264 HydrophobicContact CD2-CG1 4.46Å
167	H	84.5	Confident	80.5	Confident	21 Å²	21	31.7 Å²	31.7	10%	0.097	19%	0.188	C	C	.	.	H	α-helix	trans	-65.9	-40.5	178.6	76.8	-82	0	0	0	112.3	A165 F169 L170 N171 L207	A165-H167 VanDerWaalsContact C-N 3.27Å; A165-H167 WeakPolarHBondContact CB-ND1 3.34Å; A165-H167 PolarHBondContact O-N 3.49Å; H167-F169 VanDerWaalsContact C-N 3.33Å; H167-L170 PolarHBondContact O-N 2.89Å; H167-N171 WeakPolarHBondContact O-CB 3.39Å; H167-N171 PolarHBondContact O-N 3.19Å; H167-N171 PolarHBondContact O-ND2 3.25Å; H167-L207 HydrophobicContact CB-CD2 4.26Å
168	D	84.8	Confident	80.1	Confident	60 Å²	60	32.8 Å²	32.8	32%	0.321	19%	0.192	S	C	.	.	H	α-helix	trans	-62.2	-43.6	174.2	-64.8	-44.7	0	0	0	110.9	G163 G164 A165 L170 N171 S172	G163-D168 VanDerWaalsContact CA-CB 3.48Å; G164-D168 PolarHBondContact N-OD2 2.84Å; A165-D168 PolarHBondContact N-OD2 3.43Å; A165-D168 WeakPolarHBondContact O-CB 3.32Å; A165-D168 PolarHBondContact O-N 2.82Å; A165-D168 VanDerWaalsContact O-N 3.16Å; D168-L170 PolarHBondContact O-N 3.19Å; D168-N171 PolarHBondContact O-N 3.39Å; D168-S172 VanDerWaalsContact O-CB 3.3Å; D168-S172 WeakPolarHBondContact O-CB 3.34Å; D168-S172 PolarHBondContact O-N 2.95Å
169	F	87.3	Confident	79.1	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-56.7	-52.1	177.1	179.1	-109.6	0	0	0	110.8	I73 L76 F148 V162 A165 L166 H167 N171 S172 F173 A229 L233 Y234	I73-F169 HydrophobicContact CD1-CE2 4.06Å; I73-F169 HydrophobicContact CD1-CZ 4.46Å; L76-F169 HydrophobicContact CD1-CZ 4.35Å; F148-F169 HydrophobicContact CE2-CE1 4.45Å; F148-F169 HydrophobicContact CE2-CZ 4.05Å; V162-F169 HydrophobicContact CB-CD2 3.98Å; V162-F169 HydrophobicContact CB-CE2 4.43Å; V162-F169 HydrophobicContact CG1-CD2 3.68Å; V162-F169 HydrophobicContact CG1-CE2 4.29Å; A165-F169 PolarHBondContact O-N 3.35Å; A165-F169 VanDerWaalsContact O-N 3.08Å; L166-F169 HydrophobicContact CD1-CD1 4.36Å; L166-F169 WeakPolarHBondContact O-CB 3.43Å; L166-F169 PolarHBondContact O-N 3.4Å; H167-F169 VanDerWaalsContact C-N 3.33Å; F169-N171 PolarHBondContact O-N 2.96Å; F169-S172 PolarHBondContact O-N 3.27Å; F169-S172 PolarHBondContact O-OG 3.38Å; F169-F173 AromaticContact CD1-CE2 3.73Å; F169-F173 HydrophobicContact CD1-CE2 3.73Å; F169-F173 AromaticContact CE1-CE2 3.33Å; F169-F173 HydrophobicContact CE1-CE2 3.33Å; F169-F173 AromaticContact CE1-CZ 3.7Å; F169-F173 HydrophobicContact CE1-CZ 3.7Å; F169-F173 HydrophobicContact CE2-CE2 4.17Å; F169-F173 HydrophobicContact CG-CE2 4.31Å; F169-F173 AromaticContact CZ-CE2 3.56Å; F169-F173 HydrophobicContact CZ-CE2 3.56Å; F169-F173 AromaticContact CZ-CZ 3.75Å; F169-F173 HydrophobicContact CZ-CZ 3.75Å; F169-F173 VanDerWaalsContact O-CD2 3.24Å; F169-F173 WeakPolarHBondContact O-CD2 3.17Å; F169-A229 HydrophobicContact CD1-CB 3.98Å; F169-A229 HydrophobicContact CE1-CB 3.52Å; F169-A229 HydrophobicContact CZ-CB 4.25Å; F169-L233 HydrophobicContact CD2-CD1 4.06Å; F169-L233 HydrophobicContact CE2-CD1 3.93Å; F169-L233 HydrophobicContact CZ-CD1 4.27Å; F169-Y234 HydrophobicContact CB-CE2 4.02Å; F169-Y234 WeakPolarHBondContact CB-OH 3.47Å; F169-Y234 HydrophobicContact CG-CE2 4.46Å
170	L	87.7	Confident	77.9	Confident	2 Å²	2	37.7 Å²	37.7	1%	0.01	22%	0.216	C	C	.	.	H	α-helix	trans	-63.5	-41.9	179.9	-65.1	175.2	0	0	0	112.5	L166 H167 D168 S172 F173 V197 C199 V209 F222 I226	L166-L170 HydrophobicContact CD1-CG 4.5Å; L166-L170 HydrophobicContact CG-CD1 4.29Å; L166-L170 WeakPolarHBondContact O-CG 3.14Å; L166-L170 PolarHBondContact O-N 2.97Å; H167-L170 PolarHBondContact O-N 2.89Å; D168-L170 PolarHBondContact O-N 3.19Å; L170-S172 PolarHBondContact O-N 3.2Å; L170-F173 HydrophobicContact CD2-CE2 4.33Å; L170-F173 PolarHBondContact O-N 2.89Å; L170-V197 HydrophobicContact CB-CG1 4.25Å; L170-C199 HydrophobicContact CB-CB 3.93Å; L170-C199 HydrophobicContact CD1-CB 4.24Å; L170-V209 HydrophobicContact CD1-CG1 4.36Å; L170-V209 HydrophobicContact CD1-CG2 3.72Å; L170-F222 HydrophobicContact CD2-CZ 4.47Å; L170-I226 HydrophobicContact CD2-CG1 4.03Å
171	N	86.6	Confident	76.6	Confident	36 Å²	36	33.3 Å²	33.3	19%	0.193	21%	0.208	C	C	.	.	H	α-helix	trans	-69.2	-23.9	178.2	-72.2	-22.8	0	0	0	112.8	H167 D168 F169 F173 C199 N352	H167-N171 WeakPolarHBondContact O-CB 3.39Å; H167-N171 PolarHBondContact O-N 3.19Å; H167-N171 PolarHBondContact O-ND2 3.25Å; D168-N171 PolarHBondContact O-N 3.39Å; F169-N171 PolarHBondContact O-N 2.96Å; N171-F173 VanDerWaalsContact C-N 3.35Å; N171-C199 PolarHBondContact ND2-O 3.25Å; N171-C199 WeakPolarHBondContact OD1-CA 3.26Å; N171-C199 WeakPolarHBondContact OD1-CB 3.3Å; N171-C199 PolarHBondContact OD1-N 3.28Å; N171-C199 PolarHBondContact OD1-O 3.07Å; N171-N352 WeakPolarHBondContact CA-ND2 3.46Å; N171-N352 VanDerWaalsContact CG-ND2 3.34Å; N171-N352 PolarHBondContact OD1-ND2 3.16Å
172	S	83.9	Confident	74.8	Confident	23 Å²	23	34.6 Å²	34.6	16%	0.161	22%	0.216	C	C	.	.	H	α-helix	trans	-75.7	-17.6	177.1	79.2	0	0	0	0	114.5	V162 D168 F169 L170 N174 V175 L176	V162-S172 WeakPolarHBondContact CG1-OG 3.44Å; D168-S172 VanDerWaalsContact O-CB 3.3Å; D168-S172 WeakPolarHBondContact O-CB 3.34Å; D168-S172 PolarHBondContact O-N 2.95Å; F169-S172 PolarHBondContact O-N 3.27Å; F169-S172 PolarHBondContact O-OG 3.38Å; L170-S172 PolarHBondContact O-N 3.2Å; S172-N174 VanDerWaalsContact C-N 3.3Å; S172-N174 PolarHBondContact O-N 3.36Å; S172-V175 PolarHBondContact O-N 3.25Å; S172-L176 WeakPolarHBondContact O-CG 3.08Å; S172-L176 PolarHBondContact O-N 3.25Å
173	F	78.8	Confident	73	Confident	2 Å²	2	39.4 Å²	39.4	1%	0.009	25%	0.247	C	C	.	.	H	α-helix	trans	-53.2	-48.4	-177.1	-92.2	-108.7	0	0	0	111.2	I73 L76 A77 F169 L170 N171 V175 L176 L177 V197	I73-F173 HydrophobicContact CG2-CD1 3.82Å; I73-F173 HydrophobicContact CG2-CE1 4.11Å; I73-F173 HydrophobicContact CG2-CG 4.2Å; L76-F173 HydrophobicContact CB-CE1 4.46Å; A77-F173 HydrophobicContact CB-CD1 4.31Å; A77-F173 HydrophobicContact CB-CE1 4.44Å; F169-F173 AromaticContact CD1-CE2 3.73Å; F169-F173 HydrophobicContact CD1-CE2 3.73Å; F169-F173 AromaticContact CE1-CE2 3.33Å; F169-F173 HydrophobicContact CE1-CE2 3.33Å; F169-F173 AromaticContact CE1-CZ 3.7Å; F169-F173 HydrophobicContact CE1-CZ 3.7Å; F169-F173 HydrophobicContact CE2-CE2 4.17Å; F169-F173 HydrophobicContact CG-CE2 4.31Å; F169-F173 AromaticContact CZ-CE2 3.56Å; F169-F173 HydrophobicContact CZ-CE2 3.56Å; F169-F173 AromaticContact CZ-CZ 3.75Å; F169-F173 HydrophobicContact CZ-CZ 3.75Å; F169-F173 VanDerWaalsContact O-CD2 3.24Å; F169-F173 WeakPolarHBondContact O-CD2 3.17Å; L170-F173 HydrophobicContact CD2-CE2 4.33Å; L170-F173 PolarHBondContact O-N 2.89Å; N171-F173 VanDerWaalsContact C-N 3.35Å; F173-V175 PolarHBondContact O-N 3.13Å; F173-L176 PolarHBondContact O-N 3.29Å; F173-L177 HydrophobicContact CB-CD1 4.35Å; F173-L177 HydrophobicContact CD1-CD1 4.39Å; F173-L177 WeakPolarHBondContact O-CB 3.4Å; F173-L177 WeakPolarHBondContact O-CD1 3.48Å; F173-L177 WeakPolarHBondContact O-CG 3.4Å; F173-L177 PolarHBondContact O-N 2.73Å; F173-V197 HydrophobicContact CB-CB 4.47Å; F173-V197 HydrophobicContact CB-CG2 4.49Å
174	N	76.7	Confident	71.5	Confident	10 Å²	10	42.2 Å²	42.2	5%	0.053	26%	0.259	C	S	.	.	H	α-helix	trans	-66.4	-39.8	-175.2	-62.3	-13.9	0	0	0	112.4	S172 K178 S196 V197 N352	S172-N174 VanDerWaalsContact C-N 3.3Å; S172-N174 PolarHBondContact O-N 3.36Å; N174-K178 WeakPolarHBondContact O-CB 3.48Å; N174-K178 PolarHBondContact O-N 2.79Å; N174-S196 PolarHBondContact ND2-OG 3.43Å; N174-S196 VanDerWaalsContact OD1-CA 3.26Å; N174-S196 WeakPolarHBondContact OD1-CA 3.4Å; N174-V197 PolarHBondContact ND2-N 3.38Å; N174-V197 PolarHBondContact ND2-O 3.18Å; N174-V197 PolarHBondContact OD1-N 3.48Å; N174-N352 HydrophobicContact CB-CB 4.29Å
175	V	74	Confident	69.4	Low	49 Å²	49	45.5 Å²	45.5	30%	0.297	26%	0.262	S	S	.	.	H	α-helix	trans	-65.5	-45.7	178.9	-178.9	0	0	0	0	110.4	S172 F173 Q179 N352	S172-V175 PolarHBondContact O-N 3.25Å; F173-V175 PolarHBondContact O-N 3.13Å; V175-Q179 WeakPolarHBondContact O-CG 3.34Å; V175-Q179 PolarHBondContact O-N 2.95Å; V175-N352 WeakPolarHBondContact CG2-O 3.23Å
176	L	75.1	Confident	67.4	Low	15 Å²	15	50.6 Å²	50.6	8%	0.079	29%	0.294	C	S	.	.	H	α-helix	trans	-76.4	-36.1	-175.8	-64.8	175.8	0	0	0	112.4	L69 I73 V162 S172 F173 Q179 S180	L69-L176 HydrophobicContact CD1-CD1 4.28Å; L69-L176 HydrophobicContact CD2-CD1 4.11Å; L69-L176 HydrophobicContact CD2-CD2 3.68Å; L69-L176 HydrophobicContact CG-CD1 4.08Å; L69-L176 HydrophobicContact CG-CD2 3.98Å; I73-L176 HydrophobicContact CB-CB 4.3Å; I73-L176 HydrophobicContact CD1-CD1 4.37Å; I73-L176 HydrophobicContact CG1-CB 4.07Å; I73-L176 HydrophobicContact CG1-CD1 3.76Å; I73-L176 HydrophobicContact CG2-CB 4.33Å; V162-L176 HydrophobicContact CG1-CD1 3.94Å; V162-L176 HydrophobicContact CG2-CD1 4.06Å; S172-L176 WeakPolarHBondContact O-CG 3.08Å; S172-L176 PolarHBondContact O-N 3.25Å; F173-L176 PolarHBondContact O-N 3.29Å; L176-Q179 PolarHBondContact O-N 3.45Å; L176-S180 PolarHBondContact O-N 3.17Å
177	L	70.4	Confident	65.1	Low	26 Å²	26	57 Å²	57	14%	0.136	33%	0.328	C	S	.	.	H	α-helix	trans	-61.5	-47.1	174.6	-74.7	169.9	0	0	0	110.8	I73 R74 A77 F173 Q179 S180 S181	I73-L177 HydrophobicContact CG2-CD2 4.01Å; I73-L177 HydrophobicContact CG2-CG 3.95Å; R74-L177 HydrophobicContact CB-CD2 4.35Å; A77-L177 HydrophobicContact CB-CD1 3.81Å; A77-L177 HydrophobicContact CB-CD2 3.71Å; A77-L177 HydrophobicContact CB-CG 4.35Å; F173-L177 HydrophobicContact CB-CD1 4.35Å; F173-L177 HydrophobicContact CD1-CD1 4.39Å; F173-L177 WeakPolarHBondContact O-CB 3.4Å; F173-L177 WeakPolarHBondContact O-CD1 3.48Å; F173-L177 WeakPolarHBondContact O-CG 3.4Å; F173-L177 PolarHBondContact O-N 2.73Å; L177-Q179 VanDerWaalsContact C-N 3.31Å; L177-Q179 PolarHBondContact O-N 2.83Å; L177-S180 WeakPolarHBondContact O-CB 3.49Å; L177-S180 PolarHBondContact O-N 3.16Å; L177-S180 VanDerWaalsContact O-N 3.1Å; L177-S180 PolarHBondContact O-OG 3.34Å; L177-S181 PolarHBondContact O-N 3.23Å; L177-S181 VanDerWaalsContact O-N 3.16Å; L177-S181 PolarHBondContact O-OG 2.82Å
178	K	68.6	Low	62.9	Low	64 Å²	64	65.5 Å²	65.5	28%	0.278	36%	0.36	S	S	.	.	H	α-helix	trans	-64.1	-32	-179.8	-168.8	173.4	-178.7	176.5	0	113.7	N174 S180 S337 Q354	N174-K178 WeakPolarHBondContact O-CB 3.48Å; N174-K178 PolarHBondContact O-N 2.79Å; K178-S180 VanDerWaalsContact C-N 3.32Å; K178-S337 WeakPolarHBondContact CE-OG 3.36Å; K178-S337 PolarHBondContact NZ-OG 2.86Å; K178-Q354 PolarHBondContact NZ-O 3.09Å
179	Q	60.8	Low	60.6	Low	95 Å²	95	70.6 Å²	70.6	44%	0.444	39%	0.387	S	S	.	.	H	α-helix	trans	-73.1	-25.4	175.7	-74	177	-6.7	0	0	113.2	L66 V175 L176 L177	L66-Q179 VanDerWaalsContact CG-OE1 3.23Å; V175-Q179 WeakPolarHBondContact O-CG 3.34Å; V175-Q179 PolarHBondContact O-N 2.95Å; L176-Q179 PolarHBondContact O-N 3.45Å; L177-Q179 VanDerWaalsContact C-N 3.31Å; L177-Q179 PolarHBondContact O-N 2.83Å
180	S	54.9	Low	58.4	Low	13 Å²	13	77.2 Å²	77.2	9%	0.091	42%	0.422	C	S	.	.	H	α-helix	trans	-77.9	-35.4	174.6	79.4	0	0	0	0	111.3	R74 L176 L177 K178 V182	R74-S180 PolarHBondContact NE-OG 2.85Å; R74-S180 PolarHBondContact NH2-O 3.03Å; R74-S180 PolarHBondContact NH2-OG 3.16Å; L176-S180 PolarHBondContact O-N 3.17Å; L177-S180 WeakPolarHBondContact O-CB 3.49Å; L177-S180 PolarHBondContact O-N 3.16Å; L177-S180 VanDerWaalsContact O-N 3.1Å; L177-S180 PolarHBondContact O-OG 3.34Å; K178-S180 VanDerWaalsContact C-N 3.32Å; S180-V182 PolarHBondContact O-N 2.78Å
181	S	54.3	Low	56.5	Low	58 Å²	58	79.3 Å²	79.3	41%	0.406	44%	0.436	S	S	.	.	S	Bend	trans	-55.6	126.2	-171.8	-51.1	0	0	0	0	112.3	L177	L177-S181 PolarHBondContact O-N 3.23Å; L177-S181 VanDerWaalsContact O-N 3.16Å; L177-S181 PolarHBondContact O-OG 2.82Å
182	V	43.3	Very low	54.8	Low	120 Å²	120	81 Å²	81	73%	0.727	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-56.5	135.9	161.8	177.2	0	0	0	0	107.2	S180	S180-V182 PolarHBondContact O-N 2.78Å
183	P	42.1	Very low	53.7	Low	109 Å²	109	84.7 Å²	84.7	71%	0.708	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-53.3	133.2	178.7	19.9	-31.5	0	0	0	109.8	N185	P183-N185 PolarHBondContact O-N 3.23Å
184	P	40.2	Very low	53.2	Low	96 Å²	96	88.1 Å²	88.1	62%	0.623	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-61.1	138.5	-176.1	23	-32	0	0	0	110.5
185	N	34.6	Very low	53.2	Low	131 Å²	131	89.5 Å²	89.5	70%	0.701	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-62.8	131	170.7	-126.4	-8.6	0	0	0	108.3	P183 D187	P183-N185 PolarHBondContact O-N 3.23Å; N185-D187 PolarHBondContact O-N 3.13Å; N185-D187 VanDerWaalsContact O-N 3.11Å
186	P	42	Very low	53.7	Low	118 Å²	118	87.2 Å²	87.2	77%	0.766	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-10.8	-171.5	25.6	-33.5	0	0	0	114.8
187	D	36.1	Very low	54.2	Low	149 Å²	149	86.7 Å²	86.7	80%	0.797	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	12.9	-172.1	-64.1	-34.2	0	0	0	114.9	N185	N185-D187 PolarHBondContact O-N 3.13Å; N185-D187 VanDerWaalsContact O-N 3.11Å
188	R	40	Very low	54.9	Low	200 Å²	200	85.9 Å²	85.9	76%	0.755	47%	0.471	S	S	*	.			trans	-115.3	108.9	174.5	-75	-167.9	171.4	-163.1	-2.6	111.5	D190	R188-D190 PolarHBondContact O-N 3.41Å
189	D	35.7	Very low	55.8	Low	167 Å²	167	83.1 Å²	83.1	89%	0.893	46%	0.459	S	S	*	.	S	Bend	trans	-63.4	-2.3	174.8	-106.2	-20.4	0	0	0	114.4	C191	D189-C191 PolarHBondContact O-N 3.08Å
190	D	40.7	Very low	56.7	Low	139 Å²	139	80.6 Å²	80.6	74%	0.743	45%	0.449	S	S	*	.			trans	-81.2	19	-179.7	-79.2	-29.6	0	0	0	114.6	R188 V192	R188-D190 PolarHBondContact O-N 3.41Å; D190-V192 PolarHBondContact O-N 3.3Å; D190-V192 VanDerWaalsContact O-N 3.13Å
191	C	46.9	Very low	57.7	Low	45 Å²	45	82.2 Å²	82.2	30%	0.304	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	2.8	-173.3	-148.2	0	0	0	0	114.6	D189	D189-C191 PolarHBondContact O-N 3.08Å
192	V	51	Low	58.3	Low	72 Å²	72	83.1 Å²	83.1	44%	0.436	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-8.6	-170.1	-176.4	0	0	0	0	113.8	D190	D190-V192 PolarHBondContact O-N 3.3Å; D190-V192 VanDerWaalsContact O-N 3.13Å
193	N	61.1	Low	59.5	Low	101 Å²	101	81.6 Å²	81.6	54%	0.54	44%	0.441	S	S	.	.			trans	-127	53.9	-168.5	-63.8	-25.5	0	0	0	113.4	N213	N193-N213 HydrophobicContact CB-CB 4.42Å
194	E	69.1	Low	60.6	Low	73 Å²	73	79.8 Å²	79.8	34%	0.341	43%	0.429	S	S	.	.			trans	-69.7	134.1	168.6	-74.4	-172.6	160.1	0	0	110.5	N213 M350	E194-N213 PolarHBondContact O-ND2 3.33Å; E194-M350 HydrophobicContact CB-CE 4.18Å
195	P	76.9	Confident	62.1	Low	40 Å²	40	78.8 Å²	78.8	26%	0.26	42%	0.419	S	S	.	.			trans	-68.3	135.6	174.3	26.9	-32.3	0	0	0	110.2	F211 F212	P195-F211 HydrophobicContact CB-CE2 3.9Å; P195-F212 WeakPolarHBondContact CA-O 3.22Å
196	S	83.3	Confident	64.4	Low	0 Å²	0	75 Å²	75	0%	0	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	132.4	-178	166.9	0	0	0	0	112.1	N174 F211 F212 T349 M350	N174-S196 PolarHBondContact ND2-OG 3.43Å; N174-S196 VanDerWaalsContact OD1-CA 3.26Å; N174-S196 WeakPolarHBondContact OD1-CA 3.4Å; S196-F211 WeakPolarHBondContact O-CA 3.44Å; S196-F212 PolarHBondContact N-O 2.94Å; S196-F212 PolarHBondContact O-N 2.78Å; S196-T349 WeakPolarHBondContact CB-O 3.1Å; S196-T349 PolarHBondContact OG-O 3.06Å; S196-M350 WeakPolarHBondContact CB-SD 3.35Å
197	V	86.5	Confident	66.4	Low	4 Å²	4	69.9 Å²	69.9	2%	0.024	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	129.7	176	-177.3	0	0	0	0	110.1	L170 F173 N174 V209 Y210 F211 F222 N352	L170-V197 HydrophobicContact CB-CG1 4.25Å; F173-V197 HydrophobicContact CB-CB 4.47Å; F173-V197 HydrophobicContact CB-CG2 4.49Å; N174-V197 PolarHBondContact ND2-N 3.38Å; N174-V197 PolarHBondContact ND2-O 3.18Å; N174-V197 PolarHBondContact OD1-N 3.48Å; V197-V209 HydrophobicContact CG1-CG1 3.83Å; V197-Y210 CarbonylContact C-O 3.53Å; V197-Y210 WeakPolarHBondContact CA-O 3.49Å; V197-F211 HydrophobicContact CG2-CD2 3.99Å; V197-F211 HydrophobicContact CG2-CE2 4.15Å; V197-F211 HydrophobicContact CG2-CG 4.39Å; V197-F222 HydrophobicContact CG1-CZ 4.02Å; V197-F222 HydrophobicContact CG2-CE2 4.28Å; V197-F222 HydrophobicContact CG2-CZ 3.73Å; V197-N352 PolarHBondContact O-ND2 3.23Å
198	L	85.9	Confident	68.8	Low	10 Å²	10	63.1 Å²	63.1	5%	0.052	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	117	175	176.8	65.3	0	0	0	110.3	L200 V209 Y210 F212 L351 N352	L198-L200 HydrophobicContact CD1-CD2 4.06Å; L198-L200 HydrophobicContact CD2-CD2 4.25Å; L198-L200 HydrophobicContact CD2-CG 4.45Å; L198-L200 HydrophobicContact CG-CD2 4.09Å; L198-L200 HydrophobicContact CG-CG 4.31Å; L198-V209 CarbonylContact O-C 3.55Å; L198-V209 WeakPolarHBondContact O-CA 3.26Å; L198-Y210 HydrophobicContact CB-CD2 4.43Å; L198-Y210 HydrophobicContact CD2-CD2 4.2Å; L198-Y210 HydrophobicContact CG-CD2 4.32Å; L198-Y210 PolarHBondContact N-O 3.26Å; L198-Y210 PolarHBondContact O-N 3.49Å; L198-F212 HydrophobicContact CB-CE2 3.9Å; L198-F212 HydrophobicContact CD2-CE2 4.2Å; L198-L351 HydrophobicContact CD1-CB 4.32Å; L198-L351 HydrophobicContact CD1-CD2 4.42Å; L198-N352 WeakPolarHBondContact CA-ND2 3.36Å; L198-N352 WeakPolarHBondContact CD1-ND2 3.47Å
199	C	85.7	Confident	71.1	Confident	5 Å²	5	53.6 Å²	53.6	3%	0.034	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	117.5	174.4	-174.1	0	0	0	0	109.6	L170 N171 T208 V209	L170-C199 HydrophobicContact CB-CB 3.93Å; L170-C199 HydrophobicContact CD1-CB 4.24Å; N171-C199 PolarHBondContact ND2-O 3.25Å; N171-C199 WeakPolarHBondContact OD1-CA 3.26Å; N171-C199 WeakPolarHBondContact OD1-CB 3.3Å; N171-C199 PolarHBondContact OD1-N 3.28Å; N171-C199 PolarHBondContact OD1-O 3.07Å; C199-T208 WeakPolarHBondContact CA-O 3.47Å; C199-V209 HydrophobicContact CB-CG2 4.3Å
200	L	81.1	Confident	73.5	Confident	42 Å²	42	46 Å²	46	22%	0.22	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	132	172.2	-59.3	-174.4	0	0	0	109.8	L198 K202 T208 Y210	L198-L200 HydrophobicContact CD1-CD2 4.06Å; L198-L200 HydrophobicContact CD2-CD2 4.25Å; L198-L200 HydrophobicContact CD2-CG 4.45Å; L198-L200 HydrophobicContact CG-CD2 4.09Å; L198-L200 HydrophobicContact CG-CG 4.31Å; L200-K202 HydrophobicContact CB-CG 4.49Å; L200-T208 PolarHBondContact N-O 3.25Å; L200-T208 PolarHBondContact O-N 3.27Å; L200-Y210 HydrophobicContact CD1-CD2 4.5Å; L200-Y210 HydrophobicContact CD1-CE2 3.64Å; L200-Y210 HydrophobicContact CG-CD2 4.47Å; L200-Y210 HydrophobicContact CG-CE2 3.97Å
201	D	74.6	Confident	75.6	Confident	47 Å²	47	39.8 Å²	39.8	25%	0.251	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	91.9	174.1	-178.2	-4	0	0	0	108.2	L207 S275 R278	D201-L207 HydrophobicContact CB-CD2 4.05Å; D201-S275 WeakPolarHBondContact OD2-CB 3.24Å; D201-R278 IonicContact OD1-NH2 3.46Å; D201-R278 PolarHBondContact OD1-NH2 3.29Å
202	K	66.8	Low	77.3	Confident	77 Å²	77	37.7 Å²	37.7	34%	0.335	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	-41.9	-179.4	-70.3	-178.7	-179.1	169.8	0	111.6	L200 Y210 D249	L200-K202 HydrophobicContact CB-CG 4.49Å; K202-Y210 PolarHBondContact NZ-OH 3.28Å; K202-D249 IonicContact NZ-OD1 3.21Å; K202-D249 PolarHBondContact NZ-OD1 3.25Å; K202-D249 IonicContact NZ-OD2 2.65Å; K202-D249 PolarHBondContact NZ-OD2 3.03Å
203	D	69.2	Low	78.6	Confident	88 Å²	88	34.9 Å²	34.9	47%	0.471	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	156.7	-172.5	-66.6	-53.6	0	0	0	112.8	D205 L206 R278	D203-D205 PolarHBondContact O-N 3.4Å; D203-L206 HydrophobicContact CB-CB 3.98Å; D203-L206 PolarHBondContact O-N 3.06Å; D203-R278 PolarHBondContact O-NH2 3.1Å
204	P	64.3	Low	79.4	Confident	71 Å²	71	31.1 Å²	31.1	46%	0.461	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-21.5	-171.4	-24.2	33	0	0	0	117.3	L272	P204-L272 WeakPolarHBondContact O-CD1 3.16Å
205	D	73.6	Confident	79.8	Confident	76 Å²	76	34.3 Å²	34.3	41%	0.406	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-132.7	9.1	-175.1	-56.2	-56.6	0	0	0	112.3	D203 V266 A269	D203-D205 PolarHBondContact O-N 3.4Å; D205-V266 PolarHBondContact O-N 3.11Å; D205-A269 VanDerWaalsContact OD1-CB 3.29Å; D205-A269 WeakPolarHBondContact OD1-CB 3.35Å
206	L	82.2	Confident	79.8	Confident	51 Å²	51	36.5 Å²	36.5	27%	0.267	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	118.1	-172.2	-156.7	72.8	0	0	0	111.2	D203 T263 V265	D203-L206 HydrophobicContact CB-CB 3.98Å; D203-L206 PolarHBondContact O-N 3.06Å; L206-T263 HydrophobicContact CD1-CG2 3.28Å; L206-T263 HydrophobicContact CD2-CG2 4.2Å; L206-T263 HydrophobicContact CG-CG2 3.91Å; L206-V265 HydrophobicContact CD1-CG2 3.77Å
207	L	84.8	Confident	79.5	Confident	10 Å²	10	37.9 Å²	37.9	5%	0.052	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	128.7	169.5	-56.8	170.2	0	0	0	109.5	L166 H167 D201 V264	L166-L207 HydrophobicContact CD2-CD1 4.22Å; H167-L207 HydrophobicContact CB-CD2 4.26Å; D201-L207 HydrophobicContact CB-CD2 4.05Å; L207-V264 HydrophobicContact CB-CB 4.17Å; L207-V264 PolarHBondContact N-O 3.33Å; L207-V264 PolarHBondContact O-N 3.29Å
208	T	85.9	Confident	79.2	Confident	8 Å²	8	37.9 Å²	37.9	5%	0.049	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	111	175.1	-52.4	0	0	0	0	108.8	C199 L200 Y210 L261	C199-T208 WeakPolarHBondContact CA-O 3.47Å; L200-T208 PolarHBondContact N-O 3.25Å; L200-T208 PolarHBondContact O-N 3.27Å; T208-Y210 HydrophobicContact CG2-CE1 4.41Å; T208-Y210 HydrophobicContact CG2-CE2 3.76Å; T208-L261 HydrophobicContact CG2-CD1 3.38Å
209	V	88.1	Confident	79	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	113	-176.6	-174.3	0	0	0	0	109.9	L170 V197 L198 C199 F222 Y262 V264	L170-V209 HydrophobicContact CD1-CG1 4.36Å; L170-V209 HydrophobicContact CD1-CG2 3.72Å; V197-V209 HydrophobicContact CG1-CG1 3.83Å; L198-V209 CarbonylContact O-C 3.55Å; L198-V209 WeakPolarHBondContact O-CA 3.26Å; C199-V209 HydrophobicContact CB-CG2 4.3Å; V209-F222 HydrophobicContact CG1-CE1 4.36Å; V209-Y262 PolarHBondContact N-O 2.82Å; V209-Y262 PolarHBondContact O-N 3.18Å; V209-V264 HydrophobicContact CG2-CG2 3.88Å
210	Y	85.8	Confident	78.9	Confident	7 Å²	7	41.1 Å²	41.1	3%	0.027	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	132.9	169.7	-54.5	-88.3	0	0	0	109.7	V197 L198 L200 K202 T208 F212 D249 L252 L260 L261	V197-Y210 CarbonylContact C-O 3.53Å; V197-Y210 WeakPolarHBondContact CA-O 3.49Å; L198-Y210 HydrophobicContact CB-CD2 4.43Å; L198-Y210 HydrophobicContact CD2-CD2 4.2Å; L198-Y210 HydrophobicContact CG-CD2 4.32Å; L198-Y210 PolarHBondContact N-O 3.26Å; L198-Y210 PolarHBondContact O-N 3.49Å; L200-Y210 HydrophobicContact CD1-CD2 4.5Å; L200-Y210 HydrophobicContact CD1-CE2 3.64Å; L200-Y210 HydrophobicContact CG-CD2 4.47Å; L200-Y210 HydrophobicContact CG-CE2 3.97Å; K202-Y210 PolarHBondContact NZ-OH 3.28Å; T208-Y210 HydrophobicContact CG2-CE1 4.41Å; T208-Y210 HydrophobicContact CG2-CE2 3.76Å; Y210-F212 HydrophobicContact CD1-CZ 4.45Å; Y210-F212 HydrophobicContact CG-CE2 4.5Å; Y210-F212 HydrophobicContact CG-CZ 4.03Å; Y210-D249 VanDerWaalsContact OH-CG 3.32Å; Y210-D249 PolarHBondContact OH-OD2 3.39Å; Y210-L252 HydrophobicContact CD1-CD1 3.42Å; Y210-L252 VanDerWaalsContact CD1-CD1 3.42Å; Y210-L252 HydrophobicContact CE1-CD1 3.32Å; Y210-L252 HydrophobicContact CG-CD1 4.14Å; Y210-L260 WeakPolarHBondContact CA-O 3.42Å; Y210-L261 HydrophobicContact CD1-CD1 3.62Å; Y210-L261 HydrophobicContact CE1-CD1 3.42Å; Y210-L261 VanDerWaalsContact CE1-CD1 3.42Å; Y210-L261 HydrophobicContact CG-CD1 4.24Å
211	F	85.4	Confident	79.2	Confident	8 Å²	8	39.1 Å²	39.1	4%	0.035	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	104.9	169.4	-166.8	179.2	0	0	0	108.8	P195 S196 V197 P214 T218 F222 S259 L260 Y262	P195-F211 HydrophobicContact CB-CE2 3.9Å; S196-F211 WeakPolarHBondContact O-CA 3.44Å; V197-F211 HydrophobicContact CG2-CD2 3.99Å; V197-F211 HydrophobicContact CG2-CE2 4.15Å; V197-F211 HydrophobicContact CG2-CG 4.39Å; F211-P214 HydrophobicContact CD1-CB 3.79Å; F211-P214 HydrophobicContact CD2-CB 4.09Å; F211-P214 HydrophobicContact CE1-CB 3.66Å; F211-P214 HydrophobicContact CE2-CB 3.97Å; F211-P214 HydrophobicContact CG-CB 4.01Å; F211-P214 HydrophobicContact CZ-CB 3.75Å; F211-T218 HydrophobicContact CE1-CG2 3.77Å; F211-T218 HydrophobicContact CZ-CG2 3.85Å; F211-F222 AromaticContact CD1-CD1 3.67Å; F211-F222 HydrophobicContact CD1-CD1 3.67Å; F211-F222 HydrophobicContact CD1-CD2 4.47Å; F211-F222 AromaticContact CD1-CE1 3.88Å; F211-F222 HydrophobicContact CD1-CE1 3.88Å; F211-F222 AromaticContact CD1-CG 3.99Å; F211-F222 HydrophobicContact CD1-CG 3.99Å; F211-F222 HydrophobicContact CD1-CZ 4.39Å; F211-F222 HydrophobicContact CE1-CB 4.33Å; F211-F222 HydrophobicContact CE1-CD1 4.11Å; F211-F222 HydrophobicContact CE1-CD2 4.12Å; F211-F222 HydrophobicContact CE1-CE1 4.42Å; F211-F222 HydrophobicContact CE1-CE2 4.46Å; F211-F222 AromaticContact CE1-CG 3.94Å; F211-F222 HydrophobicContact CE1-CG 3.94Å; F211-F222 HydrophobicContact CG-CE1 4.39Å; F211-S259 WeakPolarHBondContact O-CA 3.4Å; F211-L260 HydrophobicContact CB-CB 4.43Å; F211-L260 PolarHBondContact N-O 3.45Å; F211-L260 PolarHBondContact O-N 3.25Å; F211-Y262 HydrophobicContact CB-CE2 4.08Å; F211-Y262 HydrophobicContact CD1-CE2 4.44Å
212	F	83.1	Confident	79.9	Confident	1 Å²	1	37.1 Å²	37.1	0%	0.004	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	137.8	178.3	-56	-72.3	0	0	0	110.8	P195 S196 L198 Y210 P214 L252 T349	P195-F212 WeakPolarHBondContact CA-O 3.22Å; S196-F212 PolarHBondContact N-O 2.94Å; S196-F212 PolarHBondContact O-N 2.78Å; L198-F212 HydrophobicContact CB-CE2 3.9Å; L198-F212 HydrophobicContact CD2-CE2 4.2Å; Y210-F212 HydrophobicContact CD1-CZ 4.45Å; Y210-F212 HydrophobicContact CG-CE2 4.5Å; Y210-F212 HydrophobicContact CG-CZ 4.03Å; F212-P214 VanDerWaalsContact C-CD 3.49Å; F212-L252 HydrophobicContact CE1-CD1 4.08Å; F212-L252 HydrophobicContact CZ-CD1 4.06Å; F212-L252 HydrophobicContact CZ-CD2 4.44Å; F212-T349 HydrophobicContact CD1-CG2 3.82Å; F212-T349 WeakPolarHBondContact CD2-O 3.2Å; F212-T349 HydrophobicContact CE1-CG2 3.91Å; F212-T349 HydrophobicContact CG-CG2 4.25Å; F212-T349 HydrophobicContact CZ-CG2 4.39Å
213	N	77.9	Confident	81	Confident	14 Å²	14	34.3 Å²	34.3	8%	0.075	18%	0.183	C	C	.	.	S	Bend	trans	47.3	49.6	179.6	-54.2	-39.3	0	0	0	114.1	N193 E194 P258	N193-N213 HydrophobicContact CB-CB 4.42Å; E194-N213 PolarHBondContact O-ND2 3.33Å; N213-P258 PolarHBondContact N-O 2.95Å; N213-P258 WeakPolarHBondContact OD1-CD 3.29Å
214	P	76.7	Confident	82	Confident	22 Å²	22	30.1 Å²	30.1	14%	0.143	16%	0.161	C	C	.	.			trans	-62.8	142.2	178.2	28.9	-34.5	0	0	0	110.4	F211 F212 E219 L260	F211-P214 HydrophobicContact CD1-CB 3.79Å; F211-P214 HydrophobicContact CD2-CB 4.09Å; F211-P214 HydrophobicContact CE1-CB 3.66Å; F211-P214 HydrophobicContact CE2-CB 3.97Å; F211-P214 HydrophobicContact CG-CB 4.01Å; F211-P214 HydrophobicContact CZ-CB 3.75Å; F212-P214 VanDerWaalsContact C-CD 3.49Å; P214-E219 HydrophobicContact CB-CB 4.49Å; P214-L260 HydrophobicContact CB-CD1 4.25Å; P214-L260 HydrophobicContact CG-CD1 3.64Å; P214-L260 HydrophobicContact CG-CG 4.01Å
215	R	77.2	Confident	83.3	Confident	139 Å²	139	26.9 Å²	26.9	53%	0.525	14%	0.139	S	C	.	.			trans	-70.4	143.2	166.3	-68.8	-175	179	-172.9	-0.3	108.6	S217 T218 E219	R215-S217 PolarHBondContact O-N 2.71Å; R215-S217 VanDerWaalsContact O-N 3.09Å; R215-T218 PolarHBondContact O-N 3.35Å; R215-E219 PolarHBondContact O-N 2.89Å
216	P	77.3	Confident	84.1	Confident	86 Å²	86	23.2 Å²	23.2	56%	0.558	12%	0.12	S	C	*	.	H	α-helix	trans	-54.9	-32.2	-179.9	-29.5	36.8	0	0	0	113.9	L118	L118-P216 HydrophobicContact CD2-CB 3.44Å; L118-P216 VanDerWaalsContact CD2-CB 3.44Å
217	S	77.1	Confident	84.6	Confident	30 Å²	30	24.1 Å²	24.1	21%	0.21	12%	0.122	C	C	.	.	H	α-helix	trans	-68.9	-42.6	174.7	54.4	0	0	0	0	113.3	R215 L220 F221	R215-S217 PolarHBondContact O-N 2.71Å; R215-S217 VanDerWaalsContact O-N 3.09Å; S217-L220 PolarHBondContact O-N 3.31Å; S217-F221 WeakPolarHBondContact O-CD1 3.45Å; S217-F221 WeakPolarHBondContact O-CE1 3.37Å
218	T	80.2	Confident	84.9	Confident	3 Å²	3	23.6 Å²	23.6	2%	0.018	12%	0.119	C	C	.	.	H	α-helix	trans	-71.3	-34.8	-178.5	-44.2	0	0	0	0	111.7	A77 F211 R215 L220 F221 F222	A77-T218 WeakPolarHBondContact O-CG2 3.39Å; A77-T218 PolarHBondContact O-OG1 3.35Å; F211-T218 HydrophobicContact CE1-CG2 3.77Å; F211-T218 HydrophobicContact CZ-CG2 3.85Å; R215-T218 PolarHBondContact O-N 3.35Å; T218-L220 PolarHBondContact O-N 3.02Å; T218-F221 HydrophobicContact CG2-CE2 4.2Å; T218-F221 HydrophobicContact CG2-CZ 3.96Å; T218-F221 PolarHBondContact O-N 3.21Å; T218-F222 HydrophobicContact CG2-CD2 4.37Å; T218-F222 VanDerWaalsContact O-CB 3.28Å; T218-F222 WeakPolarHBondContact O-CB 3.49Å; T218-F222 PolarHBondContact O-N 3.27Å
219	E	82.4	Confident	85.1	Confident	61 Å²	61	23.2 Å²	23.2	29%	0.285	12%	0.117	S	C	.	.	H	α-helix	trans	-53.6	-38.1	175.9	172.9	168.4	-171.7	0	0	112.6	P214 R215 F221 K242 L260	P214-E219 HydrophobicContact CB-CB 4.49Å; R215-E219 PolarHBondContact O-N 2.89Å; E219-F221 PolarHBondContact O-N 2.93Å; E219-K242 IonicContact OE1-NZ 3.3Å; E219-K242 PolarHBondContact OE1-NZ 3.38Å; E219-L260 HydrophobicContact CB-CD1 4.05Å; E219-L260 HydrophobicContact CG-CD1 3.47Å; E219-L260 VanDerWaalsContact CG-CD1 3.47Å; E219-L260 WeakPolarHBondContact OE1-CD1 3.44Å
220	L	83.4	Confident	85.2	Confident	22 Å²	22	23.2 Å²	23.2	12%	0.115	12%	0.117	C	C	.	.	H	α-helix	trans	-64.1	-38.7	-176.7	-66.7	168.5	0	0	0	113.5	L118 L121 L122 E140 S217 T218	L118-L220 HydrophobicContact CD1-CD1 3.74Å; L121-L220 HydrophobicContact CD2-CD1 4.25Å; L122-L220 HydrophobicContact CD2-CD1 3.81Å; L122-L220 HydrophobicContact CD2-CD2 3.73Å; L122-L220 HydrophobicContact CD2-CG 4.45Å; L122-L220 HydrophobicContact CG-CD1 4.29Å; E140-L220 WeakPolarHBondContact CB-O 3.24Å; E140-L220 WeakPolarHBondContact CG-O 3.27Å; S217-L220 PolarHBondContact O-N 3.31Å; T218-L220 PolarHBondContact O-N 3.02Å
221	F	87.2	Confident	85.4	Confident	1 Å²	1	27.9 Å²	27.9	0%	0.004	13%	0.134	C	C	.	.	H	α-helix	trans	-117	-6.5	-168.1	66.8	-104.9	0	0	0	114	L76 P79 L84 L143 G144 I147 S217 T218 E219 P223 G224 V225	L76-F221 WeakPolarHBondContact O-CE2 3.45Å; P79-F221 VanDerWaalsContact CD-CZ 3.5Å; P79-F221 HydrophobicContact CG-CE1 3.75Å; P79-F221 HydrophobicContact CG-CE2 4.39Å; P79-F221 HydrophobicContact CG-CZ 3.48Å; P79-F221 VanDerWaalsContact CG-CZ 3.48Å; L84-F221 HydrophobicContact CD2-CD1 4Å; L84-F221 HydrophobicContact CD2-CE1 3.83Å; L143-F221 HydrophobicContact CD2-CB 4.39Å; L143-F221 HydrophobicContact CG-CB 4.34Å; G144-F221 WeakPolarHBondContact CA-O 3.33Å; I147-F221 HydrophobicContact CD1-CB 3.99Å; I147-F221 HydrophobicContact CD1-CD1 3.79Å; I147-F221 HydrophobicContact CD1-CD2 3.73Å; I147-F221 HydrophobicContact CD1-CE1 4.21Å; I147-F221 HydrophobicContact CD1-CE2 4.18Å; I147-F221 HydrophobicContact CD1-CG 3.55Å; I147-F221 HydrophobicContact CD1-CZ 4.41Å; S217-F221 WeakPolarHBondContact O-CD1 3.45Å; S217-F221 WeakPolarHBondContact O-CE1 3.37Å; T218-F221 HydrophobicContact CG2-CE2 4.2Å; T218-F221 HydrophobicContact CG2-CZ 3.96Å; T218-F221 PolarHBondContact O-N 3.21Å; E219-F221 PolarHBondContact O-N 2.93Å; F221-P223 VanDerWaalsContact C-CD 3.45Å; F221-G224 PolarHBondContact O-N 2.97Å; F221-V225 HydrophobicContact CD2-CG2 3.69Å; F221-V225 HydrophobicContact CE2-CG2 4.01Å; F221-V225 PolarHBondContact O-N 3.2Å
222	F	88.5	Confident	85.6	Confident	4 Å²	4	29.6 Å²	29.6	2%	0.018	14%	0.144	C	C	.	.	H	α-helix	trans	-55.4	-40.1	-176.5	-168.2	-116.3	0	0	0	114.4	L170 V197 V209 F211 T218 G224 V225 I226 Y262	L170-F222 HydrophobicContact CD2-CZ 4.47Å; V197-F222 HydrophobicContact CG1-CZ 4.02Å; V197-F222 HydrophobicContact CG2-CE2 4.28Å; V197-F222 HydrophobicContact CG2-CZ 3.73Å; V209-F222 HydrophobicContact CG1-CE1 4.36Å; F211-F222 AromaticContact CD1-CD1 3.67Å; F211-F222 HydrophobicContact CD1-CD1 3.67Å; F211-F222 HydrophobicContact CD1-CD2 4.47Å; F211-F222 AromaticContact CD1-CE1 3.88Å; F211-F222 HydrophobicContact CD1-CE1 3.88Å; F211-F222 AromaticContact CD1-CG 3.99Å; F211-F222 HydrophobicContact CD1-CG 3.99Å; F211-F222 HydrophobicContact CD1-CZ 4.39Å; F211-F222 HydrophobicContact CE1-CB 4.33Å; F211-F222 HydrophobicContact CE1-CD1 4.11Å; F211-F222 HydrophobicContact CE1-CD2 4.12Å; F211-F222 HydrophobicContact CE1-CE1 4.42Å; F211-F222 HydrophobicContact CE1-CE2 4.46Å; F211-F222 AromaticContact CE1-CG 3.94Å; F211-F222 HydrophobicContact CE1-CG 3.94Å; F211-F222 HydrophobicContact CG-CE1 4.39Å; T218-F222 HydrophobicContact CG2-CD2 4.37Å; T218-F222 VanDerWaalsContact O-CB 3.28Å; T218-F222 WeakPolarHBondContact O-CB 3.49Å; T218-F222 PolarHBondContact O-N 3.27Å; F222-G224 VanDerWaalsContact C-N 3.3Å; F222-G224 PolarHBondContact O-N 3.23Å; F222-V225 WeakPolarHBondContact O-CB 3.41Å; F222-V225 PolarHBondContact O-N 2.86Å; F222-V225 VanDerWaalsContact O-N 3.13Å; F222-I226 HydrophobicContact CD1-CD1 3.91Å; F222-I226 HydrophobicContact CD1-CG1 4.45Å; F222-I226 HydrophobicContact CE1-CD1 3.69Å; F222-I226 HydrophobicContact CE1-CG1 4.23Å; F222-I226 HydrophobicContact CZ-CD1 4.29Å; F222-I226 HydrophobicContact CZ-CG1 4.38Å; F222-I226 WeakPolarHBondContact O-CG1 3.4Å; F222-I226 PolarHBondContact O-N 3.12Å; F222-I226 VanDerWaalsContact O-N 3.09Å; F222-Y262 HydrophobicContact CD1-CD2 4.36Å; F222-Y262 AromaticContact CD1-CE2 3.95Å; F222-Y262 HydrophobicContact CD1-CE2 3.95Å; F222-Y262 HydrophobicContact CE1-CE2 4.46Å
223	P	91	Very high	85.8	Confident	19 Å²	19	31 Å²	31	12%	0.123	15%	0.151	C	C	.	.	H	α-helix	trans	-58.2	-39.7	175	-26.2	36.5	0	0	0	113.5	I141 F221 I226 K227 V240 Y262	I141-P223 HydrophobicContact CG1-CB 4.38Å; F221-P223 VanDerWaalsContact C-CD 3.45Å; P223-I226 PolarHBondContact O-N 2.8Å; P223-K227 PolarHBondContact O-N 3.3Å; P223-K227 VanDerWaalsContact O-N 3.11Å; P223-V240 HydrophobicContact CB-CB 4.2Å; P223-V240 HydrophobicContact CB-CG1 3.87Å; P223-Y262 HydrophobicContact CG-CD1 4.26Å; P223-Y262 HydrophobicContact CG-CE1 3.73Å
224	G	90.3	Very high	86.2	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-66.2	-36.4	176.2	0	0	0	0	0	112.9	I141 F221 F222 K227 A228	I141-G224 WeakPolarHBondContact O-CA 3.15Å; F221-G224 PolarHBondContact O-N 2.97Å; F222-G224 VanDerWaalsContact C-N 3.3Å; F222-G224 PolarHBondContact O-N 3.23Å; G224-K227 PolarHBondContact O-N 3.28Å; G224-A228 WeakPolarHBondContact O-CB 3.39Å; G224-A228 PolarHBondContact O-N 2.89Å
225	V	91.1	Very high	86.6	Confident	2 Å²	2	38.1 Å²	38.1	1%	0.012	19%	0.185	C	C	.	.	H	α-helix	trans	-63.3	-45	174.7	169.1	0	0	0	0	111.3	F148 F221 F222 K227 A228 A229	F148-V225 HydrophobicContact CD2-CG1 4.11Å; F221-V225 HydrophobicContact CD2-CG2 3.69Å; F221-V225 HydrophobicContact CE2-CG2 4.01Å; F221-V225 PolarHBondContact O-N 3.2Å; F222-V225 WeakPolarHBondContact O-CB 3.41Å; F222-V225 PolarHBondContact O-N 2.86Å; F222-V225 VanDerWaalsContact O-N 3.13Å; V225-K227 VanDerWaalsContact C-N 3.33Å; V225-K227 PolarHBondContact O-N 3.14Å; V225-A228 PolarHBondContact O-N 3.36Å; V225-A229 VanDerWaalsContact O-CB 3.25Å; V225-A229 WeakPolarHBondContact O-CB 3.43Å; V225-A229 PolarHBondContact O-N 3.43Å
226	I	91.6	Very high	87	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-59.1	-47.3	176.3	-63.1	171.6	0	0	0	110.1	L166 L170 F222 P223 A229 A230 V240 V264	L166-I226 HydrophobicContact CD2-CG2 4.22Å; L170-I226 HydrophobicContact CD2-CG1 4.03Å; F222-I226 HydrophobicContact CD1-CD1 3.91Å; F222-I226 HydrophobicContact CD1-CG1 4.45Å; F222-I226 HydrophobicContact CE1-CD1 3.69Å; F222-I226 HydrophobicContact CE1-CG1 4.23Å; F222-I226 HydrophobicContact CZ-CD1 4.29Å; F222-I226 HydrophobicContact CZ-CG1 4.38Å; F222-I226 WeakPolarHBondContact O-CG1 3.4Å; F222-I226 PolarHBondContact O-N 3.12Å; F222-I226 VanDerWaalsContact O-N 3.09Å; P223-I226 PolarHBondContact O-N 2.8Å; I226-A229 PolarHBondContact O-N 2.9Å; I226-A230 WeakPolarHBondContact O-CB 3.42Å; I226-A230 PolarHBondContact O-N 3.1Å; I226-V240 HydrophobicContact CB-CG2 4.09Å; I226-V240 HydrophobicContact CD1-CG1 4.34Å; I226-V240 HydrophobicContact CG2-CG2 3.86Å; I226-V264 HydrophobicContact CG2-CG1 4.37Å; I226-V264 HydrophobicContact CG2-CG2 4.18Å
227	K	91.5	Very high	87.5	Confident	69 Å²	69	31.3 Å²	31.3	30%	0.3	16%	0.157	S	C	.	.	H	α-helix	trans	-64.5	-44	-178	-169.5	174.1	177.4	-166.2	0	112.7	I141 E145 P223 G224 V225 R231 V238	I141-K227 HydrophobicContact CG2-CD 4.01Å; E145-K227 WeakPolarHBondContact OE1-CD 3.22Å; E145-K227 IonicContact OE1-NZ 2.71Å; P223-K227 PolarHBondContact O-N 3.3Å; P223-K227 VanDerWaalsContact O-N 3.11Å; G224-K227 PolarHBondContact O-N 3.28Å; V225-K227 VanDerWaalsContact C-N 3.33Å; V225-K227 PolarHBondContact O-N 3.14Å; K227-R231 PolarHBondContact O-N 2.97Å; K227-R231 VanDerWaalsContact O-N 3.12Å; K227-V238 HydrophobicContact CB-CG2 4.37Å; K227-V238 HydrophobicContact CG-CG2 4.36Å
228	A	91.4	Very high	88.1	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-68	-39.7	176	0	0	0	0	0	112.6	E145 F148 G224 V225 R231 L232	E145-A228 HydrophobicContact CB-CB 4.21Å; E145-A228 HydrophobicContact CG-CB 4.13Å; F148-A228 HydrophobicContact CB-CB 3.62Å; F148-A228 HydrophobicContact CD1-CB 3.7Å; F148-A228 HydrophobicContact CG-CB 3.75Å; G224-A228 WeakPolarHBondContact O-CB 3.39Å; G224-A228 PolarHBondContact O-N 2.89Å; V225-A228 PolarHBondContact O-N 3.36Å; A228-R231 PolarHBondContact O-N 3.06Å; A228-L232 WeakPolarHBondContact O-CB 3.48Å; A228-L232 WeakPolarHBondContact O-CG 3.39Å; A228-L232 PolarHBondContact O-N 3.09Å
229	A	90.9	Very high	88.5	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-60.9	-46.2	175.6	0	0	0	0	0	111.6	F148 L166 F169 V225 I226 R231 L233	F148-A229 HydrophobicContact CD2-CB 4.27Å; F148-A229 HydrophobicContact CE2-CB 3.63Å; F148-A229 HydrophobicContact CZ-CB 3.78Å; L166-A229 HydrophobicContact CD1-CB 4.3Å; F169-A229 HydrophobicContact CD1-CB 3.98Å; F169-A229 HydrophobicContact CE1-CB 3.52Å; F169-A229 HydrophobicContact CZ-CB 4.25Å; V225-A229 VanDerWaalsContact O-CB 3.25Å; V225-A229 WeakPolarHBondContact O-CB 3.43Å; V225-A229 PolarHBondContact O-N 3.43Å; I226-A229 PolarHBondContact O-N 2.9Å; A229-R231 VanDerWaalsContact C-N 3.34Å; A229-R231 PolarHBondContact O-N 3.31Å; A229-L233 HydrophobicContact CB-CD1 4.41Å; A229-L233 VanDerWaalsContact O-CB 3.24Å; A229-L233 WeakPolarHBondContact O-CB 3.48Å; A229-L233 PolarHBondContact O-N 3.43Å
230	A	89.6	Confident	88.8	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-57	-47.3	175.5	0	0	0	0	0	111.8	L166 I226 Y234 N235 T236 V238	L166-A230 HydrophobicContact CD1-CB 4.25Å; L166-A230 HydrophobicContact CD2-CB 3.9Å; I226-A230 WeakPolarHBondContact O-CB 3.42Å; I226-A230 PolarHBondContact O-N 3.1Å; A230-Y234 CarbonylContact O-C 3.32Å; A230-Y234 PolarHBondContact O-N 3.41Å; A230-N235 PolarHBondContact O-N 2.83Å; A230-N235 VanDerWaalsContact O-N 3.09Å; A230-T236 CarbonylContact C-O 3.46Å; A230-T236 WeakPolarHBondContact CB-O 3.2Å; A230-T236 PolarHBondContact O-N 2.92Å; A230-V238 HydrophobicContact CB-CB 4.35Å; A230-V238 HydrophobicContact CB-CG1 3.81Å; A230-V238 HydrophobicContact CB-CG2 3.57Å
231	R	89.8	Confident	89	Confident	104 Å²	104	34 Å²	34	39%	0.392	17%	0.172	S	C	.	.	H	α-helix	trans	-68.7	-46.3	-178.3	-174.3	176.6	66.1	-156.8	-6.4	113.1	E145 K227 A228 A229 N235 T236	E145-R231 IonicContact OE2-CZ 2.77Å; E145-R231 VanDerWaalsContact OE2-CZ 3.3Å; E145-R231 IonicContact OE2-NH1 3.59Å; E145-R231 PolarHBondContact OE2-NH1 3.23Å; E145-R231 IonicContact OE2-NH2 2.79Å; E145-R231 PolarHBondContact OE2-NH2 3.05Å; K227-R231 PolarHBondContact O-N 2.97Å; K227-R231 VanDerWaalsContact O-N 3.12Å; A228-R231 PolarHBondContact O-N 3.06Å; A229-R231 VanDerWaalsContact C-N 3.34Å; A229-R231 PolarHBondContact O-N 3.31Å; R231-N235 WeakPolarHBondContact O-CA 3.44Å; R231-N235 PolarHBondContact O-N 3.1Å; R231-N235 PolarHBondContact O-OD1 2.8Å; R231-T236 PolarHBondContact N-O 3.36Å
232	L	88.7	Confident	88.9	Confident	44 Å²	44	38.9 Å²	38.9	23%	0.23	19%	0.193	C	C	.	.	H	α-helix	trans	-90.6	-26.3	-169.4	-66	178.8	0	0	0	114.8	F148 N149 Y152 A228	F148-L232 HydrophobicContact CD1-CD1 3.67Å; F148-L232 HydrophobicContact CE1-CB 4.03Å; F148-L232 HydrophobicContact CE1-CD1 3.83Å; F148-L232 HydrophobicContact CE1-CG 4.48Å; N149-L232 WeakPolarHBondContact OD1-CD1 3.4Å; Y152-L232 HydrophobicContact CD1-CD1 4.34Å; Y152-L232 HydrophobicContact CG-CD1 4.38Å; Y152-L232 PolarHBondContact OH-O 2.97Å; A228-L232 WeakPolarHBondContact O-CB 3.48Å; A228-L232 WeakPolarHBondContact O-CG 3.39Å; A228-L232 PolarHBondContact O-N 3.09Å
233	L	87.5	Confident	88.5	Confident	30 Å²	30	40.7 Å²	40.7	16%	0.157	20%	0.203	C	C	.	.	H	α-helix	trans	-96.3	-42.7	178.5	-57.9	-178	0	0	0	111.8	F148 Y152 L159 R160 F169 A229	F148-L233 HydrophobicContact CE1-CG 4.47Å; F148-L233 HydrophobicContact CZ-CD1 3.89Å; F148-L233 HydrophobicContact CZ-CD2 4.36Å; F148-L233 HydrophobicContact CZ-CG 3.92Å; Y152-L233 HydrophobicContact CD2-CD2 3.96Å; Y152-L233 HydrophobicContact CE2-CD2 3.53Å; L159-L233 HydrophobicContact CB-CD2 4.21Å; R160-L233 HydrophobicContact CG-CD2 4.34Å; F169-L233 HydrophobicContact CD2-CD1 4.06Å; F169-L233 HydrophobicContact CE2-CD1 3.93Å; F169-L233 HydrophobicContact CZ-CD1 4.27Å; A229-L233 HydrophobicContact CB-CD1 4.41Å; A229-L233 VanDerWaalsContact O-CB 3.24Å; A229-L233 WeakPolarHBondContact O-CB 3.48Å; A229-L233 PolarHBondContact O-N 3.43Å
234	Y	86.2	Confident	87.7	Confident	46 Å²	46	43.8 Å²	43.8	18%	0.18	22%	0.223	C	C	.	.	S	Bend	trans	-112.6	-3.6	-168.8	-57.6	-68.4	0	0	0	114.2	V162 G163 G164 A165 L166 F169 A230 T236	V162-Y234 PolarHBondContact O-OH 3.11Å; G163-Y234 PolarHBondContact O-OH 2.98Å; G164-Y234 WeakPolarHBondContact O-CE1 3.28Å; A165-Y234 VanDerWaalsContact C-CZ 3.43Å; A165-Y234 PolarHBondContact O-OH 3.48Å; L166-Y234 HydrophobicContact CB-CD2 4.2Å; L166-Y234 HydrophobicContact CB-CE2 4.4Å; L166-Y234 HydrophobicContact CD1-CD2 4.42Å; L166-Y234 HydrophobicContact CD1-CE2 4.44Å; F169-Y234 HydrophobicContact CB-CE2 4.02Å; F169-Y234 WeakPolarHBondContact CB-OH 3.47Å; F169-Y234 HydrophobicContact CG-CE2 4.46Å; A230-Y234 CarbonylContact O-C 3.32Å; A230-Y234 PolarHBondContact O-N 3.41Å; Y234-T236 PolarHBondContact O-N 3.33Å; Y234-T236 PolarHBondContact O-OG1 3.18Å
235	N	86.2	Confident	86.4	Confident	140 Å²	140	50.4 Å²	50.4	75%	0.749	27%	0.265	S	S	*	.			trans	52.9	35	-173.7	-62	-27.3	0	0	0	112.8	A230 R231	A230-N235 PolarHBondContact O-N 2.83Å; A230-N235 VanDerWaalsContact O-N 3.09Å; R231-N235 WeakPolarHBondContact O-CA 3.44Å; R231-N235 PolarHBondContact O-N 3.1Å; R231-N235 PolarHBondContact O-OD1 2.8Å
236	T	85.3	Confident	84.7	Confident	21 Å²	21	57.4 Å²	57.4	13%	0.129	30%	0.303	C	S	.	.			trans	-109.3	136.4	179.5	-52.5	0	0	0	0	110	A230 R231 Y234 V238 V266	A230-T236 CarbonylContact C-O 3.46Å; A230-T236 WeakPolarHBondContact CB-O 3.2Å; A230-T236 PolarHBondContact O-N 2.92Å; R231-T236 PolarHBondContact N-O 3.36Å; Y234-T236 PolarHBondContact O-N 3.33Å; Y234-T236 PolarHBondContact O-OG1 3.18Å; T236-V238 HydrophobicContact CG2-CG1 4.04Å; T236-V266 HydrophobicContact CG2-CG1 3.54Å
237	T	87.2	Confident	82.8	Confident	62 Å²	62	59.5 Å²	59.5	38%	0.38	32%	0.32	S	S	.	.			trans	-92.4	128.5	171.5	62.3	0	0	0	0	110.4	K267 D268	T237-K267 PolarHBondContact O-N 3.39Å; T237-K267 WeakPolarHBondContact OG1-CB 3.31Å; T237-D268 PolarHBondContact OG1-OD2 2.93Å
238	V	89.6	Confident	80.7	Confident	4 Å²	4	65.1 Å²	65.1	2%	0.024	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	144.8	-178	-58.8	0	0	0	0	111	L166 K227 A230 T236 V240 V264 V265 V266	L166-V238 HydrophobicContact CD2-CG1 4.13Å; K227-V238 HydrophobicContact CB-CG2 4.37Å; K227-V238 HydrophobicContact CG-CG2 4.36Å; A230-V238 HydrophobicContact CB-CB 4.35Å; A230-V238 HydrophobicContact CB-CG1 3.81Å; A230-V238 HydrophobicContact CB-CG2 3.57Å; T236-V238 HydrophobicContact CG2-CG1 4.04Å; V238-V240 HydrophobicContact CG2-CG2 4.39Å; V238-V264 HydrophobicContact CB-CG1 3.74Å; V238-V264 HydrophobicContact CG1-CG1 4.06Å; V238-V264 HydrophobicContact CG2-CG1 4.17Å; V238-V265 WeakPolarHBondContact CA-O 3.35Å; V238-V266 HydrophobicContact CG1-CG2 4.2Å
239	D	88.4	Confident	78.9	Confident	58 Å²	58	67.1 Å²	67.1	31%	0.31	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	134.1	164.6	-71.7	-14.1	0	0	0	108.9	V264 V265 K267	D239-V264 CarbonylContact O-C 3.49Å; D239-V264 WeakPolarHBondContact O-CA 3.5Å; D239-V265 HydrophobicContact CB-CB 4.49Å; D239-V265 PolarHBondContact N-O 2.79Å; D239-V265 PolarHBondContact O-N 3.37Å; D239-K267 VanDerWaalsContact CG-CE 3.41Å; D239-K267 WeakPolarHBondContact OD1-CE 3.38Å; D239-K267 IonicContact OD1-NZ 3.78Å; D239-K267 PolarHBondContact OD1-NZ 3.16Å; D239-K267 WeakPolarHBondContact OD2-CE 3.48Å; D239-K267 IonicContact OD2-NZ 3.91Å; D239-K267 PolarHBondContact OD2-NZ 3.45Å
240	V	90.1	Very high	77.2	Confident	18 Å²	18	72.3 Å²	72.3	11%	0.109	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	119.4	179.8	-174.3	0	0	0	0	107.9	P223 I226 V238 Y262 V264	P223-V240 HydrophobicContact CB-CB 4.2Å; P223-V240 HydrophobicContact CB-CG1 3.87Å; I226-V240 HydrophobicContact CB-CG2 4.09Å; I226-V240 HydrophobicContact CD1-CG1 4.34Å; I226-V240 HydrophobicContact CG2-CG2 3.86Å; V238-V240 HydrophobicContact CG2-CG2 4.39Å; V240-Y262 HydrophobicContact CG1-CD1 4.11Å; V240-Y262 HydrophobicContact CG1-CG 4.42Å; V240-V264 HydrophobicContact CG1-CG2 4.25Å; V240-V264 HydrophobicContact CG2-CG1 4.35Å; V240-V264 HydrophobicContact CG2-CG2 4.23Å
241	L	87.3	Confident	75.6	Confident	93 Å²	93	74.7 Å²	74.7	49%	0.487	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	128.9	178.8	-59.4	174.8	0	0	0	108.9	Y262 T263	L241-Y262 CarbonylContact O-C 3.54Å; L241-Y262 VanDerWaalsContact O-CA 3.28Å; L241-Y262 WeakPolarHBondContact O-CA 3.4Å; L241-T263 PolarHBondContact N-O 2.87Å; L241-T263 PolarHBondContact O-N 3.01Å
242	K	84.7	Confident	74.2	Confident	103 Å²	103	71 Å²	71	45%	0.448	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	116.9	172.6	-172.7	178.3	-174.9	175.5	0	108.7	E219 Y262	E219-K242 IonicContact OE1-NZ 3.3Å; E219-K242 PolarHBondContact OE1-NZ 3.38Å; K242-Y262 HydrophobicContact CB-CD1 4.07Å; K242-Y262 HydrophobicContact CB-CE1 4Å; K242-Y262 HydrophobicContact CD-CE1 4.27Å; K242-Y262 HydrophobicContact CG-CD1 4.25Å; K242-Y262 HydrophobicContact CG-CE1 3.86Å
243	D	80.6	Confident	72.6	Confident	42 Å²	42	75.6 Å²	75.6	23%	0.225	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-76.6	143.4	179.6	-72.3	-51.7	0	0	0	110.9	A247 L261 T263	D243-A247 HydrophobicContact CB-CB 4.07Å; D243-L261 HydrophobicContact CB-CB 4.09Å; D243-L261 HydrophobicContact CB-CD2 4.01Å; D243-L261 HydrophobicContact CB-CG 4.03Å; D243-L261 PolarHBondContact N-O 3.38Å; D243-L261 WeakPolarHBondContact OD2-CG 2.91Å; D243-T263 WeakPolarHBondContact OD2-CB 3.5Å; D243-T263 PolarHBondContact OD2-OG1 3.21Å
244	P	74	Confident	70.8	Confident	84 Å²	84	78.8 Å²	78.8	55%	0.545	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-62.6	148.3	177.1	24.8	-31.8	0	0	0	110.2	N246 A247	P244-N246 PolarHBondContact O-N 3.48Å; P244-A247 HydrophobicContact CG-CB 4.19Å; P244-A247 WeakPolarHBondContact O-CB 3.18Å; P244-A247 PolarHBondContact O-N 3.05Å
245	P	62.8	Low	69.3	Low	138 Å²	138	78 Å²	78	90%	0.896	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-13.3	-174.7	21	-32.2	0	0	0	114.8
246	N	54.5	Low	67.7	Low	150 Å²	150	76.7 Å²	76.7	80%	0.802	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	3.5	176.4	-78.8	-17.1	0	0	0	114.3	P244 K248	P244-N246 PolarHBondContact O-N 3.48Å; N246-K248 PolarHBondContact O-N 2.94Å
247	A	53.5	Low	66.6	Low	44 Å²	44	77.5 Å²	77.5	36%	0.364	44%	0.435	S	S	.	.			trans	-68.7	99.4	173.6	0	0	0	0	0	109	D243 P244 D249	D243-A247 HydrophobicContact CB-CB 4.07Å; P244-A247 HydrophobicContact CG-CB 4.19Å; P244-A247 WeakPolarHBondContact O-CB 3.18Å; P244-A247 PolarHBondContact O-N 3.05Å; A247-D249 PolarHBondContact O-N 2.97Å
248	K	47.1	Very low	65.6	Low	186 Å²	186	78.6 Å²	78.6	81%	0.809	44%	0.444	S	S	*	.			trans	-72.3	108.3	-171.2	-65.7	-178.2	-179.8	-179.6	0	111.1	N246	N246-K248 PolarHBondContact O-N 2.94Å
249	D	53.9	Low	65	Low	43 Å²	43	81 Å²	81	23%	0.23	46%	0.461	C	S	.	.			trans	-92.8	126.6	156.3	-126.2	-33.3	0	0	0	109.2	K202 Y210 A247 I251	K202-D249 IonicContact NZ-OD1 3.21Å; K202-D249 PolarHBondContact NZ-OD1 3.25Å; K202-D249 IonicContact NZ-OD2 2.65Å; K202-D249 PolarHBondContact NZ-OD2 3.03Å; Y210-D249 VanDerWaalsContact OH-CG 3.32Å; Y210-D249 PolarHBondContact OH-OD2 3.39Å; A247-D249 PolarHBondContact O-N 2.97Å; D249-I251 PolarHBondContact O-N 3.45Å
250	T	54.5	Low	64.7	Low	109 Å²	109	79.7 Å²	79.7	67%	0.669	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-61.1	-20.1	-171.7	-42.4	0	0	0	0	113.4
251	I	56.3	Low	64.5	Low	50 Å²	50	80.1 Å²	80.1	26%	0.256	46%	0.455	S	S	.	.	G	3₁₀ helix	trans	-79.7	-27.1	-169.5	-59.1	172	0	0	0	113	D249 L348 Y381	D249-I251 PolarHBondContact O-N 3.45Å; I251-L348 HydrophobicContact CG2-CD1 4.08Å; I251-Y381 HydrophobicContact CD1-CE1 4.16Å; I251-Y381 HydrophobicContact CG2-CE1 4.26Å
252	L	61	Low	64.5	Low	25 Å²	25	75.8 Å²	75.8	13%	0.131	43%	0.432	C	S	.	.	G	3₁₀ helix	trans	-120	19.3	-170	-59.1	168.4	0	0	0	113.9	Y210 F212 S254 S255 L348	Y210-L252 HydrophobicContact CD1-CD1 3.42Å; Y210-L252 VanDerWaalsContact CD1-CD1 3.42Å; Y210-L252 HydrophobicContact CE1-CD1 3.32Å; Y210-L252 HydrophobicContact CG-CD1 4.14Å; F212-L252 HydrophobicContact CE1-CD1 4.08Å; F212-L252 HydrophobicContact CZ-CD1 4.06Å; F212-L252 HydrophobicContact CZ-CD2 4.44Å; L252-S254 PolarHBondContact O-N 3Å; L252-S255 PolarHBondContact O-N 2.95Å; L252-L348 HydrophobicContact CD2-CB 4.26Å; L252-L348 HydrophobicContact CD2-CD1 4.25Å
253	Q	54.7	Low	64.7	Low	142 Å²	142	72 Å²	72	66%	0.664	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-10.9	-168.6	-75.4	-177.7	-4.7	0	0	116.8
254	S	49.7	Very low	65	Low	97 Å²	97	70 Å²	70	68%	0.678	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.8	12.6	-174.2	62.3	0	0	0	0	114.9	L252 P256	L252-S254 PolarHBondContact O-N 3Å; S254-P256 WeakPolarHBondContact O-CD 3.32Å
255	S	53.7	Low	65.6	Low	28 Å²	28	68.3 Å²	68.3	20%	0.196	40%	0.395	C	S	.	.			trans	-70.8	125.6	179	-164.2	0	0	0	0	111.7	L252 Q257	L252-S255 PolarHBondContact O-N 2.95Å; S255-Q257 PolarHBondContact O-N 3Å
256	P	53.8	Low	66.7	Low	114 Å²	114	62.3 Å²	62.3	74%	0.74	36%	0.356	S	S	*	.			trans	-79.6	1.7	174.9	32.2	-34.3	0	0	0	113.6	S254	S254-P256 WeakPolarHBondContact O-CD 3.32Å
257	Q	62	Low	67.8	Low	37 Å²	37	61 Å²	61	17%	0.173	34%	0.343	C	S	.	.	S	Bend	trans	-94.3	141.2	-175.6	-72.5	-174.9	-24.5	0	0	112	S255 S259 T349	S255-Q257 PolarHBondContact O-N 3Å; Q257-S259 PolarHBondContact O-N 3.33Å; Q257-T349 PolarHBondContact OE1-OG1 3.37Å
258	P	66.4	Low	68.5	Low	86 Å²	86	62.9 Å²	62.9	56%	0.558	35%	0.347	S	S	*	.			trans	-62.3	119	174.2	26.2	-33.5	0	0	0	110	N213	N213-P258 PolarHBondContact N-O 2.95Å; N213-P258 WeakPolarHBondContact OD1-CD 3.29Å
259	S	76.6	Confident	68.8	Low	55 Å²	55	56.7 Å²	56.7	39%	0.385	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	133.7	177.3	63.1	0	0	0	0	110.4	F211 Q257	F211-S259 WeakPolarHBondContact O-CA 3.4Å; Q257-S259 PolarHBondContact O-N 3.33Å
260	L	82.4	Confident	68.8	Low	30 Å²	30	64.3 Å²	64.3	16%	0.157	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	138.6	168.8	-62.6	173.4	0	0	0	109.2	Y210 F211 P214 E219 Y262	Y210-L260 WeakPolarHBondContact CA-O 3.42Å; F211-L260 HydrophobicContact CB-CB 4.43Å; F211-L260 PolarHBondContact N-O 3.45Å; F211-L260 PolarHBondContact O-N 3.25Å; P214-L260 HydrophobicContact CB-CD1 4.25Å; P214-L260 HydrophobicContact CG-CD1 3.64Å; P214-L260 HydrophobicContact CG-CG 4.01Å; E219-L260 HydrophobicContact CB-CD1 4.05Å; E219-L260 HydrophobicContact CG-CD1 3.47Å; E219-L260 VanDerWaalsContact CG-CD1 3.47Å; E219-L260 WeakPolarHBondContact OE1-CD1 3.44Å; L260-Y262 HydrophobicContact CB-CE2 3.77Å; L260-Y262 VanDerWaalsContact CD1-OH 3.32Å; L260-Y262 WeakPolarHBondContact CD1-OH 3.26Å
261	L	85.6	Confident	68.4	Low	27 Å²	27	64 Å²	64	14%	0.141	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	128	176.9	-177.8	61.1	0	0	0	108.9	T208 Y210 D243	T208-L261 HydrophobicContact CG2-CD1 3.38Å; Y210-L261 HydrophobicContact CD1-CD1 3.62Å; Y210-L261 HydrophobicContact CE1-CD1 3.42Å; Y210-L261 VanDerWaalsContact CE1-CD1 3.42Å; Y210-L261 HydrophobicContact CG-CD1 4.24Å; D243-L261 HydrophobicContact CB-CB 4.09Å; D243-L261 HydrophobicContact CB-CD2 4.01Å; D243-L261 HydrophobicContact CB-CG 4.03Å; D243-L261 PolarHBondContact N-O 3.38Å; D243-L261 WeakPolarHBondContact OD2-CG 2.91Å
262	Y	87.4	Confident	68.1	Low	1 Å²	1	64.9 Å²	64.9	0%	0.004	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	131.4	173.4	-56.5	-84.2	0	0	0	109.9	V209 F211 F222 P223 V240 L241 K242 L260	V209-Y262 PolarHBondContact N-O 2.82Å; V209-Y262 PolarHBondContact O-N 3.18Å; F211-Y262 HydrophobicContact CB-CE2 4.08Å; F211-Y262 HydrophobicContact CD1-CE2 4.44Å; F222-Y262 HydrophobicContact CD1-CD2 4.36Å; F222-Y262 AromaticContact CD1-CE2 3.95Å; F222-Y262 HydrophobicContact CD1-CE2 3.95Å; F222-Y262 HydrophobicContact CE1-CE2 4.46Å; P223-Y262 HydrophobicContact CG-CD1 4.26Å; P223-Y262 HydrophobicContact CG-CE1 3.73Å; V240-Y262 HydrophobicContact CG1-CD1 4.11Å; V240-Y262 HydrophobicContact CG1-CG 4.42Å; L241-Y262 CarbonylContact O-C 3.54Å; L241-Y262 VanDerWaalsContact O-CA 3.28Å; L241-Y262 WeakPolarHBondContact O-CA 3.4Å; K242-Y262 HydrophobicContact CB-CD1 4.07Å; K242-Y262 HydrophobicContact CB-CE1 4Å; K242-Y262 HydrophobicContact CD-CE1 4.27Å; K242-Y262 HydrophobicContact CG-CD1 4.25Å; K242-Y262 HydrophobicContact CG-CE1 3.86Å; L260-Y262 HydrophobicContact CB-CE2 3.77Å; L260-Y262 VanDerWaalsContact CD1-OH 3.32Å; L260-Y262 WeakPolarHBondContact CD1-OH 3.26Å
263	T	87.7	Confident	67.3	Low	24 Å²	24	67.1 Å²	67.1	15%	0.147	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	115.8	171.1	-73.3	0	0	0	0	108.6	L206 L241 D243 V265	L206-T263 HydrophobicContact CD1-CG2 3.28Å; L206-T263 HydrophobicContact CD2-CG2 4.2Å; L206-T263 HydrophobicContact CG-CG2 3.91Å; L241-T263 PolarHBondContact N-O 2.87Å; L241-T263 PolarHBondContact O-N 3.01Å; D243-T263 WeakPolarHBondContact OD2-CB 3.5Å; D243-T263 PolarHBondContact OD2-OG1 3.21Å; T263-V265 HydrophobicContact CG2-CG2 4.3Å
264	V	88	Confident	66.9	Low	0 Å²	0	65.2 Å²	65.2	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	111.9	-179.9	-175.4	0	0	0	0	109.1	L166 L207 V209 I226 V238 D239 V240	L166-V264 HydrophobicContact CD2-CG1 4.46Å; L207-V264 HydrophobicContact CB-CB 4.17Å; L207-V264 PolarHBondContact N-O 3.33Å; L207-V264 PolarHBondContact O-N 3.29Å; V209-V264 HydrophobicContact CG2-CG2 3.88Å; I226-V264 HydrophobicContact CG2-CG1 4.37Å; I226-V264 HydrophobicContact CG2-CG2 4.18Å; V238-V264 HydrophobicContact CB-CG1 3.74Å; V238-V264 HydrophobicContact CG1-CG1 4.06Å; V238-V264 HydrophobicContact CG2-CG1 4.17Å; D239-V264 CarbonylContact O-C 3.49Å; D239-V264 WeakPolarHBondContact O-CA 3.5Å; V240-V264 HydrophobicContact CG1-CG2 4.25Å; V240-V264 HydrophobicContact CG2-CG1 4.35Å; V240-V264 HydrophobicContact CG2-CG2 4.23Å
265	V	86.8	Confident	66.7	Low	49 Å²	49	60.9 Å²	60.9	30%	0.297	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	121.4	179.2	-175.7	0	0	0	0	109.1	L206 V238 D239 T263	L206-V265 HydrophobicContact CD1-CG2 3.77Å; V238-V265 WeakPolarHBondContact CA-O 3.35Å; D239-V265 HydrophobicContact CB-CB 4.49Å; D239-V265 PolarHBondContact N-O 2.79Å; D239-V265 PolarHBondContact O-N 3.37Å; T263-V265 HydrophobicContact CG2-CG2 4.3Å
266	V	84.1	Confident	66.3	Low	11 Å²	11	65.1 Å²	65.1	7%	0.067	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	120.3	178.6	-177.3	0	0	0	0	109.6	D205 T236 V238 L272	D205-V266 PolarHBondContact O-N 3.11Å; T236-V266 HydrophobicContact CG2-CG1 3.54Å; V238-V266 HydrophobicContact CG1-CG2 4.2Å; V266-L272 HydrophobicContact CG1-CD1 4.3Å
267	K	79.4	Confident	65.9	Low	122 Å²	122	66.6 Å²	66.6	53%	0.53	38%	0.38	S	S	.	.	S	Bend	trans	-84.4	-30.8	-175.8	-79.2	175.9	165.1	159.4	0	114	T237 D239	T237-K267 PolarHBondContact O-N 3.39Å; T237-K267 WeakPolarHBondContact OG1-CB 3.31Å; D239-K267 VanDerWaalsContact CG-CE 3.41Å; D239-K267 WeakPolarHBondContact OD1-CE 3.38Å; D239-K267 IonicContact OD1-NZ 3.78Å; D239-K267 PolarHBondContact OD1-NZ 3.16Å; D239-K267 WeakPolarHBondContact OD2-CE 3.48Å; D239-K267 IonicContact OD2-NZ 3.91Å; D239-K267 PolarHBondContact OD2-NZ 3.45Å
268	D	66.3	Low	65.4	Low	85 Å²	85	70.3 Å²	70.3	46%	0.455	39%	0.392	S	S	.	.			trans	-109.7	78	-177.4	-68.6	-50.7	0	0	0	110.9	T237 K270	T237-D268 PolarHBondContact OG1-OD2 2.93Å; D268-K270 PolarHBondContact O-N 3.28Å
269	A	55.3	Low	64.5	Low	56 Å²	56	69.7 Å²	69.7	46%	0.463	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-66.5	4.7	-176.1	0	0	0	0	0	115.7	D205 T271	D205-A269 VanDerWaalsContact OD1-CB 3.29Å; D205-A269 WeakPolarHBondContact OD1-CB 3.35Å; A269-T271 VanDerWaalsContact C-N 3.3Å; A269-T271 PolarHBondContact O-N 3Å
270	K	52.5	Low	63.1	Low	203 Å²	203	73.3 Å²	73.3	88%	0.883	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-77	-7.4	-173.1	-73.5	-174	179.8	177.2	0	114.8	D268	D268-K270 PolarHBondContact O-N 3.28Å
271	T	45.7	Very low	61.9	Low	101 Å²	101	77.8 Å²	77.8	62%	0.62	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-137.4	17.5	-172.6	46.8	0	0	0	0	114.7	A269 S273	A269-T271 VanDerWaalsContact C-N 3.3Å; A269-T271 PolarHBondContact O-N 3Å; T271-S273 VanDerWaalsContact C-N 3.34Å; T271-S273 PolarHBondContact O-N 3.23Å
272	L	50.2	Low	60.6	Low	70 Å²	70	80.3 Å²	80.3	37%	0.366	47%	0.472	S	S	.	.			trans	-70.4	98.8	165.5	-78.2	159.2	0	0	0	107.6	P204 V266	P204-L272 WeakPolarHBondContact O-CD1 3.16Å; V266-L272 HydrophobicContact CG1-CD1 4.3Å
273	S	45.4	Very low	59.5	Low	71 Å²	71	83.8 Å²	83.8	50%	0.497	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-49.9	124.9	158.3	53.8	0	0	0	0	106.4	T271 S275	T271-S273 VanDerWaalsContact C-N 3.34Å; T271-S273 PolarHBondContact O-N 3.23Å; S273-S275 PolarHBondContact O-N 3.24Å
274	P	45.2	Very low	59.1	Low	103 Å²	103	89.5 Å²	89.5	67%	0.669	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-52.4	123.4	179.6	19.5	-30.1	0	0	0	107.9
275	S	45.7	Very low	59	Low	6 Å²	6	94.4 Å²	94.4	4%	0.042	57%	0.57	C	S	.	*	P	Polyproline II helix	trans	-50	135.3	172.8	172.3	0	0	0	0	107.9	D201 S273 L277 R278	D201-S275 WeakPolarHBondContact OD2-CB 3.24Å; S273-S275 PolarHBondContact O-N 3.24Å; S275-L277 PolarHBondContact O-N 2.93Å; S275-L277 PolarHBondContact OG-N 2.89Å; S275-R278 PolarHBondContact O-N 3.36Å
276	P	45.9	Very low	59.2	Low	116 Å²	116	95.6 Å²	95.6	75%	0.753	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.3	-14.6	176.6	2.7	-5.6	0	0	0	113.1
277	L	44.8	Very low	59.3	Low	146 Å²	146	99.7 Å²	99.7	76%	0.764	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	-20	173.2	-65.6	166.5	0	0	0	113.7	S275 A279	S275-L277 PolarHBondContact O-N 2.93Å; S275-L277 PolarHBondContact OG-N 2.89Å; L277-A279 PolarHBondContact O-N 2.91Å
278	R	52.7	Low	59.7	Low	114 Å²	114	97.8 Å²	97.8	43%	0.43	61%	0.606	S	S	.	*			trans	-81.9	67.6	167.4	-81.1	-169.6	-170.7	138.1	26.3	109.8	D201 D203 S275 T280	D201-R278 IonicContact OD1-NH2 3.46Å; D201-R278 PolarHBondContact OD1-NH2 3.29Å; D203-R278 PolarHBondContact O-NH2 3.1Å; S275-R278 PolarHBondContact O-N 3.36Å; R278-T280 PolarHBondContact O-N 3.22Å; R278-T280 VanDerWaalsContact O-N 3.11Å
279	A	45.8	Very low	60.9	Low	73 Å²	73	97.4 Å²	97.4	60%	0.603	60%	0.603	S	S	*	*			trans	-65.8	110.1	168.1	0	0	0	0	0	108.9	L277 S281	L277-A279 PolarHBondContact O-N 2.91Å; A279-S281 VanDerWaalsContact C-N 3.3Å; A279-S281 PolarHBondContact O-N 3.37Å
280	T	48.8	Very low	62.6	Low	131 Å²	131	96.7 Å²	96.7	80%	0.804	59%	0.59	S	S	*	*			trans	-62.2	93.9	161.9	46.9	0	0	0	0	108.1	R278 A282	R278-T280 PolarHBondContact O-N 3.22Å; R278-T280 VanDerWaalsContact O-N 3.11Å; T280-A282 VanDerWaalsContact C-N 3.35Å; T280-A282 PolarHBondContact O-N 3.23Å
281	S	55.6	Low	64.3	Low	125 Å²	125	87.4 Å²	87.4	87%	0.874	55%	0.55	S	S	*	*	S	Bend	trans	24.8	64.9	170.1	62.7	0	0	0	0	114.6	A279	A279-S281 VanDerWaalsContact C-N 3.3Å; A279-S281 PolarHBondContact O-N 3.37Å
282	A	58.9	Low	66.4	Low	79 Å²	79	86.6 Å²	86.6	65%	0.653	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-84.7	139.5	171.2	0	0	0	0	0	109	T280	T280-A282 VanDerWaalsContact C-N 3.35Å; T280-A282 PolarHBondContact O-N 3.23Å
283	G	65.2	Low	68.4	Low	75 Å²	75	85.9 Å²	85.9	77%	0.773	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-51.7	141.9	-171.8	0	0	0	0	0	114.4
284	T	78.9	Confident	70.7	Confident	143 Å²	143	85.6 Å²	85.6	88%	0.877	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-73.7	133.3	178	43.3	0	0	0	0	111.3
285	L	85.3	Confident	72.9	Confident	104 Å²	104	81.5 Å²	81.5	55%	0.545	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-81.9	136.9	174.1	-70.8	168.2	0	0	0	110.3	T287 L289	L285-T287 PolarHBondContact O-N 3.02Å; L285-L289 HydrophobicContact CD2-CD2 4.03Å
286	P	90.6	Very high	75.2	Confident	74 Å²	74	81.4 Å²	81.4	48%	0.481	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-58	138.8	169.6	-23.8	33.6	0	0	0	111.5	S288 L289 F290	P286-S288 PolarHBondContact O-N 3.28Å; P286-L289 HydrophobicContact CB-CB 4.3Å; P286-L289 WeakPolarHBondContact O-CB 3.47Å; P286-L289 PolarHBondContact O-N 2.9Å; P286-F290 PolarHBondContact O-N 2.83Å
287	T	87.2	Confident	77.6	Confident	96 Å²	96	75.9 Å²	75.9	59%	0.589	47%	0.468	S	S	*	.	H	α-helix	trans	-60.7	-31	-178.1	54.1	0	0	0	0	113.2	L285 S291 Q308	L285-T287 PolarHBondContact O-N 3.02Å; T287-S291 WeakPolarHBondContact O-CB 3.39Å; T287-S291 PolarHBondContact O-N 3.06Å; T287-S291 PolarHBondContact O-OG 3Å; T287-Q308 PolarHBondContact O-NE2 2.79Å
288	S	87.4	Confident	79.9	Confident	83 Å²	83	68.9 Å²	68.9	58%	0.58	43%	0.431	S	S	*	.	H	α-helix	trans	-64.1	-47.5	173.4	55.1	0	0	0	0	111.6	P286 S291 T292	P286-S288 PolarHBondContact O-N 3.28Å; S288-S291 PolarHBondContact O-N 2.89Å; S288-T292 PolarHBondContact O-N 3.43Å; S288-T292 PolarHBondContact O-OG1 3.43Å
289	L	90.8	Very high	81.9	Confident	76 Å²	76	65 Å²	65	40%	0.398	42%	0.419	S	S	.	.	H	α-helix	trans	-64.5	-44.8	177.8	-178.9	59.7	0	0	0	110.9	L285 P286 S291 T292 I293	L285-L289 HydrophobicContact CD2-CD2 4.03Å; P286-L289 HydrophobicContact CB-CB 4.3Å; P286-L289 WeakPolarHBondContact O-CB 3.47Å; P286-L289 PolarHBondContact O-N 2.9Å; L289-S291 VanDerWaalsContact C-N 3.25Å; L289-S291 PolarHBondContact O-N 2.91Å; L289-T292 WeakPolarHBondContact CA-OG1 3.36Å; L289-T292 PolarHBondContact O-N 2.86Å; L289-T292 VanDerWaalsContact O-N 3.12Å; L289-T292 PolarHBondContact O-OG1 2.81Å; L289-I293 HydrophobicContact CD1-CD1 4.03Å; L289-I293 HydrophobicContact CD1-CG1 4.2Å; L289-I293 HydrophobicContact CD2-CD1 4.41Å; L289-I293 HydrophobicContact CG-CD1 3.78Å; L289-I293 HydrophobicContact CG-CG1 4.36Å; L289-I293 WeakPolarHBondContact O-CG1 3.08Å; L289-I293 PolarHBondContact O-N 2.85Å
290	F	91.6	Very high	84.2	Confident	41 Å²	41	61.6 Å²	61.6	18%	0.18	39%	0.39	C	S	.	.	H	α-helix	trans	-56	-41.6	174.5	-173.8	-97.5	0	0	0	111.9	P286 T292 I293 F294 H297 L389 L391	P286-F290 PolarHBondContact O-N 2.83Å; F290-T292 VanDerWaalsContact C-N 3.29Å; F290-T292 PolarHBondContact O-N 3.21Å; F290-I293 PolarHBondContact O-N 3.31Å; F290-F294 AromaticContact CD2-CD2 3.7Å; F290-F294 HydrophobicContact CD2-CD2 3.7Å; F290-F294 AromaticContact CD2-CE2 3.84Å; F290-F294 HydrophobicContact CD2-CE2 3.84Å; F290-F294 HydrophobicContact CE1-CD2 4.28Å; F290-F294 AromaticContact CE2-CD2 3.43Å; F290-F294 HydrophobicContact CE2-CD2 3.43Å; F290-F294 VanDerWaalsContact CE2-CD2 3.43Å; F290-F294 AromaticContact CE2-CE2 3.52Å; F290-F294 HydrophobicContact CE2-CE2 3.52Å; F290-F294 HydrophobicContact CG-CD2 4.24Å; F290-F294 AromaticContact CZ-CD2 3.76Å; F290-F294 HydrophobicContact CZ-CD2 3.76Å; F290-F294 HydrophobicContact CZ-CE2 4.22Å; F290-F294 PolarHBondContact O-N 3.29Å; F290-H297 AromaticContact CD1-CE1 3.95Å; F290-H297 AromaticContact CD1-NE2 3.91Å; F290-H297 AromaticContact CE1-CD2 3.7Å; F290-H297 AromaticContact CE1-CG 3.92Å; F290-H297 AromaticContact CE1-NE2 3.86Å; F290-L389 HydrophobicContact CE1-CD1 4.16Å; F290-L389 HydrophobicContact CZ-CD1 4.16Å; F290-L389 HydrophobicContact CZ-CD2 4.15Å; F290-L391 HydrophobicContact CZ-CD2 4.17Å
291	S	89.2	Confident	86.2	Confident	8 Å²	8	57.6 Å²	57.6	6%	0.056	36%	0.364	C	S	.	.	H	α-helix	trans	-69	-24.5	179.4	-57.3	0	0	0	0	114.9	T287 S288 L289 Q308 H311	T287-S291 WeakPolarHBondContact O-CB 3.39Å; T287-S291 PolarHBondContact O-N 3.06Å; T287-S291 PolarHBondContact O-OG 3Å; S288-S291 PolarHBondContact O-N 2.89Å; L289-S291 VanDerWaalsContact C-N 3.25Å; L289-S291 PolarHBondContact O-N 2.91Å; S291-Q308 PolarHBondContact OG-NE2 3.34Å; S291-H311 WeakPolarHBondContact O-CB 3.07Å; S291-H311 PolarHBondContact O-N 3.37Å
292	T	88.6	Confident	87.8	Confident	84 Å²	84	56.8 Å²	56.8	52%	0.515	35%	0.346	S	S	.	.	H	α-helix	trans	-83.8	-36.4	171.8	35.5	0	0	0	0	112.7	S288 L289 F290	S288-T292 PolarHBondContact O-N 3.43Å; S288-T292 PolarHBondContact O-OG1 3.43Å; L289-T292 WeakPolarHBondContact CA-OG1 3.36Å; L289-T292 PolarHBondContact O-N 2.86Å; L289-T292 VanDerWaalsContact O-N 3.12Å; L289-T292 PolarHBondContact O-OG1 2.81Å; F290-T292 VanDerWaalsContact C-N 3.29Å; F290-T292 PolarHBondContact O-N 3.21Å
293	I	92.4	Very high	89.2	Confident	55 Å²	55	59.3 Å²	59.3	28%	0.282	35%	0.349	S	S	.	.	H	α-helix	trans	-68.1	-42.2	178.2	-67.1	171	0	0	0	110.1	L289 F290 P295 P413 H415	L289-I293 HydrophobicContact CD1-CD1 4.03Å; L289-I293 HydrophobicContact CD1-CG1 4.2Å; L289-I293 HydrophobicContact CD2-CD1 4.41Å; L289-I293 HydrophobicContact CG-CD1 3.78Å; L289-I293 HydrophobicContact CG-CG1 4.36Å; L289-I293 WeakPolarHBondContact O-CG1 3.08Å; L289-I293 PolarHBondContact O-N 2.85Å; F290-I293 PolarHBondContact O-N 3.31Å; I293-P295 VanDerWaalsContact O-CD 3.29Å; I293-P295 WeakPolarHBondContact O-CD 3.39Å; I293-P413 WeakPolarHBondContact O-CG 3.38Å; I293-H415 PolarHBondContact O-CE1 3.28Å; I293-H415 PolarHBondContact O-NE2 3.36Å
294	F	93.6	Very high	90.4	Very high	65 Å²	65	56.8 Å²	56.8	29%	0.285	32%	0.317	S	S	.	.			trans	-114.7	88.2	179.1	-55.8	-69.7	0	0	0	110.5	F290 F296 H297 L391 H415	F290-F294 AromaticContact CD2-CD2 3.7Å; F290-F294 HydrophobicContact CD2-CD2 3.7Å; F290-F294 AromaticContact CD2-CE2 3.84Å; F290-F294 HydrophobicContact CD2-CE2 3.84Å; F290-F294 HydrophobicContact CE1-CD2 4.28Å; F290-F294 AromaticContact CE2-CD2 3.43Å; F290-F294 HydrophobicContact CE2-CD2 3.43Å; F290-F294 VanDerWaalsContact CE2-CD2 3.43Å; F290-F294 AromaticContact CE2-CE2 3.52Å; F290-F294 HydrophobicContact CE2-CE2 3.52Å; F290-F294 HydrophobicContact CG-CD2 4.24Å; F290-F294 AromaticContact CZ-CD2 3.76Å; F290-F294 HydrophobicContact CZ-CD2 3.76Å; F290-F294 HydrophobicContact CZ-CE2 4.22Å; F290-F294 PolarHBondContact O-N 3.29Å; F294-F296 PolarHBondContact O-N 3.41Å; F294-H297 HydrophobicContact CB-CB 4.24Å; F294-H297 PolarHBondContact O-ND1 3.15Å; F294-L391 HydrophobicContact CB-CD2 4.35Å; F294-L391 HydrophobicContact CG-CD2 4.27Å; F294-H415 AromaticContact CD1-NE2 3.95Å; F294-H415 AromaticContact CE1-NE2 3.72Å
295	P	92.3	Very high	91	Very high	17 Å²	17	51.6 Å²	51.6	11%	0.11	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-22.9	-175.8	-22.6	34	0	0	0	114.1	I293 G310 G312 L313 P413	I293-P295 VanDerWaalsContact O-CD 3.29Å; I293-P295 WeakPolarHBondContact O-CD 3.39Å; P295-G310 CarbonylContact O-C 3.43Å; P295-G310 VanDerWaalsContact O-C 3.22Å; P295-G310 WeakPolarHBondContact O-CA 3.44Å; P295-G312 WeakPolarHBondContact O-CA 3.21Å; P295-G312 PolarHBondContact O-N 2.92Å; P295-L313 PolarHBondContact O-N 2.83Å; P295-P413 HydrophobicContact CG-CG 3.63Å
296	F	93.8	Very high	91.2	Very high	4 Å²	4	47.5 Å²	47.5	2%	0.018	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.3	56.9	-175.3	-51.6	-78.9	0	0	0	111.8	F294 L313 M373 L375 G392 P394 L407 D411	F294-F296 PolarHBondContact O-N 3.41Å; F296-L313 HydrophobicContact CB-CD1 4.5Å; F296-L313 HydrophobicContact CB-CG 4.47Å; F296-L313 HydrophobicContact CD1-CD2 3.78Å; F296-L313 HydrophobicContact CD1-CG 3.97Å; F296-L313 HydrophobicContact CE1-CD2 4.5Å; F296-M373 HydrophobicContact CE1-CE 4.43Å; F296-L375 HydrophobicContact CB-CD2 4.39Å; F296-L375 HydrophobicContact CD1-CD2 4.05Å; F296-L375 HydrophobicContact CG-CD2 4.43Å; F296-G392 WeakPolarHBondContact CB-O 3.46Å; F296-G392 PolarHBondContact O-N 3.26Å; F296-P394 HydrophobicContact CD1-CG 4.18Å; F296-P394 HydrophobicContact CD2-CG 4.12Å; F296-P394 HydrophobicContact CE1-CG 3.9Å; F296-P394 HydrophobicContact CE2-CG 3.83Å; F296-P394 HydrophobicContact CG-CG 4.29Å; F296-P394 HydrophobicContact CZ-CG 3.74Å; F296-L407 HydrophobicContact CE1-CD2 3.93Å; F296-L407 HydrophobicContact CZ-CD2 3.57Å; F296-D411 WeakPolarHBondContact CE2-O 3.47Å; F296-D411 HydrophobicContact CZ-CB 4.38Å
297	H	94.9	Very high	91.2	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	157.5	174	80.6	-86.4	0	0	0	111.9	F290 F294 Q308 G310 L389 F390 L391	F290-H297 AromaticContact CD1-CE1 3.95Å; F290-H297 AromaticContact CD1-NE2 3.91Å; F290-H297 AromaticContact CE1-CD2 3.7Å; F290-H297 AromaticContact CE1-CG 3.92Å; F290-H297 AromaticContact CE1-NE2 3.86Å; F294-H297 HydrophobicContact CB-CB 4.24Å; F294-H297 PolarHBondContact O-ND1 3.15Å; H297-Q308 PolarHBondContact NE2-NE2 2.8Å; H297-G310 WeakPolarHBondContact CE1-CA 3.4Å; H297-G310 PolarHBondContact CE1-N 2.78Å; H297-G310 VanDerWaalsContact CE1-N 3.29Å; H297-G310 VanDerWaalsContact ND1-CA 3.27Å; H297-G310 WeakPolarHBondContact ND1-CA 3.24Å; H297-G310 PolarHBondContact O-N 3.28Å; H297-L389 HydrophobicContact CB-CD1 4.38Å; H297-F390 CarbonylContact C-O 3.3Å; H297-F390 WeakPolarHBondContact CA-O 3.45Å; H297-F390 WeakPolarHBondContact CB-O 3.41Å; H297-L391 HydrophobicContact CB-CD2 3.73Å
298	L	94.4	Very high	91.3	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	143.4	173.6	-52.9	169.8	0	0	0	109.5	L306 Q308 I309 L313 F329 F333 I357 L389 F390	L298-L306 HydrophobicContact CB-CD2 4.21Å; L298-L306 HydrophobicContact CD2-CD2 3.92Å; L298-L306 HydrophobicContact CG-CD2 4.46Å; L298-Q308 CarbonylContact C-O 3.55Å; L298-Q308 WeakPolarHBondContact CA-O 3.44Å; L298-I309 HydrophobicContact CD2-CB 4.43Å; L298-I309 HydrophobicContact CD2-CG1 4.04Å; L298-I309 HydrophobicContact CD2-CG2 4.04Å; L298-L313 HydrophobicContact CD2-CD1 3.69Å; L298-L313 HydrophobicContact CG-CD1 4.15Å; L298-F329 HydrophobicContact CD1-CD2 4.37Å; L298-F329 HydrophobicContact CD1-CE2 3.96Å; L298-F333 HydrophobicContact CD1-CD1 4.42Å; L298-F333 HydrophobicContact CD1-CD2 4.2Å; L298-F333 HydrophobicContact CD1-CE1 4.08Å; L298-F333 HydrophobicContact CD1-CE2 3.87Å; L298-F333 HydrophobicContact CD1-CG 4.45Å; L298-F333 HydrophobicContact CD1-CZ 3.78Å; L298-F333 HydrophobicContact CD2-CE2 3.87Å; L298-F333 HydrophobicContact CD2-CZ 3.63Å; L298-F333 HydrophobicContact CG-CZ 4.35Å; L298-I357 HydrophobicContact CD1-CD1 4.46Å; L298-L389 CarbonylContact O-C 3.47Å; L298-L389 WeakPolarHBondContact O-CA 3.43Å; L298-F390 HydrophobicContact CB-CB 4.14Å; L298-F390 HydrophobicContact CD1-CD1 4.19Å; L298-F390 HydrophobicContact CG-CD1 4.25Å; L298-F390 PolarHBondContact N-O 2.96Å; L298-F390 PolarHBondContact O-N 3.34Å
299	I	94.2	Very high	91.4	Very high	33 Å²	33	42.4 Å²	42.4	17%	0.169	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	126.2	167.5	-57.4	-176	0	0	0	108.1	V307 Q308 A387 I388 L389	I299-V307 HydrophobicContact CB-CB 4.35Å; I299-V307 HydrophobicContact CG2-CB 4.11Å; I299-V307 PolarHBondContact O-N 2.95Å; I299-Q308 HydrophobicContact CB-CB 3.92Å; I299-Q308 HydrophobicContact CD1-CB 3.85Å; I299-Q308 HydrophobicContact CD1-CG 4.44Å; I299-Q308 HydrophobicContact CG1-CB 3.93Å; I299-Q308 PolarHBondContact N-O 3.48Å; I299-Q308 PolarHBondContact O-N 2.94Å; I299-A387 HydrophobicContact CG2-CB 3.98Å; I299-I388 WeakPolarHBondContact CA-O 3.43Å; I299-L389 HydrophobicContact CD1-CD1 4.24Å; I299-L389 HydrophobicContact CG1-CD1 3.69Å
300	L	93.6	Very high	91.3	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	134.8	-176.8	-59.6	173.2	0	0	0	110	M304 V305 L306 F329 I347 A387 I388	L300-M304 HydrophobicContact CD1-CE 4.47Å; L300-M304 HydrophobicContact CD1-SD 4.46Å; L300-V305 WeakPolarHBondContact CA-O 3.32Å; L300-L306 HydrophobicContact CD2-CD2 3.49Å; L300-L306 VanDerWaalsContact CD2-CD2 3.49Å; L300-L306 HydrophobicContact CD2-CG 3.95Å; L300-F329 HydrophobicContact CD1-CD2 3.83Å; L300-F329 HydrophobicContact CD1-CE2 4.23Å; L300-F329 HydrophobicContact CD1-CG 4.26Å; L300-F329 HydrophobicContact CD2-CB 3.86Å; L300-F329 HydrophobicContact CD2-CD2 3.83Å; L300-F329 HydrophobicContact CD2-CG 4.2Å; L300-F329 HydrophobicContact CG-CD2 4.44Å; L300-I347 HydrophobicContact CD1-CD1 4.45Å; L300-A387 CarbonylContact O-C 3.54Å; L300-A387 WeakPolarHBondContact O-CA 3.23Å; L300-A387 VanDerWaalsContact O-CB 3.26Å; L300-A387 WeakPolarHBondContact O-CB 3.49Å; L300-I388 HydrophobicContact CB-CB 4.4Å; L300-I388 PolarHBondContact N-O 3.39Å; L300-I388 PolarHBondContact O-N 3.49Å
301	D	91.4	Very high	91.1	Very high	47 Å²	47	40.6 Å²	40.6	25%	0.251	21%	0.214	S	C	.	.			trans	-85.7	-176.6	168.2	66.7	14.2	0	0	0	111.9	D303 M304 V305 V307 F344	D301-D303 PolarHBondContact O-N 2.72Å; D301-D303 PolarHBondContact OD1-N 2.86Å; D301-D303 VanDerWaalsContact OD1-N 3.08Å; D301-M304 PolarHBondContact O-N 3.05Å; D301-M304 VanDerWaalsContact O-N 3.13Å; D301-M304 PolarHBondContact OD1-N 3.16Å; D301-V305 PolarHBondContact N-O 3.46Å; D301-V305 VanDerWaalsContact N-O 3.16Å; D301-V305 WeakPolarHBondContact OD1-CA 3.4Å; D301-V305 WeakPolarHBondContact OD1-CB 3.29Å; D301-V305 PolarHBondContact OD1-N 3.38Å; D301-V305 WeakPolarHBondContact OD2-CB 3.16Å; D301-V307 HydrophobicContact CB-CG2 3.9Å; D301-F344 VanDerWaalsContact O-CD2 3.22Å; D301-F344 WeakPolarHBondContact O-CD2 3.36Å
302	Q	89.4	Confident	90.9	Very high	107 Å²	107	40.5 Å²	40.5	50%	0.5	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-28.4	-179.4	-62.2	-163.3	-54.2	0	0	113.9	M304 F344 N386	Q302-M304 PolarHBondContact O-N 3.13Å; Q302-F344 HydrophobicContact CG-CD1 4.5Å; Q302-F344 HydrophobicContact CG-CE1 4.14Å; Q302-F344 HydrophobicContact CG-CE2 4.3Å; Q302-F344 HydrophobicContact CG-CZ 4.02Å; Q302-F344 WeakPolarHBondContact O-CB 3.38Å; Q302-N386 PolarHBondContact NE2-ND2 3.26Å; Q302-N386 PolarHBondContact NE2-OD1 2.89Å; Q302-N386 PolarHBondContact OE1-ND2 2.67Å
303	D	89.3	Confident	90.8	Very high	133 Å²	133	36.5 Å²	36.5	71%	0.711	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.9	9.9	-180	-64.8	-43.2	0	0	0	112.1	D301 V305	D301-D303 PolarHBondContact O-N 2.72Å; D301-D303 PolarHBondContact OD1-N 2.86Å; D301-D303 VanDerWaalsContact OD1-N 3.08Å; D303-V305 HydrophobicContact CB-CG2 4.08Å; D303-V305 PolarHBondContact O-N 3.23Å
304	M	89.8	Confident	90.4	Very high	21 Å²	21	39.1 Å²	39.1	10%	0.103	20%	0.196	C	C	.	.			trans	60.7	28.6	-176.2	-63.6	-71.5	-76	0	0	113.1	L300 D301 Q302 F329 F344 I347	L300-M304 HydrophobicContact CD1-CE 4.47Å; L300-M304 HydrophobicContact CD1-SD 4.46Å; D301-M304 PolarHBondContact O-N 3.05Å; D301-M304 VanDerWaalsContact O-N 3.13Å; D301-M304 PolarHBondContact OD1-N 3.16Å; Q302-M304 PolarHBondContact O-N 3.13Å; M304-F329 HydrophobicContact CB-CB 4.49Å; M304-F329 HydrophobicContact CE-CB 4.12Å; M304-F329 HydrophobicContact CE-CD1 3.71Å; M304-F329 HydrophobicContact CE-CE1 4.38Å; M304-F329 HydrophobicContact CE-CG 4.05Å; M304-F329 PolarHBondContact O-N 3.24Å; M304-F344 HydrophobicContact SD-CB 4.26Å; M304-F344 PolarHBondContact SD-N 3.12Å; M304-F344 VanDerWaalsContact SD-N 3.43Å; M304-I347 HydrophobicContact CE-CD1 3.71Å; M304-I347 HydrophobicContact SD-CD1 3.96Å
305	V	90.8	Very high	89.8	Confident	34 Å²	34	42.4 Å²	42.4	21%	0.206	21%	0.21	C	C	.	.	B	Isolated β-bridge	trans	-87.6	138.3	173.8	-176.7	0	0	0	0	109.7	L300 D301 D303 V307	L300-V305 WeakPolarHBondContact CA-O 3.32Å; D301-V305 PolarHBondContact N-O 3.46Å; D301-V305 VanDerWaalsContact N-O 3.16Å; D301-V305 WeakPolarHBondContact OD1-CA 3.4Å; D301-V305 WeakPolarHBondContact OD1-CB 3.29Å; D301-V305 PolarHBondContact OD1-N 3.38Å; D301-V305 WeakPolarHBondContact OD2-CB 3.16Å; D303-V305 HydrophobicContact CB-CG2 4.08Å; D303-V305 PolarHBondContact O-N 3.23Å; V305-V307 PolarHBondContact O-N 3.22Å
306	L	89.8	Confident	89	Confident	18 Å²	18	44.4 Å²	44.4	9%	0.094	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	102	178	-72	157.5	0	0	0	110.6	L298 L300 I309 S327 Y332 F333	L298-L306 HydrophobicContact CB-CD2 4.21Å; L298-L306 HydrophobicContact CD2-CD2 3.92Å; L298-L306 HydrophobicContact CG-CD2 4.46Å; L300-L306 HydrophobicContact CD2-CD2 3.49Å; L300-L306 VanDerWaalsContact CD2-CD2 3.49Å; L300-L306 HydrophobicContact CD2-CG 3.95Å; L306-I309 HydrophobicContact CB-CD1 4.08Å; L306-I309 HydrophobicContact CB-CG1 4.3Å; L306-I309 HydrophobicContact CD1-CD1 4.07Å; L306-I309 HydrophobicContact CD2-CD1 4.31Å; L306-I309 HydrophobicContact CD2-CG1 4.15Å; L306-I309 HydrophobicContact CG-CD1 4.4Å; L306-S327 PolarHBondContact N-O 3.36Å; L306-S327 VanDerWaalsContact N-O 3.16Å; L306-Y332 HydrophobicContact CD1-CD2 4.4Å; L306-F333 HydrophobicContact CD1-CD2 4.44Å; L306-F333 HydrophobicContact CD1-CE2 4.04Å; L306-F333 HydrophobicContact CD2-CE2 4.24Å
307	V	89.9	Confident	88.1	Confident	96 Å²	96	45 Å²	45	58%	0.582	22%	0.219	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-75	-44.2	176.5	-177.7	0	0	0	0	111.3	I299 D301 V305	I299-V307 HydrophobicContact CB-CB 4.35Å; I299-V307 HydrophobicContact CG2-CB 4.11Å; I299-V307 PolarHBondContact O-N 2.95Å; D301-V307 HydrophobicContact CB-CG2 3.9Å; V305-V307 PolarHBondContact O-N 3.22Å
308	Q	89.8	Confident	86.8	Confident	37 Å²	37	49.2 Å²	49.2	17%	0.173	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	144.3	-178.4	-169.3	176.6	-21.4	0	0	111.4	T287 S291 H297 L298 I299	T287-Q308 PolarHBondContact O-NE2 2.79Å; S291-Q308 PolarHBondContact OG-NE2 3.34Å; H297-Q308 PolarHBondContact NE2-NE2 2.8Å; L298-Q308 CarbonylContact C-O 3.55Å; L298-Q308 WeakPolarHBondContact CA-O 3.44Å; I299-Q308 HydrophobicContact CB-CB 3.92Å; I299-Q308 HydrophobicContact CD1-CB 3.85Å; I299-Q308 HydrophobicContact CD1-CG 4.44Å; I299-Q308 HydrophobicContact CG1-CB 3.93Å; I299-Q308 PolarHBondContact N-O 3.48Å; I299-Q308 PolarHBondContact O-N 2.94Å
309	I	89.6	Confident	84.9	Confident	13 Å²	13	59.6 Å²	59.6	7%	0.067	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	134.3	179.9	-58.9	170.6	0	0	0	109.8	L298 L306 L313 R314 F318	L298-I309 HydrophobicContact CD2-CB 4.43Å; L298-I309 HydrophobicContact CD2-CG1 4.04Å; L298-I309 HydrophobicContact CD2-CG2 4.04Å; L306-I309 HydrophobicContact CB-CD1 4.08Å; L306-I309 HydrophobicContact CB-CG1 4.3Å; L306-I309 HydrophobicContact CD1-CD1 4.07Å; L306-I309 HydrophobicContact CD2-CD1 4.31Å; L306-I309 HydrophobicContact CD2-CG1 4.15Å; L306-I309 HydrophobicContact CG-CD1 4.4Å; I309-L313 HydrophobicContact CG2-CB 3.63Å; I309-R314 HydrophobicContact CG2-CB 4.39Å; I309-R314 PolarHBondContact O-NH2 3.41Å; I309-F318 HydrophobicContact CD1-CE2 3.59Å; I309-F318 HydrophobicContact CD1-CZ 3.72Å
310	G	90.1	Very high	82.9	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	31%	0.313	C	S	.	.			trans	-57.6	149.9	174.5	0	0	0	0	0	113.7	P295 H297 G312 L313 R314	P295-G310 CarbonylContact O-C 3.43Å; P295-G310 VanDerWaalsContact O-C 3.22Å; P295-G310 WeakPolarHBondContact O-CA 3.44Å; H297-G310 WeakPolarHBondContact CE1-CA 3.4Å; H297-G310 PolarHBondContact CE1-N 2.78Å; H297-G310 VanDerWaalsContact CE1-N 3.29Å; H297-G310 VanDerWaalsContact ND1-CA 3.27Å; H297-G310 WeakPolarHBondContact ND1-CA 3.24Å; H297-G310 PolarHBondContact O-N 3.28Å; G310-G312 VanDerWaalsContact C-N 3.26Å; G310-G312 PolarHBondContact O-N 3.05Å; G310-L313 PolarHBondContact O-N 2.73Å; G310-R314 WeakPolarHBondContact O-CB 3.38Å; G310-R314 PolarHBondContact O-N 3.26Å
311	H	86.6	Confident	80.4	Confident	80 Å²	80	74.8 Å²	74.8	37%	0.37	35%	0.348	S	S	.	.	H	α-helix	trans	-62.5	-33.5	-174.6	179.9	-112.8	0	0	0	112.9	S291 K315	S291-H311 WeakPolarHBondContact O-CB 3.07Å; S291-H311 PolarHBondContact O-N 3.37Å; H311-K315 WeakPolarHBondContact CE1-CE 3.25Å; H311-K315 PolarHBondContact CE1-NZ 2.82Å; H311-K315 WeakPolarHBondContact O-CG 3.16Å; H311-K315 PolarHBondContact O-N 3.07Å
312	G	84.5	Confident	78.4	Confident	6 Å²	6	76.7 Å²	76.7	6%	0.062	38%	0.379	C	S	.	.	H	α-helix	trans	-65.7	-41	177.4	0	0	0	0	0	112.8	P295 G310	P295-G312 WeakPolarHBondContact O-CA 3.21Å; P295-G312 PolarHBondContact O-N 2.92Å; G310-G312 VanDerWaalsContact C-N 3.26Å; G310-G312 PolarHBondContact O-N 3.05Å
313	L	86.8	Confident	76.3	Confident	0 Å²	0	79.4 Å²	79.4	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-73.4	-40.5	175.3	-66.6	176	0	0	0	112.2	P295 F296 L298 I309 G310 K315 R316 L317 I359 M373 L375	P295-L313 PolarHBondContact O-N 2.83Å; F296-L313 HydrophobicContact CB-CD1 4.5Å; F296-L313 HydrophobicContact CB-CG 4.47Å; F296-L313 HydrophobicContact CD1-CD2 3.78Å; F296-L313 HydrophobicContact CD1-CG 3.97Å; F296-L313 HydrophobicContact CE1-CD2 4.5Å; L298-L313 HydrophobicContact CD2-CD1 3.69Å; L298-L313 HydrophobicContact CG-CD1 4.15Å; I309-L313 HydrophobicContact CG2-CB 3.63Å; G310-L313 PolarHBondContact O-N 2.73Å; L313-K315 VanDerWaalsContact C-N 3.3Å; L313-K315 PolarHBondContact O-N 3.25Å; L313-R316 WeakPolarHBondContact O-CB 3.46Å; L313-R316 PolarHBondContact O-N 3Å; L313-L317 HydrophobicContact CB-CD1 4.06Å; L313-L317 WeakPolarHBondContact O-CG 3.08Å; L313-L317 PolarHBondContact O-N 3.34Å; L313-I359 HydrophobicContact CD2-CD1 3.77Å; L313-M373 HydrophobicContact CD2-CE 4.1Å; L313-L375 HydrophobicContact CD1-CD1 3.95Å; L313-L375 HydrophobicContact CD2-CD1 3.67Å; L313-L375 HydrophobicContact CD2-CD2 4.4Å; L313-L375 HydrophobicContact CG-CD1 4.44Å
314	R	84.7	Confident	74.5	Confident	109 Å²	109	85.2 Å²	85.2	41%	0.411	40%	0.403	S	S	.	.	H	α-helix	trans	-58.9	-40.7	-179	-164.1	-175.3	-43.8	173.5	7.1	112.8	I309 G310 R316 F318	I309-R314 HydrophobicContact CG2-CB 4.39Å; I309-R314 PolarHBondContact O-NH2 3.41Å; G310-R314 WeakPolarHBondContact O-CB 3.38Å; G310-R314 PolarHBondContact O-N 3.26Å; R314-R316 PolarHBondContact O-N 3.2Å; R314-F318 HydrophobicContact CG-CD2 3.85Å; R314-F318 HydrophobicContact CG-CE2 4.29Å; R314-F318 PolarHBondContact O-N 2.94Å
315	K	79.7	Confident	72.7	Confident	134 Å²	134	94.3 Å²	94.3	58%	0.583	44%	0.436	S	S	*	.	H	α-helix	trans	-59.2	-24.1	174.7	-79.5	176.2	166.7	176.2	0	113.8	H311 L313	H311-K315 WeakPolarHBondContact CE1-CE 3.25Å; H311-K315 PolarHBondContact CE1-NZ 2.82Å; H311-K315 WeakPolarHBondContact O-CG 3.16Å; H311-K315 PolarHBondContact O-N 3.07Å; L313-K315 VanDerWaalsContact C-N 3.3Å; L313-K315 PolarHBondContact O-N 3.25Å
316	R	75.8	Confident	71	Confident	60 Å²	60	97.2 Å²	97.2	23%	0.226	46%	0.459	C	S	.	.	H	α-helix	trans	-100.8	-35.4	-173.1	-65.2	172.1	177.4	-99	-26.5	112.9	L313 R314 M373 C405 G406 L407	L313-R316 WeakPolarHBondContact O-CB 3.46Å; L313-R316 PolarHBondContact O-N 3Å; R314-R316 PolarHBondContact O-N 3.2Å; R316-M373 PolarHBondContact NH1-SD 3.1Å; R316-M373 VanDerWaalsContact NH1-SD 3.45Å; R316-C405 PolarHBondContact NH1-O 3.09Å; R316-G406 VanDerWaalsContact NH2-C 3.26Å; R316-G406 PolarHBondContact NH2-O 3.43Å; R316-L407 VanDerWaalsContact CZ-CG 3.49Å; R316-L407 VanDerWaalsContact NH2-CA 3.33Å
317	L	75.4	Confident	70.2	Confident	17 Å²	17	96.8 Å²	96.8	9%	0.089	46%	0.457	C	S	.	.	H	α-helix	trans	-88.1	-34.1	-171.5	-62.3	168.8	0	0	0	113.3	L313 Y332 F333 I359	L313-L317 HydrophobicContact CB-CD1 4.06Å; L313-L317 WeakPolarHBondContact O-CG 3.08Å; L313-L317 PolarHBondContact O-N 3.34Å; L317-Y332 HydrophobicContact CB-CD1 4.12Å; L317-Y332 HydrophobicContact CB-CE1 4.37Å; L317-Y332 HydrophobicContact CD2-CD1 3.95Å; L317-Y332 HydrophobicContact CG-CD1 4.49Å; L317-F333 HydrophobicContact CD1-CE1 4.14Å; L317-F333 HydrophobicContact CD1-CE2 4.03Å; L317-F333 HydrophobicContact CD1-CZ 3.37Å; L317-I359 HydrophobicContact CD2-CG2 3.56Å
318	F	66.8	Low	70	Confident	87 Å²	87	95.3 Å²	95.3	38%	0.382	45%	0.448	S	S	.	.			trans	-100.1	118.4	-173.5	-64.4	-82.1	0	0	0	111.7	I309 R314	I309-F318 HydrophobicContact CD1-CE2 3.59Å; I309-F318 HydrophobicContact CD1-CZ 3.72Å; R314-F318 HydrophobicContact CG-CD2 3.85Å; R314-F318 HydrophobicContact CG-CE2 4.29Å; R314-F318 PolarHBondContact O-N 2.94Å
319	R	56	Low	70	Confident	218 Å²	218	93.5 Å²	93.5	82%	0.823	44%	0.44	S	S	*	.			trans	-67.9	152.2	162.9	-78.6	-176.8	149.6	-175.1	-6.2	109.6	D321	R319-D321 PolarHBondContact O-N 3.31Å
320	K	51.2	Low	69.9	Low	217 Å²	217	98.5 Å²	98.5	94%	0.943	46%	0.463	S	S	*	.	S	Bend	trans	-63.9	19.1	-178.6	-79.1	-174.5	173.9	-179.7	0	115.3
321	D	41.5	Very low	69.7	Low	136 Å²	136	103.1 Å²	103.1	73%	0.727	48%	0.484	S	S	*	.			trans	-94.8	108.9	177.3	-70.6	-29.1	0	0	0	109.4	R319 Q323	R319-D321 PolarHBondContact O-N 3.31Å; D321-Q323 PolarHBondContact O-N 2.92Å
322	G	48.5	Very low	69.6	Low	87 Å²	87	101 Å²	101	90%	0.897	47%	0.473	S	S	*	.			trans	-67.2	35.9	-168.7	0	0	0	0	0	117.3
323	Q	45.3	Very low	69.9	Low	164 Å²	164	100.7 Å²	100.7	77%	0.766	47%	0.47	S	S	*	.			trans	-96.8	104.2	169.9	-89.1	174.9	-18.2	0	0	110.8	D321 R325	D321-Q323 PolarHBondContact O-N 2.92Å; Q323-R325 VanDerWaalsContact C-N 3.29Å; Q323-R325 PolarHBondContact O-N 2.86Å
324	R	52.1	Low	70.2	Confident	255 Å²	255	102.5 Å²	102.5	96%	0.962	48%	0.483	S	S	*	.			trans	-65.9	86.2	164	-75.7	-177.1	177.7	-170.4	-0.3	109.1
325	R	53	Low	70.5	Confident	212 Å²	212	98.4 Å²	98.4	80%	0.8	47%	0.469	S	S	*	.			trans	-84.8	139.2	155.2	-77.4	-174.6	174.7	179.5	-1.2	108.1	Q323 S327	Q323-R325 VanDerWaalsContact C-N 3.29Å; Q323-R325 PolarHBondContact O-N 2.86Å; R325-S327 VanDerWaalsContact C-N 3.31Å; R325-S327 PolarHBondContact O-N 3.2Å
326	S	55	Low	71	Confident	96 Å²	96	94.2 Å²	94.2	67%	0.671	45%	0.454	S	S	*	.			trans	-60.2	96	167.7	51.5	0	0	0	0	108.1	T328	S326-T328 PolarHBondContact O-N 3.14Å
327	S	72.2	Confident	71.6	Confident	8 Å²	8	92.6 Å²	92.6	6%	0.056	45%	0.452	C	S	.	.			trans	-70.9	120.9	-179.9	45.9	0	0	0	0	109.4	L306 R325	L306-S327 PolarHBondContact N-O 3.36Å; L306-S327 VanDerWaalsContact N-O 3.16Å; R325-S327 VanDerWaalsContact C-N 3.31Å; R325-S327 PolarHBondContact O-N 3.2Å
328	T	85.1	Confident	72.1	Confident	65 Å²	65	91.9 Å²	91.9	40%	0.399	45%	0.449	S	S	.	.	B	Isolated β-bridge	trans	-75.9	147.6	170.9	57.1	0	0	0	0	109.2	S326 Q330 E331	S326-T328 PolarHBondContact O-N 3.14Å; T328-Q330 PolarHBondContact O-N 3.41Å; T328-E331 WeakPolarHBondContact O-CB 3.44Å; T328-E331 PolarHBondContact O-N 3.07Å
329	F	89.7	Confident	72.8	Confident	0 Å²	0	93.3 Å²	93.3	0%	0	46%	0.456	C	S	.	.	H	α-helix	trans	-54	-41.8	180	174.5	-95.5	0	0	0	112.5	L298 L300 M304 E331 Y332 F333 I335 C342 I357	L298-F329 HydrophobicContact CD1-CD2 4.37Å; L298-F329 HydrophobicContact CD1-CE2 3.96Å; L300-F329 HydrophobicContact CD1-CD2 3.83Å; L300-F329 HydrophobicContact CD1-CE2 4.23Å; L300-F329 HydrophobicContact CD1-CG 4.26Å; L300-F329 HydrophobicContact CD2-CB 3.86Å; L300-F329 HydrophobicContact CD2-CD2 3.83Å; L300-F329 HydrophobicContact CD2-CG 4.2Å; L300-F329 HydrophobicContact CG-CD2 4.44Å; M304-F329 HydrophobicContact CB-CB 4.49Å; M304-F329 HydrophobicContact CE-CB 4.12Å; M304-F329 HydrophobicContact CE-CD1 3.71Å; M304-F329 HydrophobicContact CE-CE1 4.38Å; M304-F329 HydrophobicContact CE-CG 4.05Å; M304-F329 PolarHBondContact O-N 3.24Å; F329-E331 PolarHBondContact O-N 3.4Å; F329-Y332 PolarHBondContact O-N 2.98Å; F329-F333 HydrophobicContact CD1-CB 4.3Å; F329-F333 HydrophobicContact CD2-CB 3.95Å; F329-F333 AromaticContact CD2-CD2 3.77Å; F329-F333 HydrophobicContact CD2-CD2 3.77Å; F329-F333 HydrophobicContact CD2-CG 4.15Å; F329-F333 HydrophobicContact CE1-CB 3.92Å; F329-F333 HydrophobicContact CE2-CB 3.55Å; F329-F333 AromaticContact CE2-CD2 3.94Å; F329-F333 HydrophobicContact CE2-CD2 3.94Å; F329-F333 AromaticContact CE2-CG 3.87Å; F329-F333 HydrophobicContact CE2-CG 3.87Å; F329-F333 HydrophobicContact CG-CB 4.33Å; F329-F333 HydrophobicContact CG-CD2 4.48Å; F329-F333 HydrophobicContact CZ-CB 3.54Å; F329-F333 HydrophobicContact CZ-CG 4.34Å; F329-F333 WeakPolarHBondContact O-CB 3.14Å; F329-F333 PolarHBondContact O-N 3.34Å; F329-I335 HydrophobicContact CE1-CD1 4.28Å; F329-I335 HydrophobicContact CE1-CG1 3.88Å; F329-I335 HydrophobicContact CZ-CG1 3.99Å; F329-C342 WeakPolarHBondContact CD1-SG 3.22Å; F329-C342 VanDerWaalsContact CE1-SG 3.51Å; F329-I357 HydrophobicContact CE2-CD1 4.16Å; F329-I357 HydrophobicContact CE2-CG2 4.22Å; F329-I357 HydrophobicContact CZ-CD1 4.12Å; F329-I357 HydrophobicContact CZ-CG2 3.85Å
330	Q	88.1	Confident	74.1	Confident	117 Å²	117	84.4 Å²	84.4	55%	0.547	43%	0.425	S	S	.	.	H	α-helix	trans	-70.2	-16.4	-173.6	-157.5	170.5	10	0	0	113.8	T328 K360	T328-Q330 PolarHBondContact O-N 3.41Å; Q330-K360 PolarHBondContact O-NZ 2.73Å
331	E	85.3	Confident	75.6	Confident	98 Å²	98	81 Å²	81	46%	0.458	41%	0.41	S	S	.	.	H	α-helix	trans	-69	-44.7	174.4	-173	179.5	-177.8	0	0	111	T328 F329	T328-E331 WeakPolarHBondContact O-CB 3.44Å; T328-E331 PolarHBondContact O-N 3.07Å; F329-E331 PolarHBondContact O-N 3.4Å
332	Y	85.9	Confident	77.7	Confident	35 Å²	35	75.9 Å²	75.9	14%	0.137	38%	0.384	C	S	.	.	H	α-helix	trans	-99.2	-27.4	-173.6	-66.7	-84.6	0	0	0	113.6	L306 L317 F329 K360	L306-Y332 HydrophobicContact CD1-CD2 4.4Å; L317-Y332 HydrophobicContact CB-CD1 4.12Å; L317-Y332 HydrophobicContact CB-CE1 4.37Å; L317-Y332 HydrophobicContact CD2-CD1 3.95Å; L317-Y332 HydrophobicContact CG-CD1 4.49Å; F329-Y332 PolarHBondContact O-N 2.98Å; Y332-K360 PolarHBondContact O-N 2.82Å
333	F	90.9	Very high	79.6	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	153	-168.6	-57.5	-78.5	0	0	0	112.2	L298 L306 L317 F329 I357 R358 I359 K360	L298-F333 HydrophobicContact CD1-CD1 4.42Å; L298-F333 HydrophobicContact CD1-CD2 4.2Å; L298-F333 HydrophobicContact CD1-CE1 4.08Å; L298-F333 HydrophobicContact CD1-CE2 3.87Å; L298-F333 HydrophobicContact CD1-CG 4.45Å; L298-F333 HydrophobicContact CD1-CZ 3.78Å; L298-F333 HydrophobicContact CD2-CE2 3.87Å; L298-F333 HydrophobicContact CD2-CZ 3.63Å; L298-F333 HydrophobicContact CG-CZ 4.35Å; L306-F333 HydrophobicContact CD1-CD2 4.44Å; L306-F333 HydrophobicContact CD1-CE2 4.04Å; L306-F333 HydrophobicContact CD2-CE2 4.24Å; L317-F333 HydrophobicContact CD1-CE1 4.14Å; L317-F333 HydrophobicContact CD1-CE2 4.03Å; L317-F333 HydrophobicContact CD1-CZ 3.37Å; F329-F333 HydrophobicContact CD1-CB 4.3Å; F329-F333 HydrophobicContact CD2-CB 3.95Å; F329-F333 AromaticContact CD2-CD2 3.77Å; F329-F333 HydrophobicContact CD2-CD2 3.77Å; F329-F333 HydrophobicContact CD2-CG 4.15Å; F329-F333 HydrophobicContact CE1-CB 3.92Å; F329-F333 HydrophobicContact CE2-CB 3.55Å; F329-F333 AromaticContact CE2-CD2 3.94Å; F329-F333 HydrophobicContact CE2-CD2 3.94Å; F329-F333 AromaticContact CE2-CG 3.87Å; F329-F333 HydrophobicContact CE2-CG 3.87Å; F329-F333 HydrophobicContact CG-CB 4.33Å; F329-F333 HydrophobicContact CG-CD2 4.48Å; F329-F333 HydrophobicContact CZ-CB 3.54Å; F329-F333 HydrophobicContact CZ-CG 4.34Å; F329-F333 WeakPolarHBondContact O-CB 3.14Å; F329-F333 PolarHBondContact O-N 3.34Å; F333-I357 HydrophobicContact CB-CG2 3.63Å; F333-I357 HydrophobicContact CD1-CG2 3.71Å; F333-I357 HydrophobicContact CG-CG2 4Å; F333-R358 WeakPolarHBondContact CA-O 3.33Å; F333-I359 HydrophobicContact CD1-CG1 3.97Å; F333-I359 HydrophobicContact CE1-CD1 4.27Å; F333-I359 HydrophobicContact CE1-CG1 3.81Å; F333-K360 WeakPolarHBondContact O-CE 3.19Å
334	S	91.7	Very high	81.6	Confident	37 Å²	37	67.9 Å²	67.9	26%	0.259	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	134.7	166.8	51.5	0	0	0	0	109.7	V336 R358	S334-V336 PolarHBondContact O-N 3.09Å; S334-R358 PolarHBondContact N-O 3.38Å; S334-R358 PolarHBondContact O-N 3.32Å
335	I	92	Very high	83.2	Confident	23 Å²	23	56.6 Å²	56.6	12%	0.118	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	119.4	172.9	-56.6	176	0	0	0	107.5	F329 P338 I340 I347 F355 M379	F329-I335 HydrophobicContact CE1-CD1 4.28Å; F329-I335 HydrophobicContact CE1-CG1 3.88Å; F329-I335 HydrophobicContact CZ-CG1 3.99Å; I335-P338 WeakPolarHBondContact CG2-O 3.2Å; I335-I340 HydrophobicContact CD1-CD1 4.06Å; I335-I340 HydrophobicContact CD1-CG1 4.37Å; I335-I340 HydrophobicContact CG2-CG1 4.41Å; I335-I347 HydrophobicContact CD1-CD1 4.19Å; I335-I347 HydrophobicContact CD1-CG1 3.97Å; I335-F355 HydrophobicContact CG2-CD1 4.11Å; I335-M379 HydrophobicContact CD1-CE 4.25Å
336	V	90	Very high	84.7	Confident	46 Å²	46	47 Å²	47	28%	0.279	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-34.1	176.1	179.4	0	0	0	0	110.4	S334 Q339 I356 R358	S334-V336 PolarHBondContact O-N 3.09Å; V336-Q339 PolarHBondContact O-NE2 3.16Å; V336-I356 HydrophobicContact CB-CB 4.34Å; V336-I356 HydrophobicContact CB-CG2 4.14Å; V336-I356 PolarHBondContact N-O 2.8Å; V336-R358 HydrophobicContact CG2-CB 3.49Å; V336-R358 VanDerWaalsContact CG2-CB 3.49Å
337	S	88.6	Confident	86.3	Confident	26 Å²	26	42.4 Å²	42.4	18%	0.182	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	140.2	179.5	-163.2	0	0	0	0	109.7	K178 F355 I356	K178-S337 WeakPolarHBondContact CE-OG 3.36Å; K178-S337 PolarHBondContact NZ-OG 2.86Å; S337-F355 CarbonylContact O-C 3.58Å; S337-F355 VanDerWaalsContact O-CA 3.27Å; S337-F355 WeakPolarHBondContact O-CA 3.44Å; S337-I356 PolarHBondContact N-O 3.33Å; S337-I356 PolarHBondContact O-N 2.83Å
338	P	85	Confident	86.9	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.013	22%	0.219	C	C	.	.	S	Bend	cis	-67.7	165.3	-9.3	29.6	-31.7	0	0	0	112.9	I335 I340 M350 A353 F355	I335-P338 WeakPolarHBondContact CG2-O 3.2Å; P338-I340 HydrophobicContact CB-CG2 4.41Å; P338-I340 HydrophobicContact CG-CG1 4.46Å; P338-I340 HydrophobicContact CG-CG2 4.17Å; P338-I340 PolarHBondContact O-N 2.81Å; P338-M350 HydrophobicContact CB-CE 3.72Å; P338-M350 HydrophobicContact CB-CG 4.44Å; P338-M350 HydrophobicContact CG-CB 3.69Å; P338-M350 HydrophobicContact CG-CE 4Å; P338-M350 HydrophobicContact CG-CG 3.9Å; P338-A353 HydrophobicContact CG-CB 4.29Å; P338-F355 VanDerWaalsContact CD-CD1 3.48Å; P338-F355 HydrophobicContact CG-CD1 4.41Å; P338-F355 HydrophobicContact CG-CE1 3.96Å; P338-F355 HydrophobicContact CG-CZ 4.27Å
339	Q	81.9	Confident	86.8	Confident	117 Å²	117	39.2 Å²	39.2	55%	0.547	20%	0.201	S	C	.	.			trans	-77.1	86.3	178.3	-65.7	-65.9	-6.4	0	0	109.8	V336	V336-Q339 PolarHBondContact O-NE2 3.16Å
340	I	83.3	Confident	86.6	Confident	31 Å²	31	39.8 Å²	39.8	16%	0.159	20%	0.204	C	C	.	.			trans	-125.4	157.6	-179.5	55.4	162.1	0	0	0	111	I335 P338 C342 G346 I347 M350 F355	I335-I340 HydrophobicContact CD1-CD1 4.06Å; I335-I340 HydrophobicContact CD1-CG1 4.37Å; I335-I340 HydrophobicContact CG2-CG1 4.41Å; P338-I340 HydrophobicContact CB-CG2 4.41Å; P338-I340 HydrophobicContact CG-CG1 4.46Å; P338-I340 HydrophobicContact CG-CG2 4.17Å; P338-I340 PolarHBondContact O-N 2.81Å; I340-C342 PolarHBondContact O-N 2.92Å; I340-G346 WeakPolarHBondContact CD1-O 3.46Å; I340-I347 HydrophobicContact CD1-CB 4.45Å; I340-I347 HydrophobicContact CD1-CG1 3.94Å; I340-M350 HydrophobicContact CG2-CB 4.46Å; I340-M350 HydrophobicContact CG2-CG 3.64Å; I340-F355 HydrophobicContact CD1-CE1 3.86Å
341	K	83	Confident	86.5	Confident	146 Å²	146	35.5 Å²	35.5	64%	0.635	19%	0.185	S	C	*	.			trans	-62.1	131.6	165.4	-66.9	-175.8	-178.4	178.1	0	108.4	T343	K341-T343 HydrophobicContact CB-CG2 4.49Å; K341-T343 PolarHBondContact O-N 3.4Å
342	C	84.9	Confident	86.5	Confident	28 Å²	28	32 Å²	32	19%	0.189	17%	0.169	C	C	.	.	S	Bend	trans	-75.9	64.1	-177.9	-173.6	0	0	0	0	111.5	F329 I340	F329-C342 WeakPolarHBondContact CD1-SG 3.22Å; F329-C342 VanDerWaalsContact CE1-SG 3.51Å; I340-C342 PolarHBondContact O-N 2.92Å
343	T	88.7	Confident	86.4	Confident	66 Å²	66	30.4 Å²	30.4	41%	0.405	16%	0.163	S	C	.	.	S	Bend	trans	-125.5	158.5	177.1	63.8	0	0	0	0	109.6	K341 Q345 G346 I347	K341-T343 HydrophobicContact CB-CG2 4.49Å; K341-T343 PolarHBondContact O-N 3.4Å; T343-Q345 PolarHBondContact O-N 3.31Å; T343-G346 PolarHBondContact O-N 3.41Å; T343-G346 VanDerWaalsContact O-N 3.11Å; T343-G346 PolarHBondContact OG1-N 3Å; T343-I347 PolarHBondContact O-N 3.2Å
344	F	88.3	Confident	86.3	Confident	17 Å²	17	34.1 Å²	34.1	8%	0.075	18%	0.18	C	C	.	.	H	α-helix	trans	-52.9	-47.1	176.9	-172.5	-95.9	0	0	0	111.2	D301 Q302 M304 I347 L348 Y381 I388	D301-F344 VanDerWaalsContact O-CD2 3.22Å; D301-F344 WeakPolarHBondContact O-CD2 3.36Å; Q302-F344 HydrophobicContact CG-CD1 4.5Å; Q302-F344 HydrophobicContact CG-CE1 4.14Å; Q302-F344 HydrophobicContact CG-CE2 4.3Å; Q302-F344 HydrophobicContact CG-CZ 4.02Å; Q302-F344 WeakPolarHBondContact O-CB 3.38Å; M304-F344 HydrophobicContact SD-CB 4.26Å; M304-F344 PolarHBondContact SD-N 3.12Å; M304-F344 VanDerWaalsContact SD-N 3.43Å; F344-I347 PolarHBondContact O-N 2.95Å; F344-L348 HydrophobicContact CD1-CD1 3.94Å; F344-L348 HydrophobicContact CD1-CG 4.4Å; F344-L348 HydrophobicContact CE1-CD1 3.72Å; F344-L348 HydrophobicContact CE1-CG 4.32Å; F344-L348 WeakPolarHBondContact O-CG 3.45Å; F344-L348 PolarHBondContact O-N 3.12Å; F344-Y381 HydrophobicContact CE1-CE2 4.31Å; F344-Y381 HydrophobicContact CZ-CD2 4.23Å; F344-Y381 AromaticContact CZ-CE2 3.9Å; F344-Y381 HydrophobicContact CZ-CE2 3.9Å; F344-I388 HydrophobicContact CD1-CD1 4.45Å; F344-I388 HydrophobicContact CD2-CD1 3.37Å; F344-I388 HydrophobicContact CD2-CG1 3.99Å; F344-I388 HydrophobicContact CE1-CD1 4.48Å; F344-I388 HydrophobicContact CE2-CB 4.38Å; F344-I388 HydrophobicContact CE2-CD1 3.43Å; F344-I388 VanDerWaalsContact CE2-CD1 3.43Å; F344-I388 HydrophobicContact CE2-CG1 3.5Å; F344-I388 HydrophobicContact CG-CD1 3.94Å; F344-I388 HydrophobicContact CZ-CD1 4.01Å; F344-I388 HydrophobicContact CZ-CG1 3.98Å
345	Q	84.2	Confident	86.3	Confident	19 Å²	19	32.4 Å²	32.4	9%	0.089	17%	0.168	C	C	.	.	H	α-helix	trans	-64.6	-40.7	178.2	-172.4	51.3	51.6	0	0	113	T343 I347 L348 T349	T343-Q345 PolarHBondContact O-N 3.31Å; Q345-I347 VanDerWaalsContact C-N 3.27Å; Q345-I347 PolarHBondContact O-N 3.28Å; Q345-L348 PolarHBondContact O-N 3.21Å; Q345-T349 WeakPolarHBondContact O-CG2 3.36Å; Q345-T349 PolarHBondContact O-N 3.2Å
346	G	85.4	Confident	86.4	Confident	9 Å²	9	33.4 Å²	33.4	9%	0.093	17%	0.173	C	C	.	.	H	α-helix	trans	-64.8	-31.6	177.3	0	0	0	0	0	112.9	I340 T343 T349	I340-G346 WeakPolarHBondContact CD1-O 3.46Å; T343-G346 PolarHBondContact O-N 3.41Å; T343-G346 VanDerWaalsContact O-N 3.11Å; T343-G346 PolarHBondContact OG1-N 3Å; G346-T349 PolarHBondContact O-OG1 2.83Å
347	I	88.4	Confident	86.6	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-69.1	-43.9	174	-69.7	166.6	0	0	0	110.9	L300 M304 I335 I340 T343 F344 Q345 T349 M350 L351 F355 M379 I388	L300-I347 HydrophobicContact CD1-CD1 4.45Å; M304-I347 HydrophobicContact CE-CD1 3.71Å; M304-I347 HydrophobicContact SD-CD1 3.96Å; I335-I347 HydrophobicContact CD1-CD1 4.19Å; I335-I347 HydrophobicContact CD1-CG1 3.97Å; I340-I347 HydrophobicContact CD1-CB 4.45Å; I340-I347 HydrophobicContact CD1-CG1 3.94Å; T343-I347 PolarHBondContact O-N 3.2Å; F344-I347 PolarHBondContact O-N 2.95Å; Q345-I347 VanDerWaalsContact C-N 3.27Å; Q345-I347 PolarHBondContact O-N 3.28Å; I347-T349 PolarHBondContact O-N 3.28Å; I347-M350 CarbonylContact O-C 3.58Å; I347-M350 PolarHBondContact O-N 3.47Å; I347-L351 PolarHBondContact O-N 3.1Å; I347-F355 HydrophobicContact CG2-CE1 4.45Å; I347-F355 HydrophobicContact CG2-CZ 4.16Å; I347-M379 HydrophobicContact CB-SD 4.13Å; I347-M379 HydrophobicContact CD1-CE 4.27Å; I347-M379 HydrophobicContact CD1-SD 3.89Å; I347-M379 HydrophobicContact CG1-SD 3.88Å; I347-M379 HydrophobicContact CG2-CB 4.07Å; I347-M379 HydrophobicContact CG2-CG 4.27Å; I347-M379 HydrophobicContact CG2-SD 3.16Å; I347-M379 WeakPolarHBondContact CG2-SD 3.49Å; I347-I388 HydrophobicContact CB-CD1 4Å; I347-I388 HydrophobicContact CD1-CD1 4.42Å; I347-I388 HydrophobicContact CG2-CD1 3.73Å; I347-I388 HydrophobicContact CG2-CG2 4.16Å
348	L	85.4	Confident	86.7	Confident	5 Å²	5	34.1 Å²	34.1	3%	0.026	17%	0.167	C	C	.	.	H	α-helix	trans	-59.4	-32.7	-179	-69.5	-179.5	0	0	0	112.8	I251 L252 F344 Q345 M350 L351 Y381 I388	I251-L348 HydrophobicContact CG2-CD1 4.08Å; L252-L348 HydrophobicContact CD2-CB 4.26Å; L252-L348 HydrophobicContact CD2-CD1 4.25Å; F344-L348 HydrophobicContact CD1-CD1 3.94Å; F344-L348 HydrophobicContact CD1-CG 4.4Å; F344-L348 HydrophobicContact CE1-CD1 3.72Å; F344-L348 HydrophobicContact CE1-CG 4.32Å; F344-L348 WeakPolarHBondContact O-CG 3.45Å; F344-L348 PolarHBondContact O-N 3.12Å; Q345-L348 PolarHBondContact O-N 3.21Å; L348-M350 PolarHBondContact O-N 2.84Å; L348-L351 HydrophobicContact CD2-CD1 3.87Å; L348-L351 PolarHBondContact O-N 2.79Å; L348-Y381 HydrophobicContact CD2-CD2 3.81Å; L348-Y381 HydrophobicContact CD2-CG 4Å; L348-I388 HydrophobicContact CD2-CD1 4.2Å; L348-I388 HydrophobicContact CD2-CG1 4.37Å; L348-I388 HydrophobicContact CG-CD1 4.43Å
349	T	82.9	Confident	86.8	Confident	2 Å²	2	34.4 Å²	34.4	1%	0.012	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-19.3	179.1	64.4	0	0	0	0	113.3	S196 F212 Q257 Q345 G346 I347	S196-T349 WeakPolarHBondContact CB-O 3.1Å; S196-T349 PolarHBondContact OG-O 3.06Å; F212-T349 HydrophobicContact CD1-CG2 3.82Å; F212-T349 WeakPolarHBondContact CD2-O 3.2Å; F212-T349 HydrophobicContact CE1-CG2 3.91Å; F212-T349 HydrophobicContact CG-CG2 4.25Å; F212-T349 HydrophobicContact CZ-CG2 4.39Å; Q257-T349 PolarHBondContact OE1-OG1 3.37Å; Q345-T349 WeakPolarHBondContact O-CG2 3.36Å; Q345-T349 PolarHBondContact O-N 3.2Å; G346-T349 PolarHBondContact O-OG1 2.83Å; I347-T349 PolarHBondContact O-N 3.28Å
350	M	84.1	Confident	86.8	Confident	12 Å²	12	33.1 Å²	33.1	6%	0.059	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.3	25.5	-178.7	-63.5	-64	-80.6	0	0	112.9	E194 S196 P338 I340 I347 L348 N352 A353 F355	E194-M350 HydrophobicContact CB-CE 4.18Å; S196-M350 WeakPolarHBondContact CB-SD 3.35Å; P338-M350 HydrophobicContact CB-CE 3.72Å; P338-M350 HydrophobicContact CB-CG 4.44Å; P338-M350 HydrophobicContact CG-CB 3.69Å; P338-M350 HydrophobicContact CG-CE 4Å; P338-M350 HydrophobicContact CG-CG 3.9Å; I340-M350 HydrophobicContact CG2-CB 4.46Å; I340-M350 HydrophobicContact CG2-CG 3.64Å; I347-M350 CarbonylContact O-C 3.58Å; I347-M350 PolarHBondContact O-N 3.47Å; L348-M350 PolarHBondContact O-N 2.84Å; M350-N352 VanDerWaalsContact C-N 3.26Å; M350-N352 PolarHBondContact O-N 2.9Å; M350-A353 HydrophobicContact CB-CB 4.22Å; M350-A353 HydrophobicContact CE-CB 4.22Å; M350-A353 WeakPolarHBondContact O-CB 3.49Å; M350-A353 PolarHBondContact O-N 2.73Å; M350-F355 HydrophobicContact CB-CZ 3.99Å; M350-F355 WeakPolarHBondContact O-CE2 3.47Å; M350-F355 WeakPolarHBondContact O-CZ 3.48Å
351	L	86.6	Confident	86.2	Confident	27 Å²	27	37.6 Å²	37.6	14%	0.141	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-36.2	-172.3	-162.9	143.9	0	0	0	113.9	L198 I347 L348 A353 M379 Y381	L198-L351 HydrophobicContact CD1-CB 4.32Å; L198-L351 HydrophobicContact CD1-CD2 4.42Å; I347-L351 PolarHBondContact O-N 3.1Å; L348-L351 HydrophobicContact CD2-CD1 3.87Å; L348-L351 PolarHBondContact O-N 2.79Å; L351-A353 PolarHBondContact O-N 2.94Å; L351-M379 WeakPolarHBondContact CD2-O 3.5Å; L351-M379 WeakPolarHBondContact CG-O 3.35Å; L351-Y381 VanDerWaalsContact CD1-CB 3.48Å
352	N	84.5	Confident	84.9	Confident	24 Å²	24	32.9 Å²	32.9	13%	0.128	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-5.8	176.3	-72.8	-24.6	0	0	0	114.3	N171 N174 V175 V197 L198 M350	N171-N352 WeakPolarHBondContact CA-ND2 3.46Å; N171-N352 VanDerWaalsContact CG-ND2 3.34Å; N171-N352 PolarHBondContact OD1-ND2 3.16Å; N174-N352 HydrophobicContact CB-CB 4.29Å; V175-N352 WeakPolarHBondContact CG2-O 3.23Å; V197-N352 PolarHBondContact O-ND2 3.23Å; L198-N352 WeakPolarHBondContact CA-ND2 3.36Å; L198-N352 WeakPolarHBondContact CD1-ND2 3.47Å; M350-N352 VanDerWaalsContact C-N 3.26Å; M350-N352 PolarHBondContact O-N 2.9Å
353	A	85.3	Confident	83.3	Confident	2 Å²	2	35 Å²	35	2%	0.017	19%	0.186	C	C	.	.	S	Bend	trans	-81.2	154.6	175.4	0	0	0	0	0	111	P338 M350 L351 F355	P338-A353 HydrophobicContact CG-CB 4.29Å; M350-A353 HydrophobicContact CB-CB 4.22Å; M350-A353 HydrophobicContact CE-CB 4.22Å; M350-A353 WeakPolarHBondContact O-CB 3.49Å; M350-A353 PolarHBondContact O-N 2.73Å; L351-A353 PolarHBondContact O-N 2.94Å; A353-F355 WeakPolarHBondContact O-CD2 3.38Å; A353-F355 WeakPolarHBondContact O-CE2 3.47Å
354	Q	88.1	Confident	81.4	Confident	78 Å²	78	37.7 Å²	37.7	36%	0.364	20%	0.204	S	C	.	.	P	Polyproline II helix	trans	-78.3	126.5	166.9	-175.4	166.1	54.6	0	0	110.1	K178 K376	K178-Q354 PolarHBondContact NZ-O 3.09Å; Q354-K376 HydrophobicContact CG-CG 3.95Å
355	F	92.1	Very high	79.6	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	139.2	179.5	-72.8	-97.5	0	0	0	111.1	I335 S337 P338 I340 I347 M350 A353 K376 G377 M379 F390	I335-F355 HydrophobicContact CG2-CD1 4.11Å; S337-F355 CarbonylContact O-C 3.58Å; S337-F355 VanDerWaalsContact O-CA 3.27Å; S337-F355 WeakPolarHBondContact O-CA 3.44Å; P338-F355 VanDerWaalsContact CD-CD1 3.48Å; P338-F355 HydrophobicContact CG-CD1 4.41Å; P338-F355 HydrophobicContact CG-CE1 3.96Å; P338-F355 HydrophobicContact CG-CZ 4.27Å; I340-F355 HydrophobicContact CD1-CE1 3.86Å; I347-F355 HydrophobicContact CG2-CE1 4.45Å; I347-F355 HydrophobicContact CG2-CZ 4.16Å; M350-F355 HydrophobicContact CB-CZ 3.99Å; M350-F355 WeakPolarHBondContact O-CE2 3.47Å; M350-F355 WeakPolarHBondContact O-CZ 3.48Å; A353-F355 WeakPolarHBondContact O-CD2 3.38Å; A353-F355 WeakPolarHBondContact O-CE2 3.47Å; F355-K376 WeakPolarHBondContact O-CA 3.36Å; F355-G377 PolarHBondContact N-O 3.07Å; F355-G377 PolarHBondContact O-N 3.11Å; F355-M379 HydrophobicContact CB-CE 4.27Å; F355-M379 HydrophobicContact CB-CG 4.4Å; F355-M379 HydrophobicContact CD1-CE 3.67Å; F355-M379 HydrophobicContact CD1-CG 4.28Å; F355-M379 HydrophobicContact CD1-SD 3.66Å; F355-M379 HydrophobicContact CD2-CB 3.99Å; F355-M379 HydrophobicContact CD2-CG 3.72Å; F355-M379 HydrophobicContact CD2-SD 4.1Å; F355-M379 HydrophobicContact CE1-CE 4.19Å; F355-M379 HydrophobicContact CE1-SD 3.68Å; F355-M379 HydrophobicContact CE2-CB 3.91Å; F355-M379 HydrophobicContact CE2-CG 4.01Å; F355-M379 HydrophobicContact CE2-SD 4.12Å; F355-M379 HydrophobicContact CG-CE 3.98Å; F355-M379 HydrophobicContact CG-CG 3.87Å; F355-M379 HydrophobicContact CG-SD 3.88Å; F355-M379 HydrophobicContact CZ-CB 4.48Å; F355-M379 HydrophobicContact CZ-CG 4.41Å; F355-M379 HydrophobicContact CZ-SD 3.91Å; F355-F390 HydrophobicContact CB-CE2 4.23Å
356	I	93.5	Very high	77.9	Confident	44 Å²	44	44.1 Å²	44.1	23%	0.226	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	118.3	166.4	-58.7	177.3	0	0	0	107.2	V336 S337 D374 L375 K376	V336-I356 HydrophobicContact CB-CB 4.34Å; V336-I356 HydrophobicContact CB-CG2 4.14Å; V336-I356 PolarHBondContact N-O 2.8Å; S337-I356 PolarHBondContact N-O 3.33Å; S337-I356 PolarHBondContact O-N 2.83Å; I356-D374 HydrophobicContact CG2-CB 4.02Å; I356-L375 CarbonylContact C-O 3.5Å; I356-L375 WeakPolarHBondContact CA-O 3.44Å; I356-K376 HydrophobicContact CG1-CB 4.38Å; I356-K376 HydrophobicContact CG1-CG 4.33Å
357	I	93.9	Very high	76.1	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	124.4	179.9	-53.5	177.4	0	0	0	108.3	L298 F329 F333 L375 M379 F390	L298-I357 HydrophobicContact CD1-CD1 4.46Å; F329-I357 HydrophobicContact CE2-CD1 4.16Å; F329-I357 HydrophobicContact CE2-CG2 4.22Å; F329-I357 HydrophobicContact CZ-CD1 4.12Å; F329-I357 HydrophobicContact CZ-CG2 3.85Å; F333-I357 HydrophobicContact CB-CG2 3.63Å; F333-I357 HydrophobicContact CD1-CG2 3.71Å; F333-I357 HydrophobicContact CG-CG2 4Å; I357-L375 PolarHBondContact N-O 2.71Å; I357-L375 PolarHBondContact O-N 3.29Å; I357-M379 HydrophobicContact CD1-CE 3.51Å; I357-M379 HydrophobicContact CG1-CE 4.12Å; I357-F390 HydrophobicContact CD1-CD1 3.92Å; I357-F390 HydrophobicContact CD1-CD2 3.51Å; I357-F390 HydrophobicContact CD1-CE1 3.91Å; I357-F390 HydrophobicContact CD1-CE2 3.49Å; I357-F390 VanDerWaalsContact CD1-CE2 3.49Å; I357-F390 HydrophobicContact CD1-CG 3.71Å; I357-F390 HydrophobicContact CD1-CZ 3.68Å; I357-F390 HydrophobicContact CG1-CD2 4.45Å; I357-F390 HydrophobicContact CG1-CE2 3.99Å; I357-F390 HydrophobicContact CG1-CZ 4.11Å
358	R	91.3	Very high	73.9	Confident	88 Å²	88	57.8 Å²	57.8	33%	0.332	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	136.5	174.9	178	164.8	-67.4	167.6	4.3	110.8	F333 S334 V336 L372 D374	F333-R358 WeakPolarHBondContact CA-O 3.33Å; S334-R358 PolarHBondContact N-O 3.38Å; S334-R358 PolarHBondContact O-N 3.32Å; V336-R358 HydrophobicContact CG2-CB 3.49Å; V336-R358 VanDerWaalsContact CG2-CB 3.49Å; R358-L372 HydrophobicContact CG-CB 4.12Å; R358-L372 HydrophobicContact CG-CD1 4.45Å; R358-D374 WeakPolarHBondContact CA-OD1 3.41Å; R358-D374 WeakPolarHBondContact CB-OD1 3.46Å; R358-D374 VanDerWaalsContact CG-OD1 3.28Å; R358-D374 WeakPolarHBondContact CG-OD1 3.4Å; R358-D374 IonicContact CZ-OD1 2.74Å; R358-D374 IonicContact CZ-OD2 3.39Å; R358-D374 IonicContact NE-OD1 2.66Å; R358-D374 PolarHBondContact NE-OD1 3.34Å; R358-D374 IonicContact NE-OD2 3.54Å; R358-D374 IonicContact NH2-OD1 3.62Å; R358-D374 PolarHBondContact NH2-OD1 2.97Å; R358-D374 IonicContact NH2-OD2 3.26Å; R358-D374 PolarHBondContact NH2-OD2 3.13Å
359	I	88.3	Confident	72.1	Confident	7 Å²	7	63.5 Å²	63.5	4%	0.036	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	123.4	172.3	-57.2	-176.7	0	0	0	108.9	L313 L317 F333 H361 L372 M373 L375	L313-I359 HydrophobicContact CD2-CD1 3.77Å; L317-I359 HydrophobicContact CD2-CG2 3.56Å; F333-I359 HydrophobicContact CD1-CG1 3.97Å; F333-I359 HydrophobicContact CE1-CD1 4.27Å; F333-I359 HydrophobicContact CE1-CG1 3.81Å; I359-H361 WeakPolarHBondContact CG2-O 3.39Å; I359-L372 WeakPolarHBondContact O-CD2 3.06Å; I359-M373 HydrophobicContact CD1-CB 4.44Å; I359-M373 HydrophobicContact CD1-CE 3.26Å; I359-M373 PolarHBondContact N-O 3.25Å; I359-L375 HydrophobicContact CD1-CD1 4.28Å; I359-L375 HydrophobicContact CG1-CD1 4.48Å
360	K	81.4	Confident	70.8	Confident	91 Å²	91	65.6 Å²	65.6	40%	0.396	39%	0.386	S	S	.	.	S	Bend	trans	-75	-25.9	-175.8	-68.8	-177.9	175.8	179.4	0	114	Q330 Y332 F333	Q330-K360 PolarHBondContact O-NZ 2.73Å; Y332-K360 PolarHBondContact O-N 2.82Å; F333-K360 WeakPolarHBondContact O-CE 3.19Å
361	H	70.3	Confident	69.8	Low	124 Å²	124	71 Å²	71	57%	0.574	41%	0.409	S	S	*	.	S	Bend	trans	-107.4	106.3	179.6	-71.5	-7.5	0	0	0	109.9	I359	I359-H361 WeakPolarHBondContact CG2-O 3.39Å
362	G	55.5	Low	69.3	Low	48 Å²	48	73.2 Å²	73.2	50%	0.495	42%	0.421	S	S	.	.			trans	-74.1	154.9	174.1	0	0	0	0	0	111.9
363	V	50.8	Low	69.4	Low	73 Å²	73	72.8 Å²	72.8	44%	0.442	42%	0.418	S	S	.	.			trans	-61.9	127.4	165.3	179.9	0	0	0	0	107.3	T365	V363-T365 PolarHBondContact O-N 3.4Å
364	P	49.8	Very low	69.7	Low	121 Å²	121	74.3 Å²	74.3	79%	0.786	43%	0.426	S	S	*	.			trans	-68.8	99.7	173.2	26.1	-29.8	0	0	0	108.5
365	T	49.1	Very low	69.9	Low	61 Å²	61	70.6 Å²	70.6	37%	0.374	41%	0.408	S	S	.	.			trans	-84.8	148.1	166.1	47.1	0	0	0	0	109.1	V363 D367	V363-T365 PolarHBondContact O-N 3.4Å; T365-D367 PolarHBondContact O-N 2.88Å; T365-D367 PolarHBondContact OG1-O 3.34Å; T365-D367 VanDerWaalsContact OG1-O 3.06Å
366	A	50.2	Low	70	Confident	111 Å²	111	75.2 Å²	75.2	92%	0.917	43%	0.429	S	S	*	.	S	Bend	trans	-58	-21	-178.4	0	0	0	0	0	113.6
367	D	45.7	Very low	70	Confident	122 Å²	122	73.5 Å²	73.5	65%	0.652	42%	0.422	S	S	*	.	S	Bend	trans	-100.6	121.4	170.6	-64.9	-33.1	0	0	0	109.9	T365 T369	T365-D367 PolarHBondContact O-N 2.88Å; T365-D367 PolarHBondContact OG1-O 3.34Å; T365-D367 VanDerWaalsContact OG1-O 3.06Å; D367-T369 PolarHBondContact O-N 3.01Å
368	N	43.8	Very low	69.9	Low	174 Å²	174	78.9 Å²	78.9	93%	0.93	45%	0.447	S	S	*	.	S	Bend	trans	-66.2	26.6	-176.9	-97.7	-14.8	0	0	0	115.1
369	T	48.1	Very low	70	Confident	125 Å²	125	74.8 Å²	74.8	77%	0.767	43%	0.432	S	S	*	.			trans	-111	26.1	178.6	47.3	0	0	0	0	112.6	D367 K371	D367-T369 PolarHBondContact O-N 3.01Å; T369-K371 PolarHBondContact O-N 3.36Å
370	G	53.9	Low	70.1	Confident	45 Å²	45	77.5 Å²	77.5	46%	0.464	45%	0.446	S	S	.	.			trans	-57.7	103.5	-176.5	0	0	0	0	0	113	L372	G370-L372 PolarHBondContact O-N 2.79Å
371	K	64	Low	70.4	Confident	125 Å²	125	75.3 Å²	75.3	54%	0.543	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-59	119.3	171.3	-173.5	179	177.2	-177	0	108.3	T369 E401	T369-K371 PolarHBondContact O-N 3.36Å; K371-E401 IonicContact NZ-OE2 2.76Å; K371-E401 PolarHBondContact NZ-OE2 3.47Å
372	L	76.6	Confident	71.2	Confident	75 Å²	75	71.5 Å²	71.5	39%	0.393	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-58.3	139.9	174.4	-66.5	166.9	0	0	0	109.3	R358 I359 G370	R358-L372 HydrophobicContact CG-CB 4.12Å; R358-L372 HydrophobicContact CG-CD1 4.45Å; I359-L372 WeakPolarHBondContact O-CD2 3.06Å; G370-L372 PolarHBondContact O-N 2.79Å
373	M	85.1	Confident	72.4	Confident	15 Å²	15	72.9 Å²	72.9	7%	0.074	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-86.1	123.8	-178.1	-170.2	171.7	79	0	0	110	F296 L313 R316 I359 L375 C405 L407	F296-M373 HydrophobicContact CE1-CE 4.43Å; L313-M373 HydrophobicContact CD2-CE 4.1Å; R316-M373 PolarHBondContact NH1-SD 3.1Å; R316-M373 VanDerWaalsContact NH1-SD 3.45Å; I359-M373 HydrophobicContact CD1-CB 4.44Å; I359-M373 HydrophobicContact CD1-CE 3.26Å; I359-M373 PolarHBondContact N-O 3.25Å; M373-L375 HydrophobicContact CE-CD2 3.94Å; M373-C405 HydrophobicContact SD-CB 4.43Å; M373-L407 HydrophobicContact SD-CD1 3.61Å; M373-L407 HydrophobicContact SD-CG 4.14Å
374	D	91.5	Very high	74	Confident	33 Å²	33	77 Å²	77	18%	0.176	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	139.3	173.2	-67.5	-16.9	0	0	0	109.6	I356 R358 P394 C395	I356-D374 HydrophobicContact CG2-CB 4.02Å; R358-D374 WeakPolarHBondContact CA-OD1 3.41Å; R358-D374 WeakPolarHBondContact CB-OD1 3.46Å; R358-D374 VanDerWaalsContact CG-OD1 3.28Å; R358-D374 WeakPolarHBondContact CG-OD1 3.4Å; R358-D374 IonicContact CZ-OD1 2.74Å; R358-D374 IonicContact CZ-OD2 3.39Å; R358-D374 IonicContact NE-OD1 2.66Å; R358-D374 PolarHBondContact NE-OD1 3.34Å; R358-D374 IonicContact NE-OD2 3.54Å; R358-D374 IonicContact NH2-OD1 3.62Å; R358-D374 PolarHBondContact NH2-OD1 2.97Å; R358-D374 IonicContact NH2-OD2 3.26Å; R358-D374 PolarHBondContact NH2-OD2 3.13Å; D374-P394 WeakPolarHBondContact O-CA 3.27Å; D374-C395 HydrophobicContact CB-CB 4.03Å; D374-C395 PolarHBondContact O-N 3.13Å; D374-C395 PolarHBondContact O-SG 3.4Å
375	L	93	Very high	75.6	Confident	0 Å²	0	75.4 Å²	75.4	0%	0	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	124.7	174.2	-58.1	173.7	0	0	0	108.3	F296 L313 I356 I357 I359 M373 F390 S393 P394	F296-L375 HydrophobicContact CB-CD2 4.39Å; F296-L375 HydrophobicContact CD1-CD2 4.05Å; F296-L375 HydrophobicContact CG-CD2 4.43Å; L313-L375 HydrophobicContact CD1-CD1 3.95Å; L313-L375 HydrophobicContact CD2-CD1 3.67Å; L313-L375 HydrophobicContact CD2-CD2 4.4Å; L313-L375 HydrophobicContact CG-CD1 4.44Å; I356-L375 CarbonylContact C-O 3.5Å; I356-L375 WeakPolarHBondContact CA-O 3.44Å; I357-L375 PolarHBondContact N-O 2.71Å; I357-L375 PolarHBondContact O-N 3.29Å; I359-L375 HydrophobicContact CD1-CD1 4.28Å; I359-L375 HydrophobicContact CG1-CD1 4.48Å; M373-L375 HydrophobicContact CE-CD2 3.94Å; L375-F390 HydrophobicContact CB-CE1 4.03Å; L375-F390 HydrophobicContact CB-CZ 3.99Å; L375-F390 HydrophobicContact CD1-CE1 4.23Å; L375-S393 CarbonylContact C-O 3.54Å; L375-S393 WeakPolarHBondContact CA-O 3.33Å; L375-P394 HydrophobicContact CD2-CB 4.49Å; L375-P394 HydrophobicContact CD2-CG 4.22Å
376	K	94.1	Very high	77.4	Confident	97 Å²	97	75 Å²	75	42%	0.422	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	128.7	176.9	177.9	175.5	-176.8	-179.2	0	109.5	Q354 F355 I356 G392 S393 C395	Q354-K376 HydrophobicContact CG-CG 3.95Å; F355-K376 WeakPolarHBondContact O-CA 3.36Å; I356-K376 HydrophobicContact CG1-CB 4.38Å; I356-K376 HydrophobicContact CG1-CG 4.33Å; K376-G392 CarbonylContact O-C 3.57Å; K376-G392 WeakPolarHBondContact O-CA 3.4Å; K376-S393 PolarHBondContact N-O 3.45Å; K376-S393 PolarHBondContact O-N 2.73Å; K376-C395 WeakPolarHBondContact CB-SG 3.37Å
377	G	93.1	Very high	79.4	Confident	8 Å²	8	70 Å²	70	8%	0.082	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.7	-171.7	-171	0	0	0	0	0	114	F355 L391	F355-G377 PolarHBondContact N-O 3.07Å; F355-G377 PolarHBondContact O-N 3.11Å; G377-L391 CarbonylContact C-O 3.56Å; G377-L391 WeakPolarHBondContact CA-O 3.4Å
378	Q	92.3	Very high	81.6	Confident	113 Å²	113	64.2 Å²	64.2	53%	0.528	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	148.6	175.5	-71.7	178.1	-28.1	0	0	109.7	F390 L391	Q378-F390 WeakPolarHBondContact O-CA 3.5Å; Q378-F390 WeakPolarHBondContact O-CD2 3.36Å; Q378-L391 PolarHBondContact N-O 2.83Å; Q378-L391 PolarHBondContact O-N 2.97Å
379	M	92.5	Very high	84.1	Confident	2 Å²	2	57 Å²	57	1%	0.01	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	133.5	169.5	-68.3	-172.4	178.4	0	0	108.1	I335 I347 L351 F355 I357 I388 L389 F390	I335-M379 HydrophobicContact CD1-CE 4.25Å; I347-M379 HydrophobicContact CB-SD 4.13Å; I347-M379 HydrophobicContact CD1-CE 4.27Å; I347-M379 HydrophobicContact CD1-SD 3.89Å; I347-M379 HydrophobicContact CG1-SD 3.88Å; I347-M379 HydrophobicContact CG2-CB 4.07Å; I347-M379 HydrophobicContact CG2-CG 4.27Å; I347-M379 HydrophobicContact CG2-SD 3.16Å; I347-M379 WeakPolarHBondContact CG2-SD 3.49Å; L351-M379 WeakPolarHBondContact CD2-O 3.5Å; L351-M379 WeakPolarHBondContact CG-O 3.35Å; F355-M379 HydrophobicContact CB-CE 4.27Å; F355-M379 HydrophobicContact CB-CG 4.4Å; F355-M379 HydrophobicContact CD1-CE 3.67Å; F355-M379 HydrophobicContact CD1-CG 4.28Å; F355-M379 HydrophobicContact CD1-SD 3.66Å; F355-M379 HydrophobicContact CD2-CB 3.99Å; F355-M379 HydrophobicContact CD2-CG 3.72Å; F355-M379 HydrophobicContact CD2-SD 4.1Å; F355-M379 HydrophobicContact CE1-CE 4.19Å; F355-M379 HydrophobicContact CE1-SD 3.68Å; F355-M379 HydrophobicContact CE2-CB 3.91Å; F355-M379 HydrophobicContact CE2-CG 4.01Å; F355-M379 HydrophobicContact CE2-SD 4.12Å; F355-M379 HydrophobicContact CG-CE 3.98Å; F355-M379 HydrophobicContact CG-CG 3.87Å; F355-M379 HydrophobicContact CG-SD 3.88Å; F355-M379 HydrophobicContact CZ-CB 4.48Å; F355-M379 HydrophobicContact CZ-CG 4.41Å; F355-M379 HydrophobicContact CZ-SD 3.91Å; I357-M379 HydrophobicContact CD1-CE 3.51Å; I357-M379 HydrophobicContact CG1-CE 4.12Å; M379-I388 HydrophobicContact CB-CG2 3.86Å; M379-I388 HydrophobicContact CG-CG2 4.25Å; M379-I388 HydrophobicContact SD-CG2 4.32Å; M379-L389 CarbonylContact C-O 3.59Å; M379-L389 WeakPolarHBondContact CA-O 3.36Å; M379-F390 HydrophobicContact CE-CD2 4.26Å; M379-F390 HydrophobicContact CG-CB 4.34Å; M379-F390 HydrophobicContact CG-CD2 3.87Å
380	I	90.9	Very high	86.4	Confident	65 Å²	65	51.1 Å²	51.1	33%	0.333	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	126.6	-174.5	-56.1	173	0	0	0	107.3	I388 L389 L391	I380-I388 CarbonylContact O-C 3.17Å; I380-I388 WeakPolarHBondContact O-CA 3.43Å; I380-L389 PolarHBondContact N-O 3.42Å; I380-L389 PolarHBondContact O-N 3.19Å; I380-L391 HydrophobicContact CD1-CD1 4.02Å
381	Y	88.1	Confident	88.3	Confident	45 Å²	45	51.3 Å²	51.3	18%	0.176	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	124.9	175.5	177.2	-114.1	0	0	0	109.6	I251 F344 L348 L351 N386 I388	I251-Y381 HydrophobicContact CD1-CE1 4.16Å; I251-Y381 HydrophobicContact CG2-CE1 4.26Å; F344-Y381 HydrophobicContact CE1-CE2 4.31Å; F344-Y381 HydrophobicContact CZ-CD2 4.23Å; F344-Y381 AromaticContact CZ-CE2 3.9Å; F344-Y381 HydrophobicContact CZ-CE2 3.9Å; L348-Y381 HydrophobicContact CD2-CD2 3.81Å; L348-Y381 HydrophobicContact CD2-CG 4Å; L351-Y381 VanDerWaalsContact CD1-CB 3.48Å; Y381-N386 PolarHBondContact OH-OD1 3.42Å; Y381-I388 HydrophobicContact CD2-CG1 4.44Å
382	V	87.5	Confident	89.7	Confident	43 Å²	43	46 Å²	46	26%	0.261	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	100.3	178.5	-176.7	0	0	0	0	107.6	E384 S385 N386 A387 L389	V382-E384 VanDerWaalsContact C-N 3.29Å; V382-E384 WeakPolarHBondContact CG1-OE2 3.21Å; V382-E384 PolarHBondContact O-N 2.89Å; V382-S385 PolarHBondContact O-N 3.35Å; V382-N386 WeakPolarHBondContact O-CA 3.37Å; V382-N386 PolarHBondContact O-N 3.32Å; V382-A387 PolarHBondContact N-O 3.16Å; V382-A387 PolarHBondContact O-N 3.25Å; V382-L389 HydrophobicContact CG2-CB 4.19Å
383	S	81	Confident	90.5	Very high	78 Å²	78	43.8 Å²	43.8	55%	0.545	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-35.3	-172.7	63.9	0	0	0	0	113.3	S385 N386	S383-S385 VanDerWaalsContact C-N 3.34Å; S383-S385 PolarHBondContact O-N 3.31Å; S383-N386 PolarHBondContact O-N 2.88Å
384	E	82.8	Confident	90.9	Very high	159 Å²	159	43.2 Å²	43.2	74%	0.743	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-33.1	-175.7	-55.7	90.5	154.3	0	0	112.5	V382	V382-E384 VanDerWaalsContact C-N 3.29Å; V382-E384 WeakPolarHBondContact CG1-OE2 3.21Å; V382-E384 PolarHBondContact O-N 2.89Å
385	S	84.4	Confident	90.9	Very high	88 Å²	88	43.8 Å²	43.8	62%	0.615	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104	-3.2	178.9	-58.6	0	0	0	0	112.8	V382 S383 A387	V382-S385 PolarHBondContact O-N 3.35Å; S383-S385 VanDerWaalsContact C-N 3.34Å; S383-S385 PolarHBondContact O-N 3.31Å; S385-A387 PolarHBondContact O-N 2.89Å
386	N	87.1	Confident	90.6	Very high	53 Å²	53	44 Å²	44	28%	0.283	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.6	45.9	-174.1	-164.2	18.7	0	0	0	112.6	Q302 Y381 V382 S383	Q302-N386 PolarHBondContact NE2-ND2 3.26Å; Q302-N386 PolarHBondContact NE2-OD1 2.89Å; Q302-N386 PolarHBondContact OE1-ND2 2.67Å; Y381-N386 PolarHBondContact OH-OD1 3.42Å; V382-N386 WeakPolarHBondContact O-CA 3.37Å; V382-N386 PolarHBondContact O-N 3.32Å; S383-N386 PolarHBondContact O-N 2.88Å
387	A	91.3	Very high	90.2	Very high	6 Å²	6	44.6 Å²	44.6	5%	0.05	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	159.1	-171	0	0	0	0	0	110.8	I299 L300 V382 S385	I299-A387 HydrophobicContact CG2-CB 3.98Å; L300-A387 CarbonylContact O-C 3.54Å; L300-A387 WeakPolarHBondContact O-CA 3.23Å; L300-A387 VanDerWaalsContact O-CB 3.26Å; L300-A387 WeakPolarHBondContact O-CB 3.49Å; V382-A387 PolarHBondContact N-O 3.16Å; V382-A387 PolarHBondContact O-N 3.25Å; S385-A387 PolarHBondContact O-N 2.89Å
388	I	93.4	Very high	89.8	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	119	175.1	-64.7	165.9	0	0	0	109	I299 L300 F344 I347 L348 M379 I380 Y381	I299-I388 WeakPolarHBondContact CA-O 3.43Å; L300-I388 HydrophobicContact CB-CB 4.4Å; L300-I388 PolarHBondContact N-O 3.39Å; L300-I388 PolarHBondContact O-N 3.49Å; F344-I388 HydrophobicContact CD1-CD1 4.45Å; F344-I388 HydrophobicContact CD2-CD1 3.37Å; F344-I388 HydrophobicContact CD2-CG1 3.99Å; F344-I388 HydrophobicContact CE1-CD1 4.48Å; F344-I388 HydrophobicContact CE2-CB 4.38Å; F344-I388 HydrophobicContact CE2-CD1 3.43Å; F344-I388 VanDerWaalsContact CE2-CD1 3.43Å; F344-I388 HydrophobicContact CE2-CG1 3.5Å; F344-I388 HydrophobicContact CG-CD1 3.94Å; F344-I388 HydrophobicContact CZ-CD1 4.01Å; F344-I388 HydrophobicContact CZ-CG1 3.98Å; I347-I388 HydrophobicContact CB-CD1 4Å; I347-I388 HydrophobicContact CD1-CD1 4.42Å; I347-I388 HydrophobicContact CG2-CD1 3.73Å; I347-I388 HydrophobicContact CG2-CG2 4.16Å; L348-I388 HydrophobicContact CD2-CD1 4.2Å; L348-I388 HydrophobicContact CD2-CG1 4.37Å; L348-I388 HydrophobicContact CG-CD1 4.43Å; M379-I388 HydrophobicContact CB-CG2 3.86Å; M379-I388 HydrophobicContact CG-CG2 4.25Å; M379-I388 HydrophobicContact SD-CG2 4.32Å; I380-I388 CarbonylContact O-C 3.17Å; I380-I388 WeakPolarHBondContact O-CA 3.43Å; Y381-I388 HydrophobicContact CD2-CG1 4.44Å
389	L	94.9	Very high	89.5	Confident	22 Å²	22	47.8 Å²	47.8	12%	0.115	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	118.5	171.7	171.1	67.2	0	0	0	109.4	F290 H297 L298 I299 M379 I380 V382 L391	F290-L389 HydrophobicContact CE1-CD1 4.16Å; F290-L389 HydrophobicContact CZ-CD1 4.16Å; F290-L389 HydrophobicContact CZ-CD2 4.15Å; H297-L389 HydrophobicContact CB-CD1 4.38Å; L298-L389 CarbonylContact O-C 3.47Å; L298-L389 WeakPolarHBondContact O-CA 3.43Å; I299-L389 HydrophobicContact CD1-CD1 4.24Å; I299-L389 HydrophobicContact CG1-CD1 3.69Å; M379-L389 CarbonylContact C-O 3.59Å; M379-L389 WeakPolarHBondContact CA-O 3.36Å; I380-L389 PolarHBondContact N-O 3.42Å; I380-L389 PolarHBondContact O-N 3.19Å; V382-L389 HydrophobicContact CG2-CB 4.19Å; L389-L391 HydrophobicContact CD1-CD2 3.98Å; L389-L391 HydrophobicContact CD1-CG 4.35Å; L389-L391 HydrophobicContact CD2-CD1 4.14Å; L389-L391 HydrophobicContact CD2-CD2 4.19Å; L389-L391 HydrophobicContact CD2-CG 4.01Å; L389-L391 HydrophobicContact CG-CD2 4.17Å; L389-L391 HydrophobicContact CG-CG 3.99Å
390	F	95.9	Very high	89.2	Confident	1 Å²	1	52 Å²	52	0%	0.004	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	123.8	165.9	174.1	-102.3	0	0	0	110	H297 L298 F355 I357 L375 Q378 M379	H297-F390 CarbonylContact C-O 3.3Å; H297-F390 WeakPolarHBondContact CA-O 3.45Å; H297-F390 WeakPolarHBondContact CB-O 3.41Å; L298-F390 HydrophobicContact CB-CB 4.14Å; L298-F390 HydrophobicContact CD1-CD1 4.19Å; L298-F390 HydrophobicContact CG-CD1 4.25Å; L298-F390 PolarHBondContact N-O 2.96Å; L298-F390 PolarHBondContact O-N 3.34Å; F355-F390 HydrophobicContact CB-CE2 4.23Å; I357-F390 HydrophobicContact CD1-CD1 3.92Å; I357-F390 HydrophobicContact CD1-CD2 3.51Å; I357-F390 HydrophobicContact CD1-CE1 3.91Å; I357-F390 HydrophobicContact CD1-CE2 3.49Å; I357-F390 VanDerWaalsContact CD1-CE2 3.49Å; I357-F390 HydrophobicContact CD1-CG 3.71Å; I357-F390 HydrophobicContact CD1-CZ 3.68Å; I357-F390 HydrophobicContact CG1-CD2 4.45Å; I357-F390 HydrophobicContact CG1-CE2 3.99Å; I357-F390 HydrophobicContact CG1-CZ 4.11Å; L375-F390 HydrophobicContact CB-CE1 4.03Å; L375-F390 HydrophobicContact CB-CZ 3.99Å; L375-F390 HydrophobicContact CD1-CE1 4.23Å; Q378-F390 WeakPolarHBondContact O-CA 3.5Å; Q378-F390 WeakPolarHBondContact O-CD2 3.36Å; M379-F390 HydrophobicContact CE-CD2 4.26Å; M379-F390 HydrophobicContact CG-CB 4.34Å; M379-F390 HydrophobicContact CG-CD2 3.87Å
391	L	95.1	Very high	88.9	Confident	50 Å²	50	51.4 Å²	51.4	26%	0.262	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	116.4	169	-66.4	-179.6	0	0	0	108.8	F290 F294 H297 G377 Q378 I380 L389	F290-L391 HydrophobicContact CZ-CD2 4.17Å; F294-L391 HydrophobicContact CB-CD2 4.35Å; F294-L391 HydrophobicContact CG-CD2 4.27Å; H297-L391 HydrophobicContact CB-CD2 3.73Å; G377-L391 CarbonylContact C-O 3.56Å; G377-L391 WeakPolarHBondContact CA-O 3.4Å; Q378-L391 PolarHBondContact N-O 2.83Å; Q378-L391 PolarHBondContact O-N 2.97Å; I380-L391 HydrophobicContact CD1-CD1 4.02Å; L389-L391 HydrophobicContact CD1-CD2 3.98Å; L389-L391 HydrophobicContact CD1-CG 4.35Å; L389-L391 HydrophobicContact CD2-CD1 4.14Å; L389-L391 HydrophobicContact CD2-CD2 4.19Å; L389-L391 HydrophobicContact CD2-CG 4.01Å; L389-L391 HydrophobicContact CG-CD2 4.17Å; L389-L391 HydrophobicContact CG-CG 3.99Å
392	G	93.6	Very high	88.8	Confident	14 Å²	14	49.3 Å²	49.3	14%	0.144	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	175.3	-177.9	0	0	0	0	0	114	F296 K376	F296-G392 WeakPolarHBondContact CB-O 3.46Å; F296-G392 PolarHBondContact O-N 3.26Å; K376-G392 CarbonylContact O-C 3.57Å; K376-G392 WeakPolarHBondContact O-CA 3.4Å
393	S	93.8	Very high	88.6	Confident	27 Å²	27	51.4 Å²	51.4	19%	0.189	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	152	175.6	-55.8	0	0	0	0	109.8	L375 K376 N416	L375-S393 CarbonylContact C-O 3.54Å; L375-S393 WeakPolarHBondContact CA-O 3.33Å; K376-S393 PolarHBondContact N-O 3.45Å; K376-S393 PolarHBondContact O-N 2.73Å; S393-N416 PolarHBondContact OG-ND2 3.4Å
394	P	92.4	Very high	88.5	Confident	3 Å²	3	49.9 Å²	49.9	2%	0.019	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	139.1	174.1	-23.9	34.4	0	0	0	112.3	F296 D374 L375 V396 L407 L418	F296-P394 HydrophobicContact CD1-CG 4.18Å; F296-P394 HydrophobicContact CD2-CG 4.12Å; F296-P394 HydrophobicContact CE1-CG 3.9Å; F296-P394 HydrophobicContact CE2-CG 3.83Å; F296-P394 HydrophobicContact CG-CG 4.29Å; F296-P394 HydrophobicContact CZ-CG 3.74Å; D374-P394 WeakPolarHBondContact O-CA 3.27Å; L375-P394 HydrophobicContact CD2-CB 4.49Å; L375-P394 HydrophobicContact CD2-CG 4.22Å; P394-V396 HydrophobicContact CB-CG2 4.14Å; P394-V396 PolarHBondContact O-N 2.74Å; P394-L407 HydrophobicContact CB-CD1 3.63Å; P394-L407 HydrophobicContact CG-CD1 3.57Å; P394-L418 HydrophobicContact CB-CD2 4.5Å; P394-L418 WeakPolarHBondContact O-CD2 3.49Å
395	C	91.2	Very high	88.3	Confident	46 Å²	46	42.9 Å²	42.9	31%	0.311	25%	0.25	S	C	.	.			trans	-77.3	82.8	175.4	-62.2	0	0	0	0	110.5	D374 K376	D374-C395 HydrophobicContact CB-CB 4.03Å; D374-C395 PolarHBondContact O-N 3.13Å; D374-C395 PolarHBondContact O-SG 3.4Å; K376-C395 WeakPolarHBondContact CB-SG 3.37Å
396	V	88.1	Confident	88	Confident	3 Å²	3	40.1 Å²	40.1	2%	0.018	24%	0.235	C	C	.	.			trans	-141.6	126	-177.2	-177.1	0	0	0	0	112.2	P394 K398 E401 L402 L418	P394-V396 HydrophobicContact CB-CG2 4.14Å; P394-V396 PolarHBondContact O-N 2.74Å; V396-K398 WeakPolarHBondContact CG1-O 3.44Å; V396-E401 HydrophobicContact CG1-CB 3.52Å; V396-L402 HydrophobicContact CB-CD2 3.8Å; V396-L402 HydrophobicContact CB-CG 4.19Å; V396-L402 HydrophobicContact CG1-CB 4.36Å; V396-L402 HydrophobicContact CG1-CD2 3.76Å; V396-L402 HydrophobicContact CG1-CG 3.57Å; V396-L402 HydrophobicContact CG2-CD2 3.86Å; V396-L418 VanDerWaalsContact O-CD1 3.23Å; V396-L418 WeakPolarHBondContact O-CD1 3.28Å
397	D	84	Confident	87.9	Confident	111 Å²	111	37.7 Å²	37.7	59%	0.594	22%	0.222	S	C	*	.	S	Bend	trans	-102.2	-18.4	-179.9	-59.7	-35.5	0	0	0	113.1
398	K	86.1	Confident	87.7	Confident	117 Å²	117	45.1 Å²	45.1	51%	0.509	25%	0.25	S	C	.	.	S	Bend	trans	-128.8	151.5	-172.1	-63.5	-179.6	-176.3	170.5	0	112.5	V396 E400 E401 L402	V396-K398 WeakPolarHBondContact CG1-O 3.44Å; K398-E400 VanDerWaalsContact C-N 3.3Å; K398-E400 WeakPolarHBondContact CB-OE2 3.48Å; K398-E400 PolarHBondContact O-N 3.38Å; K398-E401 HydrophobicContact CB-CB 4.48Å; K398-E401 HydrophobicContact CB-CG 4.32Å; K398-E401 PolarHBondContact O-N 2.92Å; K398-L402 PolarHBondContact O-N 3.22Å
399	L	86.4	Confident	87.5	Confident	70 Å²	70	47.3 Å²	47.3	37%	0.366	26%	0.261	S	S	.	.	H	α-helix	trans	-65.7	-35.4	-180	-172	62.1	0	0	0	111.9	E401 L402 T403 V422 E426	L399-E401 VanDerWaalsContact C-N 3.29Å; L399-E401 PolarHBondContact O-N 2.85Å; L399-L402 HydrophobicContact CD1-CD1 4.09Å; L399-L402 WeakPolarHBondContact O-CB 3.49Å; L399-L402 PolarHBondContact O-N 3.45Å; L399-T403 PolarHBondContact O-N 3.43Å; L399-V422 HydrophobicContact CB-CG1 4.21Å; L399-V422 HydrophobicContact CD1-CG1 4.35Å; L399-E426 HydrophobicContact CB-CG 4.09Å; L399-E426 HydrophobicContact CD2-CG 4.42Å
400	E	85.2	Confident	87.2	Confident	91 Å²	91	51 Å²	51	43%	0.425	29%	0.289	S	S	.	.	H	α-helix	trans	-65.8	-34.6	178.7	-55.6	92.2	164.1	0	0	111.8	K398 T403 G404 K429	K398-E400 VanDerWaalsContact C-N 3.3Å; K398-E400 WeakPolarHBondContact CB-OE2 3.48Å; K398-E400 PolarHBondContact O-N 3.38Å; E400-T403 WeakPolarHBondContact CA-OG1 3.43Å; E400-T403 PolarHBondContact O-N 3.43Å; E400-T403 PolarHBondContact O-OG1 3.02Å; E400-G404 PolarHBondContact O-N 3.49Å; E400-K429 IonicContact OE1-NZ 2.82Å; E400-K429 PolarHBondContact OE1-NZ 3.18Å
401	E	84.9	Confident	86.9	Confident	53 Å²	53	52.6 Å²	52.6	25%	0.248	30%	0.297	C	S	.	.	H	α-helix	trans	-69.7	-33	176.3	-73	-173.2	-136.4	0	0	112.3	K371 V396 K398 L399 T403 G404 C405	K371-E401 IonicContact NZ-OE2 2.76Å; K371-E401 PolarHBondContact NZ-OE2 3.47Å; V396-E401 HydrophobicContact CG1-CB 3.52Å; K398-E401 HydrophobicContact CB-CB 4.48Å; K398-E401 HydrophobicContact CB-CG 4.32Å; K398-E401 PolarHBondContact O-N 2.92Å; L399-E401 VanDerWaalsContact C-N 3.29Å; L399-E401 PolarHBondContact O-N 2.85Å; E401-T403 VanDerWaalsContact C-N 3.35Å; E401-G404 PolarHBondContact O-N 3Å; E401-C405 PolarHBondContact O-N 3.21Å; E401-C405 PolarHBondContact O-SG 3.33Å
402	L	85.3	Confident	86.7	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-61	-48.6	172.8	-74.7	173.8	0	0	0	109.8	V396 K398 L399 G404 C405 G406 L407 L409 I412 V422	V396-L402 HydrophobicContact CB-CD2 3.8Å; V396-L402 HydrophobicContact CB-CG 4.19Å; V396-L402 HydrophobicContact CG1-CB 4.36Å; V396-L402 HydrophobicContact CG1-CD2 3.76Å; V396-L402 HydrophobicContact CG1-CG 3.57Å; V396-L402 HydrophobicContact CG2-CD2 3.86Å; K398-L402 PolarHBondContact O-N 3.22Å; L399-L402 HydrophobicContact CD1-CD1 4.09Å; L399-L402 WeakPolarHBondContact O-CB 3.49Å; L399-L402 PolarHBondContact O-N 3.45Å; L402-G404 VanDerWaalsContact C-N 3.3Å; L402-G404 PolarHBondContact O-N 2.89Å; L402-C405 CarbonylContact O-C 3.57Å; L402-C405 PolarHBondContact O-N 2.81Å; L402-C405 VanDerWaalsContact O-N 3.16Å; L402-G406 PolarHBondContact O-N 3.48Å; L402-L407 CarbonylContact C-O 3.22Å; L402-L407 HydrophobicContact CB-CB 4.29Å; L402-L407 HydrophobicContact CD2-CB 3.97Å; L402-L407 HydrophobicContact CD2-CD1 3.97Å; L402-L407 WeakPolarHBondContact O-CA 3.36Å; L402-L407 WeakPolarHBondContact O-CB 3.47Å; L402-L407 PolarHBondContact O-N 3.18Å; L402-L407 VanDerWaalsContact O-O 3.13Å; L402-L409 HydrophobicContact CD1-CD1 4.25Å; L402-I412 HydrophobicContact CD1-CD1 3.87Å; L402-I412 HydrophobicContact CD2-CD1 3.7Å; L402-I412 HydrophobicContact CG-CD1 4.47Å; L402-V422 HydrophobicContact CD1-CG1 3.98Å; L402-V422 HydrophobicContact CD1-CG2 4.32Å
403	T	83.3	Confident	86.6	Confident	88 Å²	88	50.5 Å²	50.5	54%	0.54	28%	0.284	S	S	.	.	H	α-helix	trans	-63.8	-36.5	177.7	53.3	0	0	0	0	112.3	L399 E400 E401 C405 G406	L399-T403 PolarHBondContact O-N 3.43Å; E400-T403 WeakPolarHBondContact CA-OG1 3.43Å; E400-T403 PolarHBondContact O-N 3.43Å; E400-T403 PolarHBondContact O-OG1 3.02Å; E401-T403 VanDerWaalsContact C-N 3.35Å; T403-C405 VanDerWaalsContact C-N 3.31Å; T403-C405 PolarHBondContact O-N 3.48Å; T403-G406 WeakPolarHBondContact O-CA 3.45Å; T403-G406 PolarHBondContact O-N 2.87Å
404	G	79.6	Confident	86.5	Confident	45 Å²	45	55.7 Å²	55.7	46%	0.464	31%	0.309	S	S	.	.	H	α-helix	trans	-64.6	-32.3	174.5	0	0	0	0	0	113.5	E400 E401 L402 G406	E400-G404 PolarHBondContact O-N 3.49Å; E401-G404 PolarHBondContact O-N 3Å; L402-G404 VanDerWaalsContact C-N 3.3Å; L402-G404 PolarHBondContact O-N 2.89Å; G404-G406 PolarHBondContact O-N 2.75Å
405	C	78.2	Confident	86.4	Confident	13 Å²	13	61 Å²	61	9%	0.088	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	5.8	170.3	-66.1	0	0	0	0	113.1	R316 M373 E401 L402 T403 L407	R316-C405 PolarHBondContact NH1-O 3.09Å; M373-C405 HydrophobicContact SD-CB 4.43Å; E401-C405 PolarHBondContact O-N 3.21Å; E401-C405 PolarHBondContact O-SG 3.33Å; L402-C405 CarbonylContact O-C 3.57Å; L402-C405 PolarHBondContact O-N 2.81Å; L402-C405 VanDerWaalsContact O-N 3.16Å; T403-C405 VanDerWaalsContact C-N 3.31Å; T403-C405 PolarHBondContact O-N 3.48Å; C405-L407 HydrophobicContact CB-CD1 4.28Å; C405-L407 PolarHBondContact O-N 3.05Å
406	G	78.6	Confident	86.4	Confident	30 Å²	30	60.2 Å²	60.2	31%	0.309	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.8	21.8	-176.2	0	0	0	0	0	113.8	R316 L402 T403 G404	R316-G406 VanDerWaalsContact NH2-C 3.26Å; R316-G406 PolarHBondContact NH2-O 3.43Å; L402-G406 PolarHBondContact O-N 3.48Å; T403-G406 WeakPolarHBondContact O-CA 3.45Å; T403-G406 PolarHBondContact O-N 2.87Å; G404-G406 PolarHBondContact O-N 2.75Å
407	L	84.8	Confident	86.5	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.005	35%	0.351	C	S	.	.			trans	-92.6	144.8	174.3	-77.1	164.9	0	0	0	110.3	F296 R316 M373 P394 L402 C405 D411	F296-L407 HydrophobicContact CE1-CD2 3.93Å; F296-L407 HydrophobicContact CZ-CD2 3.57Å; R316-L407 VanDerWaalsContact CZ-CG 3.49Å; R316-L407 VanDerWaalsContact NH2-CA 3.33Å; M373-L407 HydrophobicContact SD-CD1 3.61Å; M373-L407 HydrophobicContact SD-CG 4.14Å; P394-L407 HydrophobicContact CB-CD1 3.63Å; P394-L407 HydrophobicContact CG-CD1 3.57Å; L402-L407 CarbonylContact C-O 3.22Å; L402-L407 HydrophobicContact CB-CB 4.29Å; L402-L407 HydrophobicContact CD2-CB 3.97Å; L402-L407 HydrophobicContact CD2-CD1 3.97Å; L402-L407 WeakPolarHBondContact O-CA 3.36Å; L402-L407 WeakPolarHBondContact O-CB 3.47Å; L402-L407 PolarHBondContact O-N 3.18Å; L402-L407 VanDerWaalsContact O-O 3.13Å; C405-L407 HydrophobicContact CB-CD1 4.28Å; C405-L407 PolarHBondContact O-N 3.05Å; L407-D411 HydrophobicContact CD2-CB 3.9Å
408	Y	87.5	Confident	86.8	Confident	163 Å²	163	59.1 Å²	59.1	64%	0.639	33%	0.329	S	S	*	.			trans	-104	157.5	166.8	-62	-85.8	0	0	0	110.1	S410 D411	Y408-S410 WeakPolarHBondContact CB-OG 3.49Å; Y408-S410 PolarHBondContact O-N 2.74Å; Y408-S410 VanDerWaalsContact O-N 3.12Å; Y408-D411 PolarHBondContact N-OD2 2.92Å; Y408-D411 WeakPolarHBondContact O-CB 3.24Å; Y408-D411 PolarHBondContact O-N 3.35Å
409	L	88.9	Confident	87	Confident	46 Å²	46	57 Å²	57	24%	0.241	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-58.9	-26.4	173.9	-167.2	66.7	0	0	0	112.2	L402 D411 I412 R419 L423	L402-L409 HydrophobicContact CD1-CD1 4.25Å; L409-D411 PolarHBondContact O-N 2.61Å; L409-I412 PolarHBondContact O-N 3.43Å; L409-R419 HydrophobicContact CD1-CG 4.03Å; L409-R419 HydrophobicContact CG-CG 4.5Å; L409-L423 HydrophobicContact CD2-CD2 4.05Å
410	S	89.3	Confident	87.2	Confident	98 Å²	98	58.2 Å²	58.2	69%	0.685	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-68.1	-20.5	174.3	56.2	0	0	0	0	114.1	Y408 I412	Y408-S410 WeakPolarHBondContact CB-OG 3.49Å; Y408-S410 PolarHBondContact O-N 2.74Å; Y408-S410 VanDerWaalsContact O-N 3.12Å; S410-I412 VanDerWaalsContact C-N 3.28Å
411	D	88.6	Confident	87.4	Confident	35 Å²	35	57.7 Å²	57.7	19%	0.187	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-79.1	-15.3	176.9	-62.4	-43.8	0	0	0	111.8	F296 L407 Y408 L409	F296-D411 WeakPolarHBondContact CE2-O 3.47Å; F296-D411 HydrophobicContact CZ-CB 4.38Å; L407-D411 HydrophobicContact CD2-CB 3.9Å; Y408-D411 PolarHBondContact N-OD2 2.92Å; Y408-D411 WeakPolarHBondContact O-CB 3.24Å; Y408-D411 PolarHBondContact O-N 3.35Å; L409-D411 PolarHBondContact O-N 2.61Å
412	I	90.9	Very high	87.6	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.005	32%	0.315	C	S	.	.	S	Bend	trans	-93.8	117.2	174.6	-58.4	171.7	0	0	0	109	L402 L409 S410 N416 L418 R419	L402-I412 HydrophobicContact CD1-CD1 3.87Å; L402-I412 HydrophobicContact CD2-CD1 3.7Å; L402-I412 HydrophobicContact CG-CD1 4.47Å; L409-I412 PolarHBondContact O-N 3.43Å; S410-I412 VanDerWaalsContact C-N 3.28Å; I412-N416 HydrophobicContact CG2-CB 3.97Å; I412-L418 HydrophobicContact CD1-CD2 3.84Å; I412-L418 HydrophobicContact CD1-CG 4.22Å; I412-L418 HydrophobicContact CG1-CD2 4.43Å; I412-L418 HydrophobicContact CG2-CB 4.36Å; I412-R419 HydrophobicContact CG2-CB 3.91Å
413	P	91.3	Very high	87.8	Confident	20 Å²	20	58.8 Å²	58.8	13%	0.13	33%	0.334	C	S	.	.			trans	-59.5	152.9	178.8	-23.6	33.6	0	0	0	113.3	I293 P295 H415 N416	I293-P413 WeakPolarHBondContact O-CG 3.38Å; P295-P413 HydrophobicContact CG-CG 3.63Å; P413-H415 VanDerWaalsContact C-N 3.31Å; P413-H415 WeakPolarHBondContact CB-CE1 3.44Å; P413-H415 PolarHBondContact O-N 2.95Å; P413-N416 HydrophobicContact CB-CB 4.47Å; P413-N416 VanDerWaalsContact O-CB 3.29Å; P413-N416 WeakPolarHBondContact O-CB 3.46Å; P413-N416 PolarHBondContact O-N 2.93Å; P413-N416 VanDerWaalsContact O-N 3.1Å
414	I	92	Very high	88	Confident	136 Å²	136	58.9 Å²	58.9	70%	0.697	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-34.4	-176.8	-47.7	179.6	0	0	0	112.2	N416	I414-N416 PolarHBondContact O-N 3.44Å
415	H	90.9	Very high	88.1	Confident	115 Å²	115	58.5 Å²	58.5	53%	0.532	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-6.6	178.6	61.3	-95.8	0	0	0	113.1	I293 F294 P413	I293-H415 PolarHBondContact O-CE1 3.28Å; I293-H415 PolarHBondContact O-NE2 3.36Å; F294-H415 AromaticContact CD1-NE2 3.95Å; F294-H415 AromaticContact CE1-NE2 3.72Å; P413-H415 VanDerWaalsContact C-N 3.31Å; P413-H415 WeakPolarHBondContact CB-CE1 3.44Å; P413-H415 PolarHBondContact O-N 2.95Å
416	N	91.4	Very high	88.3	Confident	29 Å²	29	60.7 Å²	60.7	16%	0.155	34%	0.339	C	S	.	.			trans	-87.2	117.6	-179.7	-171	-24.2	0	0	0	109.9	S393 I412 P413 I414 L418 R419	S393-N416 PolarHBondContact OG-ND2 3.4Å; I412-N416 HydrophobicContact CG2-CB 3.97Å; P413-N416 HydrophobicContact CB-CB 4.47Å; P413-N416 VanDerWaalsContact O-CB 3.29Å; P413-N416 WeakPolarHBondContact O-CB 3.46Å; P413-N416 PolarHBondContact O-N 2.93Å; P413-N416 VanDerWaalsContact O-N 3.1Å; I414-N416 PolarHBondContact O-N 3.44Å; N416-L418 PolarHBondContact O-N 3.24Å; N416-L418 VanDerWaalsContact OD1-CB 3.25Å; N416-L418 WeakPolarHBondContact OD1-CB 3.46Å; N416-L418 PolarHBondContact OD1-N 3.42Å; N416-R419 WeakPolarHBondContact O-CB 3.25Å; N416-R419 PolarHBondContact O-N 3.29Å
417	A	89.6	Confident	88.6	Confident	66 Å²	66	64.5 Å²	64.5	55%	0.545	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-21.5	179.9	0	0	0	0	0	113.8	R419 D420 V421	A417-R419 PolarHBondContact O-N 3.16Å; A417-D420 PolarHBondContact O-N 3.42Å; A417-D420 VanDerWaalsContact O-N 3.1Å; A417-V421 WeakPolarHBondContact O-CG2 3.5Å; A417-V421 PolarHBondContact O-N 2.98Å; A417-V421 VanDerWaalsContact O-N 3.09Å
418	L	90.2	Very high	88.5	Confident	25 Å²	25	67.1 Å²	67.1	13%	0.131	37%	0.371	C	S	.	.	H	α-helix	trans	-54.3	-36.4	173.2	-176.1	65.6	0	0	0	112	P394 V396 I412 N416 D420 V421 V422	P394-L418 HydrophobicContact CB-CD2 4.5Å; P394-L418 WeakPolarHBondContact O-CD2 3.49Å; V396-L418 VanDerWaalsContact O-CD1 3.23Å; V396-L418 WeakPolarHBondContact O-CD1 3.28Å; I412-L418 HydrophobicContact CD1-CD2 3.84Å; I412-L418 HydrophobicContact CD1-CG 4.22Å; I412-L418 HydrophobicContact CG1-CD2 4.43Å; I412-L418 HydrophobicContact CG2-CB 4.36Å; N416-L418 PolarHBondContact O-N 3.24Å; N416-L418 VanDerWaalsContact OD1-CB 3.25Å; N416-L418 WeakPolarHBondContact OD1-CB 3.46Å; N416-L418 PolarHBondContact OD1-N 3.42Å; L418-D420 VanDerWaalsContact C-N 3.34Å; L418-D420 PolarHBondContact O-N 3.29Å; L418-V421 PolarHBondContact O-N 3.18Å; L418-V422 WeakPolarHBondContact O-CG2 3.49Å; L418-V422 PolarHBondContact O-N 3.47Å
419	R	91.4	Very high	88.2	Confident	72 Å²	72	65.4 Å²	65.4	27%	0.272	37%	0.367	S	S	.	.	H	α-helix	trans	-62.2	-43.1	179	-174.5	173.4	176.7	157.9	-4.7	111.5	L409 I412 N416 A417 L423	L409-R419 HydrophobicContact CD1-CG 4.03Å; L409-R419 HydrophobicContact CG-CG 4.5Å; I412-R419 HydrophobicContact CG2-CB 3.91Å; N416-R419 WeakPolarHBondContact O-CB 3.25Å; N416-R419 PolarHBondContact O-N 3.29Å; A417-R419 PolarHBondContact O-N 3.16Å; R419-L423 HydrophobicContact CG-CD1 4.13Å; R419-L423 WeakPolarHBondContact O-CB 3.21Å; R419-L423 VanDerWaalsContact O-CG 3.24Å; R419-L423 WeakPolarHBondContact O-CG 3.35Å; R419-L423 PolarHBondContact O-N 2.95Å; R419-L423 VanDerWaalsContact O-N 3.12Å
420	D	90.1	Very high	87.7	Confident	96 Å²	96	66.8 Å²	66.8	51%	0.513	39%	0.385	S	S	.	.	H	α-helix	trans	-68.6	-41.2	179.3	-62	-29.8	0	0	0	110.8	A417 L418 V422 L423 V424	A417-D420 PolarHBondContact O-N 3.42Å; A417-D420 VanDerWaalsContact O-N 3.1Å; L418-D420 VanDerWaalsContact C-N 3.34Å; L418-D420 PolarHBondContact O-N 3.29Å; D420-V422 PolarHBondContact O-N 2.93Å; D420-L423 PolarHBondContact O-N 3.49Å; D420-V424 WeakPolarHBondContact O-CB 3.43Å; D420-V424 VanDerWaalsContact O-CG2 3.25Å; D420-V424 WeakPolarHBondContact O-CG2 3.46Å; D420-V424 PolarHBondContact O-N 3.49Å
421	V	88.6	Confident	87.4	Confident	79 Å²	79	67.6 Å²	67.6	48%	0.479	38%	0.378	S	S	.	.	H	α-helix	trans	-57.9	-48.8	176.7	174	0	0	0	0	111.3	A417 L418 L423 V424 G425	A417-V421 WeakPolarHBondContact O-CG2 3.5Å; A417-V421 PolarHBondContact O-N 2.98Å; A417-V421 VanDerWaalsContact O-N 3.09Å; L418-V421 PolarHBondContact O-N 3.18Å; V421-L423 VanDerWaalsContact C-N 3.33Å; V421-L423 PolarHBondContact O-N 3.36Å; V421-V424 PolarHBondContact O-N 3.27Å; V421-G425 PolarHBondContact O-N 3.21Å
422	V	89.3	Confident	87.1	Confident	1 Å²	1	71 Å²	71	1%	0.006	40%	0.397	C	S	.	.	H	α-helix	trans	-62.5	-40.7	178.4	172.8	0	0	0	0	111.3	L399 L402 L418 D420 G425 E426	L399-V422 HydrophobicContact CB-CG1 4.21Å; L399-V422 HydrophobicContact CD1-CG1 4.35Å; L402-V422 HydrophobicContact CD1-CG1 3.98Å; L402-V422 HydrophobicContact CD1-CG2 4.32Å; L418-V422 WeakPolarHBondContact O-CG2 3.49Å; L418-V422 PolarHBondContact O-N 3.47Å; D420-V422 PolarHBondContact O-N 2.93Å; V422-G425 PolarHBondContact O-N 3.3Å; V422-E426 PolarHBondContact O-N 3.49Å
423	L	88.6	Confident	86.6	Confident	76 Å²	76	73 Å²	73	40%	0.398	42%	0.417	S	S	.	.	H	α-helix	trans	-69.9	-37.5	179.5	-71.9	173.2	0	0	0	113	L409 R419 D420 V421 G425 E426 Q427	L409-L423 HydrophobicContact CD2-CD2 4.05Å; R419-L423 HydrophobicContact CG-CD1 4.13Å; R419-L423 WeakPolarHBondContact O-CB 3.21Å; R419-L423 VanDerWaalsContact O-CG 3.24Å; R419-L423 WeakPolarHBondContact O-CG 3.35Å; R419-L423 PolarHBondContact O-N 2.95Å; R419-L423 VanDerWaalsContact O-N 3.12Å; D420-L423 PolarHBondContact O-N 3.49Å; V421-L423 VanDerWaalsContact C-N 3.33Å; V421-L423 PolarHBondContact O-N 3.36Å; L423-G425 VanDerWaalsContact C-N 3.31Å; L423-G425 PolarHBondContact O-N 3.35Å; L423-E426 PolarHBondContact O-N 3Å; L423-Q427 WeakPolarHBondContact O-CB 3.09Å; L423-Q427 PolarHBondContact O-N 3.49Å
424	V	87.7	Confident	86.2	Confident	90 Å²	90	77.8 Å²	77.8	55%	0.545	44%	0.441	S	S	.	.	H	α-helix	trans	-62.5	-39.7	176.3	167.6	0	0	0	0	110.9	D420 V421 E426 Q427 A428	D420-V424 WeakPolarHBondContact O-CB 3.43Å; D420-V424 VanDerWaalsContact O-CG2 3.25Å; D420-V424 WeakPolarHBondContact O-CG2 3.46Å; D420-V424 PolarHBondContact O-N 3.49Å; V421-V424 PolarHBondContact O-N 3.27Å; V424-E426 PolarHBondContact O-N 3.17Å; V424-Q427 PolarHBondContact O-N 3.06Å; V424-A428 WeakPolarHBondContact O-CB 3.49Å; V424-A428 PolarHBondContact O-N 3.4Å
425	G	82.3	Confident	85.9	Confident	37 Å²	37	78.8 Å²	78.8	38%	0.381	44%	0.44	S	S	.	.	H	α-helix	trans	-57.9	-47.2	175.3	0	0	0	0	0	112.8	V421 V422 L423 K429	V421-G425 PolarHBondContact O-N 3.21Å; V422-G425 PolarHBondContact O-N 3.3Å; L423-G425 VanDerWaalsContact C-N 3.31Å; L423-G425 PolarHBondContact O-N 3.35Å; G425-K429 PolarHBondContact O-N 2.91Å; G425-K429 VanDerWaalsContact O-N 3.17Å
426	E	83.1	Confident	85.6	Confident	58 Å²	58	80.2 Å²	80.2	27%	0.271	45%	0.445	S	S	.	.	H	α-helix	trans	-68.6	-40	177.3	-75	-56	124.5	0	0	112.7	L399 V422 L423 V424 A428 K429 A430	L399-E426 HydrophobicContact CB-CG 4.09Å; L399-E426 HydrophobicContact CD2-CG 4.42Å; V422-E426 PolarHBondContact O-N 3.49Å; L423-E426 PolarHBondContact O-N 3Å; V424-E426 PolarHBondContact O-N 3.17Å; E426-A428 PolarHBondContact O-N 2.78Å; E426-K429 PolarHBondContact O-N 3.45Å; E426-K429 IonicContact OE1-NZ 3.79Å; E426-A430 PolarHBondContact O-N 3.11Å
427	Q	84.7	Confident	85.4	Confident	111 Å²	111	87.9 Å²	87.9	52%	0.519	47%	0.472	S	S	.	.	H	α-helix	trans	-62.8	-43.2	176.8	-176.5	175.9	-16.7	0	0	111.8	L423 V424 K429 A430 Q431	L423-Q427 WeakPolarHBondContact O-CB 3.09Å; L423-Q427 PolarHBondContact O-N 3.49Å; V424-Q427 PolarHBondContact O-N 3.06Å; Q427-K429 VanDerWaalsContact C-N 3.35Å; Q427-K429 PolarHBondContact O-N 3.06Å; Q427-A430 PolarHBondContact O-N 2.71Å; Q427-Q431 HydrophobicContact CG-CG 4.47Å; Q427-Q431 WeakPolarHBondContact O-CB 3.46Å; Q427-Q431 WeakPolarHBondContact O-CG 3.35Å; Q427-Q431 PolarHBondContact O-N 2.94Å
428	A	82.7	Confident	85.4	Confident	56 Å²	56	90.5 Å²	90.5	46%	0.463	48%	0.476	S	S	.	.	H	α-helix	trans	-61.9	-43.5	177.4	0	0	0	0	0	111.6	V424 E426 A430 Q431 D432	V424-A428 WeakPolarHBondContact O-CB 3.49Å; V424-A428 PolarHBondContact O-N 3.4Å; E426-A428 PolarHBondContact O-N 2.78Å; A428-A430 VanDerWaalsContact C-N 3.34Å; A428-A430 PolarHBondContact O-N 3.26Å; A428-Q431 PolarHBondContact O-N 3.45Å; A428-D432 PolarHBondContact O-N 2.91Å
429	K	80.8	Confident	85.4	Confident	126 Å²	126	91.4 Å²	91.4	55%	0.548	49%	0.491	S	S	.	.	H	α-helix	trans	-60.1	-41.7	175.9	-173	-178.9	177.6	-171.9	0	112	E400 G425 E426 Q427	E400-K429 IonicContact OE1-NZ 2.82Å; E400-K429 PolarHBondContact OE1-NZ 3.18Å; G425-K429 PolarHBondContact O-N 2.91Å; G425-K429 VanDerWaalsContact O-N 3.17Å; E426-K429 PolarHBondContact O-N 3.45Å; E426-K429 IonicContact OE1-NZ 3.79Å; Q427-K429 VanDerWaalsContact C-N 3.35Å; Q427-K429 PolarHBondContact O-N 3.06Å
430	A	78.8	Confident	85.5	Confident	76 Å²	76	95 Å²	95	63%	0.628	51%	0.508	S	S	*	.	H	α-helix	trans	-68.1	-38.2	176.4	0	0	0	0	0	112.9	E426 Q427 A428	E426-A430 PolarHBondContact O-N 3.11Å; Q427-A430 PolarHBondContact O-N 2.71Å; A428-A430 VanDerWaalsContact C-N 3.34Å; A428-A430 PolarHBondContact O-N 3.26Å
431	Q	83.4	Confident	85.6	Confident	114 Å²	114	93.3 Å²	93.3	53%	0.533	51%	0.508	S	S	.	.	H	α-helix	trans	-73.6	-31.2	-178.6	-74.1	-175.8	-9.4	0	0	113.5	Q427 A428 G433 L434 K435	Q427-Q431 HydrophobicContact CG-CG 4.47Å; Q427-Q431 WeakPolarHBondContact O-CB 3.46Å; Q427-Q431 WeakPolarHBondContact O-CG 3.35Å; Q427-Q431 PolarHBondContact O-N 2.94Å; A428-Q431 PolarHBondContact O-N 3.45Å; Q431-G433 VanDerWaalsContact C-N 3.34Å; Q431-G433 PolarHBondContact O-N 2.85Å; Q431-L434 PolarHBondContact O-N 3.36Å; Q431-K435 WeakPolarHBondContact O-CB 3.49Å; Q431-K435 PolarHBondContact O-N 3.04Å
432	D	81.8	Confident	85.9	Confident	108 Å²	108	96.6 Å²	96.6	58%	0.578	52%	0.516	S	S	*	.	H	α-helix	trans	-60.9	-42.3	-178.2	-170.5	53.8	0	0	0	112.5	A428 L434 K435 K436	A428-D432 PolarHBondContact O-N 2.91Å; D432-L434 VanDerWaalsContact C-N 3.33Å; D432-L434 PolarHBondContact O-N 3.3Å; D432-K435 PolarHBondContact O-N 2.81Å; D432-K436 PolarHBondContact O-N 3.16Å
433	G	81.1	Confident	86.1	Confident	42 Å²	42	99.2 Å²	99.2	43%	0.433	54%	0.538	S	S	.	.	H	α-helix	trans	-61.1	-40.5	175.6	0	0	0	0	0	113	Q431 R437	Q431-G433 VanDerWaalsContact C-N 3.34Å; Q431-G433 PolarHBondContact O-N 2.85Å; G433-R437 WeakPolarHBondContact O-CG 3.49Å; G433-R437 PolarHBondContact O-N 3.47Å
434	L	81.9	Confident	86.4	Confident	120 Å²	120	98.6 Å²	98.6	63%	0.628	54%	0.544	S	S	*	.	H	α-helix	trans	-68.4	-44.3	176.9	-177.6	61.4	0	0	0	111.5	Q431 D432 K436 R437 L438	Q431-L434 PolarHBondContact O-N 3.36Å; D432-L434 VanDerWaalsContact C-N 3.33Å; D432-L434 PolarHBondContact O-N 3.3Å; L434-K436 VanDerWaalsContact C-N 3.3Å; L434-K436 PolarHBondContact O-N 2.91Å; L434-R437 PolarHBondContact O-N 3.05Å; L434-R437 VanDerWaalsContact O-N 3.16Å; L434-L438 WeakPolarHBondContact O-CB 3.43Å; L434-L438 PolarHBondContact O-N 3.4Å
435	K	84.6	Confident	86.8	Confident	157 Å²	157	100.3 Å²	100.3	68%	0.683	55%	0.549	S	S	*	.	H	α-helix	trans	-57.7	-43	178.6	-173.7	179.3	179	-177.4	0	111.6	Q431 D432 L438 G439	Q431-K435 WeakPolarHBondContact O-CB 3.49Å; Q431-K435 PolarHBondContact O-N 3.04Å; D432-K435 PolarHBondContact O-N 2.81Å; K435-L438 PolarHBondContact O-N 2.98Å; K435-G439 PolarHBondContact O-N 3Å
436	K	86.3	Confident	87.3	Confident	146 Å²	146	104.8 Å²	104.8	64%	0.635	56%	0.56	S	S	*	*	H	α-helix	trans	-64.2	-41	177.1	-169.7	173.8	-175.1	173.6	0	112.5	D432 L434 G439 K440	D432-K436 PolarHBondContact O-N 3.16Å; L434-K436 VanDerWaalsContact C-N 3.3Å; L434-K436 PolarHBondContact O-N 2.91Å; K436-G439 PolarHBondContact O-N 3.45Å; K436-K440 PolarHBondContact O-N 2.95Å; K436-K440 VanDerWaalsContact O-N 3.17Å
437	R	86.1	Confident	87.9	Confident	190 Å²	190	108.9 Å²	108.9	72%	0.717	58%	0.579	S	S	*	*	H	α-helix	trans	-66.6	-42.4	176.7	-71.1	178.2	69.9	177.3	2	111.7	G433 L434 G439 K440 A441	G433-R437 WeakPolarHBondContact O-CG 3.49Å; G433-R437 PolarHBondContact O-N 3.47Å; L434-R437 PolarHBondContact O-N 3.05Å; L434-R437 VanDerWaalsContact O-N 3.16Å; R437-G439 VanDerWaalsContact C-N 3.34Å; R437-G439 PolarHBondContact O-N 3.49Å; R437-K440 PolarHBondContact O-N 3.36Å; R437-A441 PolarHBondContact O-N 3.41Å
438	L	90	Very high	88.3	Confident	121 Å²	121	106.3 Å²	106.3	63%	0.634	58%	0.577	S	S	*	*	H	α-helix	trans	-61.3	-43	176.2	-175.3	64.3	0	0	0	111.5	L434 K435 K440 A441 K442	L434-L438 WeakPolarHBondContact O-CB 3.43Å; L434-L438 PolarHBondContact O-N 3.4Å; K435-L438 PolarHBondContact O-N 2.98Å; L438-K440 PolarHBondContact O-N 3.32Å; L438-A441 PolarHBondContact O-N 3.29Å; L438-K442 WeakPolarHBondContact O-CB 3.5Å; L438-K442 PolarHBondContact O-N 3.41Å
439	G	90.6	Very high	88.9	Confident	43 Å²	43	108.7 Å²	108.7	44%	0.443	58%	0.578	S	S	.	*	H	α-helix	trans	-58.8	-44.3	175.3	0	0	0	0	0	113	K435 K436 R437 K442 A443	K435-G439 PolarHBondContact O-N 3Å; K436-G439 PolarHBondContact O-N 3.45Å; R437-G439 VanDerWaalsContact C-N 3.34Å; R437-G439 PolarHBondContact O-N 3.49Å; G439-K442 PolarHBondContact O-N 2.88Å; G439-A443 PolarHBondContact O-N 3.21Å; G439-A443 VanDerWaalsContact O-N 3.09Å
440	K	93.5	Very high	89.6	Confident	147 Å²	147	107.9 Å²	107.9	64%	0.639	58%	0.576	S	S	*	*	H	α-helix	trans	-64.2	-43.5	176.2	-71.6	-176.5	176.9	-169	0	112.8	K436 R437 L438 A443 A444	K436-K440 PolarHBondContact O-N 2.95Å; K436-K440 VanDerWaalsContact O-N 3.17Å; R437-K440 PolarHBondContact O-N 3.36Å; L438-K440 PolarHBondContact O-N 3.32Å; K440-A443 PolarHBondContact O-N 3.48Å; K440-A444 PolarHBondContact O-N 2.97Å
441	A	92.3	Very high	90.4	Very high	62 Å²	62	106.5 Å²	106.5	51%	0.512	57%	0.565	S	S	.	*	H	α-helix	trans	-64.2	-41.2	178.9	0	0	0	0	0	111.7	R437 L438 A444 L445	R437-A441 PolarHBondContact O-N 3.41Å; L438-A441 PolarHBondContact O-N 3.29Å; A441-A444 PolarHBondContact O-N 3.17Å; A441-L445 WeakPolarHBondContact O-CB 3.5Å; A441-L445 PolarHBondContact O-N 3.28Å
442	K	94.3	Very high	90.9	Very high	147 Å²	147	105.5 Å²	105.5	64%	0.639	56%	0.562	S	S	*	*	H	α-helix	trans	-60.6	-47.6	175.3	-173.1	-177.3	177	-173.5	0	111.6	L438 G439 A444 L445 E446	L438-K442 WeakPolarHBondContact O-CB 3.5Å; L438-K442 PolarHBondContact O-N 3.41Å; G439-K442 PolarHBondContact O-N 2.88Å; K442-A444 VanDerWaalsContact C-N 3.32Å; K442-A444 PolarHBondContact O-N 3.09Å; K442-L445 WeakPolarHBondContact O-CB 3.47Å; K442-L445 PolarHBondContact O-N 3.42Å; K442-E446 PolarHBondContact O-N 2.96Å
443	A	94.1	Very high	91.5	Very high	57 Å²	57	103.8 Å²	103.8	47%	0.471	55%	0.551	S	S	.	*	H	α-helix	trans	-61.8	-39.8	178.4	0	0	0	0	0	112.4	G439 K440 E446 H447	G439-A443 PolarHBondContact O-N 3.21Å; G439-A443 VanDerWaalsContact O-N 3.09Å; K440-A443 PolarHBondContact O-N 3.48Å; A443-E446 PolarHBondContact O-N 3.02Å; A443-H447 PolarHBondContact O-N 2.98Å
444	A	94.7	Very high	92.1	Very high	63 Å²	63	106.6 Å²	106.6	52%	0.521	55%	0.553	S	S	.	*	H	α-helix	trans	-65	-39.7	175.7	0	0	0	0	0	112.3	K440 A441 K442 A448	K440-A444 PolarHBondContact O-N 2.97Å; A441-A444 PolarHBondContact O-N 3.17Å; K442-A444 VanDerWaalsContact C-N 3.32Å; K442-A444 PolarHBondContact O-N 3.09Å; A444-A448 WeakPolarHBondContact O-CB 3.43Å; A444-A448 PolarHBondContact O-N 3.24Å
445	L	94.9	Very high	92.6	Very high	126 Å²	126	106 Å²	106	66%	0.66	55%	0.547	S	S	*	.	H	α-helix	trans	-64.7	-42.5	176.1	-179.6	62.4	0	0	0	111.8	A441 K442 A448 H449	A441-L445 WeakPolarHBondContact O-CB 3.5Å; A441-L445 PolarHBondContact O-N 3.28Å; K442-L445 WeakPolarHBondContact O-CB 3.47Å; K442-L445 PolarHBondContact O-N 3.42Å; L445-A448 PolarHBondContact O-N 3.45Å; L445-H449 WeakPolarHBondContact O-CB 3.37Å; L445-H449 PolarHBondContact O-N 3.46Å
446	E	94.8	Very high	92.9	Very high	131 Å²	131	102.8 Å²	102.8	61%	0.612	53%	0.533	S	S	*	.	H	α-helix	trans	-63.1	-44.1	177.9	-171	164.8	-164	0	0	111.5	K442 A443 A448 H449 Q450	K442-E446 PolarHBondContact O-N 2.96Å; A443-E446 PolarHBondContact O-N 3.02Å; E446-A448 PolarHBondContact O-N 3.37Å; E446-H449 PolarHBondContact O-N 3.01Å; E446-Q450 PolarHBondContact O-N 3.4Å
447	H	94.6	Very high	93.1	Very high	144 Å²	144	102.4 Å²	102.4	67%	0.667	53%	0.531	S	S	*	.	H	α-helix	trans	-63.7	-40.8	174.6	-170.2	-74.4	0	0	0	112.6	A443 H449 Q450 A451	A443-H447 PolarHBondContact O-N 2.98Å; H447-H449 VanDerWaalsContact C-N 3.33Å; H447-Q450 PolarHBondContact O-N 3.36Å; H447-A451 PolarHBondContact O-N 3.24Å
448	A	94	Very high	93.3	Very high	57 Å²	57	99.1 Å²	99.1	47%	0.471	52%	0.522	S	S	.	.	H	α-helix	trans	-65.6	-37.6	176.4	0	0	0	0	0	112	A444 L445 E446 L452	A444-A448 WeakPolarHBondContact O-CB 3.43Å; A444-A448 PolarHBondContact O-N 3.24Å; L445-A448 PolarHBondContact O-N 3.45Å; E446-A448 PolarHBondContact O-N 3.37Å; A448-L452 WeakPolarHBondContact O-CB 3.29Å; A448-L452 PolarHBondContact O-N 3.09Å
449	H	94.4	Very high	93.3	Very high	106 Å²	106	97.1 Å²	97.1	49%	0.491	52%	0.515	S	S	.	.	H	α-helix	trans	-65.3	-45.2	175.5	-176.7	51.8	0	0	0	111.6	L445 E446 H447 A451 L452 E453	L445-H449 WeakPolarHBondContact O-CB 3.37Å; L445-H449 PolarHBondContact O-N 3.46Å; E446-H449 PolarHBondContact O-N 3.01Å; H447-H449 VanDerWaalsContact C-N 3.33Å; H449-A451 PolarHBondContact O-N 3.33Å; H449-L452 WeakPolarHBondContact O-CB 3.4Å; H449-L452 PolarHBondContact O-N 2.87Å; H449-L452 VanDerWaalsContact O-N 3.15Å; H449-E453 IonicContact CE1-OE1 3.46Å; H449-E453 PolarHBondContact O-N 2.74Å
450	Q	95.1	Very high	93.3	Very high	109 Å²	109	96.8 Å²	96.8	51%	0.509	50%	0.504	S	S	.	.	H	α-helix	trans	-59.5	-46.4	177.1	-173.3	62.5	26.9	0	0	111.9	E446 H447 L452 E453 E454	E446-Q450 PolarHBondContact O-N 3.4Å; H447-Q450 PolarHBondContact O-N 3.36Å; Q450-L452 VanDerWaalsContact C-N 3.28Å; Q450-L452 PolarHBondContact O-N 3.15Å; Q450-E453 PolarHBondContact O-N 3.28Å; Q450-E454 WeakPolarHBondContact O-CG 3.32Å; Q450-E454 PolarHBondContact O-N 2.88Å
451	A	95	Very high	93.1	Very high	47 Å²	47	93.7 Å²	93.7	39%	0.388	50%	0.495	S	S	.	.	H	α-helix	trans	-61.7	-36.6	176.6	0	0	0	0	0	112.4	H447 H449 E455	H447-A451 PolarHBondContact O-N 3.24Å; H449-A451 PolarHBondContact O-N 3.33Å; A451-E455 WeakPolarHBondContact O-CB 3.42Å; A451-E455 PolarHBondContact O-N 3.45Å
452	L	95.3	Very high	93	Very high	92 Å²	92	95.9 Å²	95.9	48%	0.482	50%	0.497	S	S	.	.	H	α-helix	trans	-65.9	-41.7	175.3	179.1	64.6	0	0	0	111.9	A448 H449 Q450 E455 K456	A448-L452 WeakPolarHBondContact O-CB 3.29Å; A448-L452 PolarHBondContact O-N 3.09Å; H449-L452 WeakPolarHBondContact O-CB 3.4Å; H449-L452 PolarHBondContact O-N 2.87Å; H449-L452 VanDerWaalsContact O-N 3.15Å; Q450-L452 VanDerWaalsContact C-N 3.28Å; Q450-L452 PolarHBondContact O-N 3.15Å; L452-E455 PolarHBondContact O-N 2.98Å; L452-K456 HydrophobicContact CG-CD 4.47Å; L452-K456 WeakPolarHBondContact O-CB 3.32Å; L452-K456 WeakPolarHBondContact O-CG 3.45Å; L452-K456 PolarHBondContact O-N 3.32Å
453	E	93.4	Very high	92.8	Very high	73 Å²	73	90.6 Å²	90.6	34%	0.341	48%	0.476	S	S	.	.	H	α-helix	trans	-67.4	-37.2	177.7	-68.5	-53	130.2	0	0	112.2	H449 Q450 K456 K457	H449-E453 IonicContact CE1-OE1 3.46Å; H449-E453 PolarHBondContact O-N 2.74Å; Q450-E453 PolarHBondContact O-N 3.28Å; E453-K456 PolarHBondContact O-N 2.99Å; E453-K456 IonicContact OE1-NZ 2.92Å; E453-K456 PolarHBondContact OE1-NZ 3.04Å; E453-K457 WeakPolarHBondContact O-CB 3.43Å; E453-K457 PolarHBondContact O-N 2.96Å
454	E	94.4	Very high	92.5	Very high	101 Å²	101	93 Å²	93	47%	0.472	47%	0.474	S	S	.	.	H	α-helix	trans	-61.9	-43.1	172	-72.8	174.3	-165.8	0	0	112	Q450 K457 K458	Q450-E454 WeakPolarHBondContact O-CG 3.32Å; Q450-E454 PolarHBondContact O-N 2.88Å; E454-K457 PolarHBondContact O-N 3.42Å; E454-K458 WeakPolarHBondContact O-CG 3.49Å; E454-K458 PolarHBondContact O-N 3.44Å
455	E	93.1	Very high	92.1	Very high	106 Å²	106	95.2 Å²	95.2	50%	0.495	48%	0.484	S	S	.	.	H	α-helix	trans	-69.3	-38.7	178.7	-165.3	64.7	-172.1	0	0	112.2	A451 L452 K457 K458 T459	A451-E455 WeakPolarHBondContact O-CB 3.42Å; A451-E455 PolarHBondContact O-N 3.45Å; L452-E455 PolarHBondContact O-N 2.98Å; E455-K457 VanDerWaalsContact C-N 3.35Å; E455-K458 PolarHBondContact O-N 3.04Å; E455-K458 IonicContact OE2-NZ 2.71Å; E455-T459 WeakPolarHBondContact O-CB 3.42Å; E455-T459 PolarHBondContact O-N 3.48Å; E455-T459 PolarHBondContact O-OG1 3.46Å
456	K	90	Very high	91.8	Very high	90 Å²	90	93.3 Å²	93.3	39%	0.391	47%	0.474	S	S	.	.	H	α-helix	trans	-59.3	-46.3	171.1	-78.3	176.8	-178.5	172.1	0	111.1	L452 E453 K458 T459 V460	L452-K456 HydrophobicContact CG-CD 4.47Å; L452-K456 WeakPolarHBondContact O-CB 3.32Å; L452-K456 WeakPolarHBondContact O-CG 3.45Å; L452-K456 PolarHBondContact O-N 3.32Å; E453-K456 PolarHBondContact O-N 2.99Å; E453-K456 IonicContact OE1-NZ 2.92Å; E453-K456 PolarHBondContact OE1-NZ 3.04Å; K456-K458 PolarHBondContact O-N 2.86Å; K456-T459 WeakPolarHBondContact O-CB 3.32Å; K456-T459 PolarHBondContact O-N 3.37Å; K456-V460 WeakPolarHBondContact O-CG2 3.09Å; K456-V460 PolarHBondContact O-N 2.86Å
457	K	89.9	Confident	91.5	Very high	138 Å²	138	87.5 Å²	87.5	60%	0.6	45%	0.446	S	S	*	.	H	α-helix	trans	-59.1	-48.2	178.2	-175.8	-179.6	176.2	-177.7	0	111.4	E453 E454 E455 T459 V460 D461	E453-K457 WeakPolarHBondContact O-CB 3.43Å; E453-K457 PolarHBondContact O-N 2.96Å; E454-K457 PolarHBondContact O-N 3.42Å; E455-K457 VanDerWaalsContact C-N 3.35Å; K457-T459 VanDerWaalsContact C-N 3.27Å; K457-T459 PolarHBondContact O-N 3.17Å; K457-V460 PolarHBondContact O-N 3.01Å; K457-V460 VanDerWaalsContact O-N 3.15Å; K457-D461 VanDerWaalsContact O-CG 3.29Å; K457-D461 PolarHBondContact O-N 2.82Å
458	K	91.5	Very high	91.3	Very high	122 Å²	122	81.1 Å²	81.1	53%	0.53	42%	0.418	S	S	.	.	H	α-helix	trans	-57.9	-40.1	175.4	-69.9	173.4	-167.8	163.2	0	112.4	E454 E455 K456 D461 L462	E454-K458 WeakPolarHBondContact O-CG 3.49Å; E454-K458 PolarHBondContact O-N 3.44Å; E455-K458 PolarHBondContact O-N 3.04Å; E455-K458 IonicContact OE2-NZ 2.71Å; K456-K458 PolarHBondContact O-N 2.86Å; K458-D461 PolarHBondContact O-N 3.07Å; K458-L462 VanDerWaalsContact O-CB 3.32Å; K458-L462 WeakPolarHBondContact O-CB 3.37Å; K458-L462 PolarHBondContact O-N 2.94Å
459	T	90.3	Very high	91	Very high	78 Å²	78	79.9 Å²	79.9	48%	0.479	41%	0.41	S	S	.	.	H	α-helix	trans	-65.3	-41.8	177.9	-56.5	0	0	0	0	111.5	E455 K456 K457 L463	E455-T459 WeakPolarHBondContact O-CB 3.42Å; E455-T459 PolarHBondContact O-N 3.48Å; E455-T459 PolarHBondContact O-OG1 3.46Å; K456-T459 WeakPolarHBondContact O-CB 3.32Å; K456-T459 PolarHBondContact O-N 3.37Å; K457-T459 VanDerWaalsContact C-N 3.27Å; K457-T459 PolarHBondContact O-N 3.17Å; T459-L463 PolarHBondContact O-N 3.48Å; T459-L463 VanDerWaalsContact O-N 3.13Å
460	V	89.6	Confident	90.7	Very high	36 Å²	36	83 Å²	83	22%	0.218	42%	0.422	C	S	.	.	H	α-helix	trans	-63.8	-52.5	174.9	173.3	0	0	0	0	110	K456 K457 L462 L463 Y464 W476	K456-V460 WeakPolarHBondContact O-CG2 3.09Å; K456-V460 PolarHBondContact O-N 2.86Å; K457-V460 PolarHBondContact O-N 3.01Å; K457-V460 VanDerWaalsContact O-N 3.15Å; V460-L462 VanDerWaalsContact C-N 3.27Å; V460-L462 PolarHBondContact O-N 3.21Å; V460-L463 WeakPolarHBondContact O-CA 3.46Å; V460-L463 WeakPolarHBondContact O-CB 3.39Å; V460-L463 PolarHBondContact O-N 2.74Å; V460-Y464 HydrophobicContact CG1-CD2 3.72Å; V460-Y464 HydrophobicContact CG1-CE2 3.62Å; V460-Y464 WeakPolarHBondContact O-CD2 3.41Å; V460-Y464 PolarHBondContact O-N 3.41Å; V460-W476 HydrophobicContact CG2-CD2 4.46Å; V460-W476 HydrophobicContact CG2-CG 4.4Å; V460-W476 HydrophobicContact CG2-CZ2 4.44Å
461	D	89.3	Confident	90.4	Very high	83 Å²	83	78.4 Å²	78.4	44%	0.444	40%	0.402	S	S	.	.	H	α-helix	trans	-55.2	-44	-180	-67.4	-18.9	0	0	0	111.2	K457 K458 L463 Y464 C465	K457-D461 VanDerWaalsContact O-CG 3.29Å; K457-D461 PolarHBondContact O-N 2.82Å; K458-D461 PolarHBondContact O-N 3.07Å; D461-L463 VanDerWaalsContact C-N 3.32Å; D461-L463 PolarHBondContact O-N 3.44Å; D461-Y464 PolarHBondContact O-N 3.34Å; D461-C465 PolarHBondContact O-N 3.37Å; D461-C465 PolarHBondContact O-SG 3.05Å
462	L	90.5	Very high	90.2	Very high	108 Å²	108	76.1 Å²	76.1	57%	0.565	38%	0.383	S	S	*	.	H	α-helix	trans	-60.3	-39.8	175.4	-178.2	63	0	0	0	112.6	K458 V460 C465 I466	K458-L462 VanDerWaalsContact O-CB 3.32Å; K458-L462 WeakPolarHBondContact O-CB 3.37Å; K458-L462 PolarHBondContact O-N 2.94Å; V460-L462 VanDerWaalsContact C-N 3.27Å; V460-L462 PolarHBondContact O-N 3.21Å; L462-C465 WeakPolarHBondContact O-CB 3.32Å; L462-C465 PolarHBondContact O-N 2.83Å; L462-I466 HydrophobicContact CD1-CD1 4.36Å; L462-I466 HydrophobicContact CG-CD1 4.26Å; L462-I466 WeakPolarHBondContact O-CG1 3.47Å; L462-I466 PolarHBondContact O-N 3.06Å
463	L	90.2	Very high	90	Very high	36 Å²	36	76.1 Å²	76.1	19%	0.188	38%	0.381	C	S	.	.	H	α-helix	trans	-67.2	-38.3	179	-164	69.6	0	0	0	111.7	T459 V460 D461 C465 I466 F467 A472 L475 W476	T459-L463 PolarHBondContact O-N 3.48Å; T459-L463 VanDerWaalsContact O-N 3.13Å; V460-L463 WeakPolarHBondContact O-CA 3.46Å; V460-L463 WeakPolarHBondContact O-CB 3.39Å; V460-L463 PolarHBondContact O-N 2.74Å; D461-L463 VanDerWaalsContact C-N 3.32Å; D461-L463 PolarHBondContact O-N 3.44Å; L463-C465 VanDerWaalsContact C-N 3.31Å; L463-I466 PolarHBondContact O-N 2.88Å; L463-F467 HydrophobicContact CD1-CD2 3.62Å; L463-F467 HydrophobicContact CD1-CE2 3.71Å; L463-F467 HydrophobicContact CG-CD2 4.1Å; L463-F467 PolarHBondContact O-N 2.97Å; L463-A472 HydrophobicContact CB-CB 4.49Å; L463-A472 HydrophobicContact CD2-CB 4.19Å; L463-A472 WeakPolarHBondContact CD2-O 3.42Å; L463-A472 HydrophobicContact CG-CB 3.97Å; L463-L475 HydrophobicContact CD2-CB 4.3Å; L463-W476 HydrophobicContact CD2-CB 3.76Å
464	Y	88.1	Confident	89.8	Confident	107 Å²	107	76.1 Å²	76.1	42%	0.42	38%	0.381	S	S	.	.	H	α-helix	trans	-71	-23.8	174.5	-82.6	-96.7	0	0	0	113.1	V460 D461 I466 A472	V460-Y464 HydrophobicContact CG1-CD2 3.72Å; V460-Y464 HydrophobicContact CG1-CE2 3.62Å; V460-Y464 WeakPolarHBondContact O-CD2 3.41Å; V460-Y464 PolarHBondContact O-N 3.41Å; D461-Y464 PolarHBondContact O-N 3.34Å; Y464-I466 VanDerWaalsContact C-N 3.33Å; Y464-A472 HydrophobicContact CD1-CB 4.21Å; Y464-A472 HydrophobicContact CD2-CB 3.95Å; Y464-A472 HydrophobicContact CE1-CB 4.32Å; Y464-A472 HydrophobicContact CE2-CB 4.06Å; Y464-A472 HydrophobicContact CG-CB 4.03Å
465	C	86	Confident	89.5	Confident	109 Å²	109	73.5 Å²	73.5	74%	0.736	37%	0.37	S	S	*	.	H	α-helix	trans	-71.2	-27.6	170.3	-67.3	0	0	0	0	112.9	D461 L462 L463	D461-C465 PolarHBondContact O-N 3.37Å; D461-C465 PolarHBondContact O-SG 3.05Å; L462-C465 WeakPolarHBondContact O-CB 3.32Å; L462-C465 PolarHBondContact O-N 2.83Å; L463-C465 VanDerWaalsContact C-N 3.31Å
466	I	87.9	Confident	89.2	Confident	87 Å²	87	75.5 Å²	75.5	45%	0.446	37%	0.373	S	S	.	.	H	α-helix	trans	-93.9	-42.5	-176.2	-60.5	166.7	0	0	0	111.2	L462 L463 Y464 Y532	L462-I466 HydrophobicContact CD1-CD1 4.36Å; L462-I466 HydrophobicContact CG-CD1 4.26Å; L462-I466 WeakPolarHBondContact O-CG1 3.47Å; L462-I466 PolarHBondContact O-N 3.06Å; L463-I466 PolarHBondContact O-N 2.88Å; Y464-I466 VanDerWaalsContact C-N 3.33Å; I466-Y532 PolarHBondContact O-OH 3.41Å
467	F	89.7	Confident	89.2	Confident	8 Å²	8	75.8 Å²	75.8	4%	0.035	38%	0.375	C	S	.	.	S	Bend	trans	-116.6	152.8	-172.3	-59.5	-79.3	0	0	0	112.5	L463 V471 A472 L475 P601	L463-F467 HydrophobicContact CD1-CD2 3.62Å; L463-F467 HydrophobicContact CD1-CE2 3.71Å; L463-F467 HydrophobicContact CG-CD2 4.1Å; L463-F467 PolarHBondContact O-N 2.97Å; F467-V471 HydrophobicContact CB-CB 4.25Å; F467-V471 HydrophobicContact CB-CG1 4.02Å; F467-V471 HydrophobicContact CD1-CG1 4.01Å; F467-V471 HydrophobicContact CG-CG1 4.25Å; F467-A472 HydrophobicContact CB-CB 4.12Å; F467-L475 HydrophobicContact CD1-CD1 4.1Å; F467-L475 HydrophobicContact CD2-CD1 3.96Å; F467-L475 HydrophobicContact CE1-CD1 4.1Å; F467-L475 HydrophobicContact CE2-CD1 3.95Å; F467-L475 HydrophobicContact CG-CD1 4.04Å; F467-L475 HydrophobicContact CZ-CD1 4.03Å; F467-P601 HydrophobicContact CE1-CB 4.28Å; F467-P601 HydrophobicContact CE2-CG 4.34Å; F467-P601 HydrophobicContact CZ-CB 3.81Å; F467-P601 HydrophobicContact CZ-CG 3.8Å; F467-P601 VanDerWaalsContact CZ-O 3.28Å; F467-P601 WeakPolarHBondContact CZ-O 3.14Å
468	P	89.7	Confident	89	Confident	10 Å²	10	72.4 Å²	72.4	7%	0.065	38%	0.38	C	S	.	.			trans	-55.9	144.6	168.3	-22.8	34.1	0	0	0	111.1	K470 V471 A472 Y532 H548 Y603	P468-K470 VanDerWaalsContact C-N 3.3Å; P468-K470 PolarHBondContact O-N 3.44Å; P468-K470 VanDerWaalsContact O-N 3.07Å; P468-V471 HydrophobicContact CB-CG2 4.37Å; P468-V471 HydrophobicContact CG-CG2 4.46Å; P468-V471 WeakPolarHBondContact O-CA 3.3Å; P468-V471 WeakPolarHBondContact O-CB 3.34Å; P468-V471 PolarHBondContact O-N 2.89Å; P468-A472 PolarHBondContact O-N 2.94Å; P468-Y532 HydrophobicContact CG-CD2 4.16Å; P468-Y532 HydrophobicContact CG-CE1 4.48Å; P468-Y532 HydrophobicContact CG-CE2 3.7Å; P468-H548 HydrophobicContact CB-CB 3.93Å; P468-H548 HydrophobicContact CG-CB 4.23Å; P468-Y603 HydrophobicContact CG-CD1 3.91Å; P468-Y603 HydrophobicContact CG-CE1 3.73Å
469	G	87.2	Confident	88.8	Confident	31 Å²	31	71.3 Å²	71.3	32%	0.32	38%	0.377	S	S	.	.	H	α-helix	trans	-55.2	-36.8	-167.8	0	0	0	0	0	116.1	Q473	G469-Q473 WeakPolarHBondContact O-CB 3.49Å; G469-Q473 PolarHBondContact O-N 3.18Å
470	K	87.8	Confident	88.5	Confident	171 Å²	171	72.9 Å²	72.9	74%	0.743	39%	0.386	S	S	*	.	H	α-helix	trans	-66.9	-38.9	174.8	-69.7	-173.3	177.1	-178.1	0	112.6	P468 Q474	P468-K470 VanDerWaalsContact C-N 3.3Å; P468-K470 PolarHBondContact O-N 3.44Å; P468-K470 VanDerWaalsContact O-N 3.07Å; K470-Q474 WeakPolarHBondContact O-CG 3.49Å; K470-Q474 PolarHBondContact O-N 2.89Å; K470-Q474 VanDerWaalsContact O-N 3.17Å
471	V	89.9	Confident	88.5	Confident	13 Å²	13	72.4 Å²	72.4	8%	0.079	38%	0.384	C	S	.	.	H	α-helix	trans	-70.8	-43.1	178.3	175.5	0	0	0	0	110	F467 P468 Q473 Q474 L475 V481 V595 Y603	F467-V471 HydrophobicContact CB-CB 4.25Å; F467-V471 HydrophobicContact CB-CG1 4.02Å; F467-V471 HydrophobicContact CD1-CG1 4.01Å; F467-V471 HydrophobicContact CG-CG1 4.25Å; P468-V471 HydrophobicContact CB-CG2 4.37Å; P468-V471 HydrophobicContact CG-CG2 4.46Å; P468-V471 WeakPolarHBondContact O-CA 3.3Å; P468-V471 WeakPolarHBondContact O-CB 3.34Å; P468-V471 PolarHBondContact O-N 2.89Å; V471-Q473 VanDerWaalsContact C-N 3.34Å; V471-Q473 PolarHBondContact O-N 2.75Å; V471-Q474 PolarHBondContact O-N 3.25Å; V471-L475 HydrophobicContact CG1-CD1 4.05Å; V471-L475 HydrophobicContact CG1-CG 4.48Å; V471-L475 WeakPolarHBondContact O-CB 3.45Å; V471-L475 WeakPolarHBondContact O-CG 3.43Å; V471-L475 PolarHBondContact O-N 2.85Å; V471-V481 HydrophobicContact CG1-CG1 4.12Å; V471-V481 HydrophobicContact CG1-CG2 4.06Å; V471-V481 HydrophobicContact CG2-CG1 4.24Å; V471-V595 HydrophobicContact CG1-CG2 3.65Å; V471-Y603 HydrophobicContact CG1-CD2 4.42Å; V471-Y603 HydrophobicContact CG2-CD2 4.46Å; V471-Y603 HydrophobicContact CG2-CE2 4.01Å
472	A	90.8	Very high	88.4	Confident	0 Å²	0	75.5 Å²	75.5	0%	0	40%	0.395	C	S	.	.	H	α-helix	trans	-57.6	-46.7	174.3	0	0	0	0	0	111.3	L463 Y464 F467 P468 Q474 L475 W476	L463-A472 HydrophobicContact CB-CB 4.49Å; L463-A472 HydrophobicContact CD2-CB 4.19Å; L463-A472 WeakPolarHBondContact CD2-O 3.42Å; L463-A472 HydrophobicContact CG-CB 3.97Å; Y464-A472 HydrophobicContact CD1-CB 4.21Å; Y464-A472 HydrophobicContact CD2-CB 3.95Å; Y464-A472 HydrophobicContact CE1-CB 4.32Å; Y464-A472 HydrophobicContact CE2-CB 4.06Å; Y464-A472 HydrophobicContact CG-CB 4.03Å; F467-A472 HydrophobicContact CB-CB 4.12Å; P468-A472 PolarHBondContact O-N 2.94Å; A472-Q474 PolarHBondContact O-N 3.04Å; A472-L475 PolarHBondContact O-N 3.26Å; A472-W476 VanDerWaalsContact O-CB 3.32Å; A472-W476 WeakPolarHBondContact O-CB 3.31Å; A472-W476 PolarHBondContact O-N 2.95Å
473	Q	89.9	Confident	88.4	Confident	92 Å²	92	73.9 Å²	73.9	43%	0.43	40%	0.398	S	S	.	.	H	α-helix	trans	-61	-46.1	178.7	-172.6	176.4	5.1	0	0	112.6	G469 V471 W476 Q477	G469-Q473 WeakPolarHBondContact O-CB 3.49Å; G469-Q473 PolarHBondContact O-N 3.18Å; V471-Q473 VanDerWaalsContact C-N 3.34Å; V471-Q473 PolarHBondContact O-N 2.75Å; Q473-W476 PolarHBondContact O-N 3.15Å; Q473-Q477 VanDerWaalsContact O-CG 3.29Å; Q473-Q477 WeakPolarHBondContact O-CG 3.37Å; Q473-Q477 PolarHBondContact O-N 2.91Å
474	Q	90	Very high	88.5	Confident	72 Å²	72	76.8 Å²	76.8	34%	0.336	41%	0.409	S	S	.	.	H	α-helix	trans	-61.9	-45.8	177.5	-74	-179	-30.5	0	0	111.7	K470 V471 A472 W476 Q477 G478 E479 V481	K470-Q474 WeakPolarHBondContact O-CG 3.49Å; K470-Q474 PolarHBondContact O-N 2.89Å; K470-Q474 VanDerWaalsContact O-N 3.17Å; V471-Q474 PolarHBondContact O-N 3.25Å; A472-Q474 PolarHBondContact O-N 3.04Å; Q474-W476 VanDerWaalsContact C-N 3.34Å; Q474-W476 PolarHBondContact O-N 3.24Å; Q474-Q477 PolarHBondContact O-N 2.95Å; Q474-G478 PolarHBondContact O-N 3.49Å; Q474-E479 HydrophobicContact CB-CB 4.25Å; Q474-E479 WeakPolarHBondContact O-CB 3.39Å; Q474-E479 PolarHBondContact O-N 3.49Å; Q474-V481 HydrophobicContact CB-CG2 3.95Å
475	L	88.4	Confident	88.8	Confident	46 Å²	46	77.2 Å²	77.2	24%	0.241	41%	0.413	C	S	.	.	H	α-helix	trans	-63.3	-39.5	177	-71.1	174.9	0	0	0	112.1	L463 F467 V471 A472 Q477 G478 V481 V595	L463-L475 HydrophobicContact CD2-CB 4.3Å; F467-L475 HydrophobicContact CD1-CD1 4.1Å; F467-L475 HydrophobicContact CD2-CD1 3.96Å; F467-L475 HydrophobicContact CE1-CD1 4.1Å; F467-L475 HydrophobicContact CE2-CD1 3.95Å; F467-L475 HydrophobicContact CG-CD1 4.04Å; F467-L475 HydrophobicContact CZ-CD1 4.03Å; V471-L475 HydrophobicContact CG1-CD1 4.05Å; V471-L475 HydrophobicContact CG1-CG 4.48Å; V471-L475 WeakPolarHBondContact O-CB 3.45Å; V471-L475 WeakPolarHBondContact O-CG 3.43Å; V471-L475 PolarHBondContact O-N 2.85Å; A472-L475 PolarHBondContact O-N 3.26Å; L475-Q477 VanDerWaalsContact C-N 3.3Å; L475-Q477 PolarHBondContact O-N 3.13Å; L475-G478 PolarHBondContact O-N 3.32Å; L475-G478 VanDerWaalsContact O-N 3.09Å; L475-V481 HydrophobicContact CD2-CG2 3.79Å; L475-V481 HydrophobicContact CG-CG2 3.8Å; L475-V595 HydrophobicContact CD1-CG2 4.48Å
476	W	87.4	Confident	89.1	Confident	148 Å²	148	73 Å²	73	56%	0.561	38%	0.382	S	S	*	.	H	α-helix	trans	-64.8	-35	176.9	-177.7	74.4	0	0	0	112.5	V460 L463 A472 Q473 Q474 G478	V460-W476 HydrophobicContact CG2-CD2 4.46Å; V460-W476 HydrophobicContact CG2-CG 4.4Å; V460-W476 HydrophobicContact CG2-CZ2 4.44Å; L463-W476 HydrophobicContact CD2-CB 3.76Å; A472-W476 VanDerWaalsContact O-CB 3.32Å; A472-W476 WeakPolarHBondContact O-CB 3.31Å; A472-W476 PolarHBondContact O-N 2.95Å; Q473-W476 PolarHBondContact O-N 3.15Å; Q474-W476 VanDerWaalsContact C-N 3.34Å; Q474-W476 PolarHBondContact O-N 3.24Å; W476-G478 PolarHBondContact O-N 3.17Å
477	Q	88.6	Confident	89.3	Confident	96 Å²	96	73.7 Å²	73.7	45%	0.449	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-4.1	174.8	-69.2	170.8	-11.7	0	0	113.2	Q473 Q474 L475 E479	Q473-Q477 VanDerWaalsContact O-CG 3.29Å; Q473-Q477 WeakPolarHBondContact O-CG 3.37Å; Q473-Q477 PolarHBondContact O-N 2.91Å; Q474-Q477 PolarHBondContact O-N 2.95Å; L475-Q477 VanDerWaalsContact C-N 3.3Å; L475-Q477 PolarHBondContact O-N 3.13Å; Q477-E479 VanDerWaalsContact C-N 3.27Å; Q477-E479 HydrophobicContact CB-CG 4.04Å
478	G	85.4	Confident	89.5	Confident	67 Å²	67	79.2 Å²	79.2	69%	0.691	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.5	15	-175.9	0	0	0	0	0	113.7	Q474 L475 W476	Q474-G478 PolarHBondContact O-N 3.49Å; L475-G478 PolarHBondContact O-N 3.32Å; L475-G478 VanDerWaalsContact O-N 3.09Å; W476-G478 PolarHBondContact O-N 3.17Å
479	E	87.7	Confident	89.8	Confident	99 Å²	99	78.8 Å²	78.8	46%	0.463	41%	0.41	S	S	.	.			trans	-80.3	148.8	177.4	-59.9	-172.5	165.6	0	0	111.4	Q474 Q477	Q474-E479 HydrophobicContact CB-CB 4.25Å; Q474-E479 WeakPolarHBondContact O-CB 3.39Å; Q474-E479 PolarHBondContact O-N 3.49Å; Q477-E479 VanDerWaalsContact C-N 3.27Å; Q477-E479 HydrophobicContact CB-CG 4.04Å
480	T	84.9	Confident	90.3	Very high	111 Å²	111	77.3 Å²	77.3	68%	0.681	39%	0.394	S	S	*	.			trans	-79.1	124.6	174.6	58.8	0	0	0	0	110.6	Q482	T480-Q482 PolarHBondContact O-N 3.02Å
481	V	88.2	Confident	90.7	Very high	27 Å²	27	69.2 Å²	69.2	16%	0.164	36%	0.359	C	S	.	.			trans	-82.4	112.7	176.9	-176.5	0	0	0	0	109.9	V471 Q474 L475 V595	V471-V481 HydrophobicContact CG1-CG1 4.12Å; V471-V481 HydrophobicContact CG1-CG2 4.06Å; V471-V481 HydrophobicContact CG2-CG1 4.24Å; Q474-V481 HydrophobicContact CB-CG2 3.95Å; L475-V481 HydrophobicContact CD2-CG2 3.79Å; L475-V481 HydrophobicContact CG-CG2 3.8Å; V481-V595 HydrophobicContact CB-CB 4.28Å; V481-V595 HydrophobicContact CB-CG2 3.84Å; V481-V595 HydrophobicContact CG1-CG2 3.85Å; V481-V595 HydrophobicContact CG2-CG2 4.16Å
482	Q	88.6	Confident	91.1	Very high	147 Å²	147	68.6 Å²	68.6	69%	0.687	36%	0.355	S	S	*	.			trans	-77.2	147.8	176.3	-63.5	-62.9	-32.7	0	0	111.3	T480 K484	T480-Q482 PolarHBondContact O-N 3.02Å; Q482-K484 PolarHBondContact O-N 3.35Å
483	A	90.3	Very high	91.3	Very high	75 Å²	75	70 Å²	70	62%	0.62	36%	0.362	S	S	*	.			trans	-65.7	131.4	174.7	0	0	0	0	0	110.6	A593	A483-A593 CarbonylContact C-O 3.54Å; A483-A593 WeakPolarHBondContact CA-O 3.37Å
484	K	91.9	Very high	91.5	Very high	96 Å²	96	65.7 Å²	65.7	42%	0.417	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	138.5	179.4	-176.1	179.5	172.8	-160.9	0	110.2	Q482 F486 E550 A593	Q482-K484 PolarHBondContact O-N 3.35Å; K484-F486 HydrophobicContact CB-CD2 4.46Å; K484-F486 HydrophobicContact CB-CE2 3.76Å; K484-F486 HydrophobicContact CB-CZ 4.18Å; K484-F486 HydrophobicContact CD-CE1 4.02Å; K484-F486 HydrophobicContact CD-CE2 4.07Å; K484-F486 HydrophobicContact CD-CZ 3.69Å; K484-F486 HydrophobicContact CG-CD2 4.37Å; K484-F486 HydrophobicContact CG-CE2 3.91Å; K484-F486 HydrophobicContact CG-CZ 4.08Å; K484-F486 WeakPolarHBondContact O-CD2 3.48Å; K484-E550 IonicContact NZ-OE1 3.05Å; K484-E550 PolarHBondContact NZ-OE1 3.02Å; K484-A593 PolarHBondContact N-O 2.91Å; K484-A593 PolarHBondContact O-N 2.82Å
485	K	93.6	Very high	91.7	Very high	116 Å²	116	63.6 Å²	63.6	50%	0.504	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	132.3	168.7	-169.2	-172	179	-134.2	0	109.4	D487 V591 L592	K485-D487 VanDerWaalsContact CE-OD1 3.32Å; K485-D487 WeakPolarHBondContact CE-OD1 3.5Å; K485-D487 IonicContact NZ-OD1 3.2Å; K485-D487 PolarHBondContact NZ-OD1 2.82Å; K485-V591 WeakPolarHBondContact CA-O 3.32Å; K485-L592 HydrophobicContact CB-CD2 3.85Å; K485-L592 HydrophobicContact CG-CD2 4.29Å
486	F	94.2	Very high	91.9	Very high	21 Å²	21	61.9 Å²	61.9	9%	0.092	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	123	174.7	-64.3	-97.6	0	0	0	108.3	K484 V489 L547 S590 V591 A593	K484-F486 HydrophobicContact CB-CD2 4.46Å; K484-F486 HydrophobicContact CB-CE2 3.76Å; K484-F486 HydrophobicContact CB-CZ 4.18Å; K484-F486 HydrophobicContact CD-CE1 4.02Å; K484-F486 HydrophobicContact CD-CE2 4.07Å; K484-F486 HydrophobicContact CD-CZ 3.69Å; K484-F486 HydrophobicContact CG-CD2 4.37Å; K484-F486 HydrophobicContact CG-CE2 3.91Å; K484-F486 HydrophobicContact CG-CZ 4.08Å; K484-F486 WeakPolarHBondContact O-CD2 3.48Å; F486-V489 HydrophobicContact CB-CG2 3.54Å; F486-V489 HydrophobicContact CG-CG2 4.43Å; F486-L547 HydrophobicContact CD2-CD1 4.02Å; F486-L547 WeakPolarHBondContact CE1-O 3.43Å; F486-L547 HydrophobicContact CE2-CD1 4.13Å; F486-L547 HydrophobicContact CG-CD1 4.3Å; F486-L547 HydrophobicContact CZ-CD1 4.47Å; F486-S590 CarbonylContact O-C 3.6Å; F486-S590 WeakPolarHBondContact O-CA 3.28Å; F486-S590 WeakPolarHBondContact O-CB 3.42Å; F486-V591 HydrophobicContact CB-CG2 4.13Å; F486-V591 PolarHBondContact N-O 2.85Å; F486-V591 PolarHBondContact O-N 3Å; F486-A593 HydrophobicContact CD2-CB 4.06Å; F486-A593 HydrophobicContact CE2-CB 3.8Å
487	D	92.3	Very high	92.1	Very high	102 Å²	102	57.1 Å²	57.1	55%	0.545	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	-31.7	-172.7	-66.4	-50.2	0	0	0	113.5	K485 S590	K485-D487 VanDerWaalsContact CE-OD1 3.32Å; K485-D487 WeakPolarHBondContact CE-OD1 3.5Å; K485-D487 IonicContact NZ-OD1 3.2Å; K485-D487 PolarHBondContact NZ-OD1 2.82Å; D487-S590 WeakPolarHBondContact O-CA 3.44Å; D487-S590 PolarHBondContact O-N 3.45Å
488	Q	92.9	Very high	92	Very high	124 Å²	124	54.6 Å²	54.6	58%	0.579	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.9	84.4	-176.5	-64.4	-175.3	10.6	0	0	110.7
489	V	96.6	Very high	92.2	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	135.8	176.7	178.4	0	0	0	0	109.4	F486 M491 A544 G545 S588 G589 V591	F486-V489 HydrophobicContact CB-CG2 3.54Å; F486-V489 HydrophobicContact CG-CG2 4.43Å; V489-M491 HydrophobicContact CG1-CG 4.21Å; V489-A544 HydrophobicContact CG1-CB 4.17Å; V489-G545 WeakPolarHBondContact CA-O 3.4Å; V489-G545 WeakPolarHBondContact CG1-O 3.46Å; V489-S588 VanDerWaalsContact O-CA 3.31Å; V489-S588 WeakPolarHBondContact O-CA 3Å; V489-G589 PolarHBondContact N-O 2.83Å; V489-G589 PolarHBondContact O-N 3.26Å; V489-G589 VanDerWaalsContact O-O 3.14Å; V489-V591 HydrophobicContact CB-CG1 4.5Å; V489-V591 HydrophobicContact CB-CG2 3.89Å; V489-V591 HydrophobicContact CG1-CG2 4.02Å; V489-V591 HydrophobicContact CG2-CG2 3.66Å
490	T	97.4	Very high	92.2	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	123.8	168.2	-59.1	0	0	0	0	109	A544 G545 H554 A555 I558 H587 S588 T631	T490-A544 WeakPolarHBondContact O-CA 3.36Å; T490-G545 PolarHBondContact N-O 3.46Å; T490-G545 VanDerWaalsContact N-O 3.11Å; T490-G545 PolarHBondContact O-N 2.9Å; T490-H554 PolarHBondContact N-ND1 3.5Å; T490-H554 PolarHBondContact OG1-CE1 3.43Å; T490-H554 PolarHBondContact OG1-ND1 2.92Å; T490-A555 WeakPolarHBondContact OG1-CA 3.32Å; T490-I558 HydrophobicContact CG2-CB 3.92Å; T490-I558 HydrophobicContact CG2-CG1 4.37Å; T490-I558 HydrophobicContact CG2-CG2 3.71Å; T490-H587 WeakPolarHBondContact CA-O 3.49Å; T490-S588 WeakPolarHBondContact CG2-OG 3.22Å; T490-S588 PolarHBondContact OG1-OG 3.48Å; T490-T631 HydrophobicContact CG2-CG2 4.12Å
491	M	96.6	Very high	92.4	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.005	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	139.5	177.4	-64.3	164.4	-75.4	0	0	109.9	V489 F493 L586 H587 V591 L605 N609 V610 A613	V489-M491 HydrophobicContact CG1-CG 4.21Å; M491-F493 HydrophobicContact CB-CD2 4.41Å; M491-F493 HydrophobicContact CB-CE2 4.17Å; M491-L586 WeakPolarHBondContact O-CA 3.13Å; M491-H587 PolarHBondContact N-O 2.84Å; M491-H587 PolarHBondContact O-N 3.32Å; M491-V591 HydrophobicContact CE-CG1 3.71Å; M491-V591 HydrophobicContact SD-CG1 3.66Å; M491-L605 HydrophobicContact CG-CD1 4.46Å; M491-N609 HydrophobicContact CE-CB 3.86Å; M491-N609 VanDerWaalsContact CE-O 3.3Å; M491-N609 WeakPolarHBondContact CE-O 3.09Å; M491-V610 HydrophobicContact SD-CB 4.16Å; M491-V610 HydrophobicContact SD-CG1 4.45Å; M491-V610 HydrophobicContact SD-CG2 3.77Å; M491-A613 HydrophobicContact CB-CB 3.95Å; M491-A613 HydrophobicContact CE-CB 4.07Å; M491-A613 HydrophobicContact SD-CB 4.26Å
492	L	96.9	Very high	92.3	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	123.1	170.3	-176.8	168.2	0	0	0	107.5	C542 V543 I558 M561 A562 M565 I584 G585 L586	L492-C542 WeakPolarHBondContact O-CA 3.37Å; L492-V543 HydrophobicContact CB-CG2 3.58Å; L492-V543 HydrophobicContact CD1-CG2 3.81Å; L492-V543 HydrophobicContact CD2-CG2 4.17Å; L492-V543 HydrophobicContact CG-CG2 4.06Å; L492-V543 PolarHBondContact N-O 3.39Å; L492-V543 PolarHBondContact O-N 3.43Å; L492-I558 HydrophobicContact CB-CG2 3.71Å; L492-I558 HydrophobicContact CD1-CG2 4.12Å; L492-I558 HydrophobicContact CG-CG2 4.49Å; L492-M561 HydrophobicContact CD1-CG 4.34Å; L492-A562 HydrophobicContact CD1-CB 3.69Å; L492-M565 HydrophobicContact CD1-SD 3.87Å; L492-M565 HydrophobicContact CD2-CE 4.15Å; L492-M565 HydrophobicContact CD2-SD 3.81Å; L492-I584 HydrophobicContact CD1-CG2 4.12Å; L492-I584 HydrophobicContact CD2-CG2 3.76Å; L492-I584 HydrophobicContact CG-CG2 3.64Å; L492-G585 WeakPolarHBondContact CA-O 3.37Å; L492-L586 HydrophobicContact CB-CD2 3.86Å; L492-L586 HydrophobicContact CD1-CD2 4.05Å; L492-L586 HydrophobicContact CG-CD2 3.91Å
493	F	96	Very high	92.4	Very high	29 Å²	29	46.7 Å²	46.7	13%	0.127	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	131	168	-80.3	-103.3	0	0	0	108	M491 C542 I584 G585 V610 A613 N614 E617	M491-F493 HydrophobicContact CB-CD2 4.41Å; M491-F493 HydrophobicContact CB-CE2 4.17Å; F493-C542 WeakPolarHBondContact CD1-SG 3.43Å; F493-C542 WeakPolarHBondContact CE1-SG 3.43Å; F493-I584 CarbonylContact O-C 3.49Å; F493-I584 WeakPolarHBondContact O-CA 3.2Å; F493-G585 PolarHBondContact N-O 3.36Å; F493-G585 PolarHBondContact O-N 3.05Å; F493-V610 HydrophobicContact CE2-CG1 4.37Å; F493-V610 HydrophobicContact CZ-CG1 3.87Å; F493-A613 HydrophobicContact CD2-CB 3.57Å; F493-A613 HydrophobicContact CE2-CB 3.61Å; F493-N614 HydrophobicContact CD1-CB 3.94Å; F493-N614 HydrophobicContact CE1-CB 3.97Å; F493-N614 HydrophobicContact CG-CB 4.32Å; F493-N614 HydrophobicContact CZ-CB 4.36Å; F493-E617 HydrophobicContact CB-CB 3.69Å; F493-E617 HydrophobicContact CB-CG 4.14Å
494	S	94.6	Very high	92.4	Very high	3 Å²	3	47.3 Å²	47.3	2%	0.021	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	155.8	170.8	76.5	0	0	0	0	111.4	A540 Y541 M565 R583	S494-A540 WeakPolarHBondContact O-CA 3.32Å; S494-A540 WeakPolarHBondContact O-CB 3.35Å; S494-Y541 PolarHBondContact N-O 3.3Å; S494-Y541 PolarHBondContact O-N 3.46Å; S494-Y541 VanDerWaalsContact O-N 3.14Å; S494-Y541 VanDerWaalsContact OG-CB 3.3Å; S494-Y541 WeakPolarHBondContact OG-CB 3.49Å; S494-Y541 PolarHBondContact OG-N 2.98Å; S494-Y541 PolarHBondContact OG-O 3.19Å; S494-Y541 VanDerWaalsContact OG-O 3.13Å; S494-M565 WeakPolarHBondContact OG-CE 3.3Å; S494-R583 CarbonylContact C-O 3.59Å; S494-R583 WeakPolarHBondContact CA-O 3.25Å
495	D	94.1	Very high	92.3	Very high	28 Å²	28	48.2 Å²	48.2	15%	0.15	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	149.8	176.1	-171.6	42.8	0	0	0	110.7	D539 M582 R583 E617	D495-D539 VanDerWaalsContact OD1-OD2 3.12Å; D495-M582 WeakPolarHBondContact O-CA 3.38Å; D495-R583 PolarHBondContact N-O 3.01Å; D495-R583 PolarHBondContact O-N 3.27Å; D495-R583 IonicContact OD2-CZ 2.78Å; D495-R583 IonicContact OD2-NE 3.55Å; D495-R583 IonicContact OD2-NH2 2.85Å; D495-R583 PolarHBondContact OD2-NH2 3.49Å; D495-E617 HydrophobicContact CB-CG 4.18Å; D495-E617 WeakPolarHBondContact CB-OE1 3.44Å
496	L	92.4	Very high	92.2	Very high	9 Å²	9	43.6 Å²	43.6	5%	0.047	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	120	179.5	-64	-170.1	0	0	0	110.1	G498 F499 M514 L515 L518 D539 I580 M582	L496-G498 PolarHBondContact O-N 3.46Å; L496-F499 HydrophobicContact CB-CB 3.86Å; L496-F499 HydrophobicContact CB-CD2 4.31Å; L496-F499 HydrophobicContact CB-CG 4.39Å; L496-F499 HydrophobicContact CD1-CD2 3.85Å; L496-F499 HydrophobicContact CD1-CE2 4.35Å; L496-F499 PolarHBondContact O-N 3.28Å; L496-M514 HydrophobicContact CD1-CE 4.33Å; L496-L515 HydrophobicContact CD1-CD2 3.78Å; L496-L518 HydrophobicContact CD1-CD2 4.27Å; L496-L518 HydrophobicContact CD2-CD2 3.89Å; L496-D539 HydrophobicContact CB-CB 4.39Å; L496-D539 HydrophobicContact CD1-CB 4.25Å; L496-D539 HydrophobicContact CG-CB 4.28Å; L496-I580 HydrophobicContact CD2-CG2 3.58Å; L496-M582 HydrophobicContact CD2-CG 3.71Å; L496-M582 HydrophobicContact CD2-SD 3.91Å
497	V	91.3	Very high	92.1	Very high	48 Å²	48	46 Å²	46	29%	0.291	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	123	-178.2	-178.8	0	0	0	0	109.6	F499 Q581 R583 P622	V497-F499 VanDerWaalsContact C-N 3.3Å; V497-F499 PolarHBondContact O-N 2.91Å; V497-Q581 HydrophobicContact CB-CB 4Å; V497-Q581 HydrophobicContact CG2-CB 4.23Å; V497-Q581 PolarHBondContact N-O 3.33Å; V497-R583 HydrophobicContact CG2-CG 3.69Å; V497-P622 HydrophobicContact CG1-CB 4.37Å; V497-P622 HydrophobicContact CG1-CG 4.18Å; V497-P622 HydrophobicContact CG2-CB 3.99Å; V497-P622 HydrophobicContact CG2-CG 4.19Å
498	G	86.6	Confident	92	Very high	43 Å²	43	46 Å²	46	44%	0.443	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.5	13.2	176.9	0	0	0	0	0	114.5	L496 T500 A501 V502	L496-G498 PolarHBondContact O-N 3.46Å; G498-T500 VanDerWaalsContact C-N 3.27Å; G498-T500 PolarHBondContact O-N 2.95Å; G498-A501 WeakPolarHBondContact O-CA 3.47Å; G498-A501 WeakPolarHBondContact O-CB 3.32Å; G498-A501 PolarHBondContact O-N 3.33Å; G498-V502 PolarHBondContact O-N 3.27Å; G498-V502 VanDerWaalsContact O-N 3.08Å
499	F	88.5	Confident	92	Very high	31 Å²	31	46.6 Å²	46.6	14%	0.136	30%	0.299	C	S	.	.	H	α-helix	trans	-54.3	-40.4	-179.5	-178.4	-103.7	0	0	0	113.8	L496 V497 A501 V502 C503 V511 M514 L515 D539	L496-F499 HydrophobicContact CB-CB 3.86Å; L496-F499 HydrophobicContact CB-CD2 4.31Å; L496-F499 HydrophobicContact CB-CG 4.39Å; L496-F499 HydrophobicContact CD1-CD2 3.85Å; L496-F499 HydrophobicContact CD1-CE2 4.35Å; L496-F499 PolarHBondContact O-N 3.28Å; V497-F499 VanDerWaalsContact C-N 3.3Å; V497-F499 PolarHBondContact O-N 2.91Å; F499-A501 VanDerWaalsContact C-N 3.26Å; F499-A501 PolarHBondContact O-N 2.85Å; F499-V502 PolarHBondContact O-N 3.37Å; F499-C503 WeakPolarHBondContact CE1-SG 3.45Å; F499-C503 WeakPolarHBondContact CZ-SG 3.39Å; F499-C503 WeakPolarHBondContact O-CB 3.28Å; F499-C503 PolarHBondContact O-N 3.07Å; F499-C503 PolarHBondContact O-SG 3.23Å; F499-V511 HydrophobicContact CE2-CG1 3.76Å; F499-V511 HydrophobicContact CZ-CG1 3.81Å; F499-M514 HydrophobicContact CD2-CE 4.29Å; F499-M514 HydrophobicContact CE2-CE 4.09Å; F499-L515 HydrophobicContact CE2-CD1 3.99Å; F499-L515 HydrophobicContact CE2-CD2 3.91Å; F499-L515 HydrophobicContact CE2-CG 4.14Å; F499-L515 HydrophobicContact CZ-CD1 3.89Å; F499-L515 HydrophobicContact CZ-CD2 4.49Å; F499-D539 HydrophobicContact CB-CB 4.29Å; F499-D539 WeakPolarHBondContact CB-OD2 3.32Å; F499-D539 HydrophobicContact CD1-CB 3.47Å; F499-D539 VanDerWaalsContact CD1-CB 3.47Å; F499-D539 WeakPolarHBondContact CD1-OD2 3.37Å; F499-D539 HydrophobicContact CD2-CB 3.81Å; F499-D539 HydrophobicContact CE1-CB 3.62Å; F499-D539 HydrophobicContact CE2-CB 3.94Å; F499-D539 HydrophobicContact CG-CB 3.58Å; F499-D539 WeakPolarHBondContact CG-OD2 3.34Å; F499-D539 HydrophobicContact CZ-CB 3.85Å
500	T	88.9	Confident	91.7	Very high	119 Å²	119	51 Å²	51	73%	0.73	32%	0.319	S	S	*	.	H	α-helix	trans	-59.7	-37.2	175.8	-46	0	0	0	0	112.2	G498 A504	G498-T500 VanDerWaalsContact C-N 3.27Å; G498-T500 PolarHBondContact O-N 2.95Å; T500-A504 PolarHBondContact O-N 2.8Å; T500-A504 VanDerWaalsContact O-N 3.13Å
501	A	88.3	Confident	91.4	Very high	63 Å²	63	51.5 Å²	51.5	52%	0.521	32%	0.322	S	S	.	.	H	α-helix	trans	-71.1	-42	177	0	0	0	0	0	111.2	G498 F499 C503 A504 V505	G498-A501 WeakPolarHBondContact O-CA 3.47Å; G498-A501 WeakPolarHBondContact O-CB 3.32Å; G498-A501 PolarHBondContact O-N 3.33Å; F499-A501 VanDerWaalsContact C-N 3.26Å; F499-A501 PolarHBondContact O-N 2.85Å; A501-C503 VanDerWaalsContact C-N 3.32Å; A501-C503 PolarHBondContact O-N 3.48Å; A501-A504 PolarHBondContact O-N 3.22Å; A501-A504 VanDerWaalsContact O-N 3.16Å; A501-V505 WeakPolarHBondContact O-CG2 2.95Å; A501-V505 PolarHBondContact O-N 3.39Å
502	V	87.4	Confident	91.2	Very high	20 Å²	20	55.6 Å²	55.6	12%	0.121	34%	0.343	C	S	.	.	H	α-helix	trans	-59.3	-44.4	174.2	178.2	0	0	0	0	110.7	G498 F499 A504 V505 C506 T574	G498-V502 PolarHBondContact O-N 3.27Å; G498-V502 VanDerWaalsContact O-N 3.08Å; F499-V502 PolarHBondContact O-N 3.37Å; V502-A504 VanDerWaalsContact C-N 3.28Å; V502-A504 PolarHBondContact O-N 3.27Å; V502-V505 PolarHBondContact O-N 3.01Å; V502-C506 HydrophobicContact CG1-CB 4.48Å; V502-C506 VanDerWaalsContact O-CB 3.27Å; V502-C506 WeakPolarHBondContact O-CB 3.3Å; V502-C506 PolarHBondContact O-N 3.35Å; V502-C506 PolarHBondContact O-SG 2.95Å; V502-C506 VanDerWaalsContact O-SG 3.36Å; V502-T574 HydrophobicContact CG2-CG2 4.38Å
503	C	89.3	Confident	90.9	Very high	52 Å²	52	59.3 Å²	59.3	35%	0.351	37%	0.366	S	S	.	.	H	α-helix	trans	-65	-28.8	177.3	-67.9	0	0	0	0	113.9	F499 A501	F499-C503 WeakPolarHBondContact CE1-SG 3.45Å; F499-C503 WeakPolarHBondContact CZ-SG 3.39Å; F499-C503 WeakPolarHBondContact O-CB 3.28Å; F499-C503 PolarHBondContact O-N 3.07Å; F499-C503 PolarHBondContact O-SG 3.23Å; A501-C503 VanDerWaalsContact C-N 3.32Å; A501-C503 PolarHBondContact O-N 3.48Å
504	A	90.1	Very high	90.7	Very high	88 Å²	88	58.4 Å²	58.4	73%	0.727	36%	0.362	S	S	*	.	H	α-helix	trans	-76.4	-25.5	178.3	0	0	0	0	0	112.9	T500 A501 V502	T500-A504 PolarHBondContact O-N 2.8Å; T500-A504 VanDerWaalsContact O-N 3.13Å; A501-A504 PolarHBondContact O-N 3.22Å; A501-A504 VanDerWaalsContact O-N 3.16Å; V502-A504 VanDerWaalsContact C-N 3.28Å; V502-A504 PolarHBondContact O-N 3.27Å
505	V	89.9	Confident	90.5	Very high	116 Å²	116	59.4 Å²	59.4	70%	0.703	37%	0.367	S	S	*	.	H	α-helix	trans	-105.3	-28.8	-173.3	-179.2	0	0	0	0	112.5	A501 V502	A501-V505 WeakPolarHBondContact O-CG2 2.95Å; A501-V505 PolarHBondContact O-N 3.39Å; V502-V505 PolarHBondContact O-N 3.01Å
506	C	91.1	Very high	90.4	Very high	18 Å²	18	62.6 Å²	62.6	12%	0.122	38%	0.384	C	S	.	.	S	Bend	trans	-98.7	159.8	-175.6	-57.4	0	0	0	0	112.8	V502 V511 P575	V502-C506 HydrophobicContact CG1-CB 4.48Å; V502-C506 VanDerWaalsContact O-CB 3.27Å; V502-C506 WeakPolarHBondContact O-CB 3.3Å; V502-C506 PolarHBondContact O-N 3.35Å; V502-C506 PolarHBondContact O-SG 2.95Å; V502-C506 VanDerWaalsContact O-SG 3.36Å; C506-V511 HydrophobicContact CB-CG2 3.98Å; C506-P575 HydrophobicContact CB-CB 4.2Å; C506-P575 HydrophobicContact CB-CG 4.21Å
507	T	92.9	Very high	90.4	Very high	72 Å²	72	66.1 Å²	66.1	44%	0.442	40%	0.401	S	S	.	.			trans	-70.8	146.1	173.9	66.3	0	0	0	0	110.8	M509 Q510 V511	T507-M509 PolarHBondContact O-N 3.36Å; T507-M509 VanDerWaalsContact O-N 3.12Å; T507-Q510 VanDerWaalsContact N-OE1 3.12Å; T507-Q510 PolarHBondContact O-N 3.31Å; T507-Q510 VanDerWaalsContact OG1-CD 3.25Å; T507-Q510 VanDerWaalsContact OG1-CG 3.25Å; T507-Q510 WeakPolarHBondContact OG1-CG 3.36Å; T507-Q510 PolarHBondContact OG1-N 3Å; T507-Q510 PolarHBondContact OG1-OE1 3.39Å; T507-V511 PolarHBondContact O-N 3.11Å
508	P	91.2	Very high	90.4	Very high	103 Å²	103	63.9 Å²	63.9	67%	0.669	39%	0.387	S	S	*	.	H	α-helix	trans	-54.3	-35.1	178.1	-28.6	35.3	0	0	0	113.7	V511 I512	P508-V511 PolarHBondContact O-N 2.88Å; P508-I512 VanDerWaalsContact O-CG1 3.28Å; P508-I512 WeakPolarHBondContact O-CG1 3.49Å; P508-I512 PolarHBondContact O-N 3.12Å
509	M	91.6	Very high	90.8	Very high	135 Å²	135	63.4 Å²	63.4	67%	0.665	37%	0.372	S	S	*	.	H	α-helix	trans	-64.8	-43	177.8	-169.8	61	67	0	0	112.1	T507 V511 I512 T513	T507-M509 PolarHBondContact O-N 3.36Å; T507-M509 VanDerWaalsContact O-N 3.12Å; M509-V511 VanDerWaalsContact C-N 3.34Å; M509-V511 PolarHBondContact O-N 3.03Å; M509-I512 PolarHBondContact O-N 2.76Å; M509-T513 PolarHBondContact O-N 2.75Å; M509-T513 PolarHBondContact O-OG1 2.92Å; M509-T513 VanDerWaalsContact O-OG1 3.05Å
510	Q	91.6	Very high	91	Very high	92 Å²	92	66.5 Å²	66.5	43%	0.43	39%	0.394	S	S	.	.	H	α-helix	trans	-64.1	-39.8	177.1	-72.6	166.4	-47.1	0	0	111.8	T507 T513 M514 P575	T507-Q510 VanDerWaalsContact N-OE1 3.12Å; T507-Q510 PolarHBondContact O-N 3.31Å; T507-Q510 VanDerWaalsContact OG1-CD 3.25Å; T507-Q510 VanDerWaalsContact OG1-CG 3.25Å; T507-Q510 WeakPolarHBondContact OG1-CG 3.36Å; T507-Q510 PolarHBondContact OG1-N 3Å; T507-Q510 PolarHBondContact OG1-OE1 3.39Å; Q510-T513 PolarHBondContact O-N 3.21Å; Q510-M514 WeakPolarHBondContact O-CB 3.38Å; Q510-M514 PolarHBondContact O-N 2.81Å; Q510-P575 HydrophobicContact CB-CB 4.01Å; Q510-P575 HydrophobicContact CB-CG 3.89Å
511	V	91.1	Very high	91.3	Very high	11 Å²	11	64.2 Å²	64.2	7%	0.067	37%	0.372	C	S	.	.	H	α-helix	trans	-64.2	-44.6	176.3	177.8	0	0	0	0	111	F499 C506 T507 P508 M509 M514 L515	F499-V511 HydrophobicContact CE2-CG1 3.76Å; F499-V511 HydrophobicContact CZ-CG1 3.81Å; C506-V511 HydrophobicContact CB-CG2 3.98Å; T507-V511 PolarHBondContact O-N 3.11Å; P508-V511 PolarHBondContact O-N 2.88Å; M509-V511 VanDerWaalsContact C-N 3.34Å; M509-V511 PolarHBondContact O-N 3.03Å; V511-M514 PolarHBondContact O-N 3.43Å; V511-L515 HydrophobicContact CG1-CD1 4.22Å; V511-L515 WeakPolarHBondContact O-CG 3.48Å; V511-L515 PolarHBondContact O-N 2.77Å
512	I	90.8	Very high	91.6	Very high	87 Å²	87	61.2 Å²	61.2	45%	0.446	35%	0.347	S	S	.	.	H	α-helix	trans	-63.8	-43.6	177.8	-69.8	167.4	0	0	0	111.2	P508 M509 M514 L515 N516	P508-I512 VanDerWaalsContact O-CG1 3.28Å; P508-I512 WeakPolarHBondContact O-CG1 3.49Å; P508-I512 PolarHBondContact O-N 3.12Å; M509-I512 PolarHBondContact O-N 2.76Å; I512-M514 VanDerWaalsContact C-N 3.34Å; I512-M514 PolarHBondContact O-N 2.77Å; I512-L515 PolarHBondContact O-N 3.14Å; I512-N516 WeakPolarHBondContact CG2-ND2 3.38Å; I512-N516 WeakPolarHBondContact O-CB 3.31Å; I512-N516 PolarHBondContact O-N 3.17Å; I512-N516 PolarHBondContact O-ND2 2.97Å
513	T	91.1	Very high	91.9	Very high	78 Å²	78	63.3 Å²	63.3	48%	0.479	36%	0.358	S	S	.	.	H	α-helix	trans	-60.1	-45.6	177	-60.7	0	0	0	0	111.2	M509 Q510 N516 E517	M509-T513 PolarHBondContact O-N 2.75Å; M509-T513 PolarHBondContact O-OG1 2.92Å; M509-T513 VanDerWaalsContact O-OG1 3.05Å; Q510-T513 PolarHBondContact O-N 3.21Å; T513-N516 PolarHBondContact O-N 3Å; T513-E517 WeakPolarHBondContact O-CB 3.45Å; T513-E517 PolarHBondContact O-N 3.26Å
514	M	91.2	Very high	92.2	Very high	10 Å²	10	66.5 Å²	66.5	5%	0.049	37%	0.367	C	S	.	.	H	α-helix	trans	-59.2	-48.6	176.3	-180	-162.7	72.5	0	0	111.9	L496 F499 Q510 V511 I512 E517 L518 V572 T574 I580	L496-M514 HydrophobicContact CD1-CE 4.33Å; F499-M514 HydrophobicContact CD2-CE 4.29Å; F499-M514 HydrophobicContact CE2-CE 4.09Å; Q510-M514 WeakPolarHBondContact O-CB 3.38Å; Q510-M514 PolarHBondContact O-N 2.81Å; V511-M514 PolarHBondContact O-N 3.43Å; I512-M514 VanDerWaalsContact C-N 3.34Å; I512-M514 PolarHBondContact O-N 2.77Å; M514-E517 PolarHBondContact O-N 3.05Å; M514-L518 WeakPolarHBondContact O-CB 3.43Å; M514-L518 PolarHBondContact O-N 3.12Å; M514-V572 HydrophobicContact CG-CG1 4.35Å; M514-T574 HydrophobicContact SD-CG2 4.27Å; M514-I580 HydrophobicContact CG-CD1 3.7Å; M514-I580 HydrophobicContact SD-CD1 3.8Å; M514-I580 HydrophobicContact SD-CG1 4.26Å
515	L	91.8	Very high	92.4	Very high	24 Å²	24	63.4 Å²	63.4	13%	0.126	34%	0.337	C	S	.	.	H	α-helix	trans	-62.9	-42.9	178.7	-73.8	176.1	0	0	0	112.1	L496 F499 V511 I512 E517 L518 Y519	L496-L515 HydrophobicContact CD1-CD2 3.78Å; F499-L515 HydrophobicContact CE2-CD1 3.99Å; F499-L515 HydrophobicContact CE2-CD2 3.91Å; F499-L515 HydrophobicContact CE2-CG 4.14Å; F499-L515 HydrophobicContact CZ-CD1 3.89Å; F499-L515 HydrophobicContact CZ-CD2 4.49Å; V511-L515 HydrophobicContact CG1-CD1 4.22Å; V511-L515 WeakPolarHBondContact O-CG 3.48Å; V511-L515 PolarHBondContact O-N 2.77Å; I512-L515 PolarHBondContact O-N 3.14Å; L515-E517 VanDerWaalsContact C-N 3.34Å; L515-E517 PolarHBondContact O-N 3.09Å; L515-L518 PolarHBondContact O-N 3.16Å; L515-Y519 HydrophobicContact CB-CE2 4.42Å; L515-Y519 HydrophobicContact CD2-CE2 4.39Å; L515-Y519 WeakPolarHBondContact O-CB 3.47Å; L515-Y519 VanDerWaalsContact O-CG 3.31Å; L515-Y519 PolarHBondContact O-N 3.29Å
516	N	90.9	Very high	92.6	Very high	95 Å²	95	58.4 Å²	58.4	51%	0.508	31%	0.307	S	S	.	.	H	α-helix	trans	-62.6	-41.9	176.9	-77.4	-23.8	0	0	0	111.4	I512 T513 L518 T520	I512-N516 WeakPolarHBondContact CG2-ND2 3.38Å; I512-N516 WeakPolarHBondContact O-CB 3.31Å; I512-N516 PolarHBondContact O-N 3.17Å; I512-N516 PolarHBondContact O-ND2 2.97Å; T513-N516 PolarHBondContact O-N 3Å; N516-L518 VanDerWaalsContact C-N 3.33Å; N516-L518 PolarHBondContact O-N 2.87Å; N516-T520 VanDerWaalsContact O-CB 3.24Å; N516-T520 WeakPolarHBondContact O-CB 3.4Å; N516-T520 PolarHBondContact O-N 3.03Å; N516-T520 PolarHBondContact O-OG1 3.42Å
517	E	92.4	Very high	92.6	Very high	84 Å²	84	60.4 Å²	60.4	39%	0.393	33%	0.332	S	S	.	.	H	α-helix	trans	-61.9	-42.3	176.9	-131.7	-161.5	118	0	0	112	T513 M514 L515 R521	T513-E517 WeakPolarHBondContact O-CB 3.45Å; T513-E517 PolarHBondContact O-N 3.26Å; M514-E517 PolarHBondContact O-N 3.05Å; L515-E517 VanDerWaalsContact C-N 3.34Å; L515-E517 PolarHBondContact O-N 3.09Å; E517-R521 WeakPolarHBondContact O-CG 3.26Å; E517-R521 PolarHBondContact O-N 3.47Å; E517-R521 PolarHBondContact O-NH1 2.9Å; E517-R521 IonicContact OE1-CZ 2.95Å; E517-R521 IonicContact OE1-NH1 2.74Å; E517-R521 PolarHBondContact OE1-NH1 3.1Å; E517-R521 IonicContact OE1-NH2 2.79Å; E517-R521 PolarHBondContact OE1-NH2 3.3Å
518	L	92.8	Very high	92.6	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-69.7	-50.5	179.8	-172.4	67.7	0	0	0	111.2	L496 M514 L515 N516 T520 R521 F522 V572 I580	L496-L518 HydrophobicContact CD1-CD2 4.27Å; L496-L518 HydrophobicContact CD2-CD2 3.89Å; M514-L518 WeakPolarHBondContact O-CB 3.43Å; M514-L518 PolarHBondContact O-N 3.12Å; L515-L518 PolarHBondContact O-N 3.16Å; N516-L518 VanDerWaalsContact C-N 3.33Å; N516-L518 PolarHBondContact O-N 2.87Å; L518-T520 VanDerWaalsContact C-N 3.35Å; L518-T520 PolarHBondContact O-N 3.29Å; L518-R521 PolarHBondContact O-N 2.88Å; L518-F522 HydrophobicContact CD1-CE1 3.87Å; L518-F522 HydrophobicContact CD1-CE2 3.97Å; L518-F522 HydrophobicContact CD1-CZ 3.44Å; L518-F522 VanDerWaalsContact CD1-CZ 3.44Å; L518-F522 HydrophobicContact CD2-CE2 3.85Å; L518-F522 HydrophobicContact CD2-CZ 4.06Å; L518-F522 HydrophobicContact CG-CD2 4.22Å; L518-F522 HydrophobicContact CG-CE1 4.3Å; L518-F522 HydrophobicContact CG-CE2 3.56Å; L518-F522 HydrophobicContact CG-CZ 3.61Å; L518-F522 WeakPolarHBondContact O-CG 3.44Å; L518-F522 PolarHBondContact O-N 3.39Å; L518-V572 HydrophobicContact CD1-CB 4.34Å; L518-V572 HydrophobicContact CD1-CG2 4.1Å; L518-I580 HydrophobicContact CD1-CD1 4.44Å; L518-I580 HydrophobicContact CD2-CD1 4.15Å; L518-I580 HydrophobicContact CD2-CG2 4.42Å
519	Y	93.6	Very high	92.7	Very high	33 Å²	33	59.5 Å²	59.5	13%	0.129	31%	0.314	C	S	.	.	H	α-helix	trans	-67.9	-32.1	-178.7	-66.8	-16.1	0	0	0	112.8	L515 R521 F522 D523 D539 A540 Y541	L515-Y519 HydrophobicContact CB-CE2 4.42Å; L515-Y519 HydrophobicContact CD2-CE2 4.39Å; L515-Y519 WeakPolarHBondContact O-CB 3.47Å; L515-Y519 VanDerWaalsContact O-CG 3.31Å; L515-Y519 PolarHBondContact O-N 3.29Å; Y519-R521 VanDerWaalsContact C-N 3.31Å; Y519-R521 PolarHBondContact O-N 3.3Å; Y519-F522 HydrophobicContact CD1-CD2 4.09Å; Y519-F522 PolarHBondContact O-N 2.89Å; Y519-D523 VanDerWaalsContact O-CB 3.25Å; Y519-D523 WeakPolarHBondContact O-CB 3.36Å; Y519-D523 PolarHBondContact O-N 3.02Å; Y519-D539 VanDerWaalsContact OH-C 3.23Å; Y519-D539 WeakPolarHBondContact OH-CA 3.3Å; Y519-D539 PolarHBondContact OH-O 3.32Å; Y519-A540 PolarHBondContact OH-O 2.9Å; Y519-Y541 AromaticContact CD1-CD2 3.42Å; Y519-Y541 HydrophobicContact CD1-CD2 3.42Å; Y519-Y541 VanDerWaalsContact CD1-CD2 3.42Å; Y519-Y541 AromaticContact CD1-CE2 3.89Å; Y519-Y541 HydrophobicContact CD1-CE2 3.89Å; Y519-Y541 HydrophobicContact CD1-CG 4.29Å; Y519-Y541 AromaticContact CE1-CD2 3.53Å; Y519-Y541 HydrophobicContact CE1-CD2 3.53Å; Y519-Y541 HydrophobicContact CE1-CE2 4.44Å; Y519-Y541 HydrophobicContact CE1-CG 4.15Å; Y519-Y541 HydrophobicContact CG-CD2 4.06Å; Y519-Y541 HydrophobicContact CG-CE2 4.19Å
520	T	93.1	Very high	92.7	Very high	96 Å²	96	56.5 Å²	56.5	59%	0.589	30%	0.301	S	S	*	.	H	α-helix	trans	-62	-41	173.9	-58.7	0	0	0	0	111.1	N516 L518 H524	N516-T520 VanDerWaalsContact O-CB 3.24Å; N516-T520 WeakPolarHBondContact O-CB 3.4Å; N516-T520 PolarHBondContact O-N 3.03Å; N516-T520 PolarHBondContact O-OG1 3.42Å; L518-T520 VanDerWaalsContact C-N 3.35Å; L518-T520 PolarHBondContact O-N 3.29Å; T520-H524 WeakPolarHBondContact O-CB 3.49Å; T520-H524 PolarHBondContact O-N 3.06Å; T520-H524 VanDerWaalsContact O-N 3.07Å
521	R	94.8	Very high	92.9	Very high	71 Å²	71	52.6 Å²	52.6	27%	0.268	28%	0.283	S	S	.	.	H	α-helix	trans	-67.3	-41	175.7	-70.8	-177.8	179.1	84.6	-7.8	112.1	E517 L518 Y519 H524 Q525 L568 E571	E517-R521 WeakPolarHBondContact O-CG 3.26Å; E517-R521 PolarHBondContact O-N 3.47Å; E517-R521 PolarHBondContact O-NH1 2.9Å; E517-R521 IonicContact OE1-CZ 2.95Å; E517-R521 IonicContact OE1-NH1 2.74Å; E517-R521 PolarHBondContact OE1-NH1 3.1Å; E517-R521 IonicContact OE1-NH2 2.79Å; E517-R521 PolarHBondContact OE1-NH2 3.3Å; L518-R521 PolarHBondContact O-N 2.88Å; Y519-R521 VanDerWaalsContact C-N 3.31Å; Y519-R521 PolarHBondContact O-N 3.3Å; R521-H524 PolarHBondContact O-N 3.02Å; R521-Q525 PolarHBondContact O-N 2.98Å; R521-L568 HydrophobicContact CB-CD1 4.25Å; R521-E571 IonicContact NE-OE2 2.74Å
522	F	95.4	Very high	93	Very high	1 Å²	1	53.7 Å²	53.7	0%	0.004	29%	0.286	C	S	.	.	H	α-helix	trans	-67.3	-41.9	176.3	-64.7	-15.4	0	0	0	112.6	L518 Y519 H524 Q525 C526 Y541 M561 M565 L568 M582	L518-F522 HydrophobicContact CD1-CE1 3.87Å; L518-F522 HydrophobicContact CD1-CE2 3.97Å; L518-F522 HydrophobicContact CD1-CZ 3.44Å; L518-F522 VanDerWaalsContact CD1-CZ 3.44Å; L518-F522 HydrophobicContact CD2-CE2 3.85Å; L518-F522 HydrophobicContact CD2-CZ 4.06Å; L518-F522 HydrophobicContact CG-CD2 4.22Å; L518-F522 HydrophobicContact CG-CE1 4.3Å; L518-F522 HydrophobicContact CG-CE2 3.56Å; L518-F522 HydrophobicContact CG-CZ 3.61Å; L518-F522 WeakPolarHBondContact O-CG 3.44Å; L518-F522 PolarHBondContact O-N 3.39Å; Y519-F522 HydrophobicContact CD1-CD2 4.09Å; Y519-F522 PolarHBondContact O-N 2.89Å; F522-H524 VanDerWaalsContact C-N 3.26Å; F522-H524 PolarHBondContact O-N 3.07Å; F522-Q525 CarbonylContact O-C 3.35Å; F522-Q525 PolarHBondContact O-N 2.91Å; F522-Q525 VanDerWaalsContact O-N 3.14Å; F522-C526 PolarHBondContact O-N 3.14Å; F522-C526 PolarHBondContact O-SG 2.86Å; F522-Y541 HydrophobicContact CB-CD1 4.44Å; F522-Y541 HydrophobicContact CB-CE1 3.77Å; F522-Y541 HydrophobicContact CB-CE2 4.07Å; F522-Y541 AromaticContact CD2-CD1 3.96Å; F522-Y541 HydrophobicContact CD2-CD1 3.96Å; F522-Y541 HydrophobicContact CD2-CD2 4.14Å; F522-Y541 HydrophobicContact CD2-CE1 4.13Å; F522-Y541 HydrophobicContact CD2-CE2 4.29Å; F522-Y541 AromaticContact CD2-CG 3.95Å; F522-Y541 HydrophobicContact CD2-CG 3.95Å; F522-Y541 HydrophobicContact CG-CE1 4.34Å; F522-M561 HydrophobicContact CB-CE 4.14Å; F522-M565 HydrophobicContact CD1-CB 4.47Å; F522-M565 HydrophobicContact CD1-CG 3.89Å; F522-M565 HydrophobicContact CD2-CE 3.89Å; F522-M565 HydrophobicContact CE1-CB 3.97Å; F522-M565 HydrophobicContact CE1-CG 3.87Å; F522-M565 HydrophobicContact CE2-CE 3.66Å; F522-M565 HydrophobicContact CG-CE 4.45Å; F522-M565 HydrophobicContact CG-CG 4.27Å; F522-M565 HydrophobicContact CZ-CB 4.22Å; F522-M565 HydrophobicContact CZ-CE 4.03Å; F522-M565 HydrophobicContact CZ-CG 4.21Å; F522-L568 HydrophobicContact CD1-CD1 4.32Å; F522-L568 HydrophobicContact CE1-CB 4.12Å; F522-M582 HydrophobicContact CE1-CE 4.43Å; F522-M582 HydrophobicContact CE2-SD 4.02Å; F522-M582 HydrophobicContact CZ-CE 3.71Å; F522-M582 HydrophobicContact CZ-SD 3.64Å
523	D	93.8	Very high	93.1	Very high	64 Å²	64	53 Å²	53	34%	0.342	28%	0.28	S	S	.	.	H	α-helix	trans	-62.8	-37.3	178	-70.5	-1.8	0	0	0	110.5	Y519 C526 G527 K533 Y541	Y519-D523 VanDerWaalsContact O-CB 3.25Å; Y519-D523 WeakPolarHBondContact O-CB 3.36Å; Y519-D523 PolarHBondContact O-N 3.02Å; D523-C526 WeakPolarHBondContact O-CB 3.44Å; D523-C526 PolarHBondContact O-N 3.48Å; D523-G527 PolarHBondContact O-N 3.26Å; D523-K533 VanDerWaalsContact OD1-CD 3.32Å; D523-K533 WeakPolarHBondContact OD1-CD 3.33Å; D523-K533 WeakPolarHBondContact OD1-CE 3.2Å; D523-K533 IonicContact OD1-NZ 2.92Å; D523-K533 PolarHBondContact OD1-NZ 3.18Å; D523-K533 IonicContact OD2-NZ 2.75Å; D523-K533 PolarHBondContact OD2-NZ 2.98Å; D523-Y541 PolarHBondContact N-OH 3.4Å; D523-Y541 WeakPolarHBondContact OD1-CE2 3.36Å; D523-Y541 PolarHBondContact OD1-OH 3.15Å
524	H	94.8	Very high	93.1	Very high	119 Å²	119	50 Å²	50	55%	0.551	26%	0.262	S	S	*	.	H	α-helix	trans	-60.8	-47	172.1	-174.4	59.8	0	0	0	112	T520 R521 F522 C526 G527 E528	T520-H524 WeakPolarHBondContact O-CB 3.49Å; T520-H524 PolarHBondContact O-N 3.06Å; T520-H524 VanDerWaalsContact O-N 3.07Å; R521-H524 PolarHBondContact O-N 3.02Å; F522-H524 VanDerWaalsContact C-N 3.26Å; F522-H524 PolarHBondContact O-N 3.07Å; H524-C526 VanDerWaalsContact C-N 3.32Å; H524-C526 PolarHBondContact O-N 2.82Å; H524-G527 PolarHBondContact O-N 3.33Å; H524-G527 VanDerWaalsContact O-N 3.16Å; H524-E528 IonicContact CE1-OE1 2.74Å; H524-E528 IonicContact NE2-OE1 3.6Å; H524-E528 PolarHBondContact NE2-OE1 3.03Å; H524-E528 PolarHBondContact O-N 3.28Å
525	Q	94.9	Very high	92.6	Very high	22 Å²	22	54 Å²	54	10%	0.103	28%	0.28	C	S	.	.	H	α-helix	trans	-66.9	-29.6	176.4	-75.8	-57.1	-38.8	0	0	113.8	R521 F522 G527 E528 L529 M561 K564 L568	R521-Q525 PolarHBondContact O-N 2.98Å; F522-Q525 CarbonylContact O-C 3.35Å; F522-Q525 PolarHBondContact O-N 2.91Å; F522-Q525 VanDerWaalsContact O-N 3.14Å; Q525-G527 VanDerWaalsContact C-N 3.25Å; Q525-G527 PolarHBondContact O-N 3.23Å; Q525-E528 PolarHBondContact NE2-OE2 2.79Å; Q525-E528 PolarHBondContact O-N 3.32Å; Q525-E528 PolarHBondContact OE1-OE2 2.68Å; Q525-L529 WeakPolarHBondContact O-CB 3.49Å; Q525-L529 PolarHBondContact O-N 3.18Å; Q525-M561 HydrophobicContact CB-CE 4.22Å; Q525-M561 HydrophobicContact CB-SD 3.81Å; Q525-K564 HydrophobicContact CG-CB 4.44Å; Q525-L568 HydrophobicContact CG-CD1 3.5Å
526	C	93.9	Very high	91.7	Very high	11 Å²	11	54.7 Å²	54.7	7%	0.074	29%	0.285	C	S	.	.	H	α-helix	trans	-60.6	-39	172.1	-68.2	0	0	0	0	111.6	F522 D523 H524 D530 V531 Y541 M561	F522-C526 PolarHBondContact O-N 3.14Å; F522-C526 PolarHBondContact O-SG 2.86Å; D523-C526 WeakPolarHBondContact O-CB 3.44Å; D523-C526 PolarHBondContact O-N 3.48Å; H524-C526 VanDerWaalsContact C-N 3.32Å; H524-C526 PolarHBondContact O-N 2.82Å; C526-D530 WeakPolarHBondContact O-CA 3.12Å; C526-D530 PolarHBondContact O-N 3.06Å; C526-D530 VanDerWaalsContact O-N 3.12Å; C526-V531 HydrophobicContact CB-CG2 4.05Å; C526-V531 PolarHBondContact O-N 3.18Å; C526-Y541 PolarHBondContact SG-OH 2.84Å; C526-Y541 VanDerWaalsContact SG-OH 3.33Å; C526-M561 VanDerWaalsContact SG-CE 3.54Å
527	G	90.7	Very high	91	Very high	61 Å²	61	57.7 Å²	57.7	63%	0.629	30%	0.3	S	S	*	.	H	α-helix	trans	-67	-42.4	175	0	0	0	0	0	113.2	D523 H524 Q525	D523-G527 PolarHBondContact O-N 3.26Å; H524-G527 PolarHBondContact O-N 3.33Å; H524-G527 VanDerWaalsContact O-N 3.16Å; Q525-G527 VanDerWaalsContact C-N 3.25Å; Q525-G527 PolarHBondContact O-N 3.23Å
528	E	93.6	Very high	90.3	Very high	120 Å²	120	56.5 Å²	56.5	56%	0.561	31%	0.311	S	S	*	.	H	α-helix	trans	-68.5	-39.7	179.7	-66.4	-168	157.7	0	0	113	H524 Q525	H524-E528 IonicContact CE1-OE1 2.74Å; H524-E528 IonicContact NE2-OE1 3.6Å; H524-E528 PolarHBondContact NE2-OE1 3.03Å; H524-E528 PolarHBondContact O-N 3.28Å; Q525-E528 PolarHBondContact NE2-OE2 2.79Å; Q525-E528 PolarHBondContact O-N 3.32Å; Q525-E528 PolarHBondContact OE1-OE2 2.68Å
529	L	93.1	Very high	89.8	Confident	35 Å²	35	57.9 Å²	57.9	18%	0.183	32%	0.318	C	S	.	.	H	α-helix	trans	-90.1	-2	-177.3	-64.8	174.1	0	0	0	113.7	Q525 V531 Q557 L560 M561	Q525-L529 WeakPolarHBondContact O-CB 3.49Å; Q525-L529 PolarHBondContact O-N 3.18Å; L529-V531 HydrophobicContact CB-CG1 4.44Å; L529-V531 HydrophobicContact CB-CG2 4.46Å; L529-Q557 PolarHBondContact O-NE2 3.5Å; L529-L560 HydrophobicContact CD1-CB 4.31Å; L529-L560 HydrophobicContact CD2-CB 4.26Å; L529-L560 HydrophobicContact CD2-CD1 4.47Å; L529-M561 HydrophobicContact CD1-CB 3.77Å; L529-M561 HydrophobicContact CD1-CG 4.47Å; L529-M561 HydrophobicContact CD1-SD 4Å
530	D	92.5	Very high	89.5	Confident	73 Å²	73	57.3 Å²	57.3	39%	0.39	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	56.7	-176.2	-170.4	28.1	0	0	0	111.9	C526 H548	C526-D530 WeakPolarHBondContact O-CA 3.12Å; C526-D530 PolarHBondContact O-N 3.06Å; C526-D530 VanDerWaalsContact O-N 3.12Å; D530-H548 PolarHBondContact O-CE1 3.33Å; D530-H548 PolarHBondContact O-NE2 3.2Å; D530-H548 IonicContact OD1-CD2 3.51Å; D530-H548 IonicContact OD1-CE1 3.93Å; D530-H548 IonicContact OD1-NE2 2.83Å; D530-H548 PolarHBondContact OD1-NE2 3.34Å; D530-H548 IonicContact OD2-NE2 3.41Å
531	V	94.4	Very high	89.5	Confident	9 Å²	9	52.8 Å²	52.8	6%	0.055	29%	0.292	C	S	.	.			trans	-120.6	148.6	176.1	-64.1	0	0	0	0	111	C526 L529 Q557 I558 M561	C526-V531 HydrophobicContact CB-CG2 4.05Å; C526-V531 PolarHBondContact O-N 3.18Å; L529-V531 HydrophobicContact CB-CG1 4.44Å; L529-V531 HydrophobicContact CB-CG2 4.46Å; V531-Q557 HydrophobicContact CG1-CB 3.82Å; V531-I558 HydrophobicContact CB-CD1 3.99Å; V531-I558 HydrophobicContact CG1-CD1 3.71Å; V531-I558 HydrophobicContact CG1-CG1 4.2Å; V531-M561 HydrophobicContact CG2-CG 4.32Å
532	Y	93	Very high	89.5	Confident	34 Å²	34	49.9 Å²	49.9	13%	0.133	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	124.9	-174.3	-176.5	-97.2	0	0	0	112.1	I466 P468 V534 V543 A544 L547 H548 Y603	I466-Y532 PolarHBondContact O-OH 3.41Å; P468-Y532 HydrophobicContact CG-CD2 4.16Å; P468-Y532 HydrophobicContact CG-CE1 4.48Å; P468-Y532 HydrophobicContact CG-CE2 3.7Å; Y532-V534 HydrophobicContact CD1-CG2 4.15Å; Y532-V534 HydrophobicContact CE1-CG2 4.47Å; Y532-V543 CarbonylContact O-C 3.59Å; Y532-V543 WeakPolarHBondContact O-CA 3.45Å; Y532-A544 PolarHBondContact N-O 2.82Å; Y532-A544 PolarHBondContact O-N 3.27Å; Y532-L547 HydrophobicContact CD1-CD2 3.72Å; Y532-L547 HydrophobicContact CE1-CD2 4.2Å; Y532-H548 HydrophobicContact CD2-CB 3.99Å; Y532-H548 HydrophobicContact CG-CB 4.17Å; Y532-Y603 AromaticContact CE1-CD1 3.81Å; Y532-Y603 HydrophobicContact CE1-CD1 3.81Å; Y532-Y603 HydrophobicContact CE1-CE1 4.39Å
533	K	93.6	Very high	89.5	Confident	73 Å²	73	49.9 Å²	49.9	32%	0.317	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	123	171.2	179.4	-175.5	-175	168.3	0	110.5	D523 Y541	D523-K533 VanDerWaalsContact OD1-CD 3.32Å; D523-K533 WeakPolarHBondContact OD1-CD 3.33Å; D523-K533 WeakPolarHBondContact OD1-CE 3.2Å; D523-K533 IonicContact OD1-NZ 2.92Å; D523-K533 PolarHBondContact OD1-NZ 3.18Å; D523-K533 IonicContact OD2-NZ 2.75Å; D523-K533 PolarHBondContact OD2-NZ 2.98Å; K533-Y541 HydrophobicContact CD-CE2 4.1Å; K533-Y541 HydrophobicContact CG-CE2 4.38Å
534	V	90.1	Very high	89.5	Confident	16 Å²	16	46.9 Å²	46.9	10%	0.097	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	151	175.7	-174.8	0	0	0	0	108.7	Y532 T536 C542 A544 L547 L605	Y532-V534 HydrophobicContact CD1-CG2 4.15Å; Y532-V534 HydrophobicContact CE1-CG2 4.47Å; V534-T536 WeakPolarHBondContact O-CG2 3.5Å; V534-T536 PolarHBondContact O-N 3.17Å; V534-C542 HydrophobicContact CB-CB 4.17Å; V534-C542 PolarHBondContact N-O 3.16Å; V534-A544 HydrophobicContact CG2-CB 3.87Å; V534-L547 HydrophobicContact CG2-CD2 4.26Å; V534-L605 HydrophobicContact CG1-CD1 4.14Å; V534-L605 HydrophobicContact CG1-CG 4.14Å; V534-L605 HydrophobicContact CG2-CD1 3.73Å; V534-L605 HydrophobicContact CG2-CG 4.34Å
535	E	82.4	Confident	89.6	Confident	93 Å²	93	41.2 Å²	41.2	44%	0.435	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-58.5	129.4	173.9	-170.2	178.2	-169.5	0	0	110.6	R602	E535-R602 WeakPolarHBondContact OE1-CD 3.24Å; E535-R602 IonicContact OE1-CZ 3.65Å; E535-R602 IonicContact OE1-NE 3.48Å; E535-R602 PolarHBondContact OE1-NE 3.44Å; E535-R602 IonicContact OE1-NH1 3.62Å; E535-R602 IonicContact OE1-NH2 2.81Å; E535-R602 VanDerWaalsContact OE2-CB 3.3Å; E535-R602 WeakPolarHBondContact OE2-CB 3.3Å; E535-R602 WeakPolarHBondContact OE2-CD 3.39Å; E535-R602 WeakPolarHBondContact OE2-CG 3.35Å; E535-R602 IonicContact OE2-NE 3.55Å
536	T	72.9	Confident	89.4	Confident	38 Å²	38	40.2 Å²	40.2	23%	0.233	24%	0.236	C	C	.	.			trans	-108.3	163.7	-175.7	58.4	0	0	0	0	112.3	V534 A540 C542	V534-T536 WeakPolarHBondContact O-CG2 3.5Å; V534-T536 PolarHBondContact O-N 3.17Å; T536-A540 WeakPolarHBondContact CB-O 3.38Å; T536-A540 WeakPolarHBondContact CG2-O 3.33Å; T536-A540 PolarHBondContact OG1-O 2.94Å; T536-C542 HydrophobicContact CG2-CB 3.66Å
537	I	74.4	Confident	89.3	Confident	158 Å²	158	39.8 Å²	39.8	81%	0.81	23%	0.233	S	C	*	.			trans	-119.8	122.8	175.5	-57.7	173.8	0	0	0	107.8
538	G	78.5	Confident	89.1	Confident	60 Å²	60	39.6 Å²	39.6	62%	0.619	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.7	-135.4	178.1	0	0	0	0	0	112.8	A540	G538-A540 VanDerWaalsContact C-N 3.35Å
539	D	82.9	Confident	88.9	Confident	28 Å²	28	40.3 Å²	40.3	15%	0.15	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-7.2	179	53.9	-44	0	0	0	114.1	D495 L496 F499 Y519	D495-D539 VanDerWaalsContact OD1-OD2 3.12Å; L496-D539 HydrophobicContact CB-CB 4.39Å; L496-D539 HydrophobicContact CD1-CB 4.25Å; L496-D539 HydrophobicContact CG-CB 4.28Å; F499-D539 HydrophobicContact CB-CB 4.29Å; F499-D539 WeakPolarHBondContact CB-OD2 3.32Å; F499-D539 HydrophobicContact CD1-CB 3.47Å; F499-D539 VanDerWaalsContact CD1-CB 3.47Å; F499-D539 WeakPolarHBondContact CD1-OD2 3.37Å; F499-D539 HydrophobicContact CD2-CB 3.81Å; F499-D539 HydrophobicContact CE1-CB 3.62Å; F499-D539 HydrophobicContact CE2-CB 3.94Å; F499-D539 HydrophobicContact CG-CB 3.58Å; F499-D539 WeakPolarHBondContact CG-OD2 3.34Å; F499-D539 HydrophobicContact CZ-CB 3.85Å; Y519-D539 VanDerWaalsContact OH-C 3.23Å; Y519-D539 WeakPolarHBondContact OH-CA 3.3Å; Y519-D539 PolarHBondContact OH-O 3.32Å
540	A	87.3	Confident	88.8	Confident	21 Å²	21	45.3 Å²	45.3	17%	0.174	24%	0.239	C	C	.	.			trans	-64.4	143.5	176.6	0	0	0	0	0	111.4	S494 Y519 T536 G538	S494-A540 WeakPolarHBondContact O-CA 3.32Å; S494-A540 WeakPolarHBondContact O-CB 3.35Å; Y519-A540 PolarHBondContact OH-O 2.9Å; T536-A540 WeakPolarHBondContact CB-O 3.38Å; T536-A540 WeakPolarHBondContact CG2-O 3.33Å; T536-A540 PolarHBondContact OG1-O 2.94Å; G538-A540 VanDerWaalsContact C-N 3.35Å
541	Y	92.9	Very high	88.7	Confident	1 Å²	1	43.2 Å²	43.2	0%	0.004	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	126.2	171.3	-166.1	-91.7	0	0	0	109.5	S494 Y519 F522 D523 C526 K533 V543 M561 M565	S494-Y541 PolarHBondContact N-O 3.3Å; S494-Y541 PolarHBondContact O-N 3.46Å; S494-Y541 VanDerWaalsContact O-N 3.14Å; S494-Y541 VanDerWaalsContact OG-CB 3.3Å; S494-Y541 WeakPolarHBondContact OG-CB 3.49Å; S494-Y541 PolarHBondContact OG-N 2.98Å; S494-Y541 PolarHBondContact OG-O 3.19Å; S494-Y541 VanDerWaalsContact OG-O 3.13Å; Y519-Y541 AromaticContact CD1-CD2 3.42Å; Y519-Y541 HydrophobicContact CD1-CD2 3.42Å; Y519-Y541 VanDerWaalsContact CD1-CD2 3.42Å; Y519-Y541 AromaticContact CD1-CE2 3.89Å; Y519-Y541 HydrophobicContact CD1-CE2 3.89Å; Y519-Y541 HydrophobicContact CD1-CG 4.29Å; Y519-Y541 AromaticContact CE1-CD2 3.53Å; Y519-Y541 HydrophobicContact CE1-CD2 3.53Å; Y519-Y541 HydrophobicContact CE1-CE2 4.44Å; Y519-Y541 HydrophobicContact CE1-CG 4.15Å; Y519-Y541 HydrophobicContact CG-CD2 4.06Å; Y519-Y541 HydrophobicContact CG-CE2 4.19Å; F522-Y541 HydrophobicContact CB-CD1 4.44Å; F522-Y541 HydrophobicContact CB-CE1 3.77Å; F522-Y541 HydrophobicContact CB-CE2 4.07Å; F522-Y541 AromaticContact CD2-CD1 3.96Å; F522-Y541 HydrophobicContact CD2-CD1 3.96Å; F522-Y541 HydrophobicContact CD2-CD2 4.14Å; F522-Y541 HydrophobicContact CD2-CE1 4.13Å; F522-Y541 HydrophobicContact CD2-CE2 4.29Å; F522-Y541 AromaticContact CD2-CG 3.95Å; F522-Y541 HydrophobicContact CD2-CG 3.95Å; F522-Y541 HydrophobicContact CG-CE1 4.34Å; D523-Y541 PolarHBondContact N-OH 3.4Å; D523-Y541 WeakPolarHBondContact OD1-CE2 3.36Å; D523-Y541 PolarHBondContact OD1-OH 3.15Å; C526-Y541 PolarHBondContact SG-OH 2.84Å; C526-Y541 VanDerWaalsContact SG-OH 3.33Å; K533-Y541 HydrophobicContact CD-CE2 4.1Å; K533-Y541 HydrophobicContact CG-CE2 4.38Å; Y541-V543 HydrophobicContact CD1-CG1 3.93Å; Y541-V543 HydrophobicContact CE1-CG1 3.37Å; Y541-M561 HydrophobicContact CE1-CE 4.23Å; Y541-M565 HydrophobicContact CD1-CE 3.73Å; Y541-M565 HydrophobicContact CD1-SD 4.43Å; Y541-M565 HydrophobicContact CG-CE 4.38Å
542	C	93.9	Very high	88.5	Confident	10 Å²	10	51.6 Å²	51.6	7%	0.068	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	124.5	-169.1	-65.3	0	0	0	0	109.8	L492 F493 V534 T536	L492-C542 WeakPolarHBondContact O-CA 3.37Å; F493-C542 WeakPolarHBondContact CD1-SG 3.43Å; F493-C542 WeakPolarHBondContact CE1-SG 3.43Å; V534-C542 HydrophobicContact CB-CB 4.17Å; V534-C542 PolarHBondContact N-O 3.16Å; T536-C542 HydrophobicContact CG2-CB 3.66Å
543	V	95.2	Very high	88.5	Confident	2 Å²	2	52.9 Å²	52.9	1%	0.012	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	147.4	175.7	-61	0	0	0	0	110.8	L492 Y532 Y541 I558 M561	L492-V543 HydrophobicContact CB-CG2 3.58Å; L492-V543 HydrophobicContact CD1-CG2 3.81Å; L492-V543 HydrophobicContact CD2-CG2 4.17Å; L492-V543 HydrophobicContact CG-CG2 4.06Å; L492-V543 PolarHBondContact N-O 3.39Å; L492-V543 PolarHBondContact O-N 3.43Å; Y532-V543 CarbonylContact O-C 3.59Å; Y532-V543 WeakPolarHBondContact O-CA 3.45Å; Y541-V543 HydrophobicContact CD1-CG1 3.93Å; Y541-V543 HydrophobicContact CE1-CG1 3.37Å; V543-I558 HydrophobicContact CB-CD1 4.33Å; V543-I558 HydrophobicContact CG2-CD1 3.82Å; V543-M561 HydrophobicContact CG1-CE 4.48Å; V543-M561 HydrophobicContact CG2-CG 4.06Å
544	A	95.1	Very high	88.5	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	128.6	-179.9	0	0	0	0	0	110.7	V489 T490 Y532 V534 L547 L605	V489-A544 HydrophobicContact CG1-CB 4.17Å; T490-A544 WeakPolarHBondContact O-CA 3.36Å; Y532-A544 PolarHBondContact N-O 2.82Å; Y532-A544 PolarHBondContact O-N 3.27Å; V534-A544 HydrophobicContact CG2-CB 3.87Å; A544-L547 HydrophobicContact CB-CB 3.93Å; A544-L547 HydrophobicContact CB-CD2 3.85Å; A544-L605 HydrophobicContact CB-CD1 4.21Å
545	G	95.3	Very high	88.8	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	140.9	171.2	0	0	0	0	0	109.8	V489 T490 L547 I558	V489-G545 WeakPolarHBondContact CA-O 3.4Å; V489-G545 WeakPolarHBondContact CG1-O 3.46Å; T490-G545 PolarHBondContact N-O 3.46Å; T490-G545 VanDerWaalsContact N-O 3.11Å; T490-G545 PolarHBondContact O-N 2.9Å; G545-L547 VanDerWaalsContact C-N 3.33Å; G545-I558 VanDerWaalsContact N-CD1 3.26Å
546	G	92	Very high	89.4	Confident	2 Å²	2	45.6 Å²	45.6	2%	0.021	25%	0.249	C	C	.	.	S	Bend	trans	84.9	2.4	-178.1	0	0	0	0	0	114.7	K549	G546-K549 CarbonylContact C-O 3.6Å; G546-K549 VanDerWaalsContact C-O 3.3Å; G546-K549 WeakPolarHBondContact CA-O 3.42Å
547	L	90.8	Very high	90.4	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.01	25%	0.245	C	C	.	.	S	Bend	trans	-91.7	-50.8	-173.3	-177.6	66.1	0	0	0	113.8	F486 Y532 V534 A544 G545 V591 A593 Y603 L605	F486-L547 HydrophobicContact CD2-CD1 4.02Å; F486-L547 WeakPolarHBondContact CE1-O 3.43Å; F486-L547 HydrophobicContact CE2-CD1 4.13Å; F486-L547 HydrophobicContact CG-CD1 4.3Å; F486-L547 HydrophobicContact CZ-CD1 4.47Å; Y532-L547 HydrophobicContact CD1-CD2 3.72Å; Y532-L547 HydrophobicContact CE1-CD2 4.2Å; V534-L547 HydrophobicContact CG2-CD2 4.26Å; A544-L547 HydrophobicContact CB-CB 3.93Å; A544-L547 HydrophobicContact CB-CD2 3.85Å; G545-L547 VanDerWaalsContact C-N 3.33Å; L547-V591 HydrophobicContact CD1-CG2 4.4Å; L547-A593 HydrophobicContact CD1-CB 3.79Å; L547-Y603 HydrophobicContact CD1-CE1 4.22Å; L547-Y603 HydrophobicContact CD2-CD1 4.45Å; L547-Y603 HydrophobicContact CD2-CE1 3.86Å; L547-Y603 HydrophobicContact CG-CE1 3.95Å; L547-L605 HydrophobicContact CD1-CD2 3.59Å; L547-L605 HydrophobicContact CD2-CD1 4.13Å; L547-L605 HydrophobicContact CD2-CD2 3.59Å; L547-L605 HydrophobicContact CD2-CG 4.13Å; L547-L605 HydrophobicContact CG-CD2 4.24Å
548	H	87.8	Confident	91.5	Very high	57 Å²	57	37.8 Å²	37.8	26%	0.264	21%	0.206	S	C	.	.	S	Bend	trans	-78	-30.9	177.3	64.2	-53.2	0	0	0	111.7	P468 D530 Y532	P468-H548 HydrophobicContact CB-CB 3.93Å; P468-H548 HydrophobicContact CG-CB 4.23Å; D530-H548 PolarHBondContact O-CE1 3.33Å; D530-H548 PolarHBondContact O-NE2 3.2Å; D530-H548 IonicContact OD1-CD2 3.51Å; D530-H548 IonicContact OD1-CE1 3.93Å; D530-H548 IonicContact OD1-NE2 2.83Å; D530-H548 PolarHBondContact OD1-NE2 3.34Å; D530-H548 IonicContact OD2-NE2 3.41Å; Y532-H548 HydrophobicContact CD2-CB 3.99Å; Y532-H548 HydrophobicContact CG-CB 4.17Å
549	K	89.3	Confident	92.4	Very high	135 Å²	135	35 Å²	35	59%	0.587	18%	0.177	S	C	*	.	S	Bend	trans	-143.6	130	175.7	-174.7	178.9	175.1	-172.6	0	109.1	G546 S551	G546-K549 CarbonylContact C-O 3.6Å; G546-K549 VanDerWaalsContact C-O 3.3Å; G546-K549 WeakPolarHBondContact CA-O 3.42Å; K549-S551 PolarHBondContact O-N 3.02Å
550	E	89.6	Confident	93	Very high	139 Å²	139	36.2 Å²	36.2	65%	0.65	18%	0.183	S	C	*	.			trans	-63.5	128.6	175.2	-67.7	170.9	-159.2	0	0	108.7	K484	K484-E550 IonicContact NZ-OE1 3.05Å; K484-E550 PolarHBondContact NZ-OE1 3.02Å
551	S	91.3	Very high	93.4	Very high	30 Å²	30	35.2 Å²	35.2	21%	0.21	18%	0.175	C	C	.	.			trans	-143.3	133.7	-173.5	172.3	0	0	0	0	108.8	K549 T553 H554 Q557	K549-S551 PolarHBondContact O-N 3.02Å; S551-T553 VanDerWaalsContact C-N 3.31Å; S551-T553 PolarHBondContact OG-N 3.42Å; S551-T553 PolarHBondContact OG-OG1 3.2Å; S551-H554 WeakPolarHBondContact O-CB 3.45Å; S551-H554 PolarHBondContact O-CD2 3.13Å; S551-H554 PolarHBondContact OG-N 3.33Å; S551-Q557 PolarHBondContact OG-OE1 3.1Å
552	E	90.1	Very high	93.6	Very high	185 Å²	185	35.2 Å²	35.2	86%	0.864	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77	-21.9	176.4	-61.9	-176.2	170.4	0	0	112.2
553	T	92.4	Very high	93.6	Very high	61 Å²	61	35.9 Å²	35.9	37%	0.374	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	16	179.1	55.2	0	0	0	0	112.3	S551 A555 V556 Q557	S551-T553 VanDerWaalsContact C-N 3.31Å; S551-T553 PolarHBondContact OG-N 3.42Å; S551-T553 PolarHBondContact OG-OG1 3.2Å; T553-A555 PolarHBondContact O-N 3.14Å; T553-A555 VanDerWaalsContact O-N 3.14Å; T553-V556 WeakPolarHBondContact O-CA 3.35Å; T553-V556 WeakPolarHBondContact O-CB 3.41Å; T553-V556 PolarHBondContact O-N 3.18Å; T553-Q557 PolarHBondContact O-N 3.49Å
554	H	95.1	Very high	93.6	Very high	6 Å²	6	39.6 Å²	39.6	3%	0.028	19%	0.194	C	C	.	.	H	α-helix	trans	-50.9	-40.6	-177.6	66.7	92.2	0	0	0	113.5	T490 S551 I558	T490-H554 PolarHBondContact N-ND1 3.5Å; T490-H554 PolarHBondContact OG1-CE1 3.43Å; T490-H554 PolarHBondContact OG1-ND1 2.92Å; S551-H554 WeakPolarHBondContact O-CB 3.45Å; S551-H554 PolarHBondContact O-CD2 3.13Å; S551-H554 PolarHBondContact OG-N 3.33Å; H554-I558 WeakPolarHBondContact O-CB 3.43Å; H554-I558 VanDerWaalsContact O-CG1 3.26Å; H554-I558 WeakPolarHBondContact O-CG1 3.49Å; H554-I558 PolarHBondContact O-N 3.4Å
555	A	95.4	Very high	93.6	Very high	4 Å²	4	39.6 Å²	39.6	3%	0.033	19%	0.194	C	C	.	.	H	α-helix	trans	-67.6	-36.4	176.5	0	0	0	0	0	112.8	T490 T553 A559 T631 L634 L635	T490-A555 WeakPolarHBondContact OG1-CA 3.32Å; T553-A555 PolarHBondContact O-N 3.14Å; T553-A555 VanDerWaalsContact O-N 3.14Å; A555-A559 VanDerWaalsContact O-CB 3.32Å; A555-A559 WeakPolarHBondContact O-CB 3.43Å; A555-A559 PolarHBondContact O-N 2.92Å; A555-T631 HydrophobicContact CB-CG2 4.35Å; A555-L634 HydrophobicContact CB-CB 3.77Å; A555-L634 HydrophobicContact CB-CD1 3.9Å; A555-L635 HydrophobicContact CB-CD2 3.97Å; A555-L635 HydrophobicContact CB-CG 4.31Å
556	V	94.6	Very high	93.5	Very high	18 Å²	18	41 Å²	41	11%	0.109	20%	0.201	C	C	.	.	H	α-helix	trans	-68.5	-48.8	179.4	176.4	0	0	0	0	110.1	T553 I558 A559 L560 L635 F641	T553-V556 WeakPolarHBondContact O-CA 3.35Å; T553-V556 WeakPolarHBondContact O-CB 3.41Å; T553-V556 PolarHBondContact O-N 3.18Å; V556-I558 VanDerWaalsContact C-N 3.25Å; V556-I558 PolarHBondContact O-N 3.18Å; V556-A559 PolarHBondContact O-N 3.13Å; V556-L560 HydrophobicContact CG1-CD1 4.18Å; V556-L560 WeakPolarHBondContact O-CG 3.18Å; V556-L560 PolarHBondContact O-N 2.84Å; V556-L635 HydrophobicContact CB-CD2 4.31Å; V556-L635 HydrophobicContact CG2-CD2 3.72Å; V556-F641 HydrophobicContact CG1-CE2 4.03Å; V556-F641 HydrophobicContact CG1-CZ 4.05Å; V556-F641 HydrophobicContact CG2-CE2 4.47Å
557	Q	95.4	Very high	93.5	Very high	33 Å²	33	45.3 Å²	45.3	15%	0.154	22%	0.22	C	C	.	.	H	α-helix	trans	-56.3	-43.5	177.8	-64.8	173.5	-74.1	0	0	111	L529 V531 S551 T553 L560 M561	L529-Q557 PolarHBondContact O-NE2 3.5Å; V531-Q557 HydrophobicContact CG1-CB 3.82Å; S551-Q557 PolarHBondContact OG-OE1 3.1Å; T553-Q557 PolarHBondContact O-N 3.49Å; Q557-L560 PolarHBondContact O-N 3.06Å; Q557-M561 WeakPolarHBondContact O-CB 3.43Å; Q557-M561 PolarHBondContact O-N 3.18Å
558	I	97.4	Very high	93.7	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-73.5	-33.7	-179.8	-66.8	-72.9	0	0	0	112.5	T490 L492 V531 V543 G545 H554 V556 M561 A562 L586	T490-I558 HydrophobicContact CG2-CB 3.92Å; T490-I558 HydrophobicContact CG2-CG1 4.37Å; T490-I558 HydrophobicContact CG2-CG2 3.71Å; L492-I558 HydrophobicContact CB-CG2 3.71Å; L492-I558 HydrophobicContact CD1-CG2 4.12Å; L492-I558 HydrophobicContact CG-CG2 4.49Å; V531-I558 HydrophobicContact CB-CD1 3.99Å; V531-I558 HydrophobicContact CG1-CD1 3.71Å; V531-I558 HydrophobicContact CG1-CG1 4.2Å; V543-I558 HydrophobicContact CB-CD1 4.33Å; V543-I558 HydrophobicContact CG2-CD1 3.82Å; G545-I558 VanDerWaalsContact N-CD1 3.26Å; H554-I558 WeakPolarHBondContact O-CB 3.43Å; H554-I558 VanDerWaalsContact O-CG1 3.26Å; H554-I558 WeakPolarHBondContact O-CG1 3.49Å; H554-I558 PolarHBondContact O-N 3.4Å; V556-I558 VanDerWaalsContact C-N 3.25Å; V556-I558 PolarHBondContact O-N 3.18Å; I558-M561 PolarHBondContact O-N 2.54Å; I558-A562 PolarHBondContact O-N 3.12Å; I558-L586 HydrophobicContact CG2-CD2 3.36Å
559	A	95.9	Very high	93.9	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-67	-40.6	172.7	0	0	0	0	0	112.1	A555 V556 M561 A562 L563 L635 F641 L666	A555-A559 VanDerWaalsContact O-CB 3.32Å; A555-A559 WeakPolarHBondContact O-CB 3.43Å; A555-A559 PolarHBondContact O-N 2.92Å; V556-A559 PolarHBondContact O-N 3.13Å; A559-M561 VanDerWaalsContact C-N 3.35Å; A559-A562 PolarHBondContact O-N 2.79Å; A559-L563 WeakPolarHBondContact O-CG 3.09Å; A559-L563 PolarHBondContact O-N 3.5Å; A559-L563 VanDerWaalsContact O-N 3.11Å; A559-L635 HydrophobicContact CB-CD1 3.72Å; A559-L635 HydrophobicContact CB-CD2 4.24Å; A559-F641 HydrophobicContact CB-CD1 4.32Å; A559-F641 HydrophobicContact CB-CE1 3.68Å; A559-F641 HydrophobicContact CB-CE2 4.37Å; A559-F641 HydrophobicContact CB-CZ 3.71Å; A559-L666 HydrophobicContact CB-CD2 4.04Å
560	L	95.3	Very high	93.9	Very high	55 Å²	55	40.5 Å²	40.5	29%	0.288	20%	0.203	S	C	.	.	H	α-helix	trans	-63	-42.2	172	-69.7	173.4	0	0	0	111.3	L529 V556 Q557 A562 L563 K564 F641	L529-L560 HydrophobicContact CD1-CB 4.31Å; L529-L560 HydrophobicContact CD2-CB 4.26Å; L529-L560 HydrophobicContact CD2-CD1 4.47Å; V556-L560 HydrophobicContact CG1-CD1 4.18Å; V556-L560 WeakPolarHBondContact O-CG 3.18Å; V556-L560 PolarHBondContact O-N 2.84Å; Q557-L560 PolarHBondContact O-N 3.06Å; L560-A562 VanDerWaalsContact C-N 3.33Å; L560-A562 PolarHBondContact O-N 2.97Å; L560-L563 PolarHBondContact O-N 2.77Å; L560-K564 PolarHBondContact O-N 2.8Å; L560-F641 HydrophobicContact CD2-CE1 3.96Å; L560-F641 HydrophobicContact CD2-CZ 4Å; L560-F641 HydrophobicContact CG-CE1 4.29Å; L560-F641 HydrophobicContact CG-CZ 4Å
561	M	96.6	Very high	94	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-59.1	-44.3	174.7	-177.3	57.5	-179.6	0	0	111.2	L492 F522 Q525 C526 L529 V531 Y541 V543 Q557 I558 A559 L563 K564 M565	L492-M561 HydrophobicContact CD1-CG 4.34Å; F522-M561 HydrophobicContact CB-CE 4.14Å; Q525-M561 HydrophobicContact CB-CE 4.22Å; Q525-M561 HydrophobicContact CB-SD 3.81Å; C526-M561 VanDerWaalsContact SG-CE 3.54Å; L529-M561 HydrophobicContact CD1-CB 3.77Å; L529-M561 HydrophobicContact CD1-CG 4.47Å; L529-M561 HydrophobicContact CD1-SD 4Å; V531-M561 HydrophobicContact CG2-CG 4.32Å; Y541-M561 HydrophobicContact CE1-CE 4.23Å; V543-M561 HydrophobicContact CG1-CE 4.48Å; V543-M561 HydrophobicContact CG2-CG 4.06Å; Q557-M561 WeakPolarHBondContact O-CB 3.43Å; Q557-M561 PolarHBondContact O-N 3.18Å; I558-M561 PolarHBondContact O-N 2.54Å; A559-M561 VanDerWaalsContact C-N 3.35Å; M561-L563 VanDerWaalsContact C-N 3.33Å; M561-L563 PolarHBondContact O-N 3.28Å; M561-K564 PolarHBondContact O-N 3.34Å; M561-M565 HydrophobicContact CE-CG 3.69Å; M561-M565 HydrophobicContact CE-SD 3.87Å; M561-M565 HydrophobicContact CG-CG 4.29Å; M561-M565 HydrophobicContact CG-SD 4.09Å; M561-M565 VanDerWaalsContact O-CB 3.32Å; M561-M565 WeakPolarHBondContact O-CB 3.49Å; M561-M565 WeakPolarHBondContact O-CG 3Å; M561-M565 PolarHBondContact O-N 2.92Å; M561-M565 HydrophobicContact SD-CG 4.15Å
562	A	96.3	Very high	94	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-60.7	-40.2	176.8	0	0	0	0	0	112.9	L492 I558 A559 L560 M566 I584 L586 I625	L492-A562 HydrophobicContact CD1-CB 3.69Å; I558-A562 PolarHBondContact O-N 3.12Å; A559-A562 PolarHBondContact O-N 2.79Å; L560-A562 VanDerWaalsContact C-N 3.33Å; L560-A562 PolarHBondContact O-N 2.97Å; A562-M566 WeakPolarHBondContact O-CG 3.37Å; A562-M566 PolarHBondContact O-N 2.82Å; A562-M566 VanDerWaalsContact O-N 3.17Å; A562-I584 HydrophobicContact CB-CD1 4.29Å; A562-I584 HydrophobicContact CB-CG2 4.05Å; A562-I584 WeakPolarHBondContact O-CD1 3.49Å; A562-L586 HydrophobicContact CB-CD1 4.07Å; A562-L586 HydrophobicContact CB-CD2 4.35Å; A562-I625 HydrophobicContact CB-CD1 3.93Å; A562-I625 HydrophobicContact CB-CG1 4.43Å; A562-I625 HydrophobicContact CB-CG2 3.96Å
563	L	94.9	Very high	94	Very high	24 Å²	24	34.2 Å²	34.2	13%	0.126	17%	0.171	C	C	.	.	H	α-helix	trans	-66.1	-46.7	175.7	-68.1	173.3	0	0	0	111.3	A559 L560 M561 M565 M566 E567 I625 F641 L666 A668	A559-L563 WeakPolarHBondContact O-CG 3.09Å; A559-L563 PolarHBondContact O-N 3.5Å; A559-L563 VanDerWaalsContact O-N 3.11Å; L560-L563 PolarHBondContact O-N 2.77Å; M561-L563 VanDerWaalsContact C-N 3.33Å; M561-L563 PolarHBondContact O-N 3.28Å; L563-M565 VanDerWaalsContact C-N 3.34Å; L563-M565 PolarHBondContact O-N 2.85Å; L563-M566 WeakPolarHBondContact O-CB 3.43Å; L563-M566 PolarHBondContact O-N 3.44Å; L563-E567 PolarHBondContact O-N 3.47Å; L563-I625 HydrophobicContact CD2-CD1 3.76Å; L563-I625 HydrophobicContact CG-CD1 4.35Å; L563-F641 HydrophobicContact CD1-CD1 4.02Å; L563-F641 HydrophobicContact CD1-CE1 3.9Å; L563-L666 HydrophobicContact CD2-CD2 4.38Å; L563-L666 HydrophobicContact CD2-CG 4.3Å; L563-L666 HydrophobicContact CG-CD2 4.32Å; L563-A668 HydrophobicContact CD2-CB 4.15Å
564	K	95.1	Very high	93.8	Very high	81 Å²	81	32.1 Å²	32.1	35%	0.352	16%	0.159	S	C	.	.	H	α-helix	trans	-62.6	-39.7	176.9	-75.8	-73.8	164.7	-155.1	0	112.6	Q525 L560 M561 M566 E567 L568	Q525-K564 HydrophobicContact CG-CB 4.44Å; L560-K564 PolarHBondContact O-N 2.8Å; M561-K564 PolarHBondContact O-N 3.34Å; K564-M566 VanDerWaalsContact C-N 3.32Å; K564-M566 PolarHBondContact O-N 3.07Å; K564-E567 IonicContact NZ-OE2 2.76Å; K564-E567 PolarHBondContact NZ-OE2 2.93Å; K564-E567 PolarHBondContact O-N 3.14Å; K564-L568 WeakPolarHBondContact O-CB 3.4Å; K564-L568 VanDerWaalsContact O-CG 3.25Å; K564-L568 WeakPolarHBondContact O-CG 3.44Å; K564-L568 PolarHBondContact O-N 2.89Å
565	M	94.9	Very high	93.5	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-58.2	-44.6	173.6	-78.4	179.4	76.2	0	0	111.1	L492 S494 F522 Y541 M561 L563 S569 M582 I584	L492-M565 HydrophobicContact CD1-SD 3.87Å; L492-M565 HydrophobicContact CD2-CE 4.15Å; L492-M565 HydrophobicContact CD2-SD 3.81Å; S494-M565 WeakPolarHBondContact OG-CE 3.3Å; F522-M565 HydrophobicContact CD1-CB 4.47Å; F522-M565 HydrophobicContact CD1-CG 3.89Å; F522-M565 HydrophobicContact CD2-CE 3.89Å; F522-M565 HydrophobicContact CE1-CB 3.97Å; F522-M565 HydrophobicContact CE1-CG 3.87Å; F522-M565 HydrophobicContact CE2-CE 3.66Å; F522-M565 HydrophobicContact CG-CE 4.45Å; F522-M565 HydrophobicContact CG-CG 4.27Å; F522-M565 HydrophobicContact CZ-CB 4.22Å; F522-M565 HydrophobicContact CZ-CE 4.03Å; F522-M565 HydrophobicContact CZ-CG 4.21Å; Y541-M565 HydrophobicContact CD1-CE 3.73Å; Y541-M565 HydrophobicContact CD1-SD 4.43Å; Y541-M565 HydrophobicContact CG-CE 4.38Å; M561-M565 HydrophobicContact CE-CG 3.69Å; M561-M565 HydrophobicContact CE-SD 3.87Å; M561-M565 HydrophobicContact CG-CG 4.29Å; M561-M565 HydrophobicContact CG-SD 4.09Å; M561-M565 VanDerWaalsContact O-CB 3.32Å; M561-M565 WeakPolarHBondContact O-CB 3.49Å; M561-M565 WeakPolarHBondContact O-CG 3Å; M561-M565 PolarHBondContact O-N 2.92Å; M561-M565 HydrophobicContact SD-CG 4.15Å; L563-M565 VanDerWaalsContact C-N 3.34Å; L563-M565 PolarHBondContact O-N 2.85Å; M565-S569 WeakPolarHBondContact O-CB 3.23Å; M565-S569 PolarHBondContact O-N 3.39Å; M565-S569 PolarHBondContact O-OG 3.29Å; M565-M582 HydrophobicContact CB-CE 3.77Å; M565-M582 HydrophobicContact CE-CE 4.47Å; M565-M582 WeakPolarHBondContact O-CE 3.42Å; M565-I584 HydrophobicContact CB-CD1 3.93Å; M565-I584 HydrophobicContact SD-CD1 4.5Å
566	M	93.3	Very high	93	Very high	29 Å²	29	37.6 Å²	37.6	14%	0.143	19%	0.193	C	C	.	.	H	α-helix	trans	-62.8	-45.1	175.7	-70.7	-64.2	-170.9	0	0	112.1	A562 L563 K564 S569 D570 M582 I584 K624 I625	A562-M566 WeakPolarHBondContact O-CG 3.37Å; A562-M566 PolarHBondContact O-N 2.82Å; A562-M566 VanDerWaalsContact O-N 3.17Å; L563-M566 WeakPolarHBondContact O-CB 3.43Å; L563-M566 PolarHBondContact O-N 3.44Å; K564-M566 VanDerWaalsContact C-N 3.32Å; K564-M566 PolarHBondContact O-N 3.07Å; M566-S569 PolarHBondContact O-N 2.74Å; M566-S569 PolarHBondContact O-OG 3.39Å; M566-D570 PolarHBondContact O-N 2.79Å; M566-M582 HydrophobicContact CE-CB 4.47Å; M566-M582 HydrophobicContact SD-CB 4.17Å; M566-M582 HydrophobicContact SD-CE 4.37Å; M566-I584 HydrophobicContact CE-CB 4.1Å; M566-I584 HydrophobicContact CE-CD1 3.76Å; M566-I584 HydrophobicContact CE-CG1 3.69Å; M566-I584 HydrophobicContact CG-CD1 4.03Å; M566-I584 HydrophobicContact SD-CD1 4.17Å; M566-K624 WeakPolarHBondContact CE-O 3.35Å; M566-I625 HydrophobicContact CE-CG1 3.53Å; M566-I625 HydrophobicContact CG-CD1 3.83Å; M566-I625 HydrophobicContact CG-CG1 3.83Å
567	E	92.8	Very high	92.5	Very high	92 Å²	92	39.4 Å²	39.4	43%	0.43	22%	0.215	S	C	.	.	H	α-helix	trans	-59.4	-49.8	176.6	-70.2	172.3	-173	0	0	112	L563 K564 S569 D570	L563-E567 PolarHBondContact O-N 3.47Å; K564-E567 IonicContact NZ-OE2 2.76Å; K564-E567 PolarHBondContact NZ-OE2 2.93Å; K564-E567 PolarHBondContact O-N 3.14Å; E567-S569 VanDerWaalsContact C-N 3.3Å; E567-S569 PolarHBondContact O-N 2.92Å; E567-D570 WeakPolarHBondContact O-CB 3.33Å; E567-D570 PolarHBondContact O-N 3.28Å
568	L	93.6	Very high	92.1	Very high	24 Å²	24	44.2 Å²	44.2	13%	0.126	24%	0.238	C	C	.	.	H	α-helix	trans	-69	-28.7	-178.2	-67.3	170.5	0	0	0	112.6	R521 F522 Q525 K564 D570 E571	R521-L568 HydrophobicContact CB-CD1 4.25Å; F522-L568 HydrophobicContact CD1-CD1 4.32Å; F522-L568 HydrophobicContact CE1-CB 4.12Å; Q525-L568 HydrophobicContact CG-CD1 3.5Å; K564-L568 WeakPolarHBondContact O-CB 3.4Å; K564-L568 VanDerWaalsContact O-CG 3.25Å; K564-L568 WeakPolarHBondContact O-CG 3.44Å; K564-L568 PolarHBondContact O-N 2.89Å; L568-D570 VanDerWaalsContact C-N 3.27Å; L568-D570 PolarHBondContact O-N 3.39Å; L568-E571 PolarHBondContact O-N 3.11Å
569	S	92.4	Very high	91.6	Very high	3 Å²	3	46.8 Å²	46.8	2%	0.021	26%	0.255	C	S	.	.	H	α-helix	trans	-68.2	-26.5	175	68.3	0	0	0	0	113.3	M565 M566 E567 E571 V572	M565-S569 WeakPolarHBondContact O-CB 3.23Å; M565-S569 PolarHBondContact O-N 3.39Å; M565-S569 PolarHBondContact O-OG 3.29Å; M566-S569 PolarHBondContact O-N 2.74Å; M566-S569 PolarHBondContact O-OG 3.39Å; E567-S569 VanDerWaalsContact C-N 3.3Å; E567-S569 PolarHBondContact O-N 2.92Å; S569-E571 PolarHBondContact O-N 3.32Å; S569-V572 PolarHBondContact O-N 3.44Å
570	D	90.2	Very high	91.4	Very high	66 Å²	66	47 Å²	47	35%	0.353	26%	0.256	S	S	.	.	H	α-helix	trans	-72.3	-19.8	175.6	-78.5	-32.1	0	0	0	112.5	M566 E567 L568 R623	M566-D570 PolarHBondContact O-N 2.79Å; E567-D570 WeakPolarHBondContact O-CB 3.33Å; E567-D570 PolarHBondContact O-N 3.28Å; L568-D570 VanDerWaalsContact C-N 3.27Å; L568-D570 PolarHBondContact O-N 3.39Å; D570-R623 VanDerWaalsContact CG-NH2 3.27Å; D570-R623 IonicContact OD1-CZ 3.59Å; D570-R623 IonicContact OD1-NH1 2.77Å; D570-R623 PolarHBondContact OD1-NH1 2.76Å; D570-R623 IonicContact OD1-NH2 2.75Å; D570-R623 PolarHBondContact OD1-NH2 3.17Å; D570-R623 IonicContact OD2-NH2 2.74Å; D570-R623 PolarHBondContact OD2-NH2 3.41Å
571	E	91.4	Very high	91.2	Very high	121 Å²	121	48.2 Å²	48.2	57%	0.565	26%	0.26	S	S	*	.	H	α-helix	trans	-83.2	-21.1	178.4	-59.6	-179.8	-179.1	0	0	113.1	R521 L568 S569	R521-E571 IonicContact NE-OE2 2.74Å; L568-E571 PolarHBondContact O-N 3.11Å; S569-E571 PolarHBondContact O-N 3.32Å
572	V	90.5	Very high	91	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.006	26%	0.26	C	S	.	.	S	Bend	trans	-102.1	128.8	-176.9	-173	0	0	0	0	109.8	M514 L518 S569 I580	M514-V572 HydrophobicContact CG-CG1 4.35Å; L518-V572 HydrophobicContact CD1-CB 4.34Å; L518-V572 HydrophobicContact CD1-CG2 4.1Å; S569-V572 PolarHBondContact O-N 3.44Å; V572-I580 HydrophobicContact CB-CD1 3.9Å; V572-I580 HydrophobicContact CG1-CD1 3.56Å; V572-I580 HydrophobicContact CG1-CG1 4.48Å; V572-I580 WeakPolarHBondContact O-CG1 3.43Å; V572-I580 PolarHBondContact O-N 3.34Å; V572-I580 VanDerWaalsContact O-N 3.1Å
573	M	90.1	Very high	90.9	Very high	100 Å²	100	51.5 Å²	51.5	49%	0.493	27%	0.272	S	S	.	.	B	Isolated β-bridge	trans	-98.2	143.3	179.1	-61.2	-66.8	171.3	0	0	110.8	P579	M573-P579 HydrophobicContact CE-CG 4.09Å; M573-P579 HydrophobicContact SD-CB 4.12Å; M573-P579 HydrophobicContact SD-CG 3.8Å
574	T	89.1	Confident	91	Very high	18 Å²	18	50.3 Å²	50.3	11%	0.11	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-62.7	157.4	164.9	57.5	0	0	0	0	110.3	V502 M514 T576 G577 E578 I580	V502-T574 HydrophobicContact CG2-CG2 4.38Å; M514-T574 HydrophobicContact SD-CG2 4.27Å; T574-T576 PolarHBondContact O-N 2.9Å; T574-T576 PolarHBondContact OG1-OG1 3.2Å; T574-G577 PolarHBondContact O-N 2.76Å; T574-E578 WeakPolarHBondContact CB-O 3.43Å; T574-E578 WeakPolarHBondContact CG2-O 3.47Å; T574-E578 PolarHBondContact N-O 3.21Å; T574-E578 PolarHBondContact OG1-N 3.09Å; T574-E578 PolarHBondContact OG1-O 3.43Å; T574-I580 HydrophobicContact CG2-CG1 3.96Å
575	P	87.6	Confident	91.1	Very high	49 Å²	49	46.5 Å²	46.5	32%	0.318	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-14.7	176	-19.8	30.8	0	0	0	113.8	C506 Q510	C506-P575 HydrophobicContact CB-CB 4.2Å; C506-P575 HydrophobicContact CB-CG 4.21Å; Q510-P575 HydrophobicContact CB-CB 4.01Å; Q510-P575 HydrophobicContact CB-CG 3.89Å
576	T	84.8	Confident	91.2	Very high	75 Å²	75	46.5 Å²	46.5	46%	0.46	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-2.6	173.2	47.2	0	0	0	0	113.5	T574	T574-T576 PolarHBondContact O-N 2.9Å; T574-T576 PolarHBondContact OG1-OG1 3.2Å
577	G	84.6	Confident	91.4	Very high	56 Å²	56	45.2 Å²	45.2	58%	0.577	24%	0.243	S	C	*	.	S	Bend	trans	90.8	6.3	174.6	0	0	0	0	0	115.4	T574	T574-G577 PolarHBondContact O-N 2.76Å
578	E	86.8	Confident	91.6	Very high	134 Å²	134	41.3 Å²	41.3	63%	0.626	23%	0.226	S	C	*	.	P	Polyproline II helix	trans	-96.7	143	177.9	-59.3	-178.4	150.1	0	0	110.8	T574	T574-E578 WeakPolarHBondContact CB-O 3.43Å; T574-E578 WeakPolarHBondContact CG2-O 3.47Å; T574-E578 PolarHBondContact N-O 3.21Å; T574-E578 PolarHBondContact OG1-N 3.09Å; T574-E578 PolarHBondContact OG1-O 3.43Å
579	P	87.9	Confident	91.7	Very high	54 Å²	54	41 Å²	41	35%	0.351	23%	0.229	S	C	.	.	B	Isolated β-bridge	trans	-59.7	142.7	174.8	-21.3	30.7	0	0	0	111.9	M573 Q581	M573-P579 HydrophobicContact CE-CG 4.09Å; M573-P579 HydrophobicContact SD-CB 4.12Å; M573-P579 HydrophobicContact SD-CG 3.8Å; P579-Q581 PolarHBondContact O-N 2.98Å
580	I	90.4	Very high	91.8	Very high	4 Å²	4	42.9 Å²	42.9	2%	0.021	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-64.9	126.8	177.2	-66.8	178.4	0	0	0	109.6	L496 M514 L518 V572 T574 M582	L496-I580 HydrophobicContact CD2-CG2 3.58Å; M514-I580 HydrophobicContact CG-CD1 3.7Å; M514-I580 HydrophobicContact SD-CD1 3.8Å; M514-I580 HydrophobicContact SD-CG1 4.26Å; L518-I580 HydrophobicContact CD1-CD1 4.44Å; L518-I580 HydrophobicContact CD2-CD1 4.15Å; L518-I580 HydrophobicContact CD2-CG2 4.42Å; V572-I580 HydrophobicContact CB-CD1 3.9Å; V572-I580 HydrophobicContact CG1-CD1 3.56Å; V572-I580 HydrophobicContact CG1-CG1 4.48Å; V572-I580 WeakPolarHBondContact O-CG1 3.43Å; V572-I580 PolarHBondContact O-N 3.34Å; V572-I580 VanDerWaalsContact O-N 3.1Å; T574-I580 HydrophobicContact CG2-CG1 3.96Å; I580-M582 HydrophobicContact CG2-CG 4.1Å
581	Q	91.4	Very high	92	Very high	81 Å²	81	39.9 Å²	39.9	38%	0.379	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-103.4	132.3	174.3	-62.9	-174.4	7.8	0	0	109.7	V497 P579 R623	V497-Q581 HydrophobicContact CB-CB 4Å; V497-Q581 HydrophobicContact CG2-CB 4.23Å; V497-Q581 PolarHBondContact N-O 3.33Å; P579-Q581 PolarHBondContact O-N 2.98Å; Q581-R623 HydrophobicContact CB-CG 4.11Å; Q581-R623 HydrophobicContact CG-CG 3.97Å
582	M	92.3	Very high	92.1	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	152.3	-179.8	-60.4	-158.8	-59.1	0	0	112.5	D495 L496 F522 M565 M566 I580 I584 R623	D495-M582 WeakPolarHBondContact O-CA 3.38Å; L496-M582 HydrophobicContact CD2-CG 3.71Å; L496-M582 HydrophobicContact CD2-SD 3.91Å; F522-M582 HydrophobicContact CE1-CE 4.43Å; F522-M582 HydrophobicContact CE2-SD 4.02Å; F522-M582 HydrophobicContact CZ-CE 3.71Å; F522-M582 HydrophobicContact CZ-SD 3.64Å; M565-M582 HydrophobicContact CB-CE 3.77Å; M565-M582 HydrophobicContact CE-CE 4.47Å; M565-M582 WeakPolarHBondContact O-CE 3.42Å; M566-M582 HydrophobicContact CE-CB 4.47Å; M566-M582 HydrophobicContact SD-CB 4.17Å; M566-M582 HydrophobicContact SD-CE 4.37Å; I580-M582 HydrophobicContact CG2-CG 4.1Å; M582-I584 HydrophobicContact CE-CD1 4.16Å; M582-R623 WeakPolarHBondContact O-CA 3.41Å; M582-R623 PolarHBondContact O-N 3.19Å
583	R	94.8	Very high	92.2	Very high	68 Å²	68	38.2 Å²	38.2	26%	0.257	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	133.7	160.4	-69.7	-177.3	-63.7	-163.4	-3	107.7	S494 D495 V497 E617	S494-R583 CarbonylContact C-O 3.59Å; S494-R583 WeakPolarHBondContact CA-O 3.25Å; D495-R583 PolarHBondContact N-O 3.01Å; D495-R583 PolarHBondContact O-N 3.27Å; D495-R583 IonicContact OD2-CZ 2.78Å; D495-R583 IonicContact OD2-NE 3.55Å; D495-R583 IonicContact OD2-NH2 2.85Å; D495-R583 PolarHBondContact OD2-NH2 3.49Å; V497-R583 HydrophobicContact CG2-CG 3.69Å; R583-E617 WeakPolarHBondContact CB-OE1 3.47Å; R583-E617 IonicContact CZ-OE1 2.71Å; R583-E617 IonicContact NE-OE1 3.92Å; R583-E617 PolarHBondContact NE-OE1 3.47Å
584	I	96.9	Very high	92.3	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	136	175.3	-59.8	-178.7	0	0	0	109.2	L492 F493 A562 M565 M566 M582 L586 S620 K624 I625 N626	L492-I584 HydrophobicContact CD1-CG2 4.12Å; L492-I584 HydrophobicContact CD2-CG2 3.76Å; L492-I584 HydrophobicContact CG-CG2 3.64Å; F493-I584 CarbonylContact O-C 3.49Å; F493-I584 WeakPolarHBondContact O-CA 3.2Å; A562-I584 HydrophobicContact CB-CD1 4.29Å; A562-I584 HydrophobicContact CB-CG2 4.05Å; A562-I584 WeakPolarHBondContact O-CD1 3.49Å; M565-I584 HydrophobicContact CB-CD1 3.93Å; M565-I584 HydrophobicContact SD-CD1 4.5Å; M566-I584 HydrophobicContact CE-CB 4.1Å; M566-I584 HydrophobicContact CE-CD1 3.76Å; M566-I584 HydrophobicContact CE-CG1 3.69Å; M566-I584 HydrophobicContact CG-CD1 4.03Å; M566-I584 HydrophobicContact SD-CD1 4.17Å; M582-I584 HydrophobicContact CE-CD1 4.16Å; I584-L586 HydrophobicContact CG2-CG 4.42Å; I584-S620 PolarHBondContact O-OG 2.95Å; I584-K624 PolarHBondContact N-O 3.37Å; I584-I625 HydrophobicContact CB-CB 4.49Å; I584-I625 HydrophobicContact CB-CG1 4.25Å; I584-I625 HydrophobicContact CB-CG2 4.28Å; I584-I625 HydrophobicContact CD1-CG1 4.35Å; I584-I625 HydrophobicContact CG2-CG2 4.07Å; I584-N626 PolarHBondContact O-N 3.14Å
585	G	96.8	Very high	92.4	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	134.5	172.2	0	0	0	0	0	111.9	L492 F493 N626	L492-G585 WeakPolarHBondContact CA-O 3.37Å; F493-G585 PolarHBondContact N-O 3.36Å; F493-G585 PolarHBondContact O-N 3.05Å; G585-N626 CarbonylContact C-O 3.54Å; G585-N626 WeakPolarHBondContact CA-O 3.15Å
586	L	97.6	Very high	92.4	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.005	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	124.1	-176.3	-69.6	163.1	0	0	0	111.2	M491 L492 I558 A562 I584 I625 N626 V627 S628 T631 L666	M491-L586 WeakPolarHBondContact O-CA 3.13Å; L492-L586 HydrophobicContact CB-CD2 3.86Å; L492-L586 HydrophobicContact CD1-CD2 4.05Å; L492-L586 HydrophobicContact CG-CD2 3.91Å; I558-L586 HydrophobicContact CG2-CD2 3.36Å; A562-L586 HydrophobicContact CB-CD1 4.07Å; A562-L586 HydrophobicContact CB-CD2 4.35Å; I584-L586 HydrophobicContact CG2-CG 4.42Å; L586-I625 HydrophobicContact CD1-CG2 3.33Å; L586-I625 HydrophobicContact CG-CG2 4.13Å; L586-N626 PolarHBondContact N-O 2.94Å; L586-V627 HydrophobicContact CD1-CG2 3.88Å; L586-S628 WeakPolarHBondContact O-CB 3.2Å; L586-S628 PolarHBondContact O-N 3.47Å; L586-S628 PolarHBondContact O-OG 2.92Å; L586-S628 VanDerWaalsContact O-OG 3.12Å; L586-T631 HydrophobicContact CB-CG2 4.47Å; L586-L666 HydrophobicContact CD1-CD2 4.33Å
587	H	97.3	Very high	92.3	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.009	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	138.9	177.1	-176.7	57.7	0	0	0	113.5	T490 M491 N609 A613 F616 S628 T630 T631	T490-H587 WeakPolarHBondContact CA-O 3.49Å; M491-H587 PolarHBondContact N-O 2.84Å; M491-H587 PolarHBondContact O-N 3.32Å; H587-N609 PolarHBondContact CD2-O 3.25Å; H587-N609 PolarHBondContact NE2-OD1 3.17Å; H587-A613 HydrophobicContact CB-CB 3.74Å; H587-F616 HydrophobicContact CB-CD2 3.95Å; H587-F616 HydrophobicContact CB-CE2 4.49Å; H587-F616 AromaticContact ND1-CE2 3.77Å; H587-S628 WeakPolarHBondContact CA-OG 3.35Å; H587-S628 VanDerWaalsContact ND1-CB 3.34Å; H587-S628 WeakPolarHBondContact ND1-CB 3.29Å; H587-S628 PolarHBondContact ND1-OG 3.49Å; H587-T630 PolarHBondContact CE1-OG1 3.43Å; H587-T630 VanDerWaalsContact CE1-OG1 3.26Å; H587-T630 PolarHBondContact ND1-OG1 3.46Å; H587-T630 VanDerWaalsContact ND1-OG1 3.15Å; H587-T631 VanDerWaalsContact C-OG1 3.29Å; H587-T631 VanDerWaalsContact CA-OG1 3.32Å; H587-T631 WeakPolarHBondContact CA-OG1 3.32Å
588	S	97.1	Very high	92.1	Very high	9 Å²	9	38.8 Å²	38.8	6%	0.063	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	133.3	-179.4	-54.7	0	0	0	0	110.8	V489 T490 T630 T631	V489-S588 VanDerWaalsContact O-CA 3.31Å; V489-S588 WeakPolarHBondContact O-CA 3Å; T490-S588 WeakPolarHBondContact CG2-OG 3.22Å; T490-S588 PolarHBondContact OG1-OG 3.48Å; S588-T630 PolarHBondContact N-OG1 3.4Å; S588-T630 WeakPolarHBondContact O-CB 3.28Å; S588-T630 PolarHBondContact O-OG1 2.92Å; S588-T631 PolarHBondContact N-OG1 2.65Å; S588-T631 WeakPolarHBondContact OG-CA 3.32Å; S588-T631 WeakPolarHBondContact OG-CB 3.46Å; S588-T631 PolarHBondContact OG-OG1 3.17Å
589	G	94.7	Very high	91.8	Very high	18 Å²	18	42.1 Å²	42.1	19%	0.186	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	175.1	177.9	178.4	0	0	0	0	0	111.9	V489	V489-G589 PolarHBondContact N-O 2.83Å; V489-G589 PolarHBondContact O-N 3.26Å; V489-G589 VanDerWaalsContact O-O 3.14Å
590	S	94.8	Very high	91.6	Very high	43 Å²	43	46.1 Å²	46.1	30%	0.301	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	141.4	178.9	64.5	0	0	0	0	112.2	F486 D487 N609	F486-S590 CarbonylContact O-C 3.6Å; F486-S590 WeakPolarHBondContact O-CA 3.28Å; F486-S590 WeakPolarHBondContact O-CB 3.42Å; D487-S590 WeakPolarHBondContact O-CA 3.44Å; D487-S590 PolarHBondContact O-N 3.45Å; S590-N609 PolarHBondContact N-ND2 3.26Å; S590-N609 PolarHBondContact O-ND2 2.91Å
591	V	95.3	Very high	91.4	Very high	3 Å²	3	48 Å²	48	2%	0.018	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	155.2	177.3	-60	0	0	0	0	111.2	K485 F486 V489 M491 L547 L605 V610	K485-V591 WeakPolarHBondContact CA-O 3.32Å; F486-V591 HydrophobicContact CB-CG2 4.13Å; F486-V591 PolarHBondContact N-O 2.85Å; F486-V591 PolarHBondContact O-N 3Å; V489-V591 HydrophobicContact CB-CG1 4.5Å; V489-V591 HydrophobicContact CB-CG2 3.89Å; V489-V591 HydrophobicContact CG1-CG2 4.02Å; V489-V591 HydrophobicContact CG2-CG2 3.66Å; M491-V591 HydrophobicContact CE-CG1 3.71Å; M491-V591 HydrophobicContact SD-CG1 3.66Å; L547-V591 HydrophobicContact CD1-CG2 4.4Å; V591-L605 HydrophobicContact CG2-CD2 4.09Å; V591-V610 HydrophobicContact CB-CG2 4.5Å; V591-V610 HydrophobicContact CG1-CG2 3.99Å
592	L	94.1	Very high	91.2	Very high	84 Å²	84	50 Å²	50	44%	0.44	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	129.5	167.3	-77.7	153.8	0	0	0	107.8	K485 F606	K485-L592 HydrophobicContact CB-CD2 3.85Å; K485-L592 HydrophobicContact CG-CD2 4.29Å; L592-F606 HydrophobicContact CB-CB 4.26Å; L592-F606 PolarHBondContact N-O 3Å; L592-F606 PolarHBondContact O-N 3.3Å
593	A	92.6	Very high	91.1	Very high	2 Å²	2	50.8 Å²	50.8	2%	0.017	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	142.8	176.7	0	0	0	0	0	110.8	A483 K484 F486 L547 Y603 C604 L605	A483-A593 CarbonylContact C-O 3.54Å; A483-A593 WeakPolarHBondContact CA-O 3.37Å; K484-A593 PolarHBondContact N-O 2.91Å; K484-A593 PolarHBondContact O-N 2.82Å; F486-A593 HydrophobicContact CD2-CB 4.06Å; F486-A593 HydrophobicContact CE2-CB 3.8Å; L547-A593 HydrophobicContact CD1-CB 3.79Å; A593-Y603 HydrophobicContact CB-CE1 4.1Å; A593-Y603 HydrophobicContact CB-CE2 4.05Å; A593-Y603 VanDerWaalsContact CB-OH 3.31Å; A593-Y603 WeakPolarHBondContact CB-OH 3.01Å; A593-C604 WeakPolarHBondContact CA-O 3.46Å; A593-L605 HydrophobicContact CB-CD2 3.63Å
594	G	91	Very high	90.9	Very high	6 Å²	6	48.9 Å²	48.9	6%	0.062	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	166.3	-178.5	0	0	0	0	0	112.4	C604	G594-C604 PolarHBondContact N-O 3.44Å; G594-C604 PolarHBondContact O-N 2.79Å
595	V	90.9	Very high	90.6	Very high	35 Å²	35	50 Å²	50	21%	0.212	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	126.7	177.7	179.3	0	0	0	0	109.9	V471 L475 V481 P601 R602 Y603	V471-V595 HydrophobicContact CG1-CG2 3.65Å; L475-V595 HydrophobicContact CD1-CG2 4.48Å; V481-V595 HydrophobicContact CB-CB 4.28Å; V481-V595 HydrophobicContact CB-CG2 3.84Å; V481-V595 HydrophobicContact CG1-CG2 3.85Å; V481-V595 HydrophobicContact CG2-CG2 4.16Å; V595-P601 HydrophobicContact CG1-CB 3.41Å; V595-P601 VanDerWaalsContact CG1-CB 3.41Å; V595-R602 CarbonylContact C-O 3.58Å; V595-R602 VanDerWaalsContact CA-O 3.3Å; V595-R602 WeakPolarHBondContact CA-O 3.43Å; V595-Y603 HydrophobicContact CG2-CD2 4.06Å
596	V	88.1	Confident	90.3	Very high	75 Å²	75	54.9 Å²	54.9	46%	0.455	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	135.2	176.6	-177.4	0	0	0	0	110.2	P601 R602 C604 F606	V596-P601 CarbonylContact O-C 3.58Å; V596-P601 WeakPolarHBondContact O-CA 3.12Å; V596-R602 PolarHBondContact N-O 3.05Å; V596-R602 PolarHBondContact O-N 3.37Å; V596-C604 HydrophobicContact CG2-CB 4.31Å; V596-F606 HydrophobicContact CG2-CE2 3.94Å; V596-F606 HydrophobicContact CG2-CZ 3.76Å
597	G	83.7	Confident	90	Very high	45 Å²	45	56.6 Å²	56.6	46%	0.464	32%	0.317	S	S	.	.			trans	94.1	137.6	178	0	0	0	0	0	113.2	P601	G597-P601 WeakPolarHBondContact O-CA 3.46Å
598	V	79.4	Confident	89.7	Confident	149 Å²	149	61.2 Å²	61.2	90%	0.903	34%	0.342	S	S	*	.	S	Bend	trans	-89.9	-45.9	-178.9	-179	0	0	0	0	111.5
599	K	80.8	Confident	89.6	Confident	204 Å²	204	62.3 Å²	62.3	89%	0.887	35%	0.347	S	S	*	.	S	Bend	trans	-83.1	-31.5	-179	-68.5	-174.8	178	-177.9	0	113.3
600	M	83.8	Confident	89.5	Confident	138 Å²	138	62.5 Å²	62.5	68%	0.68	34%	0.344	S	S	*	.	S	Bend	trans	-132.3	81.6	178.1	-69.7	-169.2	-66.7	0	0	107.7
601	P	87.1	Confident	89.4	Confident	45 Å²	45	64.3 Å²	64.3	29%	0.292	35%	0.354	S	S	.	.			trans	-64.6	138.3	-179.7	23.8	-30.1	0	0	0	110.5	F467 V595 V596 G597	F467-P601 HydrophobicContact CE1-CB 4.28Å; F467-P601 HydrophobicContact CE2-CG 4.34Å; F467-P601 HydrophobicContact CZ-CB 3.81Å; F467-P601 HydrophobicContact CZ-CG 3.8Å; F467-P601 VanDerWaalsContact CZ-O 3.28Å; F467-P601 WeakPolarHBondContact CZ-O 3.14Å; V595-P601 HydrophobicContact CG1-CB 3.41Å; V595-P601 VanDerWaalsContact CG1-CB 3.41Å; V596-P601 CarbonylContact O-C 3.58Å; V596-P601 WeakPolarHBondContact O-CA 3.12Å; G597-P601 WeakPolarHBondContact O-CA 3.46Å
602	R	87.4	Confident	89.4	Confident	123 Å²	123	64.4 Å²	64.4	46%	0.464	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	131.9	178.3	-73.5	169	171.9	-176.9	-1	109.8	E535 V595 V596 C604	E535-R602 WeakPolarHBondContact OE1-CD 3.24Å; E535-R602 IonicContact OE1-CZ 3.65Å; E535-R602 IonicContact OE1-NE 3.48Å; E535-R602 PolarHBondContact OE1-NE 3.44Å; E535-R602 IonicContact OE1-NH1 3.62Å; E535-R602 IonicContact OE1-NH2 2.81Å; E535-R602 VanDerWaalsContact OE2-CB 3.3Å; E535-R602 WeakPolarHBondContact OE2-CB 3.3Å; E535-R602 WeakPolarHBondContact OE2-CD 3.39Å; E535-R602 WeakPolarHBondContact OE2-CG 3.35Å; E535-R602 IonicContact OE2-NE 3.55Å; V595-R602 CarbonylContact C-O 3.58Å; V595-R602 VanDerWaalsContact CA-O 3.3Å; V595-R602 WeakPolarHBondContact CA-O 3.43Å; V596-R602 PolarHBondContact N-O 3.05Å; V596-R602 PolarHBondContact O-N 3.37Å; R602-C604 PolarHBondContact O-N 3.22Å
603	Y	90	Very high	89.4	Confident	17 Å²	17	60.4 Å²	60.4	7%	0.067	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	101.8	177.8	-167.1	-118.5	0	0	0	109.8	P468 V471 Y532 L547 A593 V595	P468-Y603 HydrophobicContact CG-CD1 3.91Å; P468-Y603 HydrophobicContact CG-CE1 3.73Å; V471-Y603 HydrophobicContact CG1-CD2 4.42Å; V471-Y603 HydrophobicContact CG2-CD2 4.46Å; V471-Y603 HydrophobicContact CG2-CE2 4.01Å; Y532-Y603 AromaticContact CE1-CD1 3.81Å; Y532-Y603 HydrophobicContact CE1-CD1 3.81Å; Y532-Y603 HydrophobicContact CE1-CE1 4.39Å; L547-Y603 HydrophobicContact CD1-CE1 4.22Å; L547-Y603 HydrophobicContact CD2-CD1 4.45Å; L547-Y603 HydrophobicContact CD2-CE1 3.86Å; L547-Y603 HydrophobicContact CG-CE1 3.95Å; A593-Y603 HydrophobicContact CB-CE1 4.1Å; A593-Y603 HydrophobicContact CB-CE2 4.05Å; A593-Y603 VanDerWaalsContact CB-OH 3.31Å; A593-Y603 WeakPolarHBondContact CB-OH 3.01Å; V595-Y603 HydrophobicContact CG2-CD2 4.06Å
604	C	89.2	Confident	89.4	Confident	28 Å²	28	63.7 Å²	63.7	19%	0.189	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	146.3	-171.2	-59.8	0	0	0	0	111.5	A593 G594 V596 R602 F606	A593-C604 WeakPolarHBondContact CA-O 3.46Å; G594-C604 PolarHBondContact N-O 3.44Å; G594-C604 PolarHBondContact O-N 2.79Å; V596-C604 HydrophobicContact CG2-CB 4.31Å; R602-C604 PolarHBondContact O-N 3.22Å; C604-F606 HydrophobicContact CB-CD2 4.42Å; C604-F606 HydrophobicContact CB-CE2 3.53Å; C604-F606 HydrophobicContact CB-CZ 3.56Å
605	L	91.1	Very high	89.5	Confident	23 Å²	23	68.5 Å²	68.5	12%	0.12	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	135.9	171.5	-66.5	-176.7	0	0	0	111.1	M491 V534 A544 L547 V591 A593 V610	M491-L605 HydrophobicContact CG-CD1 4.46Å; V534-L605 HydrophobicContact CG1-CD1 4.14Å; V534-L605 HydrophobicContact CG1-CG 4.14Å; V534-L605 HydrophobicContact CG2-CD1 3.73Å; V534-L605 HydrophobicContact CG2-CG 4.34Å; A544-L605 HydrophobicContact CB-CD1 4.21Å; L547-L605 HydrophobicContact CD1-CD2 3.59Å; L547-L605 HydrophobicContact CD2-CD1 4.13Å; L547-L605 HydrophobicContact CD2-CD2 3.59Å; L547-L605 HydrophobicContact CD2-CG 4.13Å; L547-L605 HydrophobicContact CG-CD2 4.24Å; V591-L605 HydrophobicContact CG2-CD2 4.09Å; A593-L605 HydrophobicContact CB-CD2 3.63Å; L605-V610 HydrophobicContact CB-CG1 4.41Å; L605-V610 HydrophobicContact CB-CG2 3.91Å
606	F	90.1	Very high	89.7	Confident	103 Å²	103	66.8 Å²	66.8	45%	0.452	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	154.9	179.3	-59.6	-79.1	0	0	0	111.5	L592 V596 C604	L592-F606 HydrophobicContact CB-CB 4.26Å; L592-F606 PolarHBondContact N-O 3Å; L592-F606 PolarHBondContact O-N 3.3Å; V596-F606 HydrophobicContact CG2-CE2 3.94Å; V596-F606 HydrophobicContact CG2-CZ 3.76Å; C604-F606 HydrophobicContact CB-CD2 4.42Å; C604-F606 HydrophobicContact CB-CE2 3.53Å; C604-F606 HydrophobicContact CB-CZ 3.56Å
607	G	90.9	Very high	90	Very high	37 Å²	37	63.7 Å²	63.7	38%	0.381	34%	0.34	S	S	.	.	S	Bend	trans	122.1	164	173.3	0	0	0	0	0	113.4	N609 V610	G607-N609 PolarHBondContact O-N 3.47Å; G607-V610 WeakPolarHBondContact O-CB 3.42Å; G607-V610 PolarHBondContact O-N 3Å; G607-V610 VanDerWaalsContact O-N 3.07Å
608	N	92.3	Very high	90.4	Very high	99 Å²	99	64.2 Å²	64.2	53%	0.529	34%	0.337	S	S	.	.	H	α-helix	trans	-57.3	-37.5	-176.2	-171.6	42	0	0	0	112.7	V610 T611 L612	N608-V610 VanDerWaalsContact C-N 3.26Å; N608-V610 PolarHBondContact O-N 2.79Å; N608-T611 PolarHBondContact O-N 3.44Å; N608-L612 WeakPolarHBondContact O-CB 3.17Å; N608-L612 PolarHBondContact O-N 2.9Å
609	N	94.5	Very high	91	Very high	32 Å²	32	59.5 Å²	59.5	17%	0.171	31%	0.31	C	S	.	.	H	α-helix	trans	-65.2	-28	-179.7	-65.2	-35.9	0	0	0	112.8	M491 H587 S590 G607 L612 A613	M491-N609 HydrophobicContact CE-CB 3.86Å; M491-N609 VanDerWaalsContact CE-O 3.3Å; M491-N609 WeakPolarHBondContact CE-O 3.09Å; H587-N609 PolarHBondContact CD2-O 3.25Å; H587-N609 PolarHBondContact NE2-OD1 3.17Å; S590-N609 PolarHBondContact N-ND2 3.26Å; S590-N609 PolarHBondContact O-ND2 2.91Å; G607-N609 PolarHBondContact O-N 3.47Å; N609-L612 PolarHBondContact O-N 2.95Å; N609-A613 WeakPolarHBondContact O-CB 3.47Å; N609-A613 PolarHBondContact O-N 3.26Å
610	V	93.4	Very high	91.6	Very high	21 Å²	21	50.3 Å²	50.3	13%	0.127	27%	0.271	C	S	.	.	H	α-helix	trans	-68	-47.9	175.6	-175.4	0	0	0	0	110	M491 F493 V591 L605 G607 N608 L612 A613 N614	M491-V610 HydrophobicContact SD-CB 4.16Å; M491-V610 HydrophobicContact SD-CG1 4.45Å; M491-V610 HydrophobicContact SD-CG2 3.77Å; F493-V610 HydrophobicContact CE2-CG1 4.37Å; F493-V610 HydrophobicContact CZ-CG1 3.87Å; V591-V610 HydrophobicContact CB-CG2 4.5Å; V591-V610 HydrophobicContact CG1-CG2 3.99Å; L605-V610 HydrophobicContact CB-CG1 4.41Å; L605-V610 HydrophobicContact CB-CG2 3.91Å; G607-V610 WeakPolarHBondContact O-CB 3.42Å; G607-V610 PolarHBondContact O-N 3Å; G607-V610 VanDerWaalsContact O-N 3.07Å; N608-V610 VanDerWaalsContact C-N 3.26Å; N608-V610 PolarHBondContact O-N 2.79Å; V610-L612 VanDerWaalsContact C-N 3.28Å; V610-L612 PolarHBondContact O-N 3.46Å; V610-A613 WeakPolarHBondContact O-CB 3.48Å; V610-A613 PolarHBondContact O-N 2.84Å; V610-N614 PolarHBondContact O-N 2.87Å; V610-N614 VanDerWaalsContact O-N 3.1Å
611	T	92.6	Very high	92.1	Very high	82 Å²	82	47.8 Å²	47.8	50%	0.503	26%	0.258	S	S	.	.	H	α-helix	trans	-62.7	-38.5	175.6	-51.7	0	0	0	0	111.5	N608 N614 K615	N608-T611 PolarHBondContact O-N 3.44Å; T611-N614 PolarHBondContact O-N 3.17Å; T611-K615 WeakPolarHBondContact O-CG 3.49Å; T611-K615 PolarHBondContact O-N 3.31Å
612	L	93.8	Very high	92.4	Very high	5 Å²	5	48.8 Å²	48.8	3%	0.026	26%	0.264	C	S	.	.	H	α-helix	trans	-66.8	-41	177.8	-169.5	58	0	0	0	112	N608 N609 V610 N614 K615 F616 P652 F655	N608-L612 WeakPolarHBondContact O-CB 3.17Å; N608-L612 PolarHBondContact O-N 2.9Å; N609-L612 PolarHBondContact O-N 2.95Å; V610-L612 VanDerWaalsContact C-N 3.28Å; V610-L612 PolarHBondContact O-N 3.46Å; L612-N614 PolarHBondContact O-N 2.84Å; L612-K615 PolarHBondContact O-N 3.32Å; L612-K615 VanDerWaalsContact O-N 3.14Å; L612-F616 HydrophobicContact CD1-CD2 4.48Å; L612-F616 HydrophobicContact CD1-CE2 4.14Å; L612-F616 HydrophobicContact CD2-CE2 4.34Å; L612-F616 HydrophobicContact CG-CD2 4.08Å; L612-F616 HydrophobicContact CG-CE2 3.8Å; L612-F616 VanDerWaalsContact O-CD2 3.23Å; L612-F616 WeakPolarHBondContact O-CD2 3.49Å; L612-F616 PolarHBondContact O-N 3.42Å; L612-P652 HydrophobicContact CD1-CB 3.76Å; L612-P652 HydrophobicContact CD1-CG 3.93Å; L612-F655 HydrophobicContact CD1-CB 4.22Å; L612-F655 HydrophobicContact CD1-CD2 4Å; L612-F655 HydrophobicContact CD2-CD2 3.69Å; L612-F655 HydrophobicContact CD2-CE2 4.04Å; L612-F655 HydrophobicContact CG-CD2 4.18Å
613	A	94	Very high	92.6	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-59.2	-44.8	173.9	0	0	0	0	0	112	M491 F493 H587 N609 V610 K615 F616 E617	M491-A613 HydrophobicContact CB-CB 3.95Å; M491-A613 HydrophobicContact CE-CB 4.07Å; M491-A613 HydrophobicContact SD-CB 4.26Å; F493-A613 HydrophobicContact CD2-CB 3.57Å; F493-A613 HydrophobicContact CE2-CB 3.61Å; H587-A613 HydrophobicContact CB-CB 3.74Å; N609-A613 WeakPolarHBondContact O-CB 3.47Å; N609-A613 PolarHBondContact O-N 3.26Å; V610-A613 WeakPolarHBondContact O-CB 3.48Å; V610-A613 PolarHBondContact O-N 2.84Å; A613-K615 VanDerWaalsContact C-N 3.32Å; A613-K615 PolarHBondContact O-N 2.97Å; A613-F616 WeakPolarHBondContact O-CB 3.42Å; A613-F616 PolarHBondContact O-N 2.95Å; A613-F616 VanDerWaalsContact O-N 3.13Å; A613-E617 PolarHBondContact O-N 2.87Å
614	N	93.1	Very high	92.8	Very high	71 Å²	71	50.8 Å²	50.8	38%	0.38	27%	0.273	S	S	.	.	H	α-helix	trans	-59.2	-42.3	173.2	-171.7	17.3	0	0	0	111.5	F493 V610 T611 L612 F616 E617 S618	F493-N614 HydrophobicContact CD1-CB 3.94Å; F493-N614 HydrophobicContact CE1-CB 3.97Å; F493-N614 HydrophobicContact CG-CB 4.32Å; F493-N614 HydrophobicContact CZ-CB 4.36Å; V610-N614 PolarHBondContact O-N 2.87Å; V610-N614 VanDerWaalsContact O-N 3.1Å; T611-N614 PolarHBondContact O-N 3.17Å; L612-N614 PolarHBondContact O-N 2.84Å; N614-F616 VanDerWaalsContact C-N 3.33Å; N614-F616 PolarHBondContact O-N 3.47Å; N614-E617 WeakPolarHBondContact O-CB 3.3Å; N614-E617 PolarHBondContact O-N 2.74Å; N614-S618 PolarHBondContact O-N 3.03Å; N614-S618 PolarHBondContact O-OG 3.32Å
615	K	93.9	Very high	93.2	Very high	106 Å²	106	49.8 Å²	49.8	46%	0.461	27%	0.266	S	S	.	.	H	α-helix	trans	-65.4	-32.8	174.7	-68	-63.5	-177.5	-174	0	113.6	T611 L612 A613 E617 S618 C619 P652	T611-K615 WeakPolarHBondContact O-CG 3.49Å; T611-K615 PolarHBondContact O-N 3.31Å; L612-K615 PolarHBondContact O-N 3.32Å; L612-K615 VanDerWaalsContact O-N 3.14Å; A613-K615 VanDerWaalsContact C-N 3.32Å; A613-K615 PolarHBondContact O-N 2.97Å; K615-E617 VanDerWaalsContact C-N 3.29Å; K615-E617 PolarHBondContact O-N 3.38Å; K615-S618 PolarHBondContact O-N 2.88Å; K615-C619 WeakPolarHBondContact O-CB 3.45Å; K615-C619 PolarHBondContact O-N 3.34Å; K615-C619 PolarHBondContact O-SG 3.39Å; K615-C619 VanDerWaalsContact O-SG 3.34Å; K615-P652 HydrophobicContact CB-CB 3.8Å; K615-P652 HydrophobicContact CB-CG 3.87Å
616	F	94.9	Very high	93.5	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-64.7	-33.7	173.7	-88	-73.2	0	0	0	112.5	H587 L612 A613 N614 S620 N626 S628 L651 P652 F655 C663	H587-F616 HydrophobicContact CB-CD2 3.95Å; H587-F616 HydrophobicContact CB-CE2 4.49Å; H587-F616 AromaticContact ND1-CE2 3.77Å; L612-F616 HydrophobicContact CD1-CD2 4.48Å; L612-F616 HydrophobicContact CD1-CE2 4.14Å; L612-F616 HydrophobicContact CD2-CE2 4.34Å; L612-F616 HydrophobicContact CG-CD2 4.08Å; L612-F616 HydrophobicContact CG-CE2 3.8Å; L612-F616 VanDerWaalsContact O-CD2 3.23Å; L612-F616 WeakPolarHBondContact O-CD2 3.49Å; L612-F616 PolarHBondContact O-N 3.42Å; A613-F616 WeakPolarHBondContact O-CB 3.42Å; A613-F616 PolarHBondContact O-N 2.95Å; A613-F616 VanDerWaalsContact O-N 3.13Å; N614-F616 VanDerWaalsContact C-N 3.33Å; N614-F616 PolarHBondContact O-N 3.47Å; F616-S620 PolarHBondContact O-N 3.03Å; F616-N626 PolarHBondContact O-ND2 3.41Å; F616-S628 VanDerWaalsContact CE2-CB 3.42Å; F616-L651 HydrophobicContact CE1-CD2 3.77Å; F616-L651 HydrophobicContact CZ-CD2 3.87Å; F616-P652 HydrophobicContact CD1-CG 4.26Å; F616-P652 HydrophobicContact CD2-CG 4.08Å; F616-P652 HydrophobicContact CE1-CG 4.24Å; F616-P652 HydrophobicContact CE2-CG 4.07Å; F616-P652 HydrophobicContact CG-CG 4.16Å; F616-P652 HydrophobicContact CZ-CG 4.13Å; F616-F655 AromaticContact CE2-CD2 3.64Å; F616-F655 HydrophobicContact CE2-CD2 3.64Å; F616-F655 AromaticContact CE2-CE2 3.8Å; F616-F655 HydrophobicContact CE2-CE2 3.8Å; F616-F655 AromaticContact CZ-CD2 3.52Å; F616-F655 HydrophobicContact CZ-CD2 3.52Å; F616-F655 AromaticContact CZ-CE2 3.64Å; F616-F655 HydrophobicContact CZ-CE2 3.64Å; F616-F655 HydrophobicContact CZ-CG 4.5Å; F616-C663 HydrophobicContact CE1-CB 4.17Å
617	E	94.6	Very high	93.8	Very high	9 Å²	9	43.8 Å²	43.8	4%	0.042	24%	0.239	C	C	.	.	H	α-helix	trans	-64.3	-51.7	169.5	174.4	-68.8	129.2	0	0	109.9	F493 D495 R583 A613 N614 K615 C619 S620	F493-E617 HydrophobicContact CB-CB 3.69Å; F493-E617 HydrophobicContact CB-CG 4.14Å; D495-E617 HydrophobicContact CB-CG 4.18Å; D495-E617 WeakPolarHBondContact CB-OE1 3.44Å; R583-E617 WeakPolarHBondContact CB-OE1 3.47Å; R583-E617 IonicContact CZ-OE1 2.71Å; R583-E617 IonicContact NE-OE1 3.92Å; R583-E617 PolarHBondContact NE-OE1 3.47Å; A613-E617 PolarHBondContact O-N 2.87Å; N614-E617 WeakPolarHBondContact O-CB 3.3Å; N614-E617 PolarHBondContact O-N 2.74Å; K615-E617 VanDerWaalsContact C-N 3.29Å; K615-E617 PolarHBondContact O-N 3.38Å; E617-C619 PolarHBondContact O-N 2.66Å; E617-S620 WeakPolarHBondContact O-CA 3.34Å; E617-S620 WeakPolarHBondContact O-CB 3.25Å; E617-S620 PolarHBondContact O-N 3.32Å
618	S	91.9	Very high	94.1	Very high	57 Å²	57	42 Å²	42	40%	0.399	22%	0.221	S	C	.	.	H	α-helix	trans	-67.1	-26.2	-172.8	-50.9	0	0	0	0	113.2	N614 K615 S620	N614-S618 PolarHBondContact O-N 3.03Å; N614-S618 PolarHBondContact O-OG 3.32Å; K615-S618 PolarHBondContact O-N 2.88Å; S618-S620 VanDerWaalsContact C-N 3.31Å
619	C	92	Very high	94.3	Very high	50 Å²	50	37.7 Å²	37.7	34%	0.338	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	3.1	172.4	-64.4	0	0	0	0	113.6	K615 E617 R646	K615-C619 WeakPolarHBondContact O-CB 3.45Å; K615-C619 PolarHBondContact O-N 3.34Å; K615-C619 PolarHBondContact O-SG 3.39Å; K615-C619 VanDerWaalsContact O-SG 3.34Å; E617-C619 PolarHBondContact O-N 2.66Å; C619-R646 PolarHBondContact O-NH1 3.31Å; C619-R646 PolarHBondContact O-NH2 3.22Å
620	S	93.6	Very high	94.3	Very high	10 Å²	10	36.8 Å²	36.8	7%	0.07	19%	0.194	C	C	.	.	S	Bend	trans	-77.8	167.7	173.5	-162.8	0	0	0	0	111.8	I584 F616 E617 S618 K624 N626	I584-S620 PolarHBondContact O-OG 2.95Å; F616-S620 PolarHBondContact O-N 3.03Å; E617-S620 WeakPolarHBondContact O-CA 3.34Å; E617-S620 WeakPolarHBondContact O-CB 3.25Å; E617-S620 PolarHBondContact O-N 3.32Å; S618-S620 VanDerWaalsContact C-N 3.31Å; S620-K624 PolarHBondContact OG-O 2.92Å; S620-N626 WeakPolarHBondContact OG-CB 3.38Å
621	Q	93.1	Very high	94.4	Very high	86 Å²	86	35.9 Å²	35.9	40%	0.402	19%	0.188	S	C	.	.			trans	-107	152.4	176.1	-69.4	176.5	4.3	0	0	110.3	R623 K624 F665	Q621-R623 PolarHBondContact O-N 2.84Å; Q621-K624 HydrophobicContact CB-CB 4.19Å; Q621-K624 HydrophobicContact CB-CG 4.16Å; Q621-K624 WeakPolarHBondContact O-CB 3.36Å; Q621-K624 PolarHBondContact O-N 2.71Å; Q621-K624 VanDerWaalsContact O-N 3.08Å; Q621-F665 HydrophobicContact CB-CE1 4.38Å; Q621-F665 HydrophobicContact CB-CZ 4.05Å; Q621-F665 HydrophobicContact CG-CZ 3.8Å
622	P	93.4	Very high	94.6	Very high	66 Å²	66	33.3 Å²	33.3	43%	0.429	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.7	135.2	173.5	-29	36.9	0	0	0	112.4	V497 K624	V497-P622 HydrophobicContact CG1-CB 4.37Å; V497-P622 HydrophobicContact CG1-CG 4.18Å; V497-P622 HydrophobicContact CG2-CB 3.99Å; V497-P622 HydrophobicContact CG2-CG 4.19Å; P622-K624 PolarHBondContact O-N 2.71Å
623	R	92.7	Very high	94.6	Very high	117 Å²	117	41.2 Å²	41.2	44%	0.442	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.2	24	-177.7	-56.6	-175.8	62.8	101	7.7	114.5	D570 Q581 M582 Q621	D570-R623 VanDerWaalsContact CG-NH2 3.27Å; D570-R623 IonicContact OD1-CZ 3.59Å; D570-R623 IonicContact OD1-NH1 2.77Å; D570-R623 PolarHBondContact OD1-NH1 2.76Å; D570-R623 IonicContact OD1-NH2 2.75Å; D570-R623 PolarHBondContact OD1-NH2 3.17Å; D570-R623 IonicContact OD2-NH2 2.74Å; D570-R623 PolarHBondContact OD2-NH2 3.41Å; Q581-R623 HydrophobicContact CB-CG 4.11Å; Q581-R623 HydrophobicContact CG-CG 3.97Å; M582-R623 WeakPolarHBondContact O-CA 3.41Å; M582-R623 PolarHBondContact O-N 3.19Å; Q621-R623 PolarHBondContact O-N 2.84Å
624	K	94.4	Very high	94.6	Very high	65 Å²	65	45.1 Å²	45.1	28%	0.283	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	145.2	176.5	-65.2	-67.2	-170.3	-179.1	0	111.4	M566 I584 S620 Q621 P622 F665 E667	M566-K624 WeakPolarHBondContact CE-O 3.35Å; I584-K624 PolarHBondContact N-O 3.37Å; S620-K624 PolarHBondContact OG-O 2.92Å; Q621-K624 HydrophobicContact CB-CB 4.19Å; Q621-K624 HydrophobicContact CB-CG 4.16Å; Q621-K624 WeakPolarHBondContact O-CB 3.36Å; Q621-K624 PolarHBondContact O-N 2.71Å; Q621-K624 VanDerWaalsContact O-N 3.08Å; P622-K624 PolarHBondContact O-N 2.71Å; K624-F665 HydrophobicContact CB-CD1 3.61Å; K624-F665 HydrophobicContact CB-CE1 3.57Å; K624-F665 HydrophobicContact CB-CG 4.37Å; K624-F665 HydrophobicContact CB-CZ 4.28Å; K624-F665 HydrophobicContact CD-CG 4.49Å; K624-F665 HydrophobicContact CG-CD1 4.27Å; K624-F665 HydrophobicContact CG-CE1 4.21Å; K624-F665 HydrophobicContact CG-CZ 4.49Å; K624-E667 IonicContact NZ-OE1 2.82Å; K624-E667 PolarHBondContact NZ-OE1 3.08Å
625	I	96.9	Very high	94.6	Very high	6 Å²	6	41.7 Å²	41.7	3%	0.031	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	111.2	176.1	-56.7	168.5	0	0	0	107.7	A562 L563 M566 I584 L586 F665 L666	A562-I625 HydrophobicContact CB-CD1 3.93Å; A562-I625 HydrophobicContact CB-CG1 4.43Å; A562-I625 HydrophobicContact CB-CG2 3.96Å; L563-I625 HydrophobicContact CD2-CD1 3.76Å; L563-I625 HydrophobicContact CG-CD1 4.35Å; M566-I625 HydrophobicContact CE-CG1 3.53Å; M566-I625 HydrophobicContact CG-CD1 3.83Å; M566-I625 HydrophobicContact CG-CG1 3.83Å; I584-I625 HydrophobicContact CB-CB 4.49Å; I584-I625 HydrophobicContact CB-CG1 4.25Å; I584-I625 HydrophobicContact CB-CG2 4.28Å; I584-I625 HydrophobicContact CD1-CG1 4.35Å; I584-I625 HydrophobicContact CG2-CG2 4.07Å; L586-I625 HydrophobicContact CD1-CG2 3.33Å; L586-I625 HydrophobicContact CG-CG2 4.13Å; I625-F665 CarbonylContact O-C 3.58Å; I625-F665 VanDerWaalsContact O-CA 3.3Å; I625-F665 WeakPolarHBondContact O-CA 3.02Å; I625-L666 HydrophobicContact CB-CB 4.1Å; I625-L666 HydrophobicContact CD1-CD2 4.45Å; I625-L666 HydrophobicContact CG2-CB 4.06Å; I625-L666 HydrophobicContact CG2-CD2 4.25Å; I625-L666 PolarHBondContact O-N 3.24Å
626	N	97.1	Very high	94.3	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	129.7	179.2	-168	28.6	0	0	0	110.6	I584 G585 L586 F616 S620 R646 Y664 F665	I584-N626 PolarHBondContact O-N 3.14Å; G585-N626 CarbonylContact C-O 3.54Å; G585-N626 WeakPolarHBondContact CA-O 3.15Å; L586-N626 PolarHBondContact N-O 2.94Å; F616-N626 PolarHBondContact O-ND2 3.41Å; S620-N626 WeakPolarHBondContact OG-CB 3.38Å; N626-R646 PolarHBondContact OD1-NH1 3.48Å; N626-Y664 CarbonylContact C-O 3.52Å; N626-F665 HydrophobicContact CB-CE1 4.37Å
627	V	97.1	Very high	93.5	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	124.7	-174.6	-171.2	0	0	0	0	109.5	L586 T631 H632 F643 C663 Y664 L666	L586-V627 HydrophobicContact CD1-CG2 3.88Å; V627-T631 HydrophobicContact CG1-CG2 3.94Å; V627-H632 HydrophobicContact CG1-CB 4.18Å; V627-F643 HydrophobicContact CG1-CE1 4.35Å; V627-F643 HydrophobicContact CG2-CE1 4.21Å; V627-C663 CarbonylContact O-C 3.58Å; V627-C663 VanDerWaalsContact O-CA 3.32Å; V627-C663 WeakPolarHBondContact O-CA 3.48Å; V627-Y664 PolarHBondContact N-O 3.41Å; V627-Y664 PolarHBondContact O-N 3.25Å; V627-L666 HydrophobicContact CG2-CB 3.63Å
628	S	96.8	Very high	93.2	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.273	C	S	.	.			trans	-66.7	154	171.9	71.1	0	0	0	0	112.2	L586 H587 F616 T630 T631 H632	L586-S628 WeakPolarHBondContact O-CB 3.2Å; L586-S628 PolarHBondContact O-N 3.47Å; L586-S628 PolarHBondContact O-OG 2.92Å; L586-S628 VanDerWaalsContact O-OG 3.12Å; H587-S628 WeakPolarHBondContact CA-OG 3.35Å; H587-S628 VanDerWaalsContact ND1-CB 3.34Å; H587-S628 WeakPolarHBondContact ND1-CB 3.29Å; H587-S628 PolarHBondContact ND1-OG 3.49Å; F616-S628 VanDerWaalsContact CE2-CB 3.42Å; S628-T630 PolarHBondContact O-N 2.75Å; S628-T630 PolarHBondContact OG-OG1 3.4Å; S628-T630 VanDerWaalsContact OG-OG1 3.06Å; S628-T631 PolarHBondContact O-N 3.26Å; S628-T631 PolarHBondContact OG-N 2.76Å; S628-T631 PolarHBondContact OG-OG1 2.95Å; S628-H632 PolarHBondContact O-N 3.2Å
629	P	95.6	Very high	92.8	Very high	8 Å²	8	57.4 Å²	57.4	5%	0.052	29%	0.288	C	S	.	.	H	α-helix	trans	-59.2	-30.4	177.9	22.1	-33.3	0	0	0	112.8	R633 F655 V662	P629-R633 PolarHBondContact O-N 3.45Å; P629-F655 HydrophobicContact CG-CE1 4Å; P629-F655 HydrophobicContact CG-CE2 4.14Å; P629-F655 HydrophobicContact CG-CZ 3.45Å; P629-F655 VanDerWaalsContact CG-CZ 3.45Å; P629-V662 WeakPolarHBondContact CB-O 3.29Å
630	T	95.7	Very high	92.5	Very high	14 Å²	14	59.5 Å²	59.5	9%	0.086	29%	0.293	C	S	.	.	H	α-helix	trans	-66.5	-44.6	178.3	57.5	0	0	0	0	111.7	H587 S588 S628 I659	H587-T630 PolarHBondContact CE1-OG1 3.43Å; H587-T630 VanDerWaalsContact CE1-OG1 3.26Å; H587-T630 PolarHBondContact ND1-OG1 3.46Å; H587-T630 VanDerWaalsContact ND1-OG1 3.15Å; S588-T630 PolarHBondContact N-OG1 3.4Å; S588-T630 WeakPolarHBondContact O-CB 3.28Å; S588-T630 PolarHBondContact O-OG1 2.92Å; S628-T630 PolarHBondContact O-N 2.75Å; S628-T630 PolarHBondContact OG-OG1 3.4Å; S628-T630 VanDerWaalsContact OG-OG1 3.06Å; T630-I659 HydrophobicContact CG2-CD1 4.2Å; T630-I659 HydrophobicContact CG2-CG2 3.94Å
631	T	96.3	Very high	92.4	Very high	1 Å²	1	59.6 Å²	59.6	1%	0.006	29%	0.292	C	S	.	.	H	α-helix	trans	-68.6	-43.2	175.3	-53.1	0	0	0	0	111.3	T490 A555 L586 H587 S588 V627 S628 R633 L634 L635	T490-T631 HydrophobicContact CG2-CG2 4.12Å; A555-T631 HydrophobicContact CB-CG2 4.35Å; L586-T631 HydrophobicContact CB-CG2 4.47Å; H587-T631 VanDerWaalsContact C-OG1 3.29Å; H587-T631 VanDerWaalsContact CA-OG1 3.32Å; H587-T631 WeakPolarHBondContact CA-OG1 3.32Å; S588-T631 PolarHBondContact N-OG1 2.65Å; S588-T631 WeakPolarHBondContact OG-CA 3.32Å; S588-T631 WeakPolarHBondContact OG-CB 3.46Å; S588-T631 PolarHBondContact OG-OG1 3.17Å; V627-T631 HydrophobicContact CG1-CG2 3.94Å; S628-T631 PolarHBondContact O-N 3.26Å; S628-T631 PolarHBondContact OG-N 2.76Å; S628-T631 PolarHBondContact OG-OG1 2.95Å; T631-R633 VanDerWaalsContact C-N 3.26Å; T631-R633 PolarHBondContact O-N 3.1Å; T631-L634 WeakPolarHBondContact O-CB 3.38Å; T631-L634 PolarHBondContact O-N 3.12Å; T631-L635 HydrophobicContact CG2-CD1 3.89Å; T631-L635 HydrophobicContact CG2-CG 4.39Å; T631-L635 WeakPolarHBondContact O-CG 3.42Å; T631-L635 PolarHBondContact O-N 3.2Å; T631-L635 VanDerWaalsContact O-N 3.16Å
632	H	95.6	Very high	92.4	Very high	29 Å²	29	58.6 Å²	58.6	13%	0.134	29%	0.292	C	S	.	.	H	α-helix	trans	-57.1	-40.2	178.3	169.8	-102.5	0	0	0	111.9	V627 S628 L634 L635 R636 F643 Y664	V627-H632 HydrophobicContact CG1-CB 4.18Å; S628-H632 PolarHBondContact O-N 3.2Å; H632-L634 PolarHBondContact O-N 3.22Å; H632-L635 CarbonylContact O-C 3.52Å; H632-L635 PolarHBondContact O-N 3.32Å; H632-L635 VanDerWaalsContact O-N 3.09Å; H632-R636 WeakPolarHBondContact O-CB 3.28Å; H632-R636 PolarHBondContact O-N 2.79Å; H632-F643 AromaticContact CD2-CD1 3.73Å; H632-F643 AromaticContact CD2-CD2 3.75Å; H632-F643 AromaticContact CD2-CG 3.58Å; H632-Y664 HydrophobicContact CB-CD2 3.66Å; H632-Y664 HydrophobicContact CB-CE2 3.82Å; H632-Y664 HydrophobicContact CB-CG 4.48Å; H632-Y664 AromaticContact CD2-CD2 3.96Å; H632-Y664 AromaticContact CE1-CE1 3.96Å; H632-Y664 AromaticContact CE1-CE2 3.86Å; H632-Y664 AromaticContact CE1-CZ 3.56Å; H632-Y664 AromaticContact CG-CD2 3.57Å; H632-Y664 AromaticContact CG-CE2 3.45Å; H632-Y664 VanDerWaalsContact CG-CE2 3.45Å; H632-Y664 AromaticContact CG-CZ 3.95Å; H632-Y664 AromaticContact ND1-CD2 3.98Å; H632-Y664 AromaticContact ND1-CE2 3.35Å; H632-Y664 VanDerWaalsContact ND1-CE2 3.35Å; H632-Y664 WeakPolarHBondContact ND1-CE2 3.49Å; H632-Y664 AromaticContact ND1-CZ 3.53Å; H632-Y664 AromaticContact NE2-CE1 3.99Å
633	R	94.3	Very high	92.4	Very high	170 Å²	170	57.4 Å²	57.4	64%	0.642	28%	0.28	S	S	*	.	H	α-helix	trans	-59.1	-35	176.1	-175.9	173.5	62.7	-165.1	-0.7	113	P629 T631	P629-R633 PolarHBondContact O-N 3.45Å; T631-R633 VanDerWaalsContact C-N 3.26Å; T631-R633 PolarHBondContact O-N 3.1Å
634	L	93.9	Very high	92.4	Very high	82 Å²	82	54.9 Å²	54.9	43%	0.429	28%	0.277	S	S	.	.	H	α-helix	trans	-75.8	-26	177.8	-60.4	174.2	0	0	0	112.6	A555 T631 H632	A555-L634 HydrophobicContact CB-CB 3.77Å; A555-L634 HydrophobicContact CB-CD1 3.9Å; T631-L634 WeakPolarHBondContact O-CB 3.38Å; T631-L634 PolarHBondContact O-N 3.12Å; H632-L634 PolarHBondContact O-N 3.22Å
635	L	93.1	Very high	92.4	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-95.5	-15.5	-179.5	-61.7	176.7	0	0	0	113.4	A555 V556 A559 T631 H632 G637 R638 F641 F643	A555-L635 HydrophobicContact CB-CD2 3.97Å; A555-L635 HydrophobicContact CB-CG 4.31Å; V556-L635 HydrophobicContact CB-CD2 4.31Å; V556-L635 HydrophobicContact CG2-CD2 3.72Å; A559-L635 HydrophobicContact CB-CD1 3.72Å; A559-L635 HydrophobicContact CB-CD2 4.24Å; T631-L635 HydrophobicContact CG2-CD1 3.89Å; T631-L635 HydrophobicContact CG2-CG 4.39Å; T631-L635 WeakPolarHBondContact O-CG 3.42Å; T631-L635 PolarHBondContact O-N 3.2Å; T631-L635 VanDerWaalsContact O-N 3.16Å; H632-L635 CarbonylContact O-C 3.52Å; H632-L635 PolarHBondContact O-N 3.32Å; H632-L635 VanDerWaalsContact O-N 3.09Å; L635-G637 PolarHBondContact O-N 2.87Å; L635-R638 WeakPolarHBondContact O-CB 3.48Å; L635-R638 WeakPolarHBondContact O-CG 3.49Å; L635-R638 PolarHBondContact O-N 3.23Å; L635-F641 HydrophobicContact CB-CD2 4.44Å; L635-F641 HydrophobicContact CD2-CD2 4.21Å; L635-F641 HydrophobicContact CD2-CE2 3.92Å; L635-F643 HydrophobicContact CB-CE2 4.16Å; L635-F643 HydrophobicContact CB-CZ 3.61Å; L635-F643 HydrophobicContact CD1-CE1 4.22Å; L635-F643 HydrophobicContact CD1-CZ 3.81Å; L635-F643 HydrophobicContact CG-CZ 4.37Å
636	R	86.4	Confident	92.2	Very high	197 Å²	197	57 Å²	57	74%	0.743	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	128.6	-177.2	-174.4	-178.8	-179.3	-170.4	-0.4	110.2	H632	H632-R636 WeakPolarHBondContact O-CB 3.28Å; H632-R636 PolarHBondContact O-N 2.79Å
637	G	80	Confident	91.8	Very high	79 Å²	79	59.4 Å²	59.4	81%	0.814	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.4	-1.2	179.8	0	0	0	0	0	114.7	L635	L635-G637 PolarHBondContact O-N 2.87Å
638	R	86.9	Confident	91.4	Very high	116 Å²	116	64 Å²	64	44%	0.438	33%	0.328	S	S	.	.			trans	-87.3	127.1	170.3	-64.7	-73.4	-178.7	161.6	-2.1	110.2	L635 E640 F641	L635-R638 WeakPolarHBondContact O-CB 3.48Å; L635-R638 WeakPolarHBondContact O-CG 3.49Å; L635-R638 PolarHBondContact O-N 3.23Å; R638-E640 PolarHBondContact O-N 3.44Å; R638-F641 HydrophobicContact CB-CD2 3.85Å; R638-F641 HydrophobicContact CB-CE2 4.3Å
639	P	83.3	Confident	91	Very high	110 Å²	110	73 Å²	73	71%	0.714	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-16	-177.8	29.5	-35.1	0	0	0	113.7	F641	P639-F641 VanDerWaalsContact C-N 3.29Å; P639-F641 PolarHBondContact O-N 2.97Å
640	E	85.8	Confident	90.7	Very high	94 Å²	94	75.7 Å²	75.7	44%	0.439	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-19.3	-176.8	-65.2	158.2	-132.6	0	0	113.5	R638	R638-E640 PolarHBondContact O-N 3.44Å
641	F	91.4	Very high	90.5	Very high	11 Å²	11	76 Å²	76	5%	0.048	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	125.9	-172	-58.2	-58.1	0	0	0	111.7	V556 A559 L560 L563 L635 R638 P639 F643 L666	V556-F641 HydrophobicContact CG1-CE2 4.03Å; V556-F641 HydrophobicContact CG1-CZ 4.05Å; V556-F641 HydrophobicContact CG2-CE2 4.47Å; A559-F641 HydrophobicContact CB-CD1 4.32Å; A559-F641 HydrophobicContact CB-CE1 3.68Å; A559-F641 HydrophobicContact CB-CE2 4.37Å; A559-F641 HydrophobicContact CB-CZ 3.71Å; L560-F641 HydrophobicContact CD2-CE1 3.96Å; L560-F641 HydrophobicContact CD2-CZ 4Å; L560-F641 HydrophobicContact CG-CE1 4.29Å; L560-F641 HydrophobicContact CG-CZ 4Å; L563-F641 HydrophobicContact CD1-CD1 4.02Å; L563-F641 HydrophobicContact CD1-CE1 3.9Å; L635-F641 HydrophobicContact CB-CD2 4.44Å; L635-F641 HydrophobicContact CD2-CD2 4.21Å; L635-F641 HydrophobicContact CD2-CE2 3.92Å; R638-F641 HydrophobicContact CB-CD2 3.85Å; R638-F641 HydrophobicContact CB-CE2 4.3Å; P639-F641 VanDerWaalsContact C-N 3.29Å; P639-F641 PolarHBondContact O-N 2.97Å; F641-F643 HydrophobicContact CB-CD2 4.39Å; F641-F643 HydrophobicContact CB-CE2 3.52Å; F641-F643 HydrophobicContact CB-CZ 3.66Å; F641-F643 HydrophobicContact CG-CZ 4.37Å; F641-L666 HydrophobicContact CB-CD1 3.67Å; F641-L666 HydrophobicContact CD1-CD1 3.84Å; F641-L666 HydrophobicContact CD1-CD2 4.39Å; F641-L666 HydrophobicContact CG-CD1 4.09Å
642	V	93.1	Very high	90.3	Very high	65 Å²	65	76.3 Å²	76.3	39%	0.394	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	126.8	175.3	-180	0	0	0	0	109.2	E667 A669	V642-E667 HydrophobicContact CB-CB 4.46Å; V642-E667 PolarHBondContact N-O 3.36Å; V642-E667 VanDerWaalsContact N-O 3.09Å; V642-E667 PolarHBondContact O-N 2.79Å; V642-A669 HydrophobicContact CG2-CB 4.02Å
643	F	93.6	Very high	89.8	Confident	42 Å²	42	80 Å²	80	18%	0.184	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	129.8	-176.9	-62.9	-81.5	0	0	0	111.6	V627 H632 L635 F641 Y664 F665 L666	V627-F643 HydrophobicContact CG1-CE1 4.35Å; V627-F643 HydrophobicContact CG2-CE1 4.21Å; H632-F643 AromaticContact CD2-CD1 3.73Å; H632-F643 AromaticContact CD2-CD2 3.75Å; H632-F643 AromaticContact CD2-CG 3.58Å; L635-F643 HydrophobicContact CB-CE2 4.16Å; L635-F643 HydrophobicContact CB-CZ 3.61Å; L635-F643 HydrophobicContact CD1-CE1 4.22Å; L635-F643 HydrophobicContact CD1-CZ 3.81Å; L635-F643 HydrophobicContact CG-CZ 4.37Å; F641-F643 HydrophobicContact CB-CD2 4.39Å; F641-F643 HydrophobicContact CB-CE2 3.52Å; F641-F643 HydrophobicContact CB-CZ 3.66Å; F641-F643 HydrophobicContact CG-CZ 4.37Å; F643-Y664 HydrophobicContact CB-CD1 3.99Å; F643-Y664 HydrophobicContact CB-CG 4.38Å; F643-F665 CarbonylContact C-O 3.56Å; F643-F665 WeakPolarHBondContact CA-O 3.4Å; F643-L666 HydrophobicContact CD1-CD1 4.12Å; F643-L666 HydrophobicContact CE1-CB 4.38Å; F643-L666 HydrophobicContact CE1-CD1 3.65Å; F643-L666 HydrophobicContact CZ-CD1 3.91Å
644	V	94.2	Very high	89.4	Confident	64 Å²	64	78 Å²	78	39%	0.388	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	113.5	172.7	-177.1	0	0	0	0	108.5	Y664 F665	V644-Y664 CarbonylContact O-C 3.55Å; V644-Y664 VanDerWaalsContact O-CA 3.28Å; V644-Y664 WeakPolarHBondContact O-CA 3.25Å; V644-F665 HydrophobicContact CB-CB 4.36Å; V644-F665 PolarHBondContact N-O 3.36Å; V644-F665 PolarHBondContact O-N 3.39Å
645	P	93	Very high	89.3	Confident	88 Å²	88	74.8 Å²	74.8	57%	0.571	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.1	141.2	-178.6	27	-33.5	0	0	0	111.6	V662 Y664	P645-V662 HydrophobicContact CB-CG2 4.22Å; P645-Y664 HydrophobicContact CB-CD1 3.94Å; P645-Y664 HydrophobicContact CB-CE1 3.79Å
646	R	92.3	Very high	89.2	Confident	28 Å²	28	76.5 Å²	76.5	11%	0.106	42%	0.417	C	S	.	.			trans	-107.6	178.6	172.9	-66.3	-176	72	-179.6	2.7	110.8	C619 N626 E650 V662 C663 F665	C619-R646 PolarHBondContact O-NH1 3.31Å; C619-R646 PolarHBondContact O-NH2 3.22Å; N626-R646 PolarHBondContact OD1-NH1 3.48Å; R646-E650 WeakPolarHBondContact CB-OE2 3.26Å; R646-E650 IonicContact CZ-OE1 3.83Å; R646-E650 IonicContact NE-OE1 3.98Å; R646-E650 PolarHBondContact NE-OE1 3.17Å; R646-E650 IonicContact NE-OE2 3.75Å; R646-E650 VanDerWaalsContact NH2-CD 3.33Å; R646-E650 IonicContact NH2-OE1 3.15Å; R646-E650 PolarHBondContact NH2-OE1 2.78Å; R646-V662 WeakPolarHBondContact O-CB 3.44Å; R646-V662 WeakPolarHBondContact O-CG2 3.36Å; R646-C663 WeakPolarHBondContact CB-O 3.27Å; R646-C663 VanDerWaalsContact CB-SG 3.59Å; R646-C663 PolarHBondContact N-O 2.9Å; R646-F665 VanDerWaalsContact CD-CE2 3.42Å; R646-F665 HydrophobicContact CG-CD2 3.83Å; R646-F665 HydrophobicContact CG-CE2 3.86Å; R646-F665 HydrophobicContact CG-CG 4.44Å; R646-F665 HydrophobicContact CG-CZ 4.46Å
647	S	89.8	Confident	89.2	Confident	49 Å²	49	75.6 Å²	75.6	34%	0.343	42%	0.421	S	S	.	.			trans	-79.4	151.1	177.6	71.5	0	0	0	0	111.8	Q649 E650	S647-Q649 PolarHBondContact O-N 3.3Å; S647-E650 PolarHBondContact N-OE2 3.04Å; S647-E650 PolarHBondContact O-N 3.1Å; S647-E650 VanDerWaalsContact O-N 3.17Å; S647-E650 VanDerWaalsContact OG-CG 3.26Å; S647-E650 WeakPolarHBondContact OG-CG 3.39Å; S647-E650 PolarHBondContact OG-OE2 3.05Å
648	R	88.9	Confident	89.7	Confident	96 Å²	96	78.3 Å²	78.3	36%	0.362	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-61.1	-27.5	173.1	-172.4	88	176.8	168	-0.1	111.7	E650 L651 E657 I659 G661 V662	R648-E650 PolarHBondContact O-N 3.42Å; R648-L651 HydrophobicContact CG-CD1 4.15Å; R648-L651 WeakPolarHBondContact O-CB 3.46Å; R648-L651 PolarHBondContact O-N 3.46Å; R648-E657 PolarHBondContact NH2-O 3.16Å; R648-E657 VanDerWaalsContact NH2-O 3.14Å; R648-I659 PolarHBondContact NH1-O 2.93Å; R648-I659 PolarHBondContact NH2-O 3.03Å; R648-G661 WeakPolarHBondContact CD-O 3.39Å; R648-G661 PolarHBondContact NH1-O 2.88Å; R648-V662 HydrophobicContact CB-CG1 4.15Å
649	Q	87.1	Confident	89.8	Confident	189 Å²	189	74.5 Å²	74.5	88%	0.883	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-68.4	-19.1	178.9	-63.7	175.8	2.7	0	0	113	S647 L651	S647-Q649 PolarHBondContact O-N 3.3Å; Q649-L651 VanDerWaalsContact C-N 3.33Å
650	E	89.3	Confident	90.1	Very high	65 Å²	65	73.9 Å²	73.9	30%	0.304	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-90.2	5.8	177.8	-69.1	167	112.9	0	0	113.3	R646 S647 R648	R646-E650 WeakPolarHBondContact CB-OE2 3.26Å; R646-E650 IonicContact CZ-OE1 3.83Å; R646-E650 IonicContact NE-OE1 3.98Å; R646-E650 PolarHBondContact NE-OE1 3.17Å; R646-E650 IonicContact NE-OE2 3.75Å; R646-E650 VanDerWaalsContact NH2-CD 3.33Å; R646-E650 IonicContact NH2-OE1 3.15Å; R646-E650 PolarHBondContact NH2-OE1 2.78Å; S647-E650 PolarHBondContact N-OE2 3.04Å; S647-E650 PolarHBondContact O-N 3.1Å; S647-E650 VanDerWaalsContact O-N 3.17Å; S647-E650 VanDerWaalsContact OG-CG 3.26Å; S647-E650 WeakPolarHBondContact OG-CG 3.39Å; S647-E650 PolarHBondContact OG-OE2 3.05Å; R648-E650 PolarHBondContact O-N 3.42Å
651	L	91.8	Very high	90.3	Very high	20 Å²	20	71 Å²	71	11%	0.105	40%	0.397	C	S	.	.	S	Bend	trans	-72.1	151.3	168.4	-70.3	173.1	0	0	0	110.5	F616 R648 Q649 A653 F655 C663	F616-L651 HydrophobicContact CE1-CD2 3.77Å; F616-L651 HydrophobicContact CZ-CD2 3.87Å; R648-L651 HydrophobicContact CG-CD1 4.15Å; R648-L651 WeakPolarHBondContact O-CB 3.46Å; R648-L651 PolarHBondContact O-N 3.46Å; Q649-L651 VanDerWaalsContact C-N 3.33Å; L651-A653 PolarHBondContact O-N 2.74Å; L651-F655 HydrophobicContact CB-CB 4.31Å; L651-F655 HydrophobicContact CB-CG 4.49Å; L651-F655 HydrophobicContact CD1-CD1 3.91Å; L651-F655 HydrophobicContact CD1-CE1 4.25Å; L651-F655 HydrophobicContact CD1-CG 4.48Å; L651-C663 HydrophobicContact CD2-CB 3.79Å
652	P	91.9	Very high	90.4	Very high	8 Å²	8	72.1 Å²	72.1	5%	0.052	40%	0.404	C	S	.	.			trans	-54.1	140.4	171.8	-27.1	36.1	0	0	0	112.1	L612 K615 F616 N654 F655	L612-P652 HydrophobicContact CD1-CB 3.76Å; L612-P652 HydrophobicContact CD1-CG 3.93Å; K615-P652 HydrophobicContact CB-CB 3.8Å; K615-P652 HydrophobicContact CB-CG 3.87Å; F616-P652 HydrophobicContact CD1-CG 4.26Å; F616-P652 HydrophobicContact CD2-CG 4.08Å; F616-P652 HydrophobicContact CE1-CG 4.24Å; F616-P652 HydrophobicContact CE2-CG 4.07Å; F616-P652 HydrophobicContact CG-CG 4.16Å; F616-P652 HydrophobicContact CZ-CG 4.13Å; P652-N654 PolarHBondContact O-N 2.75Å; P652-N654 VanDerWaalsContact O-N 3.1Å; P652-F655 HydrophobicContact CB-CB 4.39Å; P652-F655 WeakPolarHBondContact O-CB 3.49Å; P652-F655 PolarHBondContact O-N 3.13Å
653	A	85.7	Confident	90.4	Very high	106 Å²	106	69 Å²	69	88%	0.876	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-28.8	-177.6	0	0	0	0	0	114.2	L651 F655	L651-A653 PolarHBondContact O-N 2.74Å; A653-F655 VanDerWaalsContact C-N 3.35Å
654	N	87.1	Confident	90.5	Very high	130 Å²	130	69 Å²	69	70%	0.695	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	14.5	177.5	-62	-13.6	0	0	0	112.7	P652	P652-N654 PolarHBondContact O-N 2.75Å; P652-N654 VanDerWaalsContact O-N 3.1Å
655	F	90.8	Very high	90.6	Very high	14 Å²	14	66.7 Å²	66.7	6%	0.061	37%	0.369	C	S	.	.	S	Bend	trans	-71.1	131	177.2	-173.2	-92.5	0	0	0	109.8	L612 F616 P629 L651 P652 A653 E657 I659	L612-F655 HydrophobicContact CD1-CB 4.22Å; L612-F655 HydrophobicContact CD1-CD2 4Å; L612-F655 HydrophobicContact CD2-CD2 3.69Å; L612-F655 HydrophobicContact CD2-CE2 4.04Å; L612-F655 HydrophobicContact CG-CD2 4.18Å; F616-F655 AromaticContact CE2-CD2 3.64Å; F616-F655 HydrophobicContact CE2-CD2 3.64Å; F616-F655 AromaticContact CE2-CE2 3.8Å; F616-F655 HydrophobicContact CE2-CE2 3.8Å; F616-F655 AromaticContact CZ-CD2 3.52Å; F616-F655 HydrophobicContact CZ-CD2 3.52Å; F616-F655 AromaticContact CZ-CE2 3.64Å; F616-F655 HydrophobicContact CZ-CE2 3.64Å; F616-F655 HydrophobicContact CZ-CG 4.5Å; P629-F655 HydrophobicContact CG-CE1 4Å; P629-F655 HydrophobicContact CG-CE2 4.14Å; P629-F655 HydrophobicContact CG-CZ 3.45Å; P629-F655 VanDerWaalsContact CG-CZ 3.45Å; L651-F655 HydrophobicContact CB-CB 4.31Å; L651-F655 HydrophobicContact CB-CG 4.49Å; L651-F655 HydrophobicContact CD1-CD1 3.91Å; L651-F655 HydrophobicContact CD1-CE1 4.25Å; L651-F655 HydrophobicContact CD1-CG 4.48Å; P652-F655 HydrophobicContact CB-CB 4.39Å; P652-F655 WeakPolarHBondContact O-CB 3.49Å; P652-F655 PolarHBondContact O-N 3.13Å; A653-F655 VanDerWaalsContact C-N 3.35Å; F655-E657 PolarHBondContact O-N 3.34Å; F655-I659 HydrophobicContact CE1-CB 3.81Å; F655-I659 HydrophobicContact CE1-CG2 4.09Å; F655-I659 HydrophobicContact CZ-CB 3.9Å; F655-I659 HydrophobicContact CZ-CD1 4.14Å; F655-I659 HydrophobicContact CZ-CG2 3.81Å
656	P	90.3	Very high	90.7	Very high	35 Å²	35	62.8 Å²	62.8	23%	0.227	34%	0.343	C	S	.	.			trans	-59.7	125.7	-176.4	-21.9	31.9	0	0	0	112.8	D658 I659	P656-D658 WeakPolarHBondContact CB-OD1 3.49Å; P656-D658 PolarHBondContact O-N 3.13Å; P656-I659 HydrophobicContact CB-CD1 4Å; P656-I659 HydrophobicContact CB-CG1 4.18Å; P656-I659 HydrophobicContact CG-CD1 3.98Å; P656-I659 PolarHBondContact O-N 3.08Å
657	E	87.3	Confident	90.5	Very high	179 Å²	179	63.6 Å²	63.6	84%	0.836	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-27.7	-176.4	-66.3	-170.5	168.6	0	0	112.9	R648 F655 I659	R648-E657 PolarHBondContact NH2-O 3.16Å; R648-E657 VanDerWaalsContact NH2-O 3.14Å; F655-E657 PolarHBondContact O-N 3.34Å; E657-I659 VanDerWaalsContact C-N 3.26Å; E657-I659 PolarHBondContact O-N 3.25Å
658	D	89.8	Confident	89.8	Confident	135 Å²	135	63.1 Å²	63.1	72%	0.722	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-21.5	179	62.4	-55.9	0	0	0	113.3	P656 P660	P656-D658 WeakPolarHBondContact CB-OD1 3.49Å; P656-D658 PolarHBondContact O-N 3.13Å; D658-P660 VanDerWaalsContact O-CD 3.3Å; D658-P660 WeakPolarHBondContact O-CD 3.44Å
659	I	90.6	Very high	88.8	Confident	36 Å²	36	60.7 Å²	60.7	19%	0.185	35%	0.348	C	S	.	.	S	Bend	trans	-83.8	114.7	177.3	-58.6	173.3	0	0	0	109.3	T630 R648 F655 P656 E657	T630-I659 HydrophobicContact CG2-CD1 4.2Å; T630-I659 HydrophobicContact CG2-CG2 3.94Å; R648-I659 PolarHBondContact NH1-O 2.93Å; R648-I659 PolarHBondContact NH2-O 3.03Å; F655-I659 HydrophobicContact CE1-CB 3.81Å; F655-I659 HydrophobicContact CE1-CG2 4.09Å; F655-I659 HydrophobicContact CZ-CB 3.9Å; F655-I659 HydrophobicContact CZ-CD1 4.14Å; F655-I659 HydrophobicContact CZ-CG2 3.81Å; P656-I659 HydrophobicContact CB-CD1 4Å; P656-I659 HydrophobicContact CB-CG1 4.18Å; P656-I659 HydrophobicContact CG-CD1 3.98Å; P656-I659 PolarHBondContact O-N 3.08Å; E657-I659 VanDerWaalsContact C-N 3.26Å; E657-I659 PolarHBondContact O-N 3.25Å
660	P	89.3	Confident	87.3	Confident	97 Å²	97	60.7 Å²	60.7	63%	0.63	35%	0.345	S	S	*	.			trans	-75.2	160.9	-178.9	32	-36.2	0	0	0	112.2	D658	D658-P660 VanDerWaalsContact O-CD 3.3Å; D658-P660 WeakPolarHBondContact O-CD 3.44Å
661	G	90.1	Very high	85.3	Confident	35 Å²	35	65.1 Å²	65.1	36%	0.361	36%	0.364	S	S	.	.	S	Bend	trans	112.3	-173	174.4	0	0	0	0	0	114.3	R648	R648-G661 WeakPolarHBondContact CD-O 3.39Å; R648-G661 PolarHBondContact NH1-O 2.88Å
662	V	92.9	Very high	82.7	Confident	34 Å²	34	70.5 Å²	70.5	21%	0.206	40%	0.397	C	S	.	.			trans	-127.1	171.3	176	-65.3	0	0	0	0	109.6	P629 P645 R646 R648 Y664	P629-V662 WeakPolarHBondContact CB-O 3.29Å; P645-V662 HydrophobicContact CB-CG2 4.22Å; R646-V662 WeakPolarHBondContact O-CB 3.44Å; R646-V662 WeakPolarHBondContact O-CG2 3.36Å; R648-V662 HydrophobicContact CB-CG1 4.15Å; V662-Y664 HydrophobicContact CG2-CE1 4.14Å; V662-Y664 HydrophobicContact CG2-CE2 4.05Å; V662-Y664 VanDerWaalsContact O-CD2 3.28Å; V662-Y664 WeakPolarHBondContact O-CD2 3.41Å; V662-Y664 WeakPolarHBondContact O-CE2 3.43Å
663	C	93.3	Very high	80	Confident	0 Å²	0	75 Å²	75	0%	0	43%	0.429	C	S	.	.			trans	-77.9	161.6	165.4	50.5	0	0	0	0	110.8	F616 V627 R646 L651	F616-C663 HydrophobicContact CE1-CB 4.17Å; V627-C663 CarbonylContact O-C 3.58Å; V627-C663 VanDerWaalsContact O-CA 3.32Å; V627-C663 WeakPolarHBondContact O-CA 3.48Å; R646-C663 WeakPolarHBondContact CB-O 3.27Å; R646-C663 VanDerWaalsContact CB-SG 3.59Å; R646-C663 PolarHBondContact N-O 2.9Å; L651-C663 HydrophobicContact CD2-CB 3.79Å
664	Y	95.9	Very high	77.6	Confident	40 Å²	40	79.3 Å²	79.3	16%	0.157	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	149.2	-178	-59.8	-97.4	0	0	0	109.9	N626 V627 H632 F643 V644 P645 V662	N626-Y664 CarbonylContact C-O 3.52Å; V627-Y664 PolarHBondContact N-O 3.41Å; V627-Y664 PolarHBondContact O-N 3.25Å; H632-Y664 HydrophobicContact CB-CD2 3.66Å; H632-Y664 HydrophobicContact CB-CE2 3.82Å; H632-Y664 HydrophobicContact CB-CG 4.48Å; H632-Y664 AromaticContact CD2-CD2 3.96Å; H632-Y664 AromaticContact CE1-CE1 3.96Å; H632-Y664 AromaticContact CE1-CE2 3.86Å; H632-Y664 AromaticContact CE1-CZ 3.56Å; H632-Y664 AromaticContact CG-CD2 3.57Å; H632-Y664 AromaticContact CG-CE2 3.45Å; H632-Y664 VanDerWaalsContact CG-CE2 3.45Å; H632-Y664 AromaticContact CG-CZ 3.95Å; H632-Y664 AromaticContact ND1-CD2 3.98Å; H632-Y664 AromaticContact ND1-CE2 3.35Å; H632-Y664 VanDerWaalsContact ND1-CE2 3.35Å; H632-Y664 WeakPolarHBondContact ND1-CE2 3.49Å; H632-Y664 AromaticContact ND1-CZ 3.53Å; H632-Y664 AromaticContact NE2-CE1 3.99Å; F643-Y664 HydrophobicContact CB-CD1 3.99Å; F643-Y664 HydrophobicContact CB-CG 4.38Å; V644-Y664 CarbonylContact O-C 3.55Å; V644-Y664 VanDerWaalsContact O-CA 3.28Å; V644-Y664 WeakPolarHBondContact O-CA 3.25Å; P645-Y664 HydrophobicContact CB-CD1 3.94Å; P645-Y664 HydrophobicContact CB-CE1 3.79Å; V662-Y664 HydrophobicContact CG2-CE1 4.14Å; V662-Y664 HydrophobicContact CG2-CE2 4.05Å; V662-Y664 VanDerWaalsContact O-CD2 3.28Å; V662-Y664 WeakPolarHBondContact O-CD2 3.41Å; V662-Y664 WeakPolarHBondContact O-CE2 3.43Å
665	F	96.3	Very high	75.3	Confident	17 Å²	17	78.8 Å²	78.8	8%	0.075	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	136.2	158.3	-69.8	-55.6	0	0	0	110.1	Q621 K624 I625 N626 F643 V644 R646	Q621-F665 HydrophobicContact CB-CE1 4.38Å; Q621-F665 HydrophobicContact CB-CZ 4.05Å; Q621-F665 HydrophobicContact CG-CZ 3.8Å; K624-F665 HydrophobicContact CB-CD1 3.61Å; K624-F665 HydrophobicContact CB-CE1 3.57Å; K624-F665 HydrophobicContact CB-CG 4.37Å; K624-F665 HydrophobicContact CB-CZ 4.28Å; K624-F665 HydrophobicContact CD-CG 4.49Å; K624-F665 HydrophobicContact CG-CD1 4.27Å; K624-F665 HydrophobicContact CG-CE1 4.21Å; K624-F665 HydrophobicContact CG-CZ 4.49Å; I625-F665 CarbonylContact O-C 3.58Å; I625-F665 VanDerWaalsContact O-CA 3.3Å; I625-F665 WeakPolarHBondContact O-CA 3.02Å; N626-F665 HydrophobicContact CB-CE1 4.37Å; F643-F665 CarbonylContact C-O 3.56Å; F643-F665 WeakPolarHBondContact CA-O 3.4Å; V644-F665 HydrophobicContact CB-CB 4.36Å; V644-F665 PolarHBondContact N-O 3.36Å; V644-F665 PolarHBondContact O-N 3.39Å; R646-F665 VanDerWaalsContact CD-CE2 3.42Å; R646-F665 HydrophobicContact CG-CD2 3.83Å; R646-F665 HydrophobicContact CG-CE2 3.86Å; R646-F665 HydrophobicContact CG-CG 4.44Å; R646-F665 HydrophobicContact CG-CZ 4.46Å
666	L	93.9	Very high	72.6	Confident	5 Å²	5	84.7 Å²	84.7	3%	0.026	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	129.4	172	175.5	64.9	0	0	0	110.1	A559 L563 L586 I625 V627 F641 F643	A559-L666 HydrophobicContact CB-CD2 4.04Å; L563-L666 HydrophobicContact CD2-CD2 4.38Å; L563-L666 HydrophobicContact CD2-CG 4.3Å; L563-L666 HydrophobicContact CG-CD2 4.32Å; L586-L666 HydrophobicContact CD1-CD2 4.33Å; I625-L666 HydrophobicContact CB-CB 4.1Å; I625-L666 HydrophobicContact CD1-CD2 4.45Å; I625-L666 HydrophobicContact CG2-CB 4.06Å; I625-L666 HydrophobicContact CG2-CD2 4.25Å; I625-L666 PolarHBondContact O-N 3.24Å; V627-L666 HydrophobicContact CG2-CB 3.63Å; F641-L666 HydrophobicContact CB-CD1 3.67Å; F641-L666 HydrophobicContact CD1-CD1 3.84Å; F641-L666 HydrophobicContact CD1-CD2 4.39Å; F641-L666 HydrophobicContact CG-CD1 4.09Å; F643-L666 HydrophobicContact CD1-CD1 4.12Å; F643-L666 HydrophobicContact CE1-CB 4.38Å; F643-L666 HydrophobicContact CE1-CD1 3.65Å; F643-L666 HydrophobicContact CZ-CD1 3.91Å
667	E	88.1	Confident	70.3	Confident	45 Å²	45	89.6 Å²	89.6	21%	0.21	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	150.9	171	-56.5	-158.8	168.6	0	0	110.6	K624 V642 K671	K624-E667 IonicContact NZ-OE1 2.82Å; K624-E667 PolarHBondContact NZ-OE1 3.08Å; V642-E667 HydrophobicContact CB-CB 4.46Å; V642-E667 PolarHBondContact N-O 3.36Å; V642-E667 VanDerWaalsContact N-O 3.09Å; V642-E667 PolarHBondContact O-N 2.79Å; E667-K671 IonicContact OE2-NZ 3.68Å; E667-K671 PolarHBondContact OE2-NZ 3.03Å
668	A	75.5	Confident	67.9	Low	39 Å²	39	92.3 Å²	92.3	32%	0.322	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	139.3	172.6	0	0	0	0	0	110.7	L563 F670	L563-A668 HydrophobicContact CD2-CB 4.15Å; A668-F670 VanDerWaalsContact C-N 3.26Å; A668-F670 PolarHBondContact O-N 2.97Å
669	A	67.5	Low	66.8	Low	45 Å²	45	90.2 Å²	90.2	37%	0.372	51%	0.508	S	S	.	.	S	Bend	trans	-65.8	-24.2	179.1	0	0	0	0	0	114	V642	V642-A669 HydrophobicContact CG2-CB 4.02Å
670	F	56.7	Low	65.5	Low	190 Å²	190	93 Å²	93	83%	0.833	53%	0.525	S	S	*	.			trans	-111.4	88.5	-179.9	-69.3	-84.7	0	0	0	111.5	A668 V672	A668-F670 VanDerWaalsContact C-N 3.26Å; A668-F670 PolarHBondContact O-N 2.97Å; F670-V672 PolarHBondContact O-N 3.03Å
671	K	45.9	Very low	64.2	Low	158 Å²	158	92.8 Å²	92.8	69%	0.687	52%	0.519	S	S	*	.			trans	-79.2	100.2	157	-80.5	178.8	-172.8	157.4	0	107.8	E667 S673	E667-K671 IonicContact OE2-NZ 3.68Å; E667-K671 PolarHBondContact OE2-NZ 3.03Å; K671-S673 PolarHBondContact O-N 2.73Å; K671-S673 VanDerWaalsContact O-N 3.1Å
672	V	38.9	Very low	62.7	Low	132 Å²	132	96.2 Å²	96.2	80%	0.8	53%	0.529	S	S	*	.			trans	-61.2	112.9	161.1	176.4	0	0	0	0	106.6	F670 K674	F670-V672 PolarHBondContact O-N 3.03Å; V672-K674 PolarHBondContact O-N 2.86Å; V672-K674 VanDerWaalsContact O-N 3.13Å
673	S	33.5	Very low	60.8	Low	103 Å²	103	100.1 Å²	100.1	72%	0.72	55%	0.549	S	S	*	.			trans	-54.5	115.2	171.6	48	0	0	0	0	109.2	K671	K671-S673 PolarHBondContact O-N 2.73Å; K671-S673 VanDerWaalsContact O-N 3.1Å
674	K	36.3	Very low	58.6	Low	197 Å²	197	106.7 Å²	106.7	86%	0.857	59%	0.585	S	S	*	*			trans	-55.9	128	165.7	-80.7	-176.4	174.6	-179.1	0	107.9	V672 T676	V672-K674 PolarHBondContact O-N 2.86Å; V672-K674 VanDerWaalsContact O-N 3.13Å; K674-T676 PolarHBondContact O-N 3.25Å
675	P	37.6	Very low	56	Low	118 Å²	118	111.5 Å²	111.5	77%	0.766	62%	0.616	S	S	*	*			trans	-66.2	122.7	171.7	27	-31	0	0	0	108.4	T677	P675-T677 PolarHBondContact O-N 3.21Å
676	T	35.8	Very low	52.9	Low	139 Å²	139	118.8 Å²	118.8	85%	0.853	66%	0.658	S	S	*	*			trans	-58.8	113.2	166.5	30.8	0	0	0	0	109.2	K674 N678	K674-T676 PolarHBondContact O-N 3.25Å; T676-N678 PolarHBondContact O-N 3.45Å
677	T	42.2	Very low	49.4	Very low	137 Å²	137	128.3 Å²	128.3	84%	0.84	71%	0.71	S	S	*	*			trans	-74.4	113.3	165	41	0	0	0	0	108.9	P675	P675-T677 PolarHBondContact O-N 3.21Å
678	N	35.3	Very low	45.9	Very low	236 Å²	236	135.8 Å²	135.8	100%	1.262	76%	0.756	S	S	*	*			trans	-83.4	0	153.9	-90.9	-9.3	0	0	0	109.6	T676	T676-N678 PolarHBondContact O-N 3.45Å

Retrieved 678 of 678 residues in 145.9 ms (Link to these results)

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