A0A077ZCU6_TRITR Loading...

72 kDa inositol polyphosphate 5 phosphatase

AlphaFold DB , UniProt , Accession A0A077ZCU6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 413 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	43	Very low	42	Very low	211 Å²	211	144.4 Å²	144.4	100%	1.039	69%	0.69	S	S	*	*				0	-39.6	0	-84	-162.2	-71.4	0	0	112.7	E3 R4 K5	M1-E3 VanDerWaalsContact C-N 3.31Å; M1-E3 PolarHBondContact O-N 3.22Å; M1-R4 PolarHBondContact O-N 3.03Å; M1-K5 PolarHBondContact O-N 3.36Å
2	E	31.1	Very low	42.2	Very low	175 Å²	175	137.4 Å²	137.4	82%	0.818	68%	0.675	S	S	*	*	H	α-helix	trans	-60.1	-35.5	177.9	-71.7	178	140.9	0	0	113.9	R4 K5 S6	E2-R4 VanDerWaalsContact C-N 3.28Å; E2-R4 PolarHBondContact O-N 3Å; E2-K5 PolarHBondContact O-N 3.49Å; E2-K5 VanDerWaalsContact O-N 3.11Å; E2-S6 PolarHBondContact O-N 3.47Å
3	E	34	Very low	42.5	Very low	140 Å²	140	138.9 Å²	138.9	65%	0.654	68%	0.675	S	S	*	*	H	α-helix	trans	-63.1	-32	177.2	-135	-172.3	160.5	0	0	113.2	M1 R7	M1-E3 VanDerWaalsContact C-N 3.31Å; M1-E3 PolarHBondContact O-N 3.22Å; E3-R7 WeakPolarHBondContact O-CG 3.22Å; E3-R7 PolarHBondContact O-N 3.19Å; E3-R7 IonicContact OE1-NH2 2.81Å
4	R	42.7	Very low	42.7	Very low	210 Å²	210	139.8 Å²	139.8	79%	0.792	67%	0.674	S	S	*	*	H	α-helix	trans	-74.5	-30.6	175.5	-81.3	-177.9	170.6	159.2	-2.5	112.3	M1 E2	M1-R4 PolarHBondContact O-N 3.03Å; E2-R4 VanDerWaalsContact C-N 3.28Å; E2-R4 PolarHBondContact O-N 3Å
5	K	43.6	Very low	42.9	Very low	162 Å²	162	133.7 Å²	133.7	70%	0.704	66%	0.656	S	S	*	*	H	α-helix	trans	-74.4	-44.4	177	-140.7	177.7	-177.6	-177	0	110.6	M1 E2 R7 K8 D9	M1-K5 PolarHBondContact O-N 3.36Å; E2-K5 PolarHBondContact O-N 3.49Å; E2-K5 VanDerWaalsContact O-N 3.11Å; K5-R7 VanDerWaalsContact C-N 3.34Å; K5-R7 PolarHBondContact O-N 3.49Å; K5-K8 PolarHBondContact O-N 2.87Å; K5-D9 PolarHBondContact O-N 3.45Å
6	S	44	Very low	43.3	Very low	84 Å²	84	128.4 Å²	128.4	59%	0.587	64%	0.64	S	S	*	*	H	α-helix	trans	-58.7	-39.3	176	178.4	0	0	0	0	113.3	E2 D9 G10	E2-S6 PolarHBondContact O-N 3.47Å; S6-D9 PolarHBondContact O-N 3.42Å; S6-G10 PolarHBondContact O-N 2.96Å
7	R	46.7	Very low	43.1	Very low	168 Å²	168	132.8 Å²	132.8	63%	0.634	65%	0.648	S	S	*	*	H	α-helix	trans	-69.6	-36.7	178.5	-75.6	-176.7	-174.3	178.4	6.6	113.8	E3 K5 G10 L11	E3-R7 WeakPolarHBondContact O-CG 3.22Å; E3-R7 PolarHBondContact O-N 3.19Å; E3-R7 IonicContact OE1-NH2 2.81Å; K5-R7 VanDerWaalsContact C-N 3.34Å; K5-R7 PolarHBondContact O-N 3.49Å; R7-G10 PolarHBondContact O-N 2.98Å; R7-L11 PolarHBondContact O-N 3.06Å; R7-L11 VanDerWaalsContact O-N 3.16Å
8	K	47.2	Very low	43.2	Very low	167 Å²	167	131.7 Å²	131.7	73%	0.726	64%	0.644	S	S	*	*	H	α-helix	trans	-65.1	-41.1	175.3	-79.1	-170.4	173.9	-175.1	0	111.5	K5 L11 A12	K5-K8 PolarHBondContact O-N 2.87Å; K8-L11 PolarHBondContact O-N 2.86Å; K8-A12 PolarHBondContact O-N 2.83Å
9	D	46.4	Very low	43.3	Very low	101 Å²	101	129.8 Å²	129.8	54%	0.54	64%	0.637	S	S	.	*	H	α-helix	trans	-69.5	-33.5	177.4	-69.5	-13.3	0	0	0	112.4	K5 S6 K13	K5-D9 PolarHBondContact O-N 3.45Å; S6-D9 PolarHBondContact O-N 3.42Å; D9-K13 PolarHBondContact O-N 3.06Å; D9-K13 VanDerWaalsContact O-N 3.09Å
10	G	40.1	Very low	43.2	Very low	41 Å²	41	128.7 Å²	128.7	42%	0.423	63%	0.633	S	S	.	*	H	α-helix	trans	-64.8	-41.3	174.9	0	0	0	0	0	113.5	S6 R7 K14	S6-G10 PolarHBondContact O-N 2.96Å; R7-G10 PolarHBondContact O-N 2.98Å; G10-K14 WeakPolarHBondContact O-CB 3.34Å; G10-K14 PolarHBondContact O-N 3.34Å
11	L	43.4	Very low	43	Very low	129 Å²	129	125 Å²	125	68%	0.675	62%	0.623	S	S	*	*	H	α-helix	trans	-69.3	-41.4	177.1	-96.8	123.2	0	0	0	112.3	R7 K8 K13 K14 A15	R7-L11 PolarHBondContact O-N 3.06Å; R7-L11 VanDerWaalsContact O-N 3.16Å; K8-L11 PolarHBondContact O-N 2.86Å; L11-K13 PolarHBondContact O-N 3.11Å; L11-K14 PolarHBondContact O-N 2.89Å; L11-A15 WeakPolarHBondContact O-CB 3.25Å; L11-A15 PolarHBondContact O-N 3.08Å
12	A	44.6	Very low	42.8	Very low	61 Å²	61	118.2 Å²	118.2	50%	0.504	60%	0.597	S	S	.	*	H	α-helix	trans	-61.6	-43.3	175.9	0	0	0	0	0	111.8	K8 K14 A15 A16	K8-A12 PolarHBondContact O-N 2.83Å; A12-K14 VanDerWaalsContact C-N 3.34Å; A12-K14 PolarHBondContact O-N 2.79Å; A12-A15 PolarHBondContact O-N 3.29Å; A12-A16 WeakPolarHBondContact O-CB 3.5Å; A12-A16 PolarHBondContact O-N 2.77Å
13	K	45.6	Very low	43	Very low	157 Å²	157	116.1 Å²	116.1	68%	0.683	59%	0.587	S	S	*	*	H	α-helix	trans	-65.3	-35.1	174.9	-80.7	-178.9	177.6	175	0	113	D9 L11 R17	D9-K13 PolarHBondContact O-N 3.06Å; D9-K13 VanDerWaalsContact O-N 3.09Å; L11-K13 PolarHBondContact O-N 3.11Å; K13-R17 PolarHBondContact O-N 3.2Å; K13-R17 VanDerWaalsContact O-N 3.08Å
14	K	45.1	Very low	43.1	Very low	151 Å²	151	116 Å²	116	66%	0.657	59%	0.59	S	S	*	*	H	α-helix	trans	-70.8	-40.8	177.8	-164	176.4	-178	-177.4	0	111.5	G10 L11 A12 R17 L18	G10-K14 WeakPolarHBondContact O-CB 3.34Å; G10-K14 PolarHBondContact O-N 3.34Å; L11-K14 PolarHBondContact O-N 2.89Å; A12-K14 VanDerWaalsContact C-N 3.34Å; A12-K14 PolarHBondContact O-N 2.79Å; K14-R17 PolarHBondContact O-N 3.14Å; K14-L18 WeakPolarHBondContact O-CG 3.24Å; K14-L18 PolarHBondContact O-N 3.14Å; K14-L18 VanDerWaalsContact O-N 3.14Å
15	A	45.4	Very low	42.6	Very low	49 Å²	49	111.4 Å²	111.4	41%	0.405	59%	0.585	S	S	.	*	H	α-helix	trans	-62.8	-45.7	173.4	0	0	0	0	0	111.4	L11 A12 R17 L18 I19	L11-A15 WeakPolarHBondContact O-CB 3.25Å; L11-A15 PolarHBondContact O-N 3.08Å; A12-A15 PolarHBondContact O-N 3.29Å; A15-R17 VanDerWaalsContact C-N 3.34Å; A15-R17 PolarHBondContact O-N 2.89Å; A15-L18 PolarHBondContact O-N 2.95Å; A15-L18 VanDerWaalsContact O-N 3.13Å; A15-I19 VanDerWaalsContact O-CG1 3.3Å; A15-I19 WeakPolarHBondContact O-CG1 3.39Å; A15-I19 PolarHBondContact O-N 3.38Å
16	A	49.3	Very low	42	Very low	49 Å²	49	108.2 Å²	108.2	41%	0.405	58%	0.583	S	S	.	*	H	α-helix	trans	-60.7	-39.3	177.3	0	0	0	0	0	113	A12 I19 L20	A12-A16 WeakPolarHBondContact O-CB 3.5Å; A12-A16 PolarHBondContact O-N 2.77Å; A16-I19 PolarHBondContact O-N 2.75Å; A16-L20 PolarHBondContact O-N 2.9Å
17	R	40.9	Very low	41.1	Very low	202 Å²	202	110 Å²	110	76%	0.762	59%	0.591	S	S	*	*	H	α-helix	trans	-66.3	-36.6	174.9	-80.9	-176.3	179.2	168.4	-0.4	113	K13 K14 A15 A21	K13-R17 PolarHBondContact O-N 3.2Å; K13-R17 VanDerWaalsContact O-N 3.08Å; K14-R17 PolarHBondContact O-N 3.14Å; A15-R17 VanDerWaalsContact C-N 3.34Å; A15-R17 PolarHBondContact O-N 2.89Å; R17-A21 WeakPolarHBondContact O-CB 3.3Å; R17-A21 PolarHBondContact O-N 3.46Å
18	L	45	Very low	40.1	Very low	113 Å²	113	107 Å²	107	59%	0.592	60%	0.596	S	S	*	*	H	α-helix	trans	-70.6	-37.7	177.8	-74.4	166.9	0	0	0	111.7	K14 A15 A21 S22	K14-L18 WeakPolarHBondContact O-CG 3.24Å; K14-L18 PolarHBondContact O-N 3.14Å; K14-L18 VanDerWaalsContact O-N 3.14Å; A15-L18 PolarHBondContact O-N 2.95Å; A15-L18 VanDerWaalsContact O-N 3.13Å; L18-A21 PolarHBondContact O-N 3.33Å; L18-S22 PolarHBondContact O-N 3.35Å; L18-S22 PolarHBondContact O-OG 2.79Å
19	I	44.5	Very low	39.1	Very low	97 Å²	97	104.3 Å²	104.3	50%	0.497	60%	0.598	S	S	.	*	H	α-helix	trans	-63.2	-44.7	174.3	-66	164.4	0	0	0	110.7	A15 A16 A21 S22 Q23	A15-I19 VanDerWaalsContact O-CG1 3.3Å; A15-I19 WeakPolarHBondContact O-CG1 3.39Å; A15-I19 PolarHBondContact O-N 3.38Å; A16-I19 PolarHBondContact O-N 2.75Å; I19-A21 PolarHBondContact O-N 3.31Å; I19-S22 PolarHBondContact O-N 3.07Å; I19-S22 PolarHBondContact O-OG 2.9Å; I19-Q23 WeakPolarHBondContact O-CG 3.37Å; I19-Q23 PolarHBondContact O-N 3.01Å
20	L	40.8	Very low	37.9	Very low	106 Å²	106	108.3 Å²	108.3	56%	0.555	61%	0.613	S	S	*	*	H	α-helix	trans	-65.2	-36.5	175.6	-95.2	152.3	0	0	0	112.8	A16 Q23	A16-L20 PolarHBondContact O-N 2.9Å; L20-Q23 PolarHBondContact O-N 3.21Å
21	A	39.8	Very low	37	Very low	53 Å²	53	112.4 Å²	112.4	44%	0.438	64%	0.635	S	S	.	*	H	α-helix	trans	-68.1	-38	176.5	0	0	0	0	0	112.2	R17 L18 I19 Q23 L24	R17-A21 WeakPolarHBondContact O-CB 3.3Å; R17-A21 PolarHBondContact O-N 3.46Å; L18-A21 PolarHBondContact O-N 3.33Å; I19-A21 PolarHBondContact O-N 3.31Å; A21-Q23 VanDerWaalsContact C-N 3.31Å; A21-Q23 PolarHBondContact O-N 3.21Å; A21-L24 PolarHBondContact O-N 3.12Å
22	S	38.5	Very low	36	Very low	68 Å²	68	110.2 Å²	110.2	48%	0.476	64%	0.644	S	S	.	*	H	α-helix	trans	-69.6	-26.5	176.9	54.8	0	0	0	0	113.7	L18 I19 L24 T25	L18-S22 PolarHBondContact O-N 3.35Å; L18-S22 PolarHBondContact O-OG 2.79Å; I19-S22 PolarHBondContact O-N 3.07Å; I19-S22 PolarHBondContact O-OG 2.9Å; S22-L24 VanDerWaalsContact C-N 3.32Å; S22-T25 PolarHBondContact O-OG1 3.46Å
23	Q	35.8	Very low	34.8	Very low	130 Å²	130	112.8 Å²	112.8	61%	0.607	66%	0.658	S	S	*	*	H	α-helix	trans	-76.5	-18.7	176.6	-73.7	178.8	-9	0	0	113.2	I19 L20 A21	I19-Q23 WeakPolarHBondContact O-CG 3.37Å; I19-Q23 PolarHBondContact O-N 3.01Å; L20-Q23 PolarHBondContact O-N 3.21Å; A21-Q23 VanDerWaalsContact C-N 3.31Å; A21-Q23 PolarHBondContact O-N 3.21Å
24	L	35.8	Very low	33.8	Very low	137 Å²	137	112 Å²	112	72%	0.717	67%	0.666	S	S	*	*	S	Bend	trans	-86	-14.2	178.1	-74.4	166.3	0	0	0	113.5	A21 S22	A21-L24 PolarHBondContact O-N 3.12Å; S22-L24 VanDerWaalsContact C-N 3.32Å
25	T	33.2	Very low	32.6	Very low	115 Å²	115	109.4 Å²	109.4	71%	0.706	67%	0.667	S	S	*	*	S	Bend	trans	-101.3	2.1	-174.8	51	0	0	0	0	114.8	S22	S22-T25 PolarHBondContact O-OG1 3.46Å
26	S	30	Very low	31.5	Very low	94 Å²	94	114.8 Å²	114.8	66%	0.657	69%	0.689	S	S	*	*			trans	-115	53	178.9	66.1	0	0	0	0	112.5
27	T	25.7	Very low	30.1	Very low	121 Å²	121	119 Å²	119	74%	0.742	71%	0.705	S	S	*	*			trans	-140.2	79.9	163.3	48.1	0	0	0	0	109.5
28	S	26.1	Very low	29.4	Very low	106 Å²	106	117.6 Å²	117.6	74%	0.741	71%	0.713	S	S	*	*			trans	-165.1	125.3	158.2	27.4	0	0	0	0	113.1
29	S	25.9	Very low	28.3	Very low	111 Å²	111	119.3 Å²	119.3	78%	0.776	72%	0.722	S	S	*	*			trans	56.8	107.8	154.1	52.5	0	0	0	0	118
30	E	20.8	Very low	27.3	Very low	184 Å²	184	121.2 Å²	121.2	86%	0.86	74%	0.738	S	S	*	*				55.8	122	64.8	-78.1	-166	164.7	0	0	117.1
31	S	21.5	Very low	26.3	Very low	127 Å²	127	121 Å²	121	89%	0.888	75%	0.745	S	S	*	*			trans	79.5	130.2	151.2	75.5	0	0	0	0	119.8
32	G	22.3	Very low	25.4	Very low	83 Å²	83	126.5 Å²	126.5	86%	0.856	77%	0.767	S	S	*	*			trans	160.7	70.9	169.9	0	0	0	0	0	115.1
33	S	19.2	Very low	24.5	Very low	115 Å²	115	128.7 Å²	128.7	80%	0.804	78%	0.778	S	S	*	*			trans	-69.8	136.4	165.4	52.6	0	0	0	0	112.3
34	V	23.9	Very low	23.7	Very low	141 Å²	141	127.6 Å²	127.6	86%	0.855	78%	0.784	S	S	*	*			trans	-151.1	126.9	147.9	176.5	0	0	0	0	110.2
35	S	19.8	Very low	23.1	Very low	96 Å²	96	127.1 Å²	127.1	67%	0.671	79%	0.792	S	S	*	*			trans	-69.4	149	168.2	53	0	0	0	0	113.3
36	N	22.6	Very low	22.5	Very low	162 Å²	162	131.8 Å²	131.8	87%	0.866	80%	0.803	S	S	*	*			trans	-153.4	134.2	138.3	-104.9	-16.4	0	0	0	111.7
37	N	21.1	Very low	22.1	Very low	139 Å²	139	133 Å²	133	74%	0.743	81%	0.81	S	S	*	*			trans	-67.5	148.6	174.4	-67.6	-45	0	0	0	110.9
38	D	25.8	Very low	21.9	Very low	172 Å²	172	131.7 Å²	131.7	92%	0.92	81%	0.812	S	S	*	*			trans	-146.3	122	138.5	-91.5	-35.5	0	0	0	110.1
39	N	21.2	Very low	21.7	Very low	148 Å²	148	134.6 Å²	134.6	79%	0.791	82%	0.818	S	S	*	*			trans	-77.6	132.9	175.4	-75.2	-55.1	0	0	0	110.2
40	V	24.5	Very low	21.5	Very low	138 Å²	138	136.9 Å²	136.9	84%	0.836	82%	0.816	S	S	*	*			trans	-140.7	103.6	142.5	-179.2	0	0	0	0	108.5
41	S	18.6	Very low	21.5	Very low	100 Å²	100	136.8 Å²	136.8	70%	0.699	82%	0.816	S	S	*	*			trans	-85.3	134.4	164.1	56	0	0	0	0	109.2
42	L	20.6	Very low	21.6	Very low	169 Å²	169	136.4 Å²	136.4	89%	0.885	81%	0.813	S	S	*	*			trans	-127.7	115.1	160.3	-96.1	159.5	0	0	0	107.4
43	T	19.4	Very low	21.7	Very low	115 Å²	115	137.1 Å²	137.1	71%	0.706	81%	0.811	S	S	*	*			trans	-90	150.6	-172.2	38.8	0	0	0	0	112.2
44	S	19.9	Very low	22	Very low	106 Å²	106	139.5 Å²	139.5	74%	0.741	82%	0.815	S	S	*	*			trans	60.5	114.1	147.3	64.2	0	0	0	0	119.7
45	S	23	Very low	22	Very low	128 Å²	128	136.9 Å²	136.9	90%	0.895	82%	0.816	S	S	*	*				-147.5	107.3	123.4	-76	0	0	0	0	109.2
46	K	20.3	Very low	22.3	Very low	212 Å²	212	136.6 Å²	136.6	92%	0.922	82%	0.82	S	S	*	*			trans	-68.2	124.3	164.1	-82.5	174	168.5	177.7	0	108
47	C	21.4	Very low	22.6	Very low	120 Å²	120	138.4 Å²	138.4	81%	0.811	82%	0.823	S	S	*	*			trans	-130.5	103	149.4	-152.7	0	0	0	0	106.9
48	A	21.3	Very low	22.9	Very low	94 Å²	94	139.6 Å²	139.6	78%	0.777	83%	0.829	S	S	*	*			trans	-74.3	125	167.7	0	0	0	0	0	107.6
49	L	23.4	Very low	22.9	Very low	167 Å²	167	134 Å²	134	87%	0.874	81%	0.812	S	S	*	*			trans	-134.3	118.1	157	-106.1	157	0	0	0	106.6
50	E	20.2	Very low	23.1	Very low	159 Å²	159	129.4 Å²	129.4	74%	0.743	80%	0.8	S	S	*	*			trans	-72.4	148.2	-178.5	-65.9	176.1	141.2	0	0	111.1
51	Q	21.1	Very low	23.3	Very low	182 Å²	182	131.1 Å²	131.1	85%	0.85	80%	0.803	S	S	*	*			trans	54.7	99.3	142.7	-64.8	175.4	8.8	0	0	118.5
52	S	24.5	Very low	23.8	Very low	119 Å²	119	136.3 Å²	136.3	83%	0.832	81%	0.809	S	S	*	*				-148.8	114.5	126.3	57.4	0	0	0	0	108.8	D54	S52-D54 PolarHBondContact O-N 2.93Å
53	A	24	Very low	24.1	Very low	98 Å²	98	130.3 Å²	130.3	81%	0.81	79%	0.788	S	S	*	*			trans	-68.6	119.3	163.8	0	0	0	0	0	108
54	D	25.1	Very low	24.7	Very low	165 Å²	165	126.7 Å²	126.7	88%	0.882	76%	0.763	S	S	*	*			trans	-159.1	130.9	144.5	-97.8	-26.5	0	0	0	108	S52 A56	S52-D54 PolarHBondContact O-N 2.93Å; D54-A56 PolarHBondContact O-N 2.96Å
55	G	23.3	Very low	25.3	Very low	85 Å²	85	123.3 Å²	123.3	88%	0.876	74%	0.737	S	S	*	*			trans	-65.1	121.8	-175.6	0	0	0	0	0	111.6
56	A	27.2	Very low	25.7	Very low	91 Å²	91	119.2 Å²	119.2	75%	0.752	71%	0.705	S	S	*	*			trans	-140.7	92.9	146.4	0	0	0	0	0	104.7	D54 D58	D54-A56 PolarHBondContact O-N 2.96Å; A56-D58 VanDerWaalsContact C-N 3.26Å; A56-D58 PolarHBondContact O-N 3.3Å
57	E	28.2	Very low	26.4	Very low	200 Å²	200	113.1 Å²	113.1	94%	0.935	68%	0.676	S	S	*	*			trans	-57.4	103.6	155.5	-71.4	-177.1	160.3	0	0	105.2	G59	E57-G59 PolarHBondContact O-N 3.08Å
58	D	28	Very low	26.9	Very low	163 Å²	163	109.4 Å²	109.4	87%	0.872	65%	0.649	S	S	*	*			trans	-71.6	68.4	172.5	-158.3	20.2	0	0	0	107.1	A56 G60	A56-D58 VanDerWaalsContact C-N 3.26Å; A56-D58 PolarHBondContact O-N 3.3Å; D58-G60 VanDerWaalsContact C-N 3.28Å; D58-G60 PolarHBondContact O-N 3.4Å
59	G	25.9	Very low	27.6	Very low	55 Å²	55	107.6 Å²	107.6	57%	0.567	63%	0.627	S	S	*	*			trans	-67.3	95.4	161.7	0	0	0	0	0	105.7	E57 L61	E57-G59 PolarHBondContact O-N 3.08Å; G59-L61 PolarHBondContact O-N 3.04Å
60	G	26.3	Very low	27.8	Very low	52 Å²	52	101.6 Å²	101.6	54%	0.536	60%	0.597	S	S	.	*			trans	-50.2	109.2	172.2	0	0	0	0	0	108.6	D58 Y62	D58-G60 VanDerWaalsContact C-N 3.28Å; D58-G60 PolarHBondContact O-N 3.4Å; G60-Y62 WeakPolarHBondContact O-CD2 3.16Å; G60-Y62 PolarHBondContact O-N 3.47Å
61	L	26.9	Very low	28.2	Very low	173 Å²	173	96.1 Å²	96.1	91%	0.906	58%	0.575	S	S	*	*			trans	-59.6	105.5	170.3	-86.4	105.5	0	0	0	106.7	G59 G63	G59-L61 PolarHBondContact O-N 3.04Å; L61-G63 PolarHBondContact O-N 2.98Å
62	Y	28.9	Very low	28.5	Very low	210 Å²	210	89.4 Å²	89.4	82%	0.824	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-59	124.3	167.9	-78.6	-91.8	0	0	0	107.3	G60	G60-Y62 WeakPolarHBondContact O-CD2 3.16Å; G60-Y62 PolarHBondContact O-N 3.47Å
63	G	28	Very low	28.7	Very low	43 Å²	43	86.6 Å²	86.6	44%	0.443	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-58.3	146.9	-177.7	0	0	0	0	0	111.7	L61 N65	L61-G63 PolarHBondContact O-N 2.98Å; G63-N65 VanDerWaalsContact C-ND2 3.28Å; G63-N65 PolarHBondContact O-N 3.33Å; G63-N65 PolarHBondContact O-ND2 2.88Å
64	E	31.6	Very low	28.9	Very low	38 Å²	38	83 Å²	83	18%	0.178	49%	0.49	C	S	.	.	P	Polyproline II helix	trans	-65.2	116.1	174.4	-58	-179	-158.1	0	0	110.1	G139 S140 P409	E64-G139 VanDerWaalsContact CD-C 3.49Å; E64-G139 VanDerWaalsContact CD-CA 3.41Å; E64-G139 WeakPolarHBondContact OE1-CA 3.18Å; E64-G139 WeakPolarHBondContact OE2-CA 3.45Å; E64-S140 PolarHBondContact OE1-N 3.36Å; E64-S140 WeakPolarHBondContact OE2-CA 3.23Å; E64-S140 WeakPolarHBondContact OE2-CB 3.06Å; E64-S140 PolarHBondContact OE2-N 2.82Å; E64-P409 HydrophobicContact CB-CB 4.18Å; E64-P409 HydrophobicContact CG-CB 4.32Å
65	N	31.7	Very low	29.1	Very low	36 Å²	36	81.1 Å²	81.1	19%	0.193	49%	0.489	C	S	.	.			trans	-145	132	-172	-73.1	-66.5	0	0	0	113.4	G63 R67 F243 S245	G63-N65 VanDerWaalsContact C-ND2 3.28Å; G63-N65 PolarHBondContact O-N 3.33Å; G63-N65 PolarHBondContact O-ND2 2.88Å; N65-R67 PolarHBondContact O-N 2.62Å; N65-F243 CarbonylContact C-O 3.34Å; N65-F243 WeakPolarHBondContact CA-O 3.16Å; N65-F243 VanDerWaalsContact OD1-C 3.23Å; N65-F243 PolarHBondContact OD1-O 3.43Å; N65-S245 VanDerWaalsContact CG-CB 3.43Å
66	L	31.3	Very low	29.3	Very low	41 Å²	41	85.9 Å²	85.9	22%	0.215	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	116.6	156.7	-172.6	79.8	0	0	0	109.6	V68 L152 I186 I236 F243 V244 S245 I407	L66-V68 HydrophobicContact CD2-CG2 3.81Å; L66-V68 HydrophobicContact CG-CG2 4.04Å; L66-L152 HydrophobicContact CD1-CD2 4.08Å; L66-L152 HydrophobicContact CD2-CD2 4.03Å; L66-I186 HydrophobicContact CD2-CD1 3.56Å; L66-I236 HydrophobicContact CD2-CD1 4.2Å; L66-F243 WeakPolarHBondContact CA-O 3.5Å; L66-F243 WeakPolarHBondContact CB-O 3.32Å; L66-F243 PolarHBondContact N-O 2.92Å; L66-V244 WeakPolarHBondContact O-CA 3.49Å; L66-S245 PolarHBondContact O-N 3.46Å; L66-I407 HydrophobicContact CD1-CG2 4Å
67	R	36	Very low	29.3	Very low	85 Å²	85	83.3 Å²	83.3	32%	0.321	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	118.4	174.9	-175.4	-174	-175.8	140.5	18.5	109.7	N65 D69	N65-R67 PolarHBondContact O-N 2.62Å; R67-D69 IonicContact CZ-OD2 3.2Å; R67-D69 IonicContact NE-OD2 3.17Å; R67-D69 PolarHBondContact NE-OD2 3.23Å; R67-D69 IonicContact NH2-OD2 3.39Å
68	V	32	Very low	29.3	Very low	42 Å²	42	81.1 Å²	81.1	26%	0.255	46%	0.458	S	S	.	.			trans	-118.5	105.2	174	-166.2	0	0	0	0	110.9	L66 V70 L234	L66-V68 HydrophobicContact CD2-CG2 3.81Å; L66-V68 HydrophobicContact CG-CG2 4.04Å; V68-V70 HydrophobicContact CG1-CG2 4.47Å; V68-L234 HydrophobicContact CB-CD2 3.77Å; V68-L234 HydrophobicContact CG1-CD1 4.29Å; V68-L234 HydrophobicContact CG1-CD2 3.3Å; V68-L234 HydrophobicContact CG1-CG 4.43Å; V68-L234 HydrophobicContact CG2-CD2 4.29Å
69	D	35.5	Very low	29.2	Very low	56 Å²	56	81.7 Å²	81.7	30%	0.299	46%	0.456	S	S	.	.			trans	-93.5	125.7	174.4	-75.1	-46.5	0	0	0	109.8	R67 R253 L276	R67-D69 IonicContact CZ-OD2 3.2Å; R67-D69 IonicContact NE-OD2 3.17Å; R67-D69 PolarHBondContact NE-OD2 3.23Å; R67-D69 IonicContact NH2-OD2 3.39Å; D69-R253 WeakPolarHBondContact OD2-CD 3.31Å; D69-R253 IonicContact OD2-CZ 3.65Å; D69-R253 IonicContact OD2-NH1 2.78Å; D69-R253 PolarHBondContact OD2-NH1 3.17Å; D69-L276 HydrophobicContact CB-CD1 3.62Å; D69-L276 HydrophobicContact CB-CD2 4.27Å; D69-L276 WeakPolarHBondContact OD2-CD1 3.45Å
70	V	28.5	Very low	29.3	Very low	40 Å²	40	84.3 Å²	84.3	24%	0.242	46%	0.456	C	S	.	.			trans	-109.7	106.3	-179.6	-177.3	0	0	0	0	108.7	V68 R223 V225 L232 L234	V68-V70 HydrophobicContact CG1-CG2 4.47Å; V70-R223 HydrophobicContact CG2-CG 4.36Å; V70-V225 HydrophobicContact CG1-CG2 3.6Å; V70-L232 HydrophobicContact CG1-CB 4.36Å; V70-L232 HydrophobicContact CG1-CD2 3.25Å; V70-L232 HydrophobicContact CG1-CG 3.56Å; V70-L234 HydrophobicContact CG2-CD2 4.18Å
71	C	29.3	Very low	29.3	Very low	44 Å²	44	86.2 Å²	86.2	30%	0.297	46%	0.461	S	S	.	.			trans	-111.6	146.5	176.9	-166.8	0	0	0	0	110.6	C257 L276	C71-C257 WeakPolarHBondContact CB-SG 3.36Å; C71-C257 WeakPolarHBondContact SG-CB 3.39Å; C71-C257 CovalentContact SG-SG 2.06Å; C71-C257 PolarHBondContact SG-SG 2.8Å; C71-L276 HydrophobicContact CB-CD2 4.42Å
72	F	25.4	Very low	29.3	Very low	41 Å²	41	87.4 Å²	87.4	18%	0.18	46%	0.459	C	S	.	.			trans	-115.8	139.9	174.6	-81.3	-73.4	0	0	0	111.2	V225 M227 Q230 L232	F72-V225 HydrophobicContact CD2-CB 4.15Å; F72-V225 HydrophobicContact CD2-CG2 3.73Å; F72-V225 VanDerWaalsContact CE2-C 3.4Å; F72-V225 HydrophobicContact CE2-CB 3.43Å; F72-V225 VanDerWaalsContact CE2-CB 3.43Å; F72-V225 HydrophobicContact CE2-CG2 3.07Å; F72-V225 WeakPolarHBondContact CE2-O 3.3Å; F72-V225 HydrophobicContact CZ-CB 4.35Å; F72-V225 HydrophobicContact CZ-CG2 3.81Å; F72-V225 WeakPolarHBondContact CZ-O 3.29Å; F72-M227 HydrophobicContact CB-CE 3.8Å; F72-Q230 HydrophobicContact CE1-CB 4.16Å; F72-L232 HydrophobicContact CD1-CB 4.31Å; F72-L232 HydrophobicContact CD1-CD2 4.48Å; F72-L232 HydrophobicContact CE1-CB 3.33Å; F72-L232 HydrophobicContact CE1-CD2 4.23Å; F72-L232 HydrophobicContact CE1-CG 4.45Å; F72-L232 HydrophobicContact CE2-CB 4.02Å; F72-L232 HydrophobicContact CZ-CB 3.19Å; F72-L232 HydrophobicContact CZ-CG 4.45Å; F72-L232 VanDerWaalsContact CZ-N 3.29Å
73	E	28.9	Very low	29.2	Very low	61 Å²	61	81 Å²	81	29%	0.285	46%	0.457	S	S	.	.			trans	-117.1	105.7	158.1	-69.5	-151.6	140	0	0	110.2	E261 F264 W285	E73-E261 WeakPolarHBondContact OE1-CA 3.48Å; E73-F264 WeakPolarHBondContact OE1-CD2 3.03Å; E73-F264 WeakPolarHBondContact OE2-CD2 3.33Å; E73-W285 WeakPolarHBondContact OE2-CZ2 3.38Å
74	G	28.1	Very low	29	Very low	22 Å²	22	84.9 Å²	84.9	23%	0.227	47%	0.468	C	S	.	.			trans	-89.3	141.9	165.8	0	0	0	0	0	110.4	K76	G74-K76 PolarHBondContact O-N 3.33Å
75	S	30.3	Very low	28.6	Very low	125 Å²	125	93.2 Å²	93.2	87%	0.874	50%	0.503	S	S	*	.	S	Bend	trans	-65.8	5.4	179.7	-18.2	0	0	0	0	114.6
76	K	27.1	Very low	28.4	Very low	185 Å²	185	100 Å²	100	80%	0.804	53%	0.531	S	S	*	.	S	Bend	trans	-141.4	89.5	174.9	-69.1	-172.1	-180	177.8	0	109.1	G74 E78	G74-K76 PolarHBondContact O-N 3.33Å; K76-E78 PolarHBondContact O-N 3.44Å
77	G	26.5	Very low	28	Very low	38 Å²	38	104.9 Å²	104.9	39%	0.392	56%	0.563	S	S	.	*			trans	-61	101.5	163.8	0	0	0	0	0	109.6
78	E	29.3	Very low	27.6	Very low	154 Å²	154	104.1 Å²	104.1	72%	0.72	58%	0.581	S	S	*	*			trans	-127.6	95.8	156.4	-77.5	-168.9	174.3	0	0	107.1	K76 L80	K76-E78 PolarHBondContact O-N 3.44Å; E78-L80 HydrophobicContact CB-CD1 4.43Å; E78-L80 HydrophobicContact CB-CG 4.49Å; E78-L80 PolarHBondContact O-N 2.65Å; E78-L80 VanDerWaalsContact O-N 3.09Å
79	E	26.2	Very low	27.1	Very low	175 Å²	175	107.9 Å²	107.9	82%	0.818	61%	0.61	S	S	*	*			trans	-62.4	100.3	162.8	-171.5	-178.4	-161.2	0	0	107.7
80	L	28.2	Very low	26.6	Very low	110 Å²	110	114.6 Å²	114.6	58%	0.576	63%	0.631	S	S	*	*			trans	-118.7	75.9	173.4	-75.9	171.3	0	0	0	109.8	E78	E78-L80 HydrophobicContact CB-CD1 4.43Å; E78-L80 HydrophobicContact CB-CG 4.49Å; E78-L80 PolarHBondContact O-N 2.65Å; E78-L80 VanDerWaalsContact O-N 3.09Å
81	S	25.8	Very low	26.4	Very low	92 Å²	92	122.2 Å²	122.2	64%	0.643	66%	0.664	S	S	*	*			trans	-61.4	136.9	150.3	63.1	0	0	0	0	109.3
82	K	25.8	Very low	26.3	Very low	198 Å²	198	123.5 Å²	123.5	86%	0.861	67%	0.673	S	S	*	*	S	Bend	trans	67	89.3	166.8	-59.8	-177.4	-179.7	176.8	0	117.1
83	G	27.6	Very low	26.3	Very low	76 Å²	76	130.4 Å²	130.4	78%	0.784	71%	0.706	S	S	*	*			trans	67.8	76.5	133.8	0	0	0	0	0	117.2
84	N	24.9	Very low	26.1	Very low	123 Å²	123	133.7 Å²	133.7	66%	0.658	72%	0.721	S	S	*	*			trans	-125	114.6	159.6	-82.6	-32	0	0	0	110.6	F86	N84-F86 HydrophobicContact CB-CE2 4.49Å; N84-F86 PolarHBondContact O-N 3.31Å; N84-F86 VanDerWaalsContact O-N 3.14Å
85	K	22.1	Very low	26.2	Very low	214 Å²	214	138.3 Å²	138.3	93%	0.93	74%	0.735	S	S	*	*			trans	-62.2	105.8	166.5	-92	178.8	171.3	175.9	0	108.6
86	F	27.4	Very low	26.1	Very low	177 Å²	177	135.6 Å²	135.6	78%	0.776	71%	0.713	S	S	*	*			trans	-85.4	119.2	169.6	-96.8	-86.7	0	0	0	110.9	N84	N84-F86 HydrophobicContact CB-CE2 4.49Å; N84-F86 PolarHBondContact O-N 3.31Å; N84-F86 VanDerWaalsContact O-N 3.14Å
87	V	22.8	Very low	26.6	Very low	144 Å²	144	133.7 Å²	133.7	87%	0.873	71%	0.707	S	S	*	*			trans	-89.4	93.4	166.3	-179.1	0	0	0	0	106.7
88	G	27.4	Very low	27.3	Very low	69 Å²	69	135.2 Å²	135.2	71%	0.711	71%	0.712	S	S	*	*			trans	-86.5	130.8	175.7	0	0	0	0	0	111.7	R90	G88-R90 PolarHBondContact O-N 3.07Å
89	S	23.1	Very low	28.1	Very low	122 Å²	122	129.8 Å²	129.8	85%	0.853	69%	0.691	S	S	*	*			trans	-74.6	114.5	179.4	57.3	0	0	0	0	112	Q91	S89-Q91 PolarHBondContact O-N 3.24Å
90	R	24.9	Very low	29.1	Very low	197 Å²	197	122.9 Å²	122.9	74%	0.743	66%	0.659	S	S	*	*			trans	-30.8	118.3	167.5	-105.1	175.3	157.9	-175.5	-7.1	115.3	G88 E94	G88-R90 PolarHBondContact O-N 3.07Å; R90-E94 IonicContact NH2-OE1 2.78Å; R90-E94 PolarHBondContact NH2-OE1 3.04Å
91	Q	23.6	Very low	30.1	Very low	200 Å²	200	124 Å²	124	94%	0.935	66%	0.661	S	S	*	*				-151.8	57.9	122.8	-80.2	-163.2	-14.3	0	0	107.7	S89	S89-Q91 PolarHBondContact O-N 3.24Å
92	S	27.1	Very low	31.4	Very low	70 Å²	70	125.8 Å²	125.8	49%	0.49	66%	0.662	S	S	.	*			trans	-80.2	128.5	163.7	44.5	0	0	0	0	107.7	E94	S92-E94 PolarHBondContact O-N 3.27Å; S92-E94 VanDerWaalsContact O-N 3.1Å
93	Q	25.5	Very low	32.6	Very low	186 Å²	186	118.3 Å²	118.3	87%	0.869	63%	0.633	S	S	*	*			trans	-50.5	115.6	145.4	-100.9	173.9	-28	0	0	104.9	F95	Q93-F95 VanDerWaalsContact C-N 3.28Å; Q93-F95 PolarHBondContact O-N 3.48Å
94	E	24.4	Very low	33.7	Very low	130 Å²	130	118.5 Å²	118.5	61%	0.607	62%	0.616	S	S	*	*			trans	-58.6	96.6	177.5	-78.3	174.2	174.6	0	0	107.6	R90 S92 T96	R90-E94 IonicContact NH2-OE1 2.78Å; R90-E94 PolarHBondContact NH2-OE1 3.04Å; S92-E94 PolarHBondContact O-N 3.27Å; S92-E94 VanDerWaalsContact O-N 3.1Å; E94-T96 HydrophobicContact CB-CG2 4.25Å; E94-T96 PolarHBondContact O-N 3.1Å
95	F	29.6	Very low	35.1	Very low	119 Å²	119	115.9 Å²	115.9	52%	0.522	61%	0.605	S	S	.	*			trans	-69.3	85.4	159.6	-136.1	-93.8	0	0	0	104.6	Q93 F100	Q93-F95 VanDerWaalsContact C-N 3.28Å; Q93-F95 PolarHBondContact O-N 3.48Å; F95-F100 HydrophobicContact CD1-CE2 4.1Å
96	T	29.9	Very low	36.8	Very low	68 Å²	68	111.4 Å²	111.4	42%	0.417	59%	0.586	S	S	.	*			trans	-56.8	143.8	-178	50.8	0	0	0	0	109	E94 S98 S99	E94-T96 HydrophobicContact CB-CG2 4.25Å; E94-T96 PolarHBondContact O-N 3.1Å; T96-S98 PolarHBondContact O-N 3.05Å; T96-S98 PolarHBondContact OG1-OG 2.96Å; T96-S99 PolarHBondContact O-N 3.24Å
97	E	36.3	Very low	38.2	Very low	145 Å²	145	104.2 Å²	104.2	68%	0.678	55%	0.554	S	S	*	*	H	α-helix	trans	-48.3	-20.5	173.5	-68.5	-176.6	132.2	0	0	113.1	S99 F100 E101	E97-S99 VanDerWaalsContact C-N 3.31Å; E97-S99 PolarHBondContact O-N 3.27Å; E97-F100 WeakPolarHBondContact O-CB 3.37Å; E97-F100 PolarHBondContact O-N 3.3Å; E97-F100 VanDerWaalsContact O-N 3.08Å; E97-E101 PolarHBondContact O-N 3.3Å
98	S	41.6	Very low	39.6	Very low	70 Å²	70	102.7 Å²	102.7	49%	0.49	54%	0.535	S	S	.	.	H	α-helix	trans	-55.1	-37.7	172.8	80.6	0	0	0	0	114.2	T96 F100 E101 L102	T96-S98 PolarHBondContact O-N 3.05Å; T96-S98 PolarHBondContact OG1-OG 2.96Å; S98-F100 VanDerWaalsContact C-N 3.31Å; S98-F100 PolarHBondContact O-N 3.48Å; S98-E101 PolarHBondContact O-N 3.34Å; S98-L102 WeakPolarHBondContact O-CG 3.2Å; S98-L102 PolarHBondContact O-N 2.88Å
99	S	46.4	Very low	40.7	Very low	40 Å²	40	105.4 Å²	105.4	28%	0.28	53%	0.529	S	S	.	.	H	α-helix	trans	-68	-33.9	176.7	-62.1	0	0	0	0	111.6	T96 E97 L102 V103	T96-S99 PolarHBondContact O-N 3.24Å; E97-S99 VanDerWaalsContact C-N 3.31Å; E97-S99 PolarHBondContact O-N 3.27Å; S99-L102 PolarHBondContact O-N 3.14Å; S99-V103 WeakPolarHBondContact O-CG2 3.41Å
100	F	46.4	Very low	42.1	Very low	31 Å²	31	104 Å²	104	14%	0.136	51%	0.512	C	S	.	.	H	α-helix	trans	-72	-38.4	177.2	-72.1	-89.1	0	0	0	112.2	F95 E97 S98 L102 V103 I104 E202 V205	F95-F100 HydrophobicContact CD1-CE2 4.1Å; E97-F100 WeakPolarHBondContact O-CB 3.37Å; E97-F100 PolarHBondContact O-N 3.3Å; E97-F100 VanDerWaalsContact O-N 3.08Å; S98-F100 VanDerWaalsContact C-N 3.31Å; S98-F100 PolarHBondContact O-N 3.48Å; F100-L102 PolarHBondContact O-N 3.09Å; F100-V103 PolarHBondContact O-N 3.16Å; F100-I104 PolarHBondContact O-N 3Å; F100-E202 HydrophobicContact CE1-CG 4.31Å; F100-E202 HydrophobicContact CZ-CG 3.95Å; F100-V205 HydrophobicContact CD1-CG2 3.77Å; F100-V205 HydrophobicContact CE1-CG2 3.77Å
101	E	50.5	Low	43.2	Very low	133 Å²	133	100 Å²	100	62%	0.621	51%	0.508	S	S	*	.	H	α-helix	trans	-64.6	-17.2	172.7	-76.6	-72.9	159.6	0	0	112.8	E97 S98 P105	E97-E101 PolarHBondContact O-N 3.3Å; S98-E101 PolarHBondContact O-N 3.34Å; E101-P105 WeakPolarHBondContact O-CD 2.79Å; E101-P105 WeakPolarHBondContact O-CG 3.34Å
102	L	52.5	Low	44	Very low	129 Å²	129	95.8 Å²	95.8	68%	0.675	49%	0.492	S	S	*	.	H	α-helix	trans	-84.1	-33.4	174.6	-70.6	170.5	0	0	0	113	S98 S99 F100	S98-L102 WeakPolarHBondContact O-CG 3.2Å; S98-L102 PolarHBondContact O-N 2.88Å; S99-L102 PolarHBondContact O-N 3.14Å; F100-L102 PolarHBondContact O-N 3.09Å
103	V	51.2	Low	44.9	Very low	42 Å²	42	96.9 Å²	96.9	26%	0.255	50%	0.5	S	S	.	.	H	α-helix	trans	-76.9	-41	-176.7	-178.8	0	0	0	0	111.1	S99 F100 K106 Y107 V205	S99-V103 WeakPolarHBondContact O-CG2 3.41Å; F100-V103 PolarHBondContact O-N 3.16Å; V103-K106 WeakPolarHBondContact O-CB 3.02Å; V103-K106 PolarHBondContact O-N 3.31Å; V103-Y107 HydrophobicContact CG1-CD2 3.83Å; V103-Y107 HydrophobicContact CG1-CE2 3.48Å; V103-Y107 VanDerWaalsContact CG1-CE2 3.48Å; V103-Y107 WeakPolarHBondContact O-CD2 3.21Å; V103-Y107 PolarHBondContact O-N 3.26Å; V103-V205 HydrophobicContact CG1-CG1 4.38Å
104	I	50.7	Low	45.9	Very low	80 Å²	80	92.7 Å²	92.7	41%	0.41	49%	0.492	S	S	.	.	H	α-helix	trans	-62.3	-46.9	-176.3	-65.9	171.7	0	0	0	112.4	F100 K106 Y107 K108	F100-I104 PolarHBondContact O-N 3Å; I104-K106 VanDerWaalsContact C-N 3.34Å; I104-K106 PolarHBondContact O-N 2.98Å; I104-Y107 PolarHBondContact O-N 3.22Å; I104-K108 WeakPolarHBondContact O-CB 3.46Å; I104-K108 PolarHBondContact O-N 2.81Å
105	P	54	Low	47.1	Very low	67 Å²	67	95.3 Å²	95.3	44%	0.435	50%	0.504	S	S	.	.	H	α-helix	trans	-61.9	-38.6	175.5	-24.5	35.3	0	0	0	113.1	E101 Y107 K108	E101-P105 WeakPolarHBondContact O-CD 2.79Å; E101-P105 WeakPolarHBondContact O-CG 3.34Å; P105-Y107 PolarHBondContact O-N 3.37Å; P105-K108 WeakPolarHBondContact O-CB 3.33Å; P105-K108 PolarHBondContact O-N 2.81Å; P105-K108 VanDerWaalsContact O-N 3.07Å
106	K	58.3	Low	47.7	Very low	120 Å²	120	97.6 Å²	97.6	52%	0.522	52%	0.52	S	S	.	.	H	α-helix	trans	-55.5	-37.6	178.8	-169.9	-176.6	179.9	-172.9	0	111.3	V103 I104 H109 D168	V103-K106 WeakPolarHBondContact O-CB 3.02Å; V103-K106 PolarHBondContact O-N 3.31Å; I104-K106 VanDerWaalsContact C-N 3.34Å; I104-K106 PolarHBondContact O-N 2.98Å; K106-H109 PolarHBondContact O-CE1 3.39Å; K106-H109 PolarHBondContact O-ND1 2.87Å; K106-D168 IonicContact NZ-OD2 2.65Å; K106-D168 PolarHBondContact NZ-OD2 3.49Å
107	Y	55.5	Low	49.1	Very low	26 Å²	26	100.5 Å²	100.5	10%	0.102	54%	0.539	C	S	.	.	H	α-helix	trans	-102.3	-0.9	178.1	-52.3	-64.6	0	0	0	114.2	V103 I104 P105 H109 L110 D168 R209 C212	V103-Y107 HydrophobicContact CG1-CD2 3.83Å; V103-Y107 HydrophobicContact CG1-CE2 3.48Å; V103-Y107 VanDerWaalsContact CG1-CE2 3.48Å; V103-Y107 WeakPolarHBondContact O-CD2 3.21Å; V103-Y107 PolarHBondContact O-N 3.26Å; I104-Y107 PolarHBondContact O-N 3.22Å; P105-Y107 PolarHBondContact O-N 3.37Å; Y107-H109 PolarHBondContact O-N 2.89Å; Y107-L110 HydrophobicContact CD1-CD1 4.34Å; Y107-L110 WeakPolarHBondContact O-CB 3.43Å; Y107-L110 PolarHBondContact O-N 3.45Å; Y107-D168 PolarHBondContact OH-OD1 2.93Å; Y107-D168 PolarHBondContact OH-OD2 3.13Å; Y107-R209 HydrophobicContact CE2-CG 4.04Å; Y107-C212 HydrophobicContact CD1-CB 4.09Å; Y107-C212 WeakPolarHBondContact CD1-SG 3.39Å; Y107-C212 HydrophobicContact CE1-CB 3.96Å
108	K	52.7	Low	50.7	Low	113 Å²	113	105 Å²	105	49%	0.491	55%	0.549	S	S	.	.	H	α-helix	trans	-60.3	-31.8	-177	-171.5	174.8	-176.2	177.8	0	112.7	I104 P105 L110 V111 N112	I104-K108 WeakPolarHBondContact O-CB 3.46Å; I104-K108 PolarHBondContact O-N 2.81Å; P105-K108 WeakPolarHBondContact O-CB 3.33Å; P105-K108 PolarHBondContact O-N 2.81Å; P105-K108 VanDerWaalsContact O-N 3.07Å; K108-L110 PolarHBondContact O-N 3.28Å; K108-V111 PolarHBondContact O-N 3.45Å; K108-V111 VanDerWaalsContact O-N 3.12Å; K108-N112 WeakPolarHBondContact O-CB 3.02Å; K108-N112 PolarHBondContact O-N 3.32Å
109	H	50	Low	52.2	Low	125 Å²	125	107.3 Å²	107.3	58%	0.579	56%	0.555	S	S	*	*	H	α-helix	trans	-64.6	-26.6	176.7	67.5	-83.1	0	0	0	113.1	K106 Y107	K106-H109 PolarHBondContact O-CE1 3.39Å; K106-H109 PolarHBondContact O-ND1 2.87Å; Y107-H109 PolarHBondContact O-N 2.89Å
110	L	52.5	Low	53.6	Low	94 Å²	94	108.5 Å²	108.5	49%	0.492	56%	0.562	S	S	.	*	H	α-helix	trans	-77.4	-26.6	174.1	-62.5	168	0	0	0	112.2	Y107 K108	Y107-L110 HydrophobicContact CD1-CD1 4.34Å; Y107-L110 WeakPolarHBondContact O-CB 3.43Å; Y107-L110 PolarHBondContact O-N 3.45Å; K108-L110 PolarHBondContact O-N 3.28Å
111	V	48.2	Very low	55.2	Low	111 Å²	111	111.5 Å²	111.5	67%	0.673	58%	0.583	S	S	*	*	H	α-helix	trans	-88.6	-29.3	179.3	-173.3	0	0	0	0	112	K108	K108-V111 PolarHBondContact O-N 3.45Å; K108-V111 VanDerWaalsContact O-N 3.12Å
112	N	40.4	Very low	56.6	Low	112 Å²	112	109.2 Å²	109.2	60%	0.599	58%	0.581	S	S	*	*	S	Bend	trans	-90.8	2.2	-175	-81.7	6.7	0	0	0	114.8	K108 S114	K108-N112 WeakPolarHBondContact O-CB 3.02Å; K108-N112 PolarHBondContact O-N 3.32Å; N112-S114 PolarHBondContact O-N 2.73Å
113	S	45.7	Very low	57.5	Low	93 Å²	93	108.3 Å²	108.3	65%	0.65	57%	0.574	S	S	*	*	S	Bend	trans	-92.5	92	173.4	177.2	0	0	0	0	109.9
114	S	46.4	Very low	58.3	Low	99 Å²	99	109.3 Å²	109.3	69%	0.692	59%	0.586	S	S	*	*			trans	113	93	167.9	-44	0	0	0	0	112.3	N112 L116	N112-S114 PolarHBondContact O-N 2.73Å; S114-L116 PolarHBondContact O-N 3.06Å; S114-L116 VanDerWaalsContact O-N 3.14Å
115	E	49.8	Very low	59.2	Low	185 Å²	185	113 Å²	113	86%	0.864	60%	0.595	S	S	*	*			trans	-49.6	122.5	143.8	-71	-175.9	164.3	0	0	106.4	T117	E115-T117 PolarHBondContact O-N 3.48Å
116	L	43.2	Very low	60	Low	166 Å²	166	114.7 Å²	114.7	87%	0.869	60%	0.604	S	S	*	*			trans	-55.8	107.6	173.2	-79.9	163	0	0	0	107.2	S114 R118	S114-L116 PolarHBondContact O-N 3.06Å; S114-L116 VanDerWaalsContact O-N 3.14Å; L116-R118 PolarHBondContact O-N 3.28Å
117	T	58.5	Low	59.7	Low	130 Å²	130	115.1 Å²	115.1	80%	0.798	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-60.1	117.1	176.7	44.6	0	0	0	0	107.5	E115 I119	E115-T117 PolarHBondContact O-N 3.48Å; T117-I119 PolarHBondContact O-N 2.84Å; T117-I119 VanDerWaalsContact O-N 3.11Å
118	R	70.7	Confident	59.5	Low	238 Å²	238	123.3 Å²	123.3	90%	0.898	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-62.9	116.9	177.6	-69.7	-178.7	176.5	-179.5	-0.7	108.3	L116 P120	L116-R118 PolarHBondContact O-N 3.28Å; R118-P120 VanDerWaalsContact O-CD 3.24Å; R118-P120 WeakPolarHBondContact O-CD 3.48Å
119	I	71.7	Confident	59.3	Low	120 Å²	120	123.4 Å²	123.4	62%	0.615	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-69.2	116.4	172.9	-57	171.9	0	0	0	107.4	T117 V121 E123 A124	T117-I119 PolarHBondContact O-N 2.84Å; T117-I119 VanDerWaalsContact O-N 3.11Å; I119-V121 PolarHBondContact O-N 3.13Å; I119-E123 HydrophobicContact CG2-CB 4.17Å; I119-E123 HydrophobicContact CG2-CG 4.39Å; I119-A124 HydrophobicContact CG2-CB 4.41Å
120	P	76.7	Confident	59	Low	64 Å²	64	125.5 Å²	125.5	42%	0.416	67%	0.667	S	S	.	*	P	Polyproline II helix	trans	-59.6	138	174.1	-20.9	33.8	0	0	0	110.5	R118 S122 E123 A124	R118-P120 VanDerWaalsContact O-CD 3.24Å; R118-P120 WeakPolarHBondContact O-CD 3.48Å; P120-S122 PolarHBondContact O-N 3.2Å; P120-E123 VanDerWaalsContact CD-OE2 3.3Å; P120-E123 WeakPolarHBondContact CD-OE2 3.15Å; P120-E123 WeakPolarHBondContact O-CB 3.23Å; P120-E123 PolarHBondContact O-N 2.94Å; P120-A124 PolarHBondContact O-N 3.38Å
121	V	79.3	Confident	58.5	Low	95 Å²	95	124.7 Å²	124.7	58%	0.576	67%	0.67	S	S	*	*	H	α-helix	trans	-56.1	-28.7	179.8	175.7	0	0	0	0	112.3	I119 A124 R125	I119-V121 PolarHBondContact O-N 3.13Å; V121-A124 PolarHBondContact O-N 3.3Å; V121-R125 HydrophobicContact CG1-CG 4.29Å; V121-R125 WeakPolarHBondContact O-CB 3.37Å; V121-R125 VanDerWaalsContact O-CG 3.25Å; V121-R125 WeakPolarHBondContact O-CG 3.45Å; V121-R125 PolarHBondContact O-N 2.75Å
122	S	81.3	Confident	58.3	Low	85 Å²	85	125 Å²	125	59%	0.594	67%	0.667	S	S	*	*	H	α-helix	trans	-60.6	-42	173.1	47.5	0	0	0	0	112.9	P120 R125 T126	P120-S122 PolarHBondContact O-N 3.2Å; S122-R125 PolarHBondContact O-N 3.35Å; S122-T126 PolarHBondContact O-N 3.23Å
123	E	71.7	Confident	58.4	Low	110 Å²	110	124.1 Å²	124.1	51%	0.514	67%	0.665	S	S	.	*	H	α-helix	trans	-72.7	-37.5	179.5	-170.2	177.6	169	0	0	111.4	I119 P120 R125 T126	I119-E123 HydrophobicContact CG2-CB 4.17Å; I119-E123 HydrophobicContact CG2-CG 4.39Å; P120-E123 VanDerWaalsContact CD-OE2 3.3Å; P120-E123 WeakPolarHBondContact CD-OE2 3.15Å; P120-E123 WeakPolarHBondContact O-CB 3.23Å; P120-E123 PolarHBondContact O-N 2.94Å; E123-R125 VanDerWaalsContact C-N 3.29Å; E123-R125 PolarHBondContact O-N 3.28Å; E123-T126 PolarHBondContact O-N 3.3Å; E123-T126 PolarHBondContact O-OG1 3.29Å
124	A	66.5	Low	58.3	Low	62 Å²	62	124.8 Å²	124.8	51%	0.512	67%	0.669	S	S	.	*	H	α-helix	trans	-65.4	-32.2	172.3	0	0	0	0	0	112.6	I119 P120 V121	I119-A124 HydrophobicContact CG2-CB 4.41Å; P120-A124 PolarHBondContact O-N 3.38Å; V121-A124 PolarHBondContact O-N 3.3Å
125	R	71.2	Confident	58.2	Low	158 Å²	158	123 Å²	123	60%	0.596	67%	0.667	S	S	*	*	H	α-helix	trans	-78.3	-25.3	179.5	-78	176.9	179.7	178.6	1.2	113.8	V121 S122 E123 N127 R128	V121-R125 HydrophobicContact CG1-CG 4.29Å; V121-R125 WeakPolarHBondContact O-CB 3.37Å; V121-R125 VanDerWaalsContact O-CG 3.25Å; V121-R125 WeakPolarHBondContact O-CG 3.45Å; V121-R125 PolarHBondContact O-N 2.75Å; S122-R125 PolarHBondContact O-N 3.35Å; E123-R125 VanDerWaalsContact C-N 3.29Å; E123-R125 PolarHBondContact O-N 3.28Å; R125-N127 VanDerWaalsContact C-N 3.32Å; R125-R128 WeakPolarHBondContact O-CB 3.41Å; R125-R128 WeakPolarHBondContact O-CD 3.42Å; R125-R128 WeakPolarHBondContact O-CG 3.43Å
126	T	69.1	Low	57.7	Low	102 Å²	102	118.9 Å²	118.9	63%	0.626	66%	0.655	S	S	*	*	H	α-helix	trans	-71.7	-28.4	176.3	43.7	0	0	0	0	112.3	S122 E123 R128	S122-T126 PolarHBondContact O-N 3.23Å; E123-T126 PolarHBondContact O-N 3.3Å; E123-T126 PolarHBondContact O-OG1 3.29Å; T126-R128 PolarHBondContact O-N 3.33Å
127	N	53.7	Low	58	Low	130 Å²	130	114.2 Å²	114.2	70%	0.695	63%	0.63	S	S	*	*			trans	-81.7	50	176.8	-72.7	-14	0	0	0	112.5	R125	R125-N127 VanDerWaalsContact C-N 3.32Å
128	R	50.4	Low	57.8	Low	198 Å²	198	110.5 Å²	110.5	75%	0.747	61%	0.605	S	S	*	*			trans	-95.2	-3.6	-172.8	-97.4	-176.7	-179.3	-157.8	-1.7	116.3	R125 T126	R125-R128 WeakPolarHBondContact O-CB 3.41Å; R125-R128 WeakPolarHBondContact O-CD 3.42Å; R125-R128 WeakPolarHBondContact O-CG 3.43Å; T126-R128 PolarHBondContact O-N 3.33Å
129	S	48.5	Very low	57.4	Low	115 Å²	115	99.9 Å²	99.9	80%	0.804	57%	0.57	S	S	*	*	S	Bend	trans	-118	3	-170.6	42.5	0	0	0	0	115.6
130	Q	42.8	Very low	57.2	Low	168 Å²	168	94.8 Å²	94.8	79%	0.785	55%	0.545	S	S	*	.			trans	-135.5	87.6	165.8	-69.4	-178.5	-11	0	0	106.9	I132	Q130-I132 VanDerWaalsContact C-N 3.27Å; Q130-I132 PolarHBondContact O-N 3.27Å
131	S	42.7	Very low	57.1	Low	78 Å²	78	97.9 Å²	97.9	55%	0.545	56%	0.558	S	S	.	*			trans	-57.5	103.6	160.3	178.8	0	0	0	0	106	V133 S134	S131-V133 PolarHBondContact O-N 3.05Å; S131-V133 VanDerWaalsContact O-N 3.14Å; S131-S134 PolarHBondContact OG-OG 3.43Å
132	I	43.3	Very low	56.8	Low	117 Å²	117	96.6 Å²	96.6	60%	0.6	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-25.8	174.3	-88.1	174.5	0	0	0	109.7	Q130 L137	Q130-I132 VanDerWaalsContact C-N 3.27Å; Q130-I132 PolarHBondContact O-N 3.27Å; I132-L137 HydrophobicContact CB-CD1 3.94Å; I132-L137 HydrophobicContact CG1-CD1 4.44Å; I132-L137 HydrophobicContact CG2-CD1 3.04Å; I132-L137 HydrophobicContact CG2-CG 4.45Å; I132-L137 VanDerWaalsContact O-CB 3.31Å; I132-L137 WeakPolarHBondContact O-CB 3.44Å; I132-L137 WeakPolarHBondContact O-CD1 3.36Å
133	V	43.2	Very low	56.5	Low	94 Å²	94	93.1 Å²	93.1	57%	0.57	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-18.8	-164.6	-173.5	0	0	0	0	114.8	S131 G135 L138	S131-V133 PolarHBondContact O-N 3.05Å; S131-V133 VanDerWaalsContact O-N 3.14Å; V133-G135 VanDerWaalsContact C-N 3.33Å; V133-G135 PolarHBondContact O-N 2.83Å; V133-G135 VanDerWaalsContact O-N 3.08Å; V133-L138 HydrophobicContact CG1-CD1 4.35Å
134	S	43.8	Very low	56.9	Low	106 Å²	106	90.6 Å²	90.6	74%	0.741	51%	0.51	S	S	*	.	S	Bend	trans	-86.5	25.4	-161.3	-57.3	0	0	0	0	116.8	S131	S131-S134 PolarHBondContact OG-OG 3.43Å
135	G	43.7	Very low	57.6	Low	62 Å²	62	91.7 Å²	91.7	64%	0.639	51%	0.514	S	S	*	.	S	Bend	trans	171.1	-7.8	169.6	0	0	0	0	0	118.7	V133	V133-G135 VanDerWaalsContact C-N 3.33Å; V133-G135 PolarHBondContact O-N 2.83Å; V133-G135 VanDerWaalsContact O-N 3.08Å
136	T	40.5	Very low	57.8	Low	99 Å²	99	86.4 Å²	86.4	61%	0.607	50%	0.501	S	S	*	.	S	Bend	trans	-142.3	-6.9	-171.6	53.9	0	0	0	0	116.1	E142	T136-E142 WeakPolarHBondContact O-CB 3.4Å
137	L	48.2	Very low	58.4	Low	67 Å²	67	82.2 Å²	82.2	35%	0.351	48%	0.475	S	S	.	.	S	Bend	trans	-100.8	-8.6	-170.7	-123	164.4	0	0	0	115.1	I132	I132-L137 HydrophobicContact CB-CD1 3.94Å; I132-L137 HydrophobicContact CG1-CD1 4.44Å; I132-L137 HydrophobicContact CG2-CD1 3.04Å; I132-L137 HydrophobicContact CG2-CG 4.45Å; I132-L137 VanDerWaalsContact O-CB 3.31Å; I132-L137 WeakPolarHBondContact O-CB 3.44Å; I132-L137 WeakPolarHBondContact O-CD1 3.36Å
138	L	54.1	Low	59.7	Low	53 Å²	53	81.3 Å²	81.3	28%	0.277	48%	0.476	S	S	.	.	S	Bend	trans	-139.7	12.1	-174.8	-78.2	176.2	0	0	0	111.3	V133 W242	V133-L138 HydrophobicContact CG1-CD1 4.35Å; L138-W242 VanDerWaalsContact CD2-C 3.41Å; L138-W242 HydrophobicContact CD2-CB 3.3Å; L138-W242 HydrophobicContact CD2-CG 4.44Å; L138-W242 WeakPolarHBondContact CD2-O 3.44Å
139	G	62.2	Low	61.3	Low	15 Å²	15	74.4 Å²	74.4	16%	0.155	47%	0.467	C	S	.	.	S	Bend	trans	-97.4	179.5	-176.8	0	0	0	0	0	112.1	E64 D141 E142 L143	E64-G139 VanDerWaalsContact CD-C 3.49Å; E64-G139 VanDerWaalsContact CD-CA 3.41Å; E64-G139 WeakPolarHBondContact OE1-CA 3.18Å; E64-G139 WeakPolarHBondContact OE2-CA 3.45Å; G139-D141 PolarHBondContact O-N 3.34Å; G139-E142 PolarHBondContact O-N 2.87Å; G139-L143 PolarHBondContact O-N 3.26Å
140	S	69.1	Low	63.1	Low	13 Å²	13	71.4 Å²	71.4	9%	0.091	44%	0.438	C	S	.	.	H	α-helix	trans	-65.7	-33.8	-169.8	-171.5	0	0	0	0	109.9	E64 E142 L143 D144 R150 E412	E64-S140 PolarHBondContact OE1-N 3.36Å; E64-S140 WeakPolarHBondContact OE2-CA 3.23Å; E64-S140 WeakPolarHBondContact OE2-CB 3.06Å; E64-S140 PolarHBondContact OE2-N 2.82Å; S140-E142 PolarHBondContact O-N 2.81Å; S140-L143 PolarHBondContact O-N 2.78Å; S140-D144 VanDerWaalsContact O-CB 3.29Å; S140-D144 WeakPolarHBondContact O-CB 3.41Å; S140-D144 PolarHBondContact O-N 3.08Å; S140-R150 PolarHBondContact OG-NH2 3.04Å; S140-E412 WeakPolarHBondContact CB-OE1 3.41Å; S140-E412 PolarHBondContact OG-OE1 2.81Å
141	D	74	Confident	65.3	Low	128 Å²	128	66.2 Å²	66.2	68%	0.684	41%	0.411	S	S	*	.	H	α-helix	trans	-60.4	-40.2	172.4	-66	-25.7	0	0	0	113.5	G139 S145	G139-D141 PolarHBondContact O-N 3.34Å; D141-S145 WeakPolarHBondContact O-CB 3.32Å; D141-S145 PolarHBondContact O-N 3.33Å
142	E	72.4	Confident	67.6	Low	69 Å²	69	62.7 Å²	62.7	32%	0.322	39%	0.386	S	S	.	.	H	α-helix	trans	-77.7	-35.5	178.5	-172.1	62.5	-151.8	0	0	110.8	T136 G139 S140 D144 S145 C146 F243	T136-E142 WeakPolarHBondContact O-CB 3.4Å; G139-E142 PolarHBondContact O-N 2.87Å; S140-E142 PolarHBondContact O-N 2.81Å; E142-D144 VanDerWaalsContact C-N 3.33Å; E142-S145 WeakPolarHBondContact O-CB 3.4Å; E142-S145 PolarHBondContact O-N 2.93Å; E142-C146 PolarHBondContact O-N 2.62Å; E142-C146 PolarHBondContact O-SG 3.35Å; E142-C146 VanDerWaalsContact O-SG 3.35Å; E142-F243 HydrophobicContact CB-CZ 4.27Å; E142-F243 HydrophobicContact CG-CZ 4.06Å
143	L	76.2	Confident	70	Confident	12 Å²	12	57.9 Å²	57.9	6%	0.063	36%	0.363	C	S	.	.	H	α-helix	trans	-60.2	-46.5	170.4	-175.3	62	0	0	0	110.2	G139 S140 S145 C146 L147 F243 I407 P409	G139-L143 PolarHBondContact O-N 3.26Å; S140-L143 PolarHBondContact O-N 2.78Å; L143-S145 VanDerWaalsContact C-N 3.29Å; L143-S145 PolarHBondContact O-N 2.76Å; L143-C146 PolarHBondContact O-N 2.71Å; L143-C146 PolarHBondContact O-SG 2.95Å; L143-L147 HydrophobicContact CD1-CB 4.27Å; L143-L147 HydrophobicContact CD1-CD1 4.02Å; L143-L147 WeakPolarHBondContact O-CA 3.13Å; L143-L147 WeakPolarHBondContact O-CB 3.29Å; L143-L147 PolarHBondContact O-N 3.42Å; L143-F243 HydrophobicContact CB-CD1 4.21Å; L143-F243 HydrophobicContact CB-CE1 3.71Å; L143-F243 HydrophobicContact CB-CZ 4.06Å; L143-F243 HydrophobicContact CD1-CD1 4.14Å; L143-F243 HydrophobicContact CD1-CD2 4.08Å; L143-F243 HydrophobicContact CD1-CE1 4.19Å; L143-F243 HydrophobicContact CD1-CE2 4.15Å; L143-F243 HydrophobicContact CD1-CG 4.08Å; L143-F243 HydrophobicContact CD1-CZ 4.2Å; L143-I407 HydrophobicContact CD1-CD1 4.23Å; L143-I407 HydrophobicContact CD2-CD1 4.07Å; L143-P409 HydrophobicContact CD2-CG 4.02Å
144	D	80.1	Confident	72.6	Confident	56 Å²	56	54 Å²	54	30%	0.299	34%	0.339	S	S	.	.	H	α-helix	trans	-63.5	-33.8	176.6	-75.3	-26.5	0	0	0	112.4	S140 E142 L147 P148 R150	S140-D144 VanDerWaalsContact O-CB 3.29Å; S140-D144 WeakPolarHBondContact O-CB 3.41Å; S140-D144 PolarHBondContact O-N 3.08Å; E142-D144 VanDerWaalsContact C-N 3.33Å; D144-L147 CarbonylContact O-C 3.59Å; D144-P148 WeakPolarHBondContact O-CA 3.17Å; D144-R150 VanDerWaalsContact OD1-CG 3.25Å; D144-R150 WeakPolarHBondContact OD1-CG 3.28Å; D144-R150 IonicContact OD1-CZ 3.79Å; D144-R150 IonicContact OD1-NE 2.76Å; D144-R150 PolarHBondContact OD1-NE 2.86Å; D144-R150 IonicContact OD1-NH2 3.08Å; D144-R150 IonicContact OD2-CZ 2.81Å; D144-R150 IonicContact OD2-NE 3.14Å; D144-R150 IonicContact OD2-NH2 3.56Å; D144-R150 PolarHBondContact OD2-NH2 3.08Å; D144-R150 VanDerWaalsContact OD2-NH2 3.08Å
145	S	79.6	Confident	75.2	Confident	86 Å²	86	49 Å²	49	60%	0.601	30%	0.304	S	S	*	.	H	α-helix	trans	-66.1	-44.1	173.6	176.2	0	0	0	0	112.2	D141 E142 L143	D141-S145 WeakPolarHBondContact O-CB 3.32Å; D141-S145 PolarHBondContact O-N 3.33Å; E142-S145 WeakPolarHBondContact O-CB 3.4Å; E142-S145 PolarHBondContact O-N 2.93Å; L143-S145 VanDerWaalsContact C-N 3.29Å; L143-S145 PolarHBondContact O-N 2.76Å
146	C	76.8	Confident	77.8	Confident	47 Å²	47	46.1 Å²	46.1	32%	0.318	27%	0.273	S	S	.	.	H	α-helix	trans	-85.6	-25.2	-177.4	77.3	0	0	0	0	114.1	E142 L143 L240 F243	E142-C146 PolarHBondContact O-N 2.62Å; E142-C146 PolarHBondContact O-SG 3.35Å; E142-C146 VanDerWaalsContact O-SG 3.35Å; L143-C146 PolarHBondContact O-N 2.71Å; L143-C146 PolarHBondContact O-SG 2.95Å; C146-L240 VanDerWaalsContact SG-CD2 3.57Å; C146-F243 VanDerWaalsContact SG-CE2 3.59Å
147	L	81.4	Confident	80.6	Confident	13 Å²	13	41.4 Å²	41.4	7%	0.068	24%	0.244	C	C	.	.	S	Bend	trans	-134.2	68.2	-175.7	-105.8	162.9	0	0	0	109.5	L143 D144 G149 R150 R151 L152 L240 I407	L143-L147 HydrophobicContact CD1-CB 4.27Å; L143-L147 HydrophobicContact CD1-CD1 4.02Å; L143-L147 WeakPolarHBondContact O-CA 3.13Å; L143-L147 WeakPolarHBondContact O-CB 3.29Å; L143-L147 PolarHBondContact O-N 3.42Å; D144-L147 CarbonylContact O-C 3.59Å; L147-G149 PolarHBondContact O-N 3.46Å; L147-G149 VanDerWaalsContact O-N 3.07Å; L147-R150 PolarHBondContact O-N 2.82Å; L147-R151 WeakPolarHBondContact CD2-O 3.46Å; L147-L152 HydrophobicContact CD1-CD1 3.82Å; L147-L240 HydrophobicContact CD1-CD1 3.85Å; L147-L240 HydrophobicContact CD1-CD2 3.61Å; L147-L240 HydrophobicContact CD1-CG 4.39Å; L147-L240 HydrophobicContact CG-CD2 4.32Å; L147-I407 HydrophobicContact CD1-CD1 4.33Å
148	P	80	Confident	82.9	Confident	111 Å²	111	38.2 Å²	38.2	72%	0.721	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	118.2	-178.5	24.6	-33.7	0	0	0	110.3	D144	D144-P148 WeakPolarHBondContact O-CA 3.17Å
149	G	84.7	Confident	85	Confident	54 Å²	54	35.7 Å²	35.7	56%	0.557	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	94.7	0.3	-176.2	0	0	0	0	0	115	L147 R151	L147-G149 PolarHBondContact O-N 3.46Å; L147-G149 VanDerWaalsContact O-N 3.07Å; G149-R151 WeakPolarHBondContact O-CG 3.48Å; G149-R151 PolarHBondContact O-N 3.14Å
150	R	85.6	Confident	86.7	Confident	51 Å²	51	35.1 Å²	35.1	19%	0.192	21%	0.208	C	C	.	.	S	Bend	trans	55.3	35.8	175.1	-54.4	-178.4	-177.1	173.2	-6.8	113.6	S140 D144 L147 M406 I407 E412	S140-R150 PolarHBondContact OG-NH2 3.04Å; D144-R150 VanDerWaalsContact OD1-CG 3.25Å; D144-R150 WeakPolarHBondContact OD1-CG 3.28Å; D144-R150 IonicContact OD1-CZ 3.79Å; D144-R150 IonicContact OD1-NE 2.76Å; D144-R150 PolarHBondContact OD1-NE 2.86Å; D144-R150 IonicContact OD1-NH2 3.08Å; D144-R150 IonicContact OD2-CZ 2.81Å; D144-R150 IonicContact OD2-NE 3.14Å; D144-R150 IonicContact OD2-NH2 3.56Å; D144-R150 PolarHBondContact OD2-NH2 3.08Å; D144-R150 VanDerWaalsContact OD2-NH2 3.08Å; L147-R150 PolarHBondContact O-N 2.82Å; R150-M406 CarbonylContact O-C 3.48Å; R150-M406 WeakPolarHBondContact O-CA 3.25Å; R150-I407 HydrophobicContact CB-CG1 4.17Å; R150-I407 WeakPolarHBondContact CB-O 3.33Å; R150-I407 WeakPolarHBondContact O-CG1 3.35Å; R150-I407 PolarHBondContact O-N 3.45Å; R150-E412 IonicContact CZ-OE1 3.47Å; R150-E412 IonicContact CZ-OE2 3.62Å; R150-E412 IonicContact NH1-OE1 2.76Å; R150-E412 IonicContact NH1-OE2 3.82Å; R150-E412 PolarHBondContact NH1-OE2 3.36Å; R150-E412 IonicContact NH2-OE1 3.53Å; R150-E412 PolarHBondContact NH2-OE1 3.02Å; R150-E412 IonicContact NH2-OE2 3.66Å
151	R	89.7	Confident	87.9	Confident	59 Å²	59	34.5 Å²	34.5	22%	0.223	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	108.5	179	-64.2	-173.7	71.2	76.2	3.1	110.4	L147 G149 D379 H381 E404 A405	L147-R151 WeakPolarHBondContact CD2-O 3.46Å; G149-R151 WeakPolarHBondContact O-CG 3.48Å; G149-R151 PolarHBondContact O-N 3.14Å; R151-D379 IonicContact CZ-OD2 2.91Å; R151-D379 IonicContact NH1-OD2 3.48Å; R151-D379 PolarHBondContact NH1-OD2 2.93Å; R151-D379 IonicContact NH2-OD2 3.73Å; R151-H381 PolarHBondContact NH2-CD2 3.48Å; R151-E404 HydrophobicContact CB-CG 3.91Å; R151-E404 WeakPolarHBondContact CB-OE1 3.47Å; R151-E404 WeakPolarHBondContact CD-OE1 3.3Å; R151-E404 VanDerWaalsContact CZ-CD 3.46Å; R151-E404 IonicContact CZ-OE1 2.82Å; R151-E404 IonicContact CZ-OE2 3.58Å; R151-E404 IonicContact NE-OE1 3.8Å; R151-E404 PolarHBondContact NE-OE1 3.14Å; R151-E404 IonicContact NE-OE2 3.52Å; R151-E404 PolarHBondContact NE-OE2 3.39Å; R151-E404 VanDerWaalsContact NE-OE2 3.17Å; R151-E404 IonicContact NH2-OE1 2.57Å; R151-E404 IonicContact NH2-OE2 2.9Å; R151-E404 PolarHBondContact NH2-OE2 3.44Å; R151-A405 CarbonylContact C-O 3.49Å; R151-A405 WeakPolarHBondContact CA-O 3.44Å
152	L	90.9	Very high	88.8	Confident	4 Å²	4	29.5 Å²	29.5	2%	0.021	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	126.6	-179.4	-167.8	72.6	0	0	0	110.4	L66 L147 I154 D185 I186 L240 E404 A405 I407	L66-L152 HydrophobicContact CD1-CD2 4.08Å; L66-L152 HydrophobicContact CD2-CD2 4.03Å; L147-L152 HydrophobicContact CD1-CD1 3.82Å; L152-I154 HydrophobicContact CD2-CD1 4.33Å; L152-I154 HydrophobicContact CD2-CG1 4.19Å; L152-I154 HydrophobicContact CG-CG1 4.28Å; L152-D185 HydrophobicContact CD1-CB 3.39Å; L152-D185 HydrophobicContact CG-CB 4.06Å; L152-I186 HydrophobicContact CD2-CD1 3.52Å; L152-I186 HydrophobicContact CD2-CG1 4.13Å; L152-I186 HydrophobicContact CG-CD1 4.42Å; L152-L240 HydrophobicContact CD1-CD1 3.84Å; L152-E404 CarbonylContact O-C 3.51Å; L152-E404 WeakPolarHBondContact O-CA 3.3Å; L152-A405 PolarHBondContact N-O 3.5Å; L152-A405 PolarHBondContact O-N 2.9Å; L152-I407 HydrophobicContact CB-CG2 4.04Å; L152-I407 HydrophobicContact CD2-CG2 4.24Å
153	S	94.8	Very high	89.6	Confident	17 Å²	17	27.8 Å²	27.8	12%	0.119	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	127.4	172.5	59.5	0	0	0	0	111.5	A184 D185 I186 F403	S153-A184 VanDerWaalsContact OG-CA 3.29Å; S153-A184 WeakPolarHBondContact OG-CA 3.41Å; S153-D185 WeakPolarHBondContact CB-OD2 3.38Å; S153-D185 PolarHBondContact N-OD2 3.33Å; S153-D185 WeakPolarHBondContact O-CA 3.35Å; S153-D185 WeakPolarHBondContact O-CB 3.45Å; S153-D185 PolarHBondContact O-N 3.43Å; S153-D185 VanDerWaalsContact OG-CG 3.26Å; S153-D185 PolarHBondContact OG-N 2.93Å; S153-D185 PolarHBondContact OG-OD2 3.42Å; S153-I186 PolarHBondContact O-N 2.94Å; S153-F403 CarbonylContact C-O 3.59Å; S153-F403 VanDerWaalsContact CA-O 3.29Å; S153-F403 WeakPolarHBondContact CA-O 3.25Å
154	I	97.2	Very high	90.3	Very high	13 Å²	13	31.5 Å²	31.5	7%	0.067	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	118.9	-173.6	-53.9	171.2	0	0	0	108.9	L152 V156 I186 F284 F403 A405	L152-I154 HydrophobicContact CD2-CD1 4.33Å; L152-I154 HydrophobicContact CD2-CG1 4.19Å; L152-I154 HydrophobicContact CG-CG1 4.28Å; I154-V156 HydrophobicContact CG2-CG2 4.11Å; I154-I186 HydrophobicContact CG1-CB 4.37Å; I154-I186 HydrophobicContact CG2-CB 4.34Å; I154-I186 HydrophobicContact CG2-CG2 4.2Å; I154-F284 HydrophobicContact CD1-CE2 3.88Å; I154-F284 HydrophobicContact CD1-CZ 3.83Å; I154-F284 HydrophobicContact CG2-CE2 4.26Å; I154-F284 HydrophobicContact CG2-CZ 4.24Å; I154-F403 HydrophobicContact CB-CB 4.29Å; I154-F403 PolarHBondContact N-O 3.39Å; I154-F403 PolarHBondContact O-N 3.27Å; I154-A405 HydrophobicContact CD1-CB 3.91Å
155	F	98.3	Very high	90.7	Very high	1 Å²	1	33 Å²	33	0%	0.004	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	117.7	173.4	-169.3	-96.4	0	0	0	110.1	M174 P177 A184 I186 Y187 A188 I189 Y400 F402	F155-M174 WeakPolarHBondContact CE1-O 3.42Å; F155-M174 WeakPolarHBondContact CZ-O 3.21Å; F155-P177 HydrophobicContact CE2-CG 4.13Å; F155-P177 HydrophobicContact CZ-CG 3.95Å; F155-A184 HydrophobicContact CB-CB 3.59Å; F155-I186 PolarHBondContact N-O 2.82Å; F155-Y187 HydrophobicContact CB-CD1 3.67Å; F155-Y187 HydrophobicContact CB-CE1 3.75Å; F155-Y187 HydrophobicContact CB-CG 4.16Å; F155-Y187 AromaticContact CD1-CD1 3.48Å; F155-Y187 HydrophobicContact CD1-CD1 3.48Å; F155-Y187 VanDerWaalsContact CD1-CD1 3.48Å; F155-Y187 AromaticContact CD1-CE1 3.66Å; F155-Y187 HydrophobicContact CD1-CE1 3.66Å; F155-Y187 HydrophobicContact CD2-CE1 4.48Å; F155-Y187 HydrophobicContact CE1-CD1 4.35Å; F155-Y187 HydrophobicContact CE1-CE1 4.33Å; F155-Y187 AromaticContact CG-CD1 3.82Å; F155-Y187 HydrophobicContact CG-CD1 3.82Å; F155-Y187 AromaticContact CG-CE1 3.73Å; F155-Y187 HydrophobicContact CG-CE1 3.73Å; F155-Y187 CarbonylContact O-C 3.57Å; F155-Y187 WeakPolarHBondContact O-CA 3.29Å; F155-A188 PolarHBondContact O-N 3.21Å; F155-I189 HydrophobicContact CD1-CD1 4.28Å; F155-Y400 HydrophobicContact CD2-CD2 4.11Å; F155-Y400 AromaticContact CE2-CD2 3.23Å; F155-Y400 HydrophobicContact CE2-CD2 3.23Å; F155-Y400 AromaticContact CE2-CE2 3.87Å; F155-Y400 HydrophobicContact CE2-CE2 3.87Å; F155-Y400 AromaticContact CE2-CG 3.8Å; F155-Y400 HydrophobicContact CE2-CG 3.8Å; F155-Y400 AromaticContact CZ-CD2 3.6Å; F155-Y400 HydrophobicContact CZ-CD2 3.6Å; F155-Y400 HydrophobicContact CZ-CE2 4.46Å; F155-Y400 AromaticContact CZ-CG 3.62Å; F155-Y400 HydrophobicContact CZ-CG 3.62Å; F155-F402 HydrophobicContact CD2-CB 4.41Å; F155-F402 AromaticContact CD2-CD2 3.76Å; F155-F402 HydrophobicContact CD2-CD2 3.76Å
156	V	98.5	Very high	91.1	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	126.9	175.5	-178.3	0	0	0	0	108.3	I154 A188 F284 F286 V368 Y400 A401 F403	I154-V156 HydrophobicContact CG2-CG2 4.11Å; V156-A188 CarbonylContact C-O 3.54Å; V156-A188 WeakPolarHBondContact CA-O 3.35Å; V156-A188 HydrophobicContact CG2-CB 4.41Å; V156-F284 HydrophobicContact CG2-CB 4.4Å; V156-F284 HydrophobicContact CG2-CD1 3.86Å; V156-F284 HydrophobicContact CG2-CE1 4.35Å; V156-F284 HydrophobicContact CG2-CG 4.08Å; V156-F286 HydrophobicContact CG1-CB 3.88Å; V156-F286 HydrophobicContact CG1-CD1 3.3Å; V156-F286 HydrophobicContact CG1-CD2 3.61Å; V156-F286 HydrophobicContact CG1-CE1 3.59Å; V156-F286 HydrophobicContact CG1-CE2 3.83Å; V156-F286 HydrophobicContact CG1-CG 3.31Å; V156-F286 HydrophobicContact CG1-CZ 3.82Å; V156-V368 HydrophobicContact CB-CG1 4.16Å; V156-V368 HydrophobicContact CG1-CG1 3.82Å; V156-V368 HydrophobicContact CG1-CG2 3.99Å; V156-Y400 CarbonylContact O-C 3.42Å; V156-Y400 WeakPolarHBondContact O-CA 3.39Å; V156-Y400 WeakPolarHBondContact O-CB 3.39Å; V156-A401 PolarHBondContact N-O 3.29Å; V156-A401 PolarHBondContact O-N 2.99Å; V156-F403 HydrophobicContact CB-CE2 4.29Å; V156-F403 HydrophobicContact CG2-CD2 4.13Å; V156-F403 HydrophobicContact CG2-CE2 3.93Å
157	S	98	Very high	91.6	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	137.2	177	-174.7	0	0	0	0	111.2	A188 I189 G190 V399	S157-A188 PolarHBondContact N-O 3.41Å; S157-I189 WeakPolarHBondContact O-CA 3.39Å; S157-G190 PolarHBondContact O-N 3.22Å; S157-V399 CarbonylContact C-O 3.45Å; S157-V399 WeakPolarHBondContact CA-O 3.48Å
158	T	98.1	Very high	92	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	142.7	173	-179.2	0	0	0	0	111.4	G190 Q192 G287 D366 P398 V399	T158-G190 CarbonylContact C-O 3.47Å; T158-G190 WeakPolarHBondContact CA-O 3.27Å; T158-Q192 PolarHBondContact OG1-NE2 2.7Å; T158-Q192 PolarHBondContact OG1-OE1 2.98Å; T158-G287 WeakPolarHBondContact OG1-CA 3.5Å; T158-D366 HydrophobicContact CG2-CB 4.12Å; T158-P398 WeakPolarHBondContact O-CA 3.47Å; T158-V399 HydrophobicContact CG2-CB 3.96Å; T158-V399 PolarHBondContact N-O 3.33Å; T158-V399 PolarHBondContact O-N 2.85Å
159	F	97.8	Very high	92.4	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	115.9	173	-175.5	-153.9	0	0	0	113.7	M161 I166 M174 G190 L191 Q192 V391 P398	F159-M161 HydrophobicContact CD1-CG 3.61Å; F159-M161 HydrophobicContact CD1-SD 4.36Å; F159-M161 HydrophobicContact CE1-CG 3.85Å; F159-M161 HydrophobicContact CG-CG 4.06Å; F159-M161 HydrophobicContact CZ-CG 4.46Å; F159-M161 PolarHBondContact O-N 3.28Å; F159-I166 HydrophobicContact CD1-CD1 4.36Å; F159-I166 HydrophobicContact CE1-CD1 4.04Å; F159-I166 HydrophobicContact CE1-CG2 3.93Å; F159-M174 HydrophobicContact CB-SD 3.96Å; F159-M174 HydrophobicContact CD1-SD 3.96Å; F159-M174 HydrophobicContact CG-SD 4.34Å; F159-G190 PolarHBondContact N-O 2.9Å; F159-L191 HydrophobicContact CB-CD2 4.16Å; F159-Q192 PolarHBondContact O-N 3.18Å; F159-Q192 PolarHBondContact O-OE1 3.38Å; F159-V391 HydrophobicContact CE1-CG1 3.78Å; F159-V391 HydrophobicContact CZ-CG1 3.65Å; F159-P398 HydrophobicContact CB-CB 4.06Å; F159-P398 HydrophobicContact CB-CG 4.28Å; F159-P398 HydrophobicContact CD1-CG 3.95Å; F159-P398 HydrophobicContact CD2-CB 4.11Å; F159-P398 HydrophobicContact CD2-CG 3.65Å; F159-P398 HydrophobicContact CE1-CG 4.12Å; F159-P398 HydrophobicContact CE2-CG 3.87Å; F159-P398 HydrophobicContact CG-CB 4.04Å; F159-P398 HydrophobicContact CG-CG 3.72Å; F159-P398 HydrophobicContact CZ-CG 4.11Å
160	N	96.8	Very high	92.8	Very high	3 Å²	3	31.9 Å²	31.9	2%	0.016	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	113	164.4	-170.4	-24.7	0	0	0	110.7	A162 Q192 D288 S394 H396	N160-A162 PolarHBondContact OD1-N 2.97Å; N160-Q192 WeakPolarHBondContact CA-O 3.35Å; N160-Q192 HydrophobicContact CB-CB 4.18Å; N160-Q192 VanDerWaalsContact N-OE1 3.1Å; N160-D288 HydrophobicContact CB-CB 4.24Å; N160-D288 PolarHBondContact ND2-OD2 3.35Å; N160-S394 WeakPolarHBondContact O-CB 3.43Å; N160-S394 PolarHBondContact O-OG 3.1Å; N160-H396 HydrophobicContact CB-CB 4.14Å; N160-H396 WeakPolarHBondContact O-CB 3.31Å
161	M	95.3	Very high	93.2	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.157	C	C	.	.			trans	-90.2	-7.9	-173.1	-62.9	-175.3	59.3	0	0	113.5	F159 G163 K164 I166 L191 Q192 A194 W206	F159-M161 HydrophobicContact CD1-CG 3.61Å; F159-M161 HydrophobicContact CD1-SD 4.36Å; F159-M161 HydrophobicContact CE1-CG 3.85Å; F159-M161 HydrophobicContact CG-CG 4.06Å; F159-M161 HydrophobicContact CZ-CG 4.46Å; F159-M161 PolarHBondContact O-N 3.28Å; M161-G163 PolarHBondContact O-N 2.65Å; M161-G163 VanDerWaalsContact O-N 3.13Å; M161-K164 WeakPolarHBondContact CE-O 3.46Å; M161-K164 WeakPolarHBondContact O-CA 3.15Å; M161-K164 VanDerWaalsContact O-CB 3.22Å; M161-K164 WeakPolarHBondContact O-CB 3.4Å; M161-K164 WeakPolarHBondContact O-CG 3.35Å; M161-K164 PolarHBondContact O-N 3.25Å; M161-I166 HydrophobicContact CE-CD1 4.3Å; M161-I166 HydrophobicContact CE-CG1 4.42Å; M161-I166 HydrophobicContact CE-CG2 3.66Å; M161-L191 HydrophobicContact SD-CB 4.25Å; M161-L191 HydrophobicContact SD-CD1 4.14Å; M161-L191 HydrophobicContact SD-CD2 4.18Å; M161-L191 HydrophobicContact SD-CG 4.44Å; M161-Q192 PolarHBondContact N-O 3.43Å; M161-A194 HydrophobicContact CB-CB 4.49Å; M161-A194 HydrophobicContact CE-CB 4.33Å; M161-A194 HydrophobicContact CG-CB 4.29Å; M161-A194 HydrophobicContact SD-CB 3.32Å; M161-A194 WeakPolarHBondContact SD-CB 3.47Å; M161-W206 HydrophobicContact CE-CD2 4.47Å; M161-W206 HydrophobicContact CE-CH2 3.22Å; M161-W206 HydrophobicContact CE-CZ2 3.08Å; M161-W206 HydrophobicContact CE-CZ3 3.93Å; M161-W206 HydrophobicContact SD-CH2 4.33Å; M161-W206 HydrophobicContact SD-CZ2 4.12Å
162	A	92.6	Very high	93.4	Very high	24 Å²	24	32.1 Å²	32.1	20%	0.198	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.8	35.7	179	0	0	0	0	0	114.6	N160 K164 F350 D395	N160-A162 PolarHBondContact OD1-N 2.97Å; A162-K164 PolarHBondContact O-N 2.95Å; A162-F350 HydrophobicContact CB-CE1 4.23Å; A162-F350 HydrophobicContact CB-CZ 4.41Å; A162-D395 WeakPolarHBondContact CB-OD1 3.47Å
163	G	90.5	Very high	93.5	Very high	33 Å²	33	35.7 Å²	35.7	34%	0.34	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.2	14.3	-176.6	0	0	0	0	0	114.3	M161 E193	M161-G163 PolarHBondContact O-N 2.65Å; M161-G163 VanDerWaalsContact O-N 3.13Å; G163-E193 WeakPolarHBondContact CA-O 3.37Å; G163-E193 PolarHBondContact N-O 3.37Å
164	K	89.1	Confident	93.6	Very high	90 Å²	90	35 Å²	35	39%	0.391	18%	0.182	S	C	.	.			trans	-98	139.3	-179	-56.5	-61.8	-176.8	-177.8	0	111.1	M161 A162 F350 S393	M161-K164 WeakPolarHBondContact CE-O 3.46Å; M161-K164 WeakPolarHBondContact O-CA 3.15Å; M161-K164 VanDerWaalsContact O-CB 3.22Å; M161-K164 WeakPolarHBondContact O-CB 3.4Å; M161-K164 WeakPolarHBondContact O-CG 3.35Å; M161-K164 PolarHBondContact O-N 3.25Å; A162-K164 PolarHBondContact O-N 2.95Å; K164-F350 HydrophobicContact CD-CE1 4.34Å; K164-F350 HydrophobicContact CG-CD1 4.21Å; K164-F350 HydrophobicContact CG-CE1 3.83Å; K164-S393 WeakPolarHBondContact CB-O 3.16Å; K164-S393 WeakPolarHBondContact CG-O 3.46Å
165	D	88.6	Confident	93.5	Very high	87 Å²	87	34.4 Å²	34.4	47%	0.465	18%	0.179	S	C	.	.			trans	-75.9	152.9	165.2	-164.7	10.4	0	0	0	110.2	W206 R209	D165-W206 VanDerWaalsContact OD1-CH2 3.31Å; D165-W206 WeakPolarHBondContact OD1-CH2 3.29Å; D165-W206 WeakPolarHBondContact OD1-CZ2 3.3Å; D165-R209 IonicContact OD1-CZ 2.9Å; D165-R209 IonicContact OD1-NH1 3.82Å; D165-R209 PolarHBondContact OD1-NH1 3.35Å; D165-R209 IonicContact OD2-NH1 2.97Å
166	I	88	Confident	93.4	Very high	5 Å²	5	36.9 Å²	36.9	3%	0.026	19%	0.19	C	C	.	.			trans	-123.8	155.9	179.1	79.7	-171.1	0	0	0	110.1	F159 M161 H170 I171 W206 R209 S393	F159-I166 HydrophobicContact CD1-CD1 4.36Å; F159-I166 HydrophobicContact CE1-CD1 4.04Å; F159-I166 HydrophobicContact CE1-CG2 3.93Å; M161-I166 HydrophobicContact CE-CD1 4.3Å; M161-I166 HydrophobicContact CE-CG1 4.42Å; M161-I166 HydrophobicContact CE-CG2 3.66Å; I166-H170 HydrophobicContact CB-CB 4.39Å; I166-H170 HydrophobicContact CG1-CB 4.5Å; I166-I171 HydrophobicContact CD1-CG1 3.74Å; I166-I171 HydrophobicContact CG1-CD1 4.41Å; I166-I171 HydrophobicContact CG1-CG1 3.74Å; I166-W206 HydrophobicContact CD1-CH2 4.31Å; I166-W206 HydrophobicContact CD1-CZ3 4.14Å; I166-W206 HydrophobicContact CG1-CH2 3.77Å; I166-W206 HydrophobicContact CG1-CZ3 3.93Å; I166-R209 PolarHBondContact O-NH1 3.06Å; I166-R209 PolarHBondContact O-NH2 2.9Å; I166-S393 WeakPolarHBondContact CG2-OG 3.17Å
167	L	88.2	Confident	93.1	Very high	102 Å²	102	37.1 Å²	37.1	53%	0.534	19%	0.192	S	C	.	.			trans	-80.2	154.5	-179.9	-60.7	173.9	0	0	0	110.7	H169 H170 I171	L167-H169 VanDerWaalsContact C-N 3.25Å; L167-H169 VanDerWaalsContact CB-CE1 3.5Å; L167-H169 WeakPolarHBondContact CB-CE1 3.12Å; L167-H169 WeakPolarHBondContact CD1-CE1 3.48Å; L167-H169 PolarHBondContact O-N 2.83Å; L167-H170 WeakPolarHBondContact O-CB 3.4Å; L167-H170 PolarHBondContact O-N 3.33Å; L167-I171 PolarHBondContact O-N 2.8Å
168	D	89.2	Confident	92.5	Very high	50 Å²	50	46 Å²	46	27%	0.267	23%	0.233	S	C	.	.	H	α-helix	trans	-59.4	-34.7	-177.7	-69.7	-11.3	0	0	0	113	K106 Y107 H170 I171 Q172 R209	K106-D168 IonicContact NZ-OD2 2.65Å; K106-D168 PolarHBondContact NZ-OD2 3.49Å; Y107-D168 PolarHBondContact OH-OD1 2.93Å; Y107-D168 PolarHBondContact OH-OD2 3.13Å; D168-H170 VanDerWaalsContact C-N 3.33Å; D168-I171 WeakPolarHBondContact O-CB 3.15Å; D168-I171 PolarHBondContact O-N 2.94Å; D168-Q172 PolarHBondContact O-N 3.27Å; D168-Q172 VanDerWaalsContact O-N 3.11Å; D168-R209 IonicContact OD1-CZ 3.71Å; D168-R209 IonicContact OD1-NE 3.81Å; D168-R209 PolarHBondContact OD1-NE 3.09Å; D168-R209 IonicContact OD1-NH2 2.76Å; D168-R209 PolarHBondContact OD1-NH2 3.3Å
169	H	89.6	Confident	92	Very high	99 Å²	99	51.5 Å²	51.5	46%	0.458	26%	0.259	S	S	.	.	H	α-helix	trans	-68.6	-32.1	175.3	64.7	-95.2	0	0	0	112	L167 I171 Q172 E173	L167-H169 VanDerWaalsContact C-N 3.25Å; L167-H169 VanDerWaalsContact CB-CE1 3.5Å; L167-H169 WeakPolarHBondContact CB-CE1 3.12Å; L167-H169 WeakPolarHBondContact CD1-CE1 3.48Å; L167-H169 PolarHBondContact O-N 2.83Å; H169-I171 VanDerWaalsContact C-N 3.32Å; H169-I171 PolarHBondContact O-N 3Å; H169-Q172 WeakPolarHBondContact O-CB 3.11Å; H169-Q172 PolarHBondContact O-N 3.13Å; H169-Q172 VanDerWaalsContact O-N 3.14Å; H169-E173 WeakPolarHBondContact O-CG 3.26Å; H169-E173 PolarHBondContact O-N 2.52Å
170	H	93.1	Very high	91.5	Very high	31 Å²	31	52.8 Å²	52.8	14%	0.144	27%	0.267	C	S	.	.	H	α-helix	trans	-67.6	-32.6	172.7	-67.1	160.7	0	0	0	112.2	I166 L167 D168 Q172 E173 M174 V391	I166-H170 HydrophobicContact CB-CB 4.39Å; I166-H170 HydrophobicContact CG1-CB 4.5Å; L167-H170 WeakPolarHBondContact O-CB 3.4Å; L167-H170 PolarHBondContact O-N 3.33Å; D168-H170 VanDerWaalsContact C-N 3.33Å; H170-Q172 VanDerWaalsContact C-N 3.28Å; H170-E173 PolarHBondContact O-N 2.94Å; H170-M174 WeakPolarHBondContact O-CB 3.44Å; H170-M174 PolarHBondContact O-N 2.94Å; H170-V391 HydrophobicContact CB-CG1 4.21Å; H170-V391 HydrophobicContact CB-CG2 3.94Å; H170-V391 WeakPolarHBondContact O-CG2 3.49Å
171	I	93.9	Very high	91.1	Very high	3 Å²	3	60.9 Å²	60.9	2%	0.015	30%	0.304	C	S	.	.	H	α-helix	trans	-62	-42.8	170.5	-58.2	174.4	0	0	0	109.4	I166 L167 D168 H169 M174 L175 W206 R209 L210 C213	I166-I171 HydrophobicContact CD1-CG1 3.74Å; I166-I171 HydrophobicContact CG1-CD1 4.41Å; I166-I171 HydrophobicContact CG1-CG1 3.74Å; L167-I171 PolarHBondContact O-N 2.8Å; D168-I171 WeakPolarHBondContact O-CB 3.15Å; D168-I171 PolarHBondContact O-N 2.94Å; H169-I171 VanDerWaalsContact C-N 3.32Å; H169-I171 PolarHBondContact O-N 3Å; I171-M174 PolarHBondContact O-N 3.18Å; I171-L175 HydrophobicContact CG2-CD1 3.61Å; I171-L175 HydrophobicContact CG2-CG 4.22Å; I171-L175 WeakPolarHBondContact O-CB 3.46Å; I171-L175 VanDerWaalsContact O-CG 3.28Å; I171-L175 WeakPolarHBondContact O-CG 3.47Å; I171-L175 PolarHBondContact O-N 3.05Å; I171-W206 HydrophobicContact CD1-CZ3 4.02Å; I171-W206 HydrophobicContact CG1-CZ3 4.46Å; I171-R209 HydrophobicContact CD1-CB 3.86Å; I171-L210 HydrophobicContact CG2-CD2 4.1Å; I171-C213 HydrophobicContact CG2-CB 3.91Å
172	Q	93.4	Very high	90.9	Very high	112 Å²	112	67.5 Å²	67.5	52%	0.523	34%	0.335	S	S	.	.	H	α-helix	trans	-63.4	-45.8	178.1	-167.4	177.8	-13.8	0	0	112.1	D168 H169 H170 M174 L175 F176	D168-Q172 PolarHBondContact O-N 3.27Å; D168-Q172 VanDerWaalsContact O-N 3.11Å; H169-Q172 WeakPolarHBondContact O-CB 3.11Å; H169-Q172 PolarHBondContact O-N 3.13Å; H169-Q172 VanDerWaalsContact O-N 3.14Å; H170-Q172 VanDerWaalsContact C-N 3.28Å; Q172-M174 VanDerWaalsContact C-N 3.27Å; Q172-M174 PolarHBondContact O-N 2.9Å; Q172-L175 PolarHBondContact O-N 2.97Å; Q172-F176 HydrophobicContact CG-CD2 3.78Å; Q172-F176 HydrophobicContact CG-CE2 4.48Å; Q172-F176 WeakPolarHBondContact O-CA 3.5Å; Q172-F176 WeakPolarHBondContact O-CB 3.3Å; Q172-F176 PolarHBondContact O-N 3.27Å
173	E	93.6	Very high	91	Very high	79 Å²	79	68.9 Å²	68.9	37%	0.369	34%	0.341	S	S	.	.	H	α-helix	trans	-58	-39.8	174.4	-66.4	-62.9	154.6	0	0	112.2	H169 H170 V388 A390 V391	H169-E173 WeakPolarHBondContact O-CG 3.26Å; H169-E173 PolarHBondContact O-N 2.52Å; H170-E173 PolarHBondContact O-N 2.94Å; E173-V388 HydrophobicContact CB-CG1 4.12Å; E173-A390 HydrophobicContact CB-CB 4.35Å; E173-A390 HydrophobicContact CG-CB 4.11Å; E173-V391 HydrophobicContact CB-CG2 4.26Å
174	M	95.3	Very high	91.2	Very high	2 Å²	2	67.3 Å²	67.3	1%	0.01	33%	0.325	C	S	.	.	H	α-helix	trans	-68.5	-38.1	179.2	-175.5	-176.3	77.1	0	0	112.8	F155 F159 H170 I171 Q172 I189 L191 L210 P398	F155-M174 WeakPolarHBondContact CE1-O 3.42Å; F155-M174 WeakPolarHBondContact CZ-O 3.21Å; F159-M174 HydrophobicContact CB-SD 3.96Å; F159-M174 HydrophobicContact CD1-SD 3.96Å; F159-M174 HydrophobicContact CG-SD 4.34Å; H170-M174 WeakPolarHBondContact O-CB 3.44Å; H170-M174 PolarHBondContact O-N 2.94Å; I171-M174 PolarHBondContact O-N 3.18Å; Q172-M174 VanDerWaalsContact C-N 3.27Å; Q172-M174 PolarHBondContact O-N 2.9Å; M174-I189 HydrophobicContact CE-CG2 4.2Å; M174-L191 HydrophobicContact CE-CD2 4.35Å; M174-L210 HydrophobicContact CE-CD2 4.2Å; M174-P398 HydrophobicContact CG-CB 3.87Å; M174-P398 HydrophobicContact CG-CG 4.25Å; M174-P398 HydrophobicContact SD-CB 4.2Å; M174-P398 HydrophobicContact SD-CG 4.36Å
175	L	96	Very high	91.4	Very high	1 Å²	1	63.3 Å²	63.3	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-92.7	-20.6	-175.2	-62.2	178.2	0	0	0	113.6	I171 Q172 Y187 I189 L210 C213 L214	I171-L175 HydrophobicContact CG2-CD1 3.61Å; I171-L175 HydrophobicContact CG2-CG 4.22Å; I171-L175 WeakPolarHBondContact O-CB 3.46Å; I171-L175 VanDerWaalsContact O-CG 3.28Å; I171-L175 WeakPolarHBondContact O-CG 3.47Å; I171-L175 PolarHBondContact O-N 3.05Å; Q172-L175 PolarHBondContact O-N 2.97Å; L175-Y187 HydrophobicContact CD2-CD1 4.49Å; L175-Y187 WeakPolarHBondContact O-CE1 3.46Å; L175-I189 HydrophobicContact CD2-CD1 3.34Å; L175-I189 HydrophobicContact CD2-CG1 3.95Å; L175-L210 HydrophobicContact CD1-CD2 4Å; L175-L210 HydrophobicContact CD2-CD2 4.46Å; L175-C213 HydrophobicContact CD1-CB 3.94Å; L175-L214 HydrophobicContact CB-CD2 4.31Å; L175-L214 HydrophobicContact CD1-CD1 4.36Å; L175-L214 HydrophobicContact CD1-CD2 3.87Å; L175-L214 HydrophobicContact CD1-CG 3.83Å; L175-L214 HydrophobicContact CG-CD2 4.49Å
176	F	95.3	Very high	91.8	Very high	53 Å²	53	59.6 Å²	59.6	23%	0.232	29%	0.288	C	S	.	.	S	Bend	trans	-135.2	67.3	-179.1	-51.4	-73.6	0	0	0	111.2	Q172 T183 L214 C217	Q172-F176 HydrophobicContact CG-CD2 3.78Å; Q172-F176 HydrophobicContact CG-CE2 4.48Å; Q172-F176 WeakPolarHBondContact O-CA 3.5Å; Q172-F176 WeakPolarHBondContact O-CB 3.3Å; Q172-F176 PolarHBondContact O-N 3.27Å; F176-T183 HydrophobicContact CD1-CG2 4.05Å; F176-T183 HydrophobicContact CE1-CG2 3.79Å; F176-L214 HydrophobicContact CE1-CD2 4.48Å; F176-L214 HydrophobicContact CZ-CD2 3.94Å; F176-C217 HydrophobicContact CE1-CB 4.47Å
177	P	91.9	Very high	92.2	Very high	6 Å²	6	59.4 Å²	59.4	4%	0.039	29%	0.287	C	S	.	.			trans	-58.3	140.6	177.1	-21.1	32.9	0	0	0	111.6	F155 H179 V180 Y400	F155-P177 HydrophobicContact CE2-CG 4.13Å; F155-P177 HydrophobicContact CZ-CG 3.95Å; P177-H179 PolarHBondContact O-N 2.87Å; P177-V180 HydrophobicContact CB-CG2 4.15Å; P177-V180 HydrophobicContact CG-CG2 4.26Å; P177-V180 WeakPolarHBondContact O-CB 3.38Å; P177-V180 PolarHBondContact O-N 3.07Å; P177-Y400 HydrophobicContact CB-CD1 4.49Å; P177-Y400 HydrophobicContact CB-CE1 3.75Å; P177-Y400 HydrophobicContact CG-CD1 3.73Å; P177-Y400 HydrophobicContact CG-CD2 4.22Å; P177-Y400 HydrophobicContact CG-CE1 3.45Å; P177-Y400 VanDerWaalsContact CG-CE1 3.45Å; P177-Y400 HydrophobicContact CG-CE2 3.99Å; P177-Y400 HydrophobicContact CG-CG 4.1Å
178	E	86.4	Confident	92.7	Very high	185 Å²	185	55.1 Å²	55.1	86%	0.864	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-30.7	-171.9	-172.6	177.3	-168.7	0	0	114.4
179	H	86.6	Confident	93.1	Very high	116 Å²	116	52.7 Å²	52.7	54%	0.537	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-8.7	-177.1	19.6	-70.2	0	0	0	113.1	P177 Y400	P177-H179 PolarHBondContact O-N 2.87Å; H179-Y400 PolarHBondContact CD2-OH 3.38Å; H179-Y400 PolarHBondContact NE2-OH 2.06Å
180	V	88.8	Confident	93.5	Very high	28 Å²	28	48.2 Å²	48.2	17%	0.17	23%	0.234	C	C	.	.			trans	-88.3	107.5	174.2	176.8	0	0	0	0	108.9	P177 H182 Y400 F402	P177-V180 HydrophobicContact CB-CG2 4.15Å; P177-V180 HydrophobicContact CG-CG2 4.26Å; P177-V180 WeakPolarHBondContact O-CB 3.38Å; P177-V180 PolarHBondContact O-N 3.07Å; V180-H182 VanDerWaalsContact CG1-O 3.26Å; V180-H182 WeakPolarHBondContact CG1-O 3.43Å; V180-Y400 HydrophobicContact CG2-CE2 3.8Å; V180-F402 HydrophobicContact CG1-CD2 3.5Å; V180-F402 VanDerWaalsContact CG1-CD2 3.5Å; V180-F402 HydrophobicContact CG1-CE2 3.59Å; V180-F402 HydrophobicContact CG1-CG 4.47Å; V180-F402 HydrophobicContact CG2-CD2 4.4Å
181	Q	87.9	Confident	93.6	Very high	172 Å²	172	46.9 Å²	46.9	80%	0.804	23%	0.227	S	C	*	.			trans	-72.9	-29.4	-171.5	-65.2	-176.4	-8.5	0	0	114.4
182	H	91.1	Very high	93.6	Very high	139 Å²	139	47.6 Å²	47.6	64%	0.644	23%	0.231	S	C	*	.	S	Bend	trans	-130.6	144.1	-175.1	-56.4	101.4	0	0	0	110.1	V180 F402	V180-H182 VanDerWaalsContact CG1-O 3.26Å; V180-H182 WeakPolarHBondContact CG1-O 3.43Å; H182-F402 WeakPolarHBondContact O-CE2 3.38Å
183	T	94.3	Very high	93.5	Very high	53 Å²	53	46.2 Å²	46.2	33%	0.325	23%	0.225	S	C	.	.			trans	-69.2	147.2	174	58.6	0	0	0	0	110.7	F176 Y187 C217	F176-T183 HydrophobicContact CD1-CG2 4.05Å; F176-T183 HydrophobicContact CE1-CG2 3.79Å; T183-Y187 WeakPolarHBondContact CA-OH 3.4Å; T183-Y187 WeakPolarHBondContact CB-OH 3.43Å; T183-C217 HydrophobicContact CG2-CB 3.73Å
184	A	95	Very high	93.3	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.209	C	C	.	.			trans	-72.4	164.5	177.5	0	0	0	0	0	112.9	S153 F155 I186 Y187 Q219 R237 F402	S153-A184 VanDerWaalsContact OG-CA 3.29Å; S153-A184 WeakPolarHBondContact OG-CA 3.41Å; F155-A184 HydrophobicContact CB-CB 3.59Å; A184-I186 VanDerWaalsContact CB-O 3.3Å; A184-I186 WeakPolarHBondContact CB-O 3.45Å; A184-Y187 HydrophobicContact CB-CD2 4.16Å; A184-Y187 HydrophobicContact CB-CE2 3.73Å; A184-Y187 PolarHBondContact N-OH 3.1Å; A184-Q219 PolarHBondContact O-NE2 3.32Å; A184-R237 PolarHBondContact O-NH2 2.85Å; A184-F402 HydrophobicContact CB-CE2 3.95Å; A184-F402 HydrophobicContact CB-CZ 4.3Å
185	D	93.7	Very high	92.8	Very high	7 Å²	7	42.7 Å²	42.7	4%	0.037	21%	0.209	C	C	.	.	S	Bend	trans	-78.2	-41.1	168	-61.6	-62.3	0	0	0	110.3	L152 S153 Q219 I236 R237 L240	L152-D185 HydrophobicContact CD1-CB 3.39Å; L152-D185 HydrophobicContact CG-CB 4.06Å; S153-D185 WeakPolarHBondContact CB-OD2 3.38Å; S153-D185 PolarHBondContact N-OD2 3.33Å; S153-D185 WeakPolarHBondContact O-CA 3.35Å; S153-D185 WeakPolarHBondContact O-CB 3.45Å; S153-D185 PolarHBondContact O-N 3.43Å; S153-D185 VanDerWaalsContact OG-CG 3.26Å; S153-D185 PolarHBondContact OG-N 2.93Å; S153-D185 PolarHBondContact OG-OD2 3.42Å; D185-Q219 PolarHBondContact O-NE2 3.35Å; D185-Q219 PolarHBondContact O-OE1 2.91Å; D185-I236 CarbonylContact O-C 3.54Å; D185-I236 WeakPolarHBondContact O-CA 2.97Å; D185-R237 PolarHBondContact O-N 2.84Å; D185-R237 IonicContact OD1-CZ 3.52Å; D185-R237 IonicContact OD1-NE 3.83Å; D185-R237 IonicContact OD1-NH1 3Å; D185-R237 PolarHBondContact OD1-NH1 3.3Å; D185-R237 IonicContact OD1-NH2 3.96Å; D185-R237 PolarHBondContact OD1-NH2 3.42Å; D185-L240 HydrophobicContact CB-CD1 3.76Å
186	I	95.9	Very high	92.1	Very high	8 Å²	8	46.7 Å²	46.7	4%	0.041	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	138	176.9	-67.3	-174.8	0	0	0	110.6	L66 L152 S153 I154 F155 A184 L234 F235 I236	L66-I186 HydrophobicContact CD2-CD1 3.56Å; L152-I186 HydrophobicContact CD2-CD1 3.52Å; L152-I186 HydrophobicContact CD2-CG1 4.13Å; L152-I186 HydrophobicContact CG-CD1 4.42Å; S153-I186 PolarHBondContact O-N 2.94Å; I154-I186 HydrophobicContact CG1-CB 4.37Å; I154-I186 HydrophobicContact CG2-CB 4.34Å; I154-I186 HydrophobicContact CG2-CG2 4.2Å; F155-I186 PolarHBondContact N-O 2.82Å; A184-I186 VanDerWaalsContact CB-O 3.3Å; A184-I186 WeakPolarHBondContact CB-O 3.45Å; I186-L234 HydrophobicContact CG2-CD1 3.52Å; I186-F235 CarbonylContact C-O 3.52Å; I186-F235 WeakPolarHBondContact CA-O 3.31Å; I186-I236 HydrophobicContact CD1-CD1 4.28Å; I186-I236 HydrophobicContact CG1-CB 4.41Å; I186-I236 HydrophobicContact CG1-CD1 4.19Å; I186-I236 HydrophobicContact CG1-CG1 3.9Å
187	Y	98.1	Very high	91.6	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.008	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	117	168	-73.3	-103.1	0	0	0	109.9	F155 L175 T183 A184 I189 L214 Q219 L234 F235	F155-Y187 HydrophobicContact CB-CD1 3.67Å; F155-Y187 HydrophobicContact CB-CE1 3.75Å; F155-Y187 HydrophobicContact CB-CG 4.16Å; F155-Y187 AromaticContact CD1-CD1 3.48Å; F155-Y187 HydrophobicContact CD1-CD1 3.48Å; F155-Y187 VanDerWaalsContact CD1-CD1 3.48Å; F155-Y187 AromaticContact CD1-CE1 3.66Å; F155-Y187 HydrophobicContact CD1-CE1 3.66Å; F155-Y187 HydrophobicContact CD2-CE1 4.48Å; F155-Y187 HydrophobicContact CE1-CD1 4.35Å; F155-Y187 HydrophobicContact CE1-CE1 4.33Å; F155-Y187 AromaticContact CG-CD1 3.82Å; F155-Y187 HydrophobicContact CG-CD1 3.82Å; F155-Y187 AromaticContact CG-CE1 3.73Å; F155-Y187 HydrophobicContact CG-CE1 3.73Å; F155-Y187 CarbonylContact O-C 3.57Å; F155-Y187 WeakPolarHBondContact O-CA 3.29Å; L175-Y187 HydrophobicContact CD2-CD1 4.49Å; L175-Y187 WeakPolarHBondContact O-CE1 3.46Å; T183-Y187 WeakPolarHBondContact CA-OH 3.4Å; T183-Y187 WeakPolarHBondContact CB-OH 3.43Å; A184-Y187 HydrophobicContact CB-CD2 4.16Å; A184-Y187 HydrophobicContact CB-CE2 3.73Å; A184-Y187 PolarHBondContact N-OH 3.1Å; Y187-I189 HydrophobicContact CD1-CD1 4.33Å; Y187-L214 HydrophobicContact CD1-CD2 3.75Å; Y187-L214 HydrophobicContact CD2-CD2 4.09Å; Y187-L214 HydrophobicContact CE1-CD2 3.86Å; Y187-L214 HydrophobicContact CE2-CD2 4.17Å; Y187-L214 HydrophobicContact CG-CD1 4.4Å; Y187-L214 HydrophobicContact CG-CD2 3.88Å; Y187-Q219 HydrophobicContact CD2-CG 3.94Å; Y187-Q219 HydrophobicContact CE2-CG 4.03Å; Y187-L234 WeakPolarHBondContact O-CA 3.42Å; Y187-F235 PolarHBondContact N-O 2.76Å; Y187-F235 PolarHBondContact O-N 2.69Å
188	A	97.8	Very high	91.1	Very high	11 Å²	11	52 Å²	52	9%	0.091	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	107.9	172	0	0	0	0	0	109.2	F155 V156 S157 L234 F286	F155-A188 PolarHBondContact O-N 3.21Å; V156-A188 CarbonylContact C-O 3.54Å; V156-A188 WeakPolarHBondContact CA-O 3.35Å; V156-A188 HydrophobicContact CG2-CB 4.41Å; S157-A188 PolarHBondContact N-O 3.41Å; A188-L234 HydrophobicContact CB-CD1 4.12Å; A188-F286 HydrophobicContact CB-CE1 4.32Å; A188-F286 HydrophobicContact CB-CZ 3.87Å
189	I	98	Very high	91	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	118.3	-171.5	-49.1	-57.9	0	0	0	110	F155 S157 M174 L175 Y187 L191 L210 L232 S233	F155-I189 HydrophobicContact CD1-CD1 4.28Å; S157-I189 WeakPolarHBondContact O-CA 3.39Å; M174-I189 HydrophobicContact CE-CG2 4.2Å; L175-I189 HydrophobicContact CD2-CD1 3.34Å; L175-I189 HydrophobicContact CD2-CG1 3.95Å; Y187-I189 HydrophobicContact CD1-CD1 4.33Å; I189-L191 HydrophobicContact CG2-CD2 3.99Å; I189-L191 HydrophobicContact CG2-CG 4.26Å; I189-L210 HydrophobicContact CB-CD1 4.48Å; I189-L210 HydrophobicContact CG2-CD1 4.14Å; I189-L210 HydrophobicContact CG2-CD2 4.15Å; I189-L232 WeakPolarHBondContact O-CA 3.35Å; I189-S233 PolarHBondContact N-O 3.27Å; I189-S233 PolarHBondContact O-N 3.39Å; I189-S233 PolarHBondContact O-OG 3.31Å
190	G	96.6	Very high	90.8	Very high	5 Å²	5	41.3 Å²	41.3	5%	0.052	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	117.1	-179.4	0	0	0	0	0	110.5	S157 T158 F159 H231	S157-G190 PolarHBondContact O-N 3.22Å; T158-G190 CarbonylContact C-O 3.47Å; T158-G190 WeakPolarHBondContact CA-O 3.27Å; F159-G190 PolarHBondContact N-O 2.9Å; G190-H231 CarbonylContact C-O 3.59Å; G190-H231 VanDerWaalsContact CA-O 3.29Å; G190-H231 WeakPolarHBondContact CA-O 3.43Å
191	L	95.8	Very high	90.7	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.01	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	136.5	177.7	-51.6	176.6	0	0	0	109.7	F159 M161 M174 I189 A194 W206 L210 Q230 H231	F159-L191 HydrophobicContact CB-CD2 4.16Å; M161-L191 HydrophobicContact SD-CB 4.25Å; M161-L191 HydrophobicContact SD-CD1 4.14Å; M161-L191 HydrophobicContact SD-CD2 4.18Å; M161-L191 HydrophobicContact SD-CG 4.44Å; M174-L191 HydrophobicContact CE-CD2 4.35Å; I189-L191 HydrophobicContact CG2-CD2 3.99Å; I189-L191 HydrophobicContact CG2-CG 4.26Å; L191-A194 HydrophobicContact CB-CB 3.81Å; L191-A194 HydrophobicContact CD1-CB 4.26Å; L191-W206 HydrophobicContact CD1-CB 4.23Å; L191-W206 HydrophobicContact CD1-CD2 4.16Å; L191-W206 HydrophobicContact CD1-CE3 4.19Å; L191-W206 HydrophobicContact CD1-CG 4.16Å; L191-L210 HydrophobicContact CD1-CD1 4.27Å; L191-Q230 CarbonylContact O-C 3.52Å; L191-Q230 WeakPolarHBondContact O-CA 3.46Å; L191-H231 HydrophobicContact CB-CB 4.3Å; L191-H231 PolarHBondContact N-O 3.05Å; L191-H231 PolarHBondContact O-N 3.31Å
192	Q	94.3	Very high	90.6	Very high	18 Å²	18	37.4 Å²	37.4	8%	0.084	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	141	173.3	-54	81.5	5	0	0	109.5	T158 F159 N160 M161 A194 V229 Q230 D288	T158-Q192 PolarHBondContact OG1-NE2 2.7Å; T158-Q192 PolarHBondContact OG1-OE1 2.98Å; F159-Q192 PolarHBondContact O-N 3.18Å; F159-Q192 PolarHBondContact O-OE1 3.38Å; N160-Q192 WeakPolarHBondContact CA-O 3.35Å; N160-Q192 HydrophobicContact CB-CB 4.18Å; N160-Q192 VanDerWaalsContact N-OE1 3.1Å; M161-Q192 PolarHBondContact N-O 3.43Å; Q192-A194 PolarHBondContact O-N 2.98Å; Q192-A194 VanDerWaalsContact O-N 3.09Å; Q192-V229 CarbonylContact C-O 3.58Å; Q192-Q230 HydrophobicContact CG-CG 4.33Å; Q192-D288 HydrophobicContact CG-CB 4.41Å
193	E	92	Very high	90.4	Very high	84 Å²	84	30.8 Å²	30.8	39%	0.393	17%	0.174	S	C	.	.	S	Bend	trans	56.9	26.6	-179.8	-53.7	-173	-155.3	0	0	113.3	G163 V229	G163-E193 WeakPolarHBondContact CA-O 3.37Å; G163-E193 PolarHBondContact N-O 3.37Å; E193-V229 HydrophobicContact CG-CB 4.3Å; E193-V229 HydrophobicContact CG-CG2 4.15Å; E193-V229 PolarHBondContact N-O 2.88Å
194	A	88.8	Confident	90.2	Very high	6 Å²	6	35.5 Å²	35.5	5%	0.05	19%	0.186	C	C	.	.	S	Bend	trans	-77.3	-26.6	178.7	0	0	0	0	0	113.3	M161 L191 Q192 W206	M161-A194 HydrophobicContact CB-CB 4.49Å; M161-A194 HydrophobicContact CE-CB 4.33Å; M161-A194 HydrophobicContact CG-CB 4.29Å; M161-A194 HydrophobicContact SD-CB 3.32Å; M161-A194 WeakPolarHBondContact SD-CB 3.47Å; L191-A194 HydrophobicContact CB-CB 3.81Å; L191-A194 HydrophobicContact CD1-CB 4.26Å; Q192-A194 PolarHBondContact O-N 2.98Å; Q192-A194 VanDerWaalsContact O-N 3.09Å; A194-W206 HydrophobicContact CB-CG 4.47Å; A194-W206 PolarHBondContact O-NE1 2.91Å
195	A	85.3	Confident	89.9	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.194	C	C	.	.			trans	-123.3	90.9	-177.7	0	0	0	0	0	108.2	E197 C198 E202 F203	A195-E197 PolarHBondContact O-N 3.13Å; A195-C198 WeakPolarHBondContact O-CA 3.36Å; A195-C198 PolarHBondContact O-N 3.36Å; A195-E202 WeakPolarHBondContact CA-OE2 3.29Å; A195-E202 HydrophobicContact CB-CB 3.67Å; A195-E202 WeakPolarHBondContact CB-OE2 3.32Å; A195-F203 HydrophobicContact CB-CD1 3.87Å; A195-F203 HydrophobicContact CB-CD2 4.21Å; A195-F203 HydrophobicContact CB-CE1 3.5Å; A195-F203 HydrophobicContact CB-CE2 3.88Å; A195-F203 HydrophobicContact CB-CG 4.21Å; A195-F203 HydrophobicContact CB-CZ 3.53Å
196	P	80.7	Confident	89.7	Confident	85 Å²	85	37.1 Å²	37.1	55%	0.552	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-24.5	-174.5	25.7	-33.9	0	0	0	113
197	E	84.6	Confident	89.5	Confident	120 Å²	120	38.2 Å²	38.2	56%	0.561	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-0.5	173.5	-54.9	-171.5	165.3	0	0	112.6	A195 S199 E202	A195-E197 PolarHBondContact O-N 3.13Å; E197-S199 PolarHBondContact O-N 3.43Å; E197-S199 VanDerWaalsContact O-N 3.07Å; E197-E202 WeakPolarHBondContact CA-OE2 3.33Å; E197-E202 WeakPolarHBondContact CB-OE2 3.35Å; E197-E202 PolarHBondContact N-OE2 2.86Å
198	C	81.7	Confident	89.2	Confident	51 Å²	51	43 Å²	43	35%	0.345	22%	0.22	S	C	.	.			trans	50.2	31.1	-177.3	-55.4	0	0	0	0	112.8	A195 E202 G228 V229	A195-C198 WeakPolarHBondContact O-CA 3.36Å; A195-C198 PolarHBondContact O-N 3.36Å; C198-E202 PolarHBondContact N-OE2 3.11Å; C198-G228 WeakPolarHBondContact CB-O 3.39Å; C198-G228 VanDerWaalsContact SG-C 3.59Å; C198-G228 PolarHBondContact SG-O 3.14Å; C198-G228 VanDerWaalsContact SG-O 3.35Å; C198-V229 WeakPolarHBondContact SG-CG1 3.49Å
199	S	83.1	Confident	89	Confident	34 Å²	34	43.3 Å²	43.3	24%	0.238	22%	0.219	C	C	.	.			trans	-89.6	144.1	-173.4	81.3	0	0	0	0	111.2	E197 K201 E202 F203	E197-S199 PolarHBondContact O-N 3.43Å; E197-S199 VanDerWaalsContact O-N 3.07Å; S199-K201 PolarHBondContact O-N 3.08Å; S199-K201 VanDerWaalsContact O-N 3.1Å; S199-E202 PolarHBondContact O-N 2.68Å; S199-E202 WeakPolarHBondContact OG-CG 3.34Å; S199-E202 PolarHBondContact OG-N 2.89Å; S199-F203 VanDerWaalsContact O-CD2 3.29Å; S199-F203 WeakPolarHBondContact O-CD2 3.41Å; S199-F203 PolarHBondContact O-N 3.47Å; S199-F203 VanDerWaalsContact O-N 3.13Å
200	A	83.2	Confident	88.8	Confident	43 Å²	43	43.3 Å²	43.3	36%	0.355	22%	0.219	S	C	.	.	H	α-helix	trans	-57.6	-26.8	173.8	0	0	0	0	0	112.4	R204 W226	A200-R204 WeakPolarHBondContact O-CB 3.12Å; A200-R204 VanDerWaalsContact O-CG 3.23Å; A200-R204 WeakPolarHBondContact O-CG 3.46Å; A200-R204 PolarHBondContact O-N 3.04Å; A200-R204 VanDerWaalsContact O-N 3.13Å; A200-W226 HydrophobicContact CB-CH2 4.4Å; A200-W226 HydrophobicContact CB-CZ2 3.79Å
201	K	86	Confident	88.7	Confident	101 Å²	101	45.6 Å²	45.6	44%	0.439	23%	0.229	S	C	.	.	H	α-helix	trans	-67.3	-43.6	175.9	-174.3	-177.7	177.5	-175.4	0	111.2	S199 V205	S199-K201 PolarHBondContact O-N 3.08Å; S199-K201 VanDerWaalsContact O-N 3.1Å; K201-V205 PolarHBondContact O-N 3.06Å
202	E	86.6	Confident	88.5	Confident	17 Å²	17	46.5 Å²	46.5	8%	0.079	24%	0.235	C	C	.	.	H	α-helix	trans	-66.5	-46.8	177.3	-74.3	178.1	152.5	0	0	111.9	F100 A195 E197 C198 S199 R204 V205 W206	F100-E202 HydrophobicContact CE1-CG 4.31Å; F100-E202 HydrophobicContact CZ-CG 3.95Å; A195-E202 WeakPolarHBondContact CA-OE2 3.29Å; A195-E202 HydrophobicContact CB-CB 3.67Å; A195-E202 WeakPolarHBondContact CB-OE2 3.32Å; E197-E202 WeakPolarHBondContact CA-OE2 3.33Å; E197-E202 WeakPolarHBondContact CB-OE2 3.35Å; E197-E202 PolarHBondContact N-OE2 2.86Å; C198-E202 PolarHBondContact N-OE2 3.11Å; S199-E202 PolarHBondContact O-N 2.68Å; S199-E202 WeakPolarHBondContact OG-CG 3.34Å; S199-E202 PolarHBondContact OG-N 2.89Å; E202-R204 VanDerWaalsContact C-N 3.29Å; E202-R204 PolarHBondContact O-N 3.17Å; E202-V205 WeakPolarHBondContact O-CA 3.35Å; E202-V205 VanDerWaalsContact O-CB 3.31Å; E202-V205 WeakPolarHBondContact O-CB 3.28Å; E202-V205 PolarHBondContact O-N 3.47Å; E202-W206 PolarHBondContact O-N 3.49Å
203	F	87	Confident	88.4	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-60.6	-38.2	177.3	-70.1	-61.3	0	0	0	112.4	A195 S199 V205 W206 E207 W226 G228 H231	A195-F203 HydrophobicContact CB-CD1 3.87Å; A195-F203 HydrophobicContact CB-CD2 4.21Å; A195-F203 HydrophobicContact CB-CE1 3.5Å; A195-F203 HydrophobicContact CB-CE2 3.88Å; A195-F203 HydrophobicContact CB-CG 4.21Å; A195-F203 HydrophobicContact CB-CZ 3.53Å; S199-F203 VanDerWaalsContact O-CD2 3.29Å; S199-F203 WeakPolarHBondContact O-CD2 3.41Å; S199-F203 PolarHBondContact O-N 3.47Å; S199-F203 VanDerWaalsContact O-N 3.13Å; F203-V205 PolarHBondContact O-N 3.25Å; F203-W206 WeakPolarHBondContact O-CB 3.44Å; F203-W206 PolarHBondContact O-N 3.19Å; F203-W206 VanDerWaalsContact O-N 3.09Å; F203-E207 WeakPolarHBondContact O-CG 3.36Å; F203-E207 PolarHBondContact O-N 3.36Å; F203-W226 HydrophobicContact CB-CD2 4.38Å; F203-W226 HydrophobicContact CB-CE3 4.41Å; F203-W226 HydrophobicContact CB-CG 4.48Å; F203-W226 HydrophobicContact CD1-CB 4.1Å; F203-W226 HydrophobicContact CD2-CB 3.74Å; F203-W226 AromaticContact CD2-CD1 3.45Å; F203-W226 VanDerWaalsContact CD2-CD1 3.45Å; F203-W226 AromaticContact CD2-CD2 3.99Å; F203-W226 HydrophobicContact CD2-CD2 3.99Å; F203-W226 AromaticContact CD2-CG 3.43Å; F203-W226 HydrophobicContact CD2-CG 3.43Å; F203-W226 VanDerWaalsContact CD2-CG 3.43Å; F203-W226 HydrophobicContact CE1-CB 4.1Å; F203-W226 HydrophobicContact CE2-CB 3.73Å; F203-W226 AromaticContact CE2-CD1 3.43Å; F203-W226 VanDerWaalsContact CE2-CD1 3.43Å; F203-W226 AromaticContact CE2-CG 3.66Å; F203-W226 HydrophobicContact CE2-CG 3.66Å; F203-W226 HydrophobicContact CG-CB 3.92Å; F203-W226 HydrophobicContact CG-CD2 4.33Å; F203-W226 AromaticContact CG-CG 3.93Å; F203-W226 HydrophobicContact CG-CG 3.93Å; F203-W226 HydrophobicContact CZ-CB 3.9Å; F203-W226 HydrophobicContact CZ-CG 4.34Å; F203-G228 WeakPolarHBondContact CZ-O 3.41Å; F203-H231 HydrophobicContact CD1-CB 3.61Å; F203-H231 AromaticContact CD1-CG 3.82Å; F203-H231 HydrophobicContact CE1-CB 3.62Å
204	R	89.7	Confident	88.5	Confident	152 Å²	152	42.2 Å²	42.2	57%	0.574	22%	0.216	S	C	*	.	H	α-helix	trans	-64	-25.5	172.7	-76.5	178	-178.9	-162.1	1	114	A200 E202 K208	A200-R204 WeakPolarHBondContact O-CB 3.12Å; A200-R204 VanDerWaalsContact O-CG 3.23Å; A200-R204 WeakPolarHBondContact O-CG 3.46Å; A200-R204 PolarHBondContact O-N 3.04Å; A200-R204 VanDerWaalsContact O-N 3.13Å; E202-R204 VanDerWaalsContact C-N 3.29Å; E202-R204 PolarHBondContact O-N 3.17Å; R204-K208 VanDerWaalsContact O-CG 3.3Å; R204-K208 WeakPolarHBondContact O-CG 3.17Å; R204-K208 PolarHBondContact O-N 2.65Å
205	V	89.4	Confident	88.4	Confident	28 Å²	28	44.5 Å²	44.5	17%	0.17	23%	0.232	C	C	.	.	H	α-helix	trans	-68.1	-45.7	171.3	171.9	0	0	0	0	109.5	F100 V103 K201 E202 F203 K208 R209	F100-V205 HydrophobicContact CD1-CG2 3.77Å; F100-V205 HydrophobicContact CE1-CG2 3.77Å; V103-V205 HydrophobicContact CG1-CG1 4.38Å; K201-V205 PolarHBondContact O-N 3.06Å; E202-V205 WeakPolarHBondContact O-CA 3.35Å; E202-V205 VanDerWaalsContact O-CB 3.31Å; E202-V205 WeakPolarHBondContact O-CB 3.28Å; E202-V205 PolarHBondContact O-N 3.47Å; F203-V205 PolarHBondContact O-N 3.25Å; V205-K208 PolarHBondContact O-N 3.07Å; V205-R209 HydrophobicContact CG1-CG 4.38Å; V205-R209 VanDerWaalsContact O-CG 3.3Å; V205-R209 WeakPolarHBondContact O-CG 3.45Å; V205-R209 PolarHBondContact O-N 3.24Å
206	W	90.1	Very high	88.5	Confident	12 Å²	12	51.9 Å²	51.9	5%	0.045	27%	0.266	C	S	.	.	H	α-helix	trans	-61.1	-46.7	176.2	-75.3	112.2	0	0	0	112.6	M161 D165 I166 I171 L191 A194 E202 F203 K208 R209 L210	M161-W206 HydrophobicContact CE-CD2 4.47Å; M161-W206 HydrophobicContact CE-CH2 3.22Å; M161-W206 HydrophobicContact CE-CZ2 3.08Å; M161-W206 HydrophobicContact CE-CZ3 3.93Å; M161-W206 HydrophobicContact SD-CH2 4.33Å; M161-W206 HydrophobicContact SD-CZ2 4.12Å; D165-W206 VanDerWaalsContact OD1-CH2 3.31Å; D165-W206 WeakPolarHBondContact OD1-CH2 3.29Å; D165-W206 WeakPolarHBondContact OD1-CZ2 3.3Å; I166-W206 HydrophobicContact CD1-CH2 4.31Å; I166-W206 HydrophobicContact CD1-CZ3 4.14Å; I166-W206 HydrophobicContact CG1-CH2 3.77Å; I166-W206 HydrophobicContact CG1-CZ3 3.93Å; I171-W206 HydrophobicContact CD1-CZ3 4.02Å; I171-W206 HydrophobicContact CG1-CZ3 4.46Å; L191-W206 HydrophobicContact CD1-CB 4.23Å; L191-W206 HydrophobicContact CD1-CD2 4.16Å; L191-W206 HydrophobicContact CD1-CE3 4.19Å; L191-W206 HydrophobicContact CD1-CG 4.16Å; A194-W206 HydrophobicContact CB-CG 4.47Å; A194-W206 PolarHBondContact O-NE1 2.91Å; E202-W206 PolarHBondContact O-N 3.49Å; F203-W206 WeakPolarHBondContact O-CB 3.44Å; F203-W206 PolarHBondContact O-N 3.19Å; F203-W206 VanDerWaalsContact O-N 3.09Å; W206-K208 VanDerWaalsContact C-N 3.29Å; W206-K208 PolarHBondContact O-N 2.93Å; W206-R209 PolarHBondContact O-N 3.05Å; W206-R209 VanDerWaalsContact O-N 3.14Å; W206-L210 WeakPolarHBondContact O-CB 3.11Å; W206-L210 VanDerWaalsContact O-CG 3.29Å; W206-L210 WeakPolarHBondContact O-CG 3.34Å; W206-L210 PolarHBondContact O-N 2.6Å
207	E	91.2	Very high	88.8	Confident	31 Å²	31	48.6 Å²	48.6	15%	0.145	25%	0.245	C	C	.	.	H	α-helix	trans	-52.1	-47.8	174	-71.3	171.6	179.1	0	0	111.9	F203 R209 Q211 L221 S224 H231	F203-E207 WeakPolarHBondContact O-CG 3.36Å; F203-E207 PolarHBondContact O-N 3.36Å; E207-R209 PolarHBondContact O-N 2.88Å; E207-Q211 WeakPolarHBondContact O-CB 3.46Å; E207-Q211 PolarHBondContact O-N 2.76Å; E207-L221 HydrophobicContact CB-CD2 4.31Å; E207-L221 HydrophobicContact CG-CD2 4.24Å; E207-S224 WeakPolarHBondContact OE1-CB 3.43Å; E207-S224 PolarHBondContact OE1-OG 2.63Å; E207-H231 IonicContact OE1-NE2 2.93Å
208	K	91.7	Very high	89.1	Confident	103 Å²	103	48.8 Å²	48.8	45%	0.448	24%	0.244	S	C	.	.	H	α-helix	trans	-63.9	-42.5	179.3	-75.2	175.3	-178	-177	0	112.4	R204 V205 W206 Q211 C212	R204-K208 VanDerWaalsContact O-CG 3.3Å; R204-K208 WeakPolarHBondContact O-CG 3.17Å; R204-K208 PolarHBondContact O-N 2.65Å; V205-K208 PolarHBondContact O-N 3.07Å; W206-K208 VanDerWaalsContact C-N 3.29Å; W206-K208 PolarHBondContact O-N 2.93Å; K208-Q211 PolarHBondContact O-N 3.17Å; K208-C212 WeakPolarHBondContact O-CB 3.5Å; K208-C212 PolarHBondContact O-N 2.74Å; K208-C212 PolarHBondContact O-SG 3.3Å
209	R	92.9	Very high	89.7	Confident	17 Å²	17	46.5 Å²	46.5	6%	0.064	23%	0.228	C	C	.	.	H	α-helix	trans	-69.9	-42.9	-177.5	-68.1	178.9	73.2	-169.9	5.7	111.7	Y107 D165 I166 D168 I171 V205 W206 E207 C212 C213	Y107-R209 HydrophobicContact CE2-CG 4.04Å; D165-R209 IonicContact OD1-CZ 2.9Å; D165-R209 IonicContact OD1-NH1 3.82Å; D165-R209 PolarHBondContact OD1-NH1 3.35Å; D165-R209 IonicContact OD2-NH1 2.97Å; I166-R209 PolarHBondContact O-NH1 3.06Å; I166-R209 PolarHBondContact O-NH2 2.9Å; D168-R209 IonicContact OD1-CZ 3.71Å; D168-R209 IonicContact OD1-NE 3.81Å; D168-R209 PolarHBondContact OD1-NE 3.09Å; D168-R209 IonicContact OD1-NH2 2.76Å; D168-R209 PolarHBondContact OD1-NH2 3.3Å; I171-R209 HydrophobicContact CD1-CB 3.86Å; V205-R209 HydrophobicContact CG1-CG 4.38Å; V205-R209 VanDerWaalsContact O-CG 3.3Å; V205-R209 WeakPolarHBondContact O-CG 3.45Å; V205-R209 PolarHBondContact O-N 3.24Å; W206-R209 PolarHBondContact O-N 3.05Å; W206-R209 VanDerWaalsContact O-N 3.14Å; E207-R209 PolarHBondContact O-N 2.88Å; R209-C212 PolarHBondContact O-N 2.88Å; R209-C213 PolarHBondContact O-N 3.13Å
210	L	95.1	Very high	90	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-59.1	-49.7	170.7	-67.5	172.6	0	0	0	110.5	I171 M174 L175 I189 L191 W206 C212 C213 L214 S233 F235	I171-L210 HydrophobicContact CG2-CD2 4.1Å; M174-L210 HydrophobicContact CE-CD2 4.2Å; L175-L210 HydrophobicContact CD1-CD2 4Å; L175-L210 HydrophobicContact CD2-CD2 4.46Å; I189-L210 HydrophobicContact CB-CD1 4.48Å; I189-L210 HydrophobicContact CG2-CD1 4.14Å; I189-L210 HydrophobicContact CG2-CD2 4.15Å; L191-L210 HydrophobicContact CD1-CD1 4.27Å; W206-L210 WeakPolarHBondContact O-CB 3.11Å; W206-L210 VanDerWaalsContact O-CG 3.29Å; W206-L210 WeakPolarHBondContact O-CG 3.34Å; W206-L210 PolarHBondContact O-N 2.6Å; L210-C212 VanDerWaalsContact C-N 3.32Å; L210-C212 PolarHBondContact O-N 2.88Å; L210-C213 PolarHBondContact O-N 2.64Å; L210-C213 VanDerWaalsContact O-N 3.13Å; L210-L214 WeakPolarHBondContact O-CB 3.23Å; L210-L214 WeakPolarHBondContact O-CG 3.35Å; L210-L214 PolarHBondContact O-N 2.89Å; L210-S233 WeakPolarHBondContact CD1-OG 3.39Å; L210-F235 HydrophobicContact CB-CE2 4.04Å; L210-F235 HydrophobicContact CB-CZ 3.61Å; L210-F235 HydrophobicContact CD1-CE2 4.31Å; L210-F235 HydrophobicContact CD1-CZ 4.46Å
211	Q	94.2	Very high	90.5	Very high	52 Å²	52	47.8 Å²	47.8	24%	0.243	23%	0.228	C	C	.	.	H	α-helix	trans	-59.8	-39	177.8	-177.1	59.5	80.3	0	0	112.6	E207 K208 S215 Q219 F235	E207-Q211 WeakPolarHBondContact O-CB 3.46Å; E207-Q211 PolarHBondContact O-N 2.76Å; K208-Q211 PolarHBondContact O-N 3.17Å; Q211-S215 VanDerWaalsContact O-CB 3.23Å; Q211-S215 WeakPolarHBondContact O-CB 3.45Å; Q211-S215 PolarHBondContact O-N 2.87Å; Q211-Q219 PolarHBondContact NE2-O 2.88Å; Q211-F235 HydrophobicContact CB-CE1 3.94Å
212	C	90.8	Very high	90.5	Very high	21 Å²	21	45.4 Å²	45.4	14%	0.142	22%	0.219	C	C	.	.	H	α-helix	trans	-63.8	-44.9	175.6	-70.8	0	0	0	0	111	Y107 K208 R209 L210 S215	Y107-C212 HydrophobicContact CD1-CB 4.09Å; Y107-C212 WeakPolarHBondContact CD1-SG 3.39Å; Y107-C212 HydrophobicContact CE1-CB 3.96Å; K208-C212 WeakPolarHBondContact O-CB 3.5Å; K208-C212 PolarHBondContact O-N 2.74Å; K208-C212 PolarHBondContact O-SG 3.3Å; R209-C212 PolarHBondContact O-N 2.88Å; L210-C212 VanDerWaalsContact C-N 3.32Å; L210-C212 PolarHBondContact O-N 2.88Å; C212-S215 PolarHBondContact O-N 3Å; C212-S215 PolarHBondContact O-OG 2.88Å
213	C	91.8	Very high	90.5	Very high	13 Å²	13	49.5 Å²	49.5	9%	0.088	23%	0.234	C	C	.	.	H	α-helix	trans	-63.9	-47.1	178.8	-161.2	0	0	0	0	111.7	I171 L175 R209 L210 S215 H216	I171-C213 HydrophobicContact CG2-CB 3.91Å; L175-C213 HydrophobicContact CD1-CB 3.94Å; R209-C213 PolarHBondContact O-N 3.13Å; L210-C213 PolarHBondContact O-N 2.64Å; L210-C213 VanDerWaalsContact O-N 3.13Å; C213-S215 VanDerWaalsContact C-N 3.34Å; C213-S215 PolarHBondContact O-N 2.86Å; C213-H216 PolarHBondContact O-ND1 2.83Å
214	L	94	Very high	90.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-77	-16.4	-177.9	-64.8	172.4	0	0	0	113.5	L175 F176 Y187 L210 H216 C217 K218 Q219 F235	L175-L214 HydrophobicContact CB-CD2 4.31Å; L175-L214 HydrophobicContact CD1-CD1 4.36Å; L175-L214 HydrophobicContact CD1-CD2 3.87Å; L175-L214 HydrophobicContact CD1-CG 3.83Å; L175-L214 HydrophobicContact CG-CD2 4.49Å; F176-L214 HydrophobicContact CE1-CD2 4.48Å; F176-L214 HydrophobicContact CZ-CD2 3.94Å; Y187-L214 HydrophobicContact CD1-CD2 3.75Å; Y187-L214 HydrophobicContact CD2-CD2 4.09Å; Y187-L214 HydrophobicContact CE1-CD2 3.86Å; Y187-L214 HydrophobicContact CE2-CD2 4.17Å; Y187-L214 HydrophobicContact CG-CD1 4.4Å; Y187-L214 HydrophobicContact CG-CD2 3.88Å; L210-L214 WeakPolarHBondContact O-CB 3.23Å; L210-L214 WeakPolarHBondContact O-CG 3.35Å; L210-L214 PolarHBondContact O-N 2.89Å; L214-H216 PolarHBondContact O-N 3.36Å; L214-C217 PolarHBondContact O-N 2.9Å; L214-C217 PolarHBondContact O-SG 2.77Å; L214-K218 PolarHBondContact O-N 3.43Å; L214-Q219 HydrophobicContact CB-CB 3.67Å; L214-Q219 HydrophobicContact CB-CG 4.18Å; L214-Q219 WeakPolarHBondContact O-CB 3.42Å; L214-Q219 PolarHBondContact O-N 2.84Å; L214-F235 HydrophobicContact CD1-CB 4Å; L214-F235 HydrophobicContact CD1-CD1 3.71Å; L214-F235 HydrophobicContact CD1-CD2 3.49Å; L214-F235 VanDerWaalsContact CD1-CD2 3.49Å; L214-F235 HydrophobicContact CD1-CE1 4Å; L214-F235 HydrophobicContact CD1-CE2 3.8Å; L214-F235 HydrophobicContact CD1-CG 3.45Å; L214-F235 VanDerWaalsContact CD1-CG 3.45Å; L214-F235 HydrophobicContact CD1-CZ 4.05Å
215	S	88.5	Confident	90.4	Very high	54 Å²	54	45.4 Å²	45.4	38%	0.378	23%	0.227	S	C	.	.	H	α-helix	trans	-60.4	-27.1	175.9	69.8	0	0	0	0	113	Q211 C212 C213 C217 K218	Q211-S215 VanDerWaalsContact O-CB 3.23Å; Q211-S215 WeakPolarHBondContact O-CB 3.45Å; Q211-S215 PolarHBondContact O-N 2.87Å; C212-S215 PolarHBondContact O-N 3Å; C212-S215 PolarHBondContact O-OG 2.88Å; C213-S215 VanDerWaalsContact C-N 3.34Å; C213-S215 PolarHBondContact O-N 2.86Å; S215-C217 PolarHBondContact O-N 2.85Å; S215-K218 PolarHBondContact O-N 3.06Å
216	H	85.7	Confident	90.1	Very high	154 Å²	154	49.1 Å²	49.1	71%	0.713	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-27.6	175.5	-58.3	116	0	0	0	113	C213 L214	C213-H216 PolarHBondContact O-ND1 2.83Å; L214-H216 PolarHBondContact O-N 3.36Å
217	C	87.8	Confident	89.7	Confident	17 Å²	17	52.5 Å²	52.5	12%	0.115	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	24.7	175.2	58.5	0	0	0	0	112.8	F176 T183 L214 S215 Q219	F176-C217 HydrophobicContact CE1-CB 4.47Å; T183-C217 HydrophobicContact CG2-CB 3.73Å; L214-C217 PolarHBondContact O-N 2.9Å; L214-C217 PolarHBondContact O-SG 2.77Å; S215-C217 PolarHBondContact O-N 2.85Å; C217-Q219 PolarHBondContact O-N 3.1Å; C217-Q219 WeakPolarHBondContact SG-CG 3.44Å
218	K	90.6	Very high	89.4	Confident	123 Å²	123	53.3 Å²	53.3	54%	0.535	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	58	26.8	176.1	-51	175.6	176.4	177.1	0	114.4	L214 S215 R238 E239	L214-K218 PolarHBondContact O-N 3.43Å; S215-K218 PolarHBondContact O-N 3.06Å; K218-R238 HydrophobicContact CB-CB 4.44Å; K218-R238 WeakPolarHBondContact O-CB 3.39Å; K218-R238 PolarHBondContact O-N 2.79Å; K218-E239 WeakPolarHBondContact CD-OE1 3.4Å; K218-E239 IonicContact NZ-OE1 3.76Å; K218-E239 PolarHBondContact NZ-OE1 2.82Å
219	Q	94.3	Very high	89.3	Confident	3 Å²	3	51.2 Å²	51.2	1%	0.014	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	146.7	177.2	-68.6	-71.1	-29	0	0	111	A184 D185 Y187 Q211 L214 C217 F235 I236	A184-Q219 PolarHBondContact O-NE2 3.32Å; D185-Q219 PolarHBondContact O-NE2 3.35Å; D185-Q219 PolarHBondContact O-OE1 2.91Å; Y187-Q219 HydrophobicContact CD2-CG 3.94Å; Y187-Q219 HydrophobicContact CE2-CG 4.03Å; Q211-Q219 PolarHBondContact NE2-O 2.88Å; L214-Q219 HydrophobicContact CB-CB 3.67Å; L214-Q219 HydrophobicContact CB-CG 4.18Å; L214-Q219 WeakPolarHBondContact O-CB 3.42Å; L214-Q219 PolarHBondContact O-N 2.84Å; C217-Q219 PolarHBondContact O-N 3.1Å; C217-Q219 WeakPolarHBondContact SG-CG 3.44Å; Q219-F235 HydrophobicContact CB-CB 4.22Å; Q219-I236 CarbonylContact C-O 3.6Å; Q219-I236 WeakPolarHBondContact CA-O 3.37Å; Q219-I236 PolarHBondContact OE1-O 3.4Å
220	V	90.5	Very high	89.1	Confident	55 Å²	55	52.2 Å²	52.2	33%	0.333	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	131.2	-179.9	-165.7	0	0	0	0	108.9	I222 F235 I236 R238 V241	V220-I222 PolarHBondContact O-N 3.1Å; V220-F235 VanDerWaalsContact O-CA 3.25Å; V220-F235 WeakPolarHBondContact O-CA 3.45Å; V220-I236 PolarHBondContact N-O 3.25Å; V220-I236 PolarHBondContact O-N 2.93Å; V220-R238 HydrophobicContact CG2-CB 3.72Å; V220-R238 HydrophobicContact CG2-CG 4.13Å; V220-V241 HydrophobicContact CB-CG2 4.44Å; V220-V241 HydrophobicContact CG2-CG2 4.49Å
221	L	93	Very high	89	Confident	50 Å²	50	52.3 Å²	52.3	26%	0.262	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	119.5	173	-177.2	70.9	0	0	0	109.6	E207 R223 F235	E207-L221 HydrophobicContact CB-CD2 4.31Å; E207-L221 HydrophobicContact CG-CD2 4.24Å; L221-R223 WeakPolarHBondContact CD1-O 3.47Å; L221-F235 HydrophobicContact CB-CD1 3.82Å; L221-F235 HydrophobicContact CB-CE1 3.6Å; L221-F235 HydrophobicContact CB-CZ 4.28Å; L221-F235 HydrophobicContact CD1-CD1 4.17Å; L221-F235 HydrophobicContact CD1-CD2 4.21Å; L221-F235 HydrophobicContact CD1-CE1 3.77Å; L221-F235 HydrophobicContact CD1-CE2 3.81Å; L221-F235 HydrophobicContact CD1-CG 4.37Å; L221-F235 HydrophobicContact CD1-CZ 3.56Å; L221-F235 HydrophobicContact CG-CE1 4.25Å; L221-F235 HydrophobicContact CG-CZ 4.45Å
222	I	86	Confident	89	Confident	50 Å²	50	50.8 Å²	50.8	26%	0.256	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	-31.5	176.9	50.4	166.2	0	0	0	112.6	V220 L234 I236 V244	V220-I222 PolarHBondContact O-N 3.1Å; I222-L234 HydrophobicContact CD1-CD2 3.39Å; I222-L234 HydrophobicContact CD1-CG 3.78Å; I222-L234 HydrophobicContact CG1-CB 4.19Å; I222-L234 HydrophobicContact CG1-CD2 3.8Å; I222-L234 HydrophobicContact CG1-CG 3.83Å; I222-L234 VanDerWaalsContact CG1-O 3.27Å; I222-L234 WeakPolarHBondContact CG1-O 3.49Å; I222-L234 PolarHBondContact N-O 3.38Å; I222-I236 HydrophobicContact CB-CG2 4.47Å; I222-I236 HydrophobicContact CD1-CB 4.05Å; I222-I236 HydrophobicContact CD1-CG2 3.97Å; I222-I236 HydrophobicContact CG1-CG2 4.24Å; I222-I236 HydrophobicContact CG2-CG2 3.46Å; I222-I236 VanDerWaalsContact CG2-CG2 3.46Å; I222-V244 HydrophobicContact CD1-CG1 4.43Å; I222-V244 HydrophobicContact CD1-CG2 4.4Å
223	R	87.2	Confident	89.2	Confident	103 Å²	103	49.9 Å²	49.9	39%	0.389	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	139.9	177.4	-166.6	150.6	-76	-107.4	5.5	110.7	V70 L221 S233 L234 D246	V70-R223 HydrophobicContact CG2-CG 4.36Å; L221-R223 WeakPolarHBondContact CD1-O 3.47Å; R223-S233 WeakPolarHBondContact O-CA 3.37Å; R223-L234 HydrophobicContact CB-CB 4.34Å; R223-L234 PolarHBondContact N-O 3.17Å; R223-L234 PolarHBondContact O-N 2.82Å; R223-D246 IonicContact NH2-OD1 2.69Å; R223-D246 PolarHBondContact NH2-OD1 3.21Å
224	S	87.9	Confident	89.3	Confident	25 Å²	25	49.7 Å²	49.7	18%	0.175	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	132.4	174.6	179.2	0	0	0	0	108.3	E207 H231 L232	E207-S224 WeakPolarHBondContact OE1-CB 3.43Å; E207-S224 PolarHBondContact OE1-OG 2.63Å; S224-H231 PolarHBondContact OG-NE2 3.37Å; S224-L232 WeakPolarHBondContact CA-O 3.28Å
225	V	85.9	Confident	89.4	Confident	42 Å²	42	49.7 Å²	49.7	26%	0.255	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	151.3	-178.4	-75.5	0	0	0	0	107.6	V70 F72 H231 L232	V70-V225 HydrophobicContact CG1-CG2 3.6Å; F72-V225 HydrophobicContact CD2-CB 4.15Å; F72-V225 HydrophobicContact CD2-CG2 3.73Å; F72-V225 VanDerWaalsContact CE2-C 3.4Å; F72-V225 HydrophobicContact CE2-CB 3.43Å; F72-V225 VanDerWaalsContact CE2-CB 3.43Å; F72-V225 HydrophobicContact CE2-CG2 3.07Å; F72-V225 WeakPolarHBondContact CE2-O 3.3Å; F72-V225 HydrophobicContact CZ-CB 4.35Å; F72-V225 HydrophobicContact CZ-CG2 3.81Å; F72-V225 WeakPolarHBondContact CZ-O 3.29Å; V225-H231 PolarHBondContact O-CD2 3.49Å; V225-H231 VanDerWaalsContact O-CD2 3.27Å; V225-L232 HydrophobicContact CG2-CB 4.24Å; V225-L232 PolarHBondContact N-O 3.49Å; V225-L232 PolarHBondContact O-N 3.11Å
226	W	83.2	Confident	89.5	Confident	106 Å²	106	47.2 Å²	47.2	40%	0.402	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	145.9	176.1	61.7	90.9	0	0	0	110.6	A200 F203 Q230	A200-W226 HydrophobicContact CB-CH2 4.4Å; A200-W226 HydrophobicContact CB-CZ2 3.79Å; F203-W226 HydrophobicContact CB-CD2 4.38Å; F203-W226 HydrophobicContact CB-CE3 4.41Å; F203-W226 HydrophobicContact CB-CG 4.48Å; F203-W226 HydrophobicContact CD1-CB 4.1Å; F203-W226 HydrophobicContact CD2-CB 3.74Å; F203-W226 AromaticContact CD2-CD1 3.45Å; F203-W226 VanDerWaalsContact CD2-CD1 3.45Å; F203-W226 AromaticContact CD2-CD2 3.99Å; F203-W226 HydrophobicContact CD2-CD2 3.99Å; F203-W226 AromaticContact CD2-CG 3.43Å; F203-W226 HydrophobicContact CD2-CG 3.43Å; F203-W226 VanDerWaalsContact CD2-CG 3.43Å; F203-W226 HydrophobicContact CE1-CB 4.1Å; F203-W226 HydrophobicContact CE2-CB 3.73Å; F203-W226 AromaticContact CE2-CD1 3.43Å; F203-W226 VanDerWaalsContact CE2-CD1 3.43Å; F203-W226 AromaticContact CE2-CG 3.66Å; F203-W226 HydrophobicContact CE2-CG 3.66Å; F203-W226 HydrophobicContact CG-CB 3.92Å; F203-W226 HydrophobicContact CG-CD2 4.33Å; F203-W226 AromaticContact CG-CG 3.93Å; F203-W226 HydrophobicContact CG-CG 3.93Å; F203-W226 HydrophobicContact CZ-CB 3.9Å; F203-W226 HydrophobicContact CZ-CG 4.34Å; W226-Q230 CarbonylContact C-O 3.44Å; W226-Q230 WeakPolarHBondContact CA-O 3.29Å; W226-Q230 VanDerWaalsContact CB-O 3.3Å; W226-Q230 WeakPolarHBondContact CB-O 3.46Å
227	M	82	Confident	89.6	Confident	82 Å²	82	43 Å²	43	40%	0.404	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	114.2	177.5	-172.3	-172.3	-66.9	0	0	109.5	F72 V229 Q230	F72-M227 HydrophobicContact CB-CE 3.8Å; M227-V229 PolarHBondContact O-N 2.7Å; M227-V229 VanDerWaalsContact O-N 3.1Å; M227-Q230 PolarHBondContact N-O 2.91Å; M227-Q230 WeakPolarHBondContact O-CB 3.38Å; M227-Q230 PolarHBondContact O-N 3.48Å
228	G	85.2	Confident	89.6	Confident	48 Å²	48	50.2 Å²	50.2	50%	0.495	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	-117.5	-174.2	0	0	0	0	0	111	C198 F203	C198-G228 WeakPolarHBondContact CB-O 3.39Å; C198-G228 VanDerWaalsContact SG-C 3.59Å; C198-G228 PolarHBondContact SG-O 3.14Å; C198-G228 VanDerWaalsContact SG-O 3.35Å; F203-G228 WeakPolarHBondContact CZ-O 3.41Å
229	V	88.4	Confident	89.2	Confident	59 Å²	59	47.7 Å²	47.7	36%	0.358	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	2	178.5	-65.3	0	0	0	0	113.6	Q192 E193 C198 M227	Q192-V229 CarbonylContact C-O 3.58Å; E193-V229 HydrophobicContact CG-CB 4.3Å; E193-V229 HydrophobicContact CG-CG2 4.15Å; E193-V229 PolarHBondContact N-O 2.88Å; C198-V229 WeakPolarHBondContact SG-CG1 3.49Å; M227-V229 PolarHBondContact O-N 2.7Å; M227-V229 VanDerWaalsContact O-N 3.1Å
230	Q	90	Very high	88.7	Confident	39 Å²	39	48 Å²	48	18%	0.182	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	140.7	-177.1	-61	174.7	-19.4	0	0	110.7	F72 L191 Q192 W226 M227	F72-Q230 HydrophobicContact CE1-CB 4.16Å; L191-Q230 CarbonylContact O-C 3.52Å; L191-Q230 WeakPolarHBondContact O-CA 3.46Å; Q192-Q230 HydrophobicContact CG-CG 4.33Å; W226-Q230 CarbonylContact C-O 3.44Å; W226-Q230 WeakPolarHBondContact CA-O 3.29Å; W226-Q230 VanDerWaalsContact CB-O 3.3Å; W226-Q230 WeakPolarHBondContact CB-O 3.46Å; M227-Q230 PolarHBondContact N-O 2.91Å; M227-Q230 WeakPolarHBondContact O-CB 3.38Å; M227-Q230 PolarHBondContact O-N 3.48Å
231	H	92.7	Very high	88.2	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.009	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	136.5	175.8	179.2	-133.6	0	0	0	109.2	G190 L191 F203 E207 S224 V225	G190-H231 CarbonylContact C-O 3.59Å; G190-H231 VanDerWaalsContact CA-O 3.29Å; G190-H231 WeakPolarHBondContact CA-O 3.43Å; L191-H231 HydrophobicContact CB-CB 4.3Å; L191-H231 PolarHBondContact N-O 3.05Å; L191-H231 PolarHBondContact O-N 3.31Å; F203-H231 HydrophobicContact CD1-CB 3.61Å; F203-H231 AromaticContact CD1-CG 3.82Å; F203-H231 HydrophobicContact CE1-CB 3.62Å; E207-H231 IonicContact OE1-NE2 2.93Å; S224-H231 PolarHBondContact OG-NE2 3.37Å; V225-H231 PolarHBondContact O-CD2 3.49Å; V225-H231 VanDerWaalsContact O-CD2 3.27Å
232	L	93.6	Very high	87.4	Confident	21 Å²	21	53.8 Å²	53.8	11%	0.11	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	122.5	176.8	177.5	50.2	0	0	0	106.7	V70 F72 I189 S224 V225 F286	V70-L232 HydrophobicContact CG1-CB 4.36Å; V70-L232 HydrophobicContact CG1-CD2 3.25Å; V70-L232 HydrophobicContact CG1-CG 3.56Å; F72-L232 HydrophobicContact CD1-CB 4.31Å; F72-L232 HydrophobicContact CD1-CD2 4.48Å; F72-L232 HydrophobicContact CE1-CB 3.33Å; F72-L232 HydrophobicContact CE1-CD2 4.23Å; F72-L232 HydrophobicContact CE1-CG 4.45Å; F72-L232 HydrophobicContact CE2-CB 4.02Å; F72-L232 HydrophobicContact CZ-CB 3.19Å; F72-L232 HydrophobicContact CZ-CG 4.45Å; F72-L232 VanDerWaalsContact CZ-N 3.29Å; I189-L232 WeakPolarHBondContact O-CA 3.35Å; S224-L232 WeakPolarHBondContact CA-O 3.28Å; V225-L232 HydrophobicContact CG2-CB 4.24Å; V225-L232 PolarHBondContact N-O 3.49Å; V225-L232 PolarHBondContact O-N 3.11Å; L232-F286 HydrophobicContact CD1-CE1 4.45Å; L232-F286 HydrophobicContact CD1-CE2 3.99Å; L232-F286 HydrophobicContact CD1-CZ 3.47Å; L232-F286 VanDerWaalsContact CD1-CZ 3.47Å
233	S	94.6	Very high	86.9	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.007	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	139	-179.4	52.3	0	0	0	0	109.6	I189 L210 R223	I189-S233 PolarHBondContact N-O 3.27Å; I189-S233 PolarHBondContact O-N 3.39Å; I189-S233 PolarHBondContact O-OG 3.31Å; L210-S233 WeakPolarHBondContact CD1-OG 3.39Å; R223-S233 WeakPolarHBondContact O-CA 3.37Å
234	L	94.3	Very high	86.3	Confident	9 Å²	9	48.9 Å²	48.9	5%	0.047	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	121.6	-177.1	-176.2	71.9	0	0	0	108.2	V68 V70 I186 Y187 A188 I222 R223	V68-L234 HydrophobicContact CB-CD2 3.77Å; V68-L234 HydrophobicContact CG1-CD1 4.29Å; V68-L234 HydrophobicContact CG1-CD2 3.3Å; V68-L234 HydrophobicContact CG1-CG 4.43Å; V68-L234 HydrophobicContact CG2-CD2 4.29Å; V70-L234 HydrophobicContact CG2-CD2 4.18Å; I186-L234 HydrophobicContact CG2-CD1 3.52Å; Y187-L234 WeakPolarHBondContact O-CA 3.42Å; A188-L234 HydrophobicContact CB-CD1 4.12Å; I222-L234 HydrophobicContact CD1-CD2 3.39Å; I222-L234 HydrophobicContact CD1-CG 3.78Å; I222-L234 HydrophobicContact CG1-CB 4.19Å; I222-L234 HydrophobicContact CG1-CD2 3.8Å; I222-L234 HydrophobicContact CG1-CG 3.83Å; I222-L234 VanDerWaalsContact CG1-O 3.27Å; I222-L234 WeakPolarHBondContact CG1-O 3.49Å; I222-L234 PolarHBondContact N-O 3.38Å; R223-L234 HydrophobicContact CB-CB 4.34Å; R223-L234 PolarHBondContact N-O 3.17Å; R223-L234 PolarHBondContact O-N 2.82Å
235	F	95.5	Very high	85.4	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	145.6	174.3	-56.5	-105.6	0	0	0	109.2	I186 Y187 L210 Q211 L214 Q219 V220 L221	I186-F235 CarbonylContact C-O 3.52Å; I186-F235 WeakPolarHBondContact CA-O 3.31Å; Y187-F235 PolarHBondContact N-O 2.76Å; Y187-F235 PolarHBondContact O-N 2.69Å; L210-F235 HydrophobicContact CB-CE2 4.04Å; L210-F235 HydrophobicContact CB-CZ 3.61Å; L210-F235 HydrophobicContact CD1-CE2 4.31Å; L210-F235 HydrophobicContact CD1-CZ 4.46Å; Q211-F235 HydrophobicContact CB-CE1 3.94Å; L214-F235 HydrophobicContact CD1-CB 4Å; L214-F235 HydrophobicContact CD1-CD1 3.71Å; L214-F235 HydrophobicContact CD1-CD2 3.49Å; L214-F235 VanDerWaalsContact CD1-CD2 3.49Å; L214-F235 HydrophobicContact CD1-CE1 4Å; L214-F235 HydrophobicContact CD1-CE2 3.8Å; L214-F235 HydrophobicContact CD1-CG 3.45Å; L214-F235 VanDerWaalsContact CD1-CG 3.45Å; L214-F235 HydrophobicContact CD1-CZ 4.05Å; Q219-F235 HydrophobicContact CB-CB 4.22Å; V220-F235 VanDerWaalsContact O-CA 3.25Å; V220-F235 WeakPolarHBondContact O-CA 3.45Å; L221-F235 HydrophobicContact CB-CD1 3.82Å; L221-F235 HydrophobicContact CB-CE1 3.6Å; L221-F235 HydrophobicContact CB-CZ 4.28Å; L221-F235 HydrophobicContact CD1-CD1 4.17Å; L221-F235 HydrophobicContact CD1-CD2 4.21Å; L221-F235 HydrophobicContact CD1-CE1 3.77Å; L221-F235 HydrophobicContact CD1-CE2 3.81Å; L221-F235 HydrophobicContact CD1-CG 4.37Å; L221-F235 HydrophobicContact CD1-CZ 3.56Å; L221-F235 HydrophobicContact CG-CE1 4.25Å; L221-F235 HydrophobicContact CG-CZ 4.45Å
236	I	90.7	Very high	84.2	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.01	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	149.1	173.7	-166.5	169.5	0	0	0	109.9	L66 D185 I186 Q219 V220 I222 R238 L240 V241 V244	L66-I236 HydrophobicContact CD2-CD1 4.2Å; D185-I236 CarbonylContact O-C 3.54Å; D185-I236 WeakPolarHBondContact O-CA 2.97Å; I186-I236 HydrophobicContact CD1-CD1 4.28Å; I186-I236 HydrophobicContact CG1-CB 4.41Å; I186-I236 HydrophobicContact CG1-CD1 4.19Å; I186-I236 HydrophobicContact CG1-CG1 3.9Å; Q219-I236 CarbonylContact C-O 3.6Å; Q219-I236 WeakPolarHBondContact CA-O 3.37Å; Q219-I236 PolarHBondContact OE1-O 3.4Å; V220-I236 PolarHBondContact N-O 3.25Å; V220-I236 PolarHBondContact O-N 2.93Å; I222-I236 HydrophobicContact CB-CG2 4.47Å; I222-I236 HydrophobicContact CD1-CB 4.05Å; I222-I236 HydrophobicContact CD1-CG2 3.97Å; I222-I236 HydrophobicContact CG1-CG2 4.24Å; I222-I236 HydrophobicContact CG2-CG2 3.46Å; I222-I236 VanDerWaalsContact CG2-CG2 3.46Å; I236-R238 PolarHBondContact O-N 2.83Å; I236-L240 HydrophobicContact CD1-CB 3.82Å; I236-L240 HydrophobicContact CG1-CB 3.94Å; I236-V241 HydrophobicContact CG2-CG2 3.62Å; I236-V244 HydrophobicContact CD1-CG2 3.61Å
237	R	88.5	Confident	82.7	Confident	66 Å²	66	49.4 Å²	49.4	25%	0.249	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.4	131.1	172.8	-178.3	174.9	-62.4	151.9	13.3	109.1	A184 D185 E239 L240 V241	A184-R237 PolarHBondContact O-NH2 2.85Å; D185-R237 PolarHBondContact O-N 2.84Å; D185-R237 IonicContact OD1-CZ 3.52Å; D185-R237 IonicContact OD1-NE 3.83Å; D185-R237 IonicContact OD1-NH1 3Å; D185-R237 PolarHBondContact OD1-NH1 3.3Å; D185-R237 IonicContact OD1-NH2 3.96Å; D185-R237 PolarHBondContact OD1-NH2 3.42Å; R237-E239 WeakPolarHBondContact CG-OE2 3.38Å; R237-E239 PolarHBondContact O-N 3.23Å; R237-E239 VanDerWaalsContact O-N 3.13Å; R237-L240 HydrophobicContact CB-CD1 4.21Å; R237-L240 HydrophobicContact CB-CG 4.33Å; R237-L240 PolarHBondContact O-N 3.36Å; R237-V241 PolarHBondContact O-N 3.19Å
238	R	86.8	Confident	81	Confident	168 Å²	168	49.9 Å²	49.9	63%	0.634	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-50.4	-41.6	-175.2	178.4	-178.6	172.4	-140.6	-3	113	K218 V220 I236 L240 V241	K218-R238 HydrophobicContact CB-CB 4.44Å; K218-R238 WeakPolarHBondContact O-CB 3.39Å; K218-R238 PolarHBondContact O-N 2.79Å; V220-R238 HydrophobicContact CG2-CB 3.72Å; V220-R238 HydrophobicContact CG2-CG 4.13Å; I236-R238 PolarHBondContact O-N 2.83Å; R238-L240 PolarHBondContact O-N 2.96Å; R238-V241 WeakPolarHBondContact O-CG2 3.21Å; R238-V241 PolarHBondContact O-N 3.12Å
239	E	83.7	Confident	79.5	Confident	71 Å²	71	52 Å²	52	33%	0.332	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-63.8	-23.6	-179.8	-65.1	86.3	172.5	0	0	113	K218 R237	K218-E239 WeakPolarHBondContact CD-OE1 3.4Å; K218-E239 IonicContact NZ-OE1 3.76Å; K218-E239 PolarHBondContact NZ-OE1 2.82Å; R237-E239 WeakPolarHBondContact CG-OE2 3.38Å; R237-E239 PolarHBondContact O-N 3.23Å; R237-E239 VanDerWaalsContact O-N 3.13Å
240	L	83.7	Confident	77.7	Confident	8 Å²	8	54.6 Å²	54.6	4%	0.042	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-97.1	-6.9	-177.7	-59	178.5	0	0	0	114.3	C146 L147 L152 D185 I236 R237 R238 W242 F243	C146-L240 VanDerWaalsContact SG-CD2 3.57Å; L147-L240 HydrophobicContact CD1-CD1 3.85Å; L147-L240 HydrophobicContact CD1-CD2 3.61Å; L147-L240 HydrophobicContact CD1-CG 4.39Å; L147-L240 HydrophobicContact CG-CD2 4.32Å; L152-L240 HydrophobicContact CD1-CD1 3.84Å; D185-L240 HydrophobicContact CB-CD1 3.76Å; I236-L240 HydrophobicContact CD1-CB 3.82Å; I236-L240 HydrophobicContact CG1-CB 3.94Å; R237-L240 HydrophobicContact CB-CD1 4.21Å; R237-L240 HydrophobicContact CB-CG 4.33Å; R237-L240 PolarHBondContact O-N 3.36Å; R238-L240 PolarHBondContact O-N 2.96Å; L240-W242 PolarHBondContact O-N 3.06Å; L240-W242 VanDerWaalsContact O-N 3.08Å; L240-F243 HydrophobicContact CD2-CD2 4.19Å; L240-F243 HydrophobicContact CD2-CE2 4.25Å; L240-F243 PolarHBondContact O-N 2.78Å
241	V	79.9	Confident	76	Confident	52 Å²	52	58.6 Å²	58.6	32%	0.315	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-54.2	-32.7	-179.1	171.8	0	0	0	0	112	V220 I236 R237 R238 F243 V244	V220-V241 HydrophobicContact CB-CG2 4.44Å; V220-V241 HydrophobicContact CG2-CG2 4.49Å; I236-V241 HydrophobicContact CG2-CG2 3.62Å; R237-V241 PolarHBondContact O-N 3.19Å; R238-V241 WeakPolarHBondContact O-CG2 3.21Å; R238-V241 PolarHBondContact O-N 3.12Å; V241-F243 PolarHBondContact O-N 2.75Å; V241-V244 PolarHBondContact O-N 2.95Å
242	W	75.5	Confident	74.2	Confident	175 Å²	175	61.1 Å²	61.1	66%	0.663	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-65.6	-26.5	-176.9	-57.8	109.8	0	0	0	112.9	L138 L240 V244	L138-W242 VanDerWaalsContact CD2-C 3.41Å; L138-W242 HydrophobicContact CD2-CB 3.3Å; L138-W242 HydrophobicContact CD2-CG 4.44Å; L138-W242 WeakPolarHBondContact CD2-O 3.44Å; L240-W242 PolarHBondContact O-N 3.06Å; L240-W242 VanDerWaalsContact O-N 3.08Å; W242-V244 VanDerWaalsContact C-N 3.33Å
243	F	75.6	Confident	72.5	Confident	11 Å²	11	61.8 Å²	61.8	5%	0.048	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-90.7	13.4	177.3	-52.1	-81.3	0	0	0	112.7	N65 L66 E142 L143 C146 L240 V241	N65-F243 CarbonylContact C-O 3.34Å; N65-F243 WeakPolarHBondContact CA-O 3.16Å; N65-F243 VanDerWaalsContact OD1-C 3.23Å; N65-F243 PolarHBondContact OD1-O 3.43Å; L66-F243 WeakPolarHBondContact CA-O 3.5Å; L66-F243 WeakPolarHBondContact CB-O 3.32Å; L66-F243 PolarHBondContact N-O 2.92Å; E142-F243 HydrophobicContact CB-CZ 4.27Å; E142-F243 HydrophobicContact CG-CZ 4.06Å; L143-F243 HydrophobicContact CB-CD1 4.21Å; L143-F243 HydrophobicContact CB-CE1 3.71Å; L143-F243 HydrophobicContact CB-CZ 4.06Å; L143-F243 HydrophobicContact CD1-CD1 4.14Å; L143-F243 HydrophobicContact CD1-CD2 4.08Å; L143-F243 HydrophobicContact CD1-CE1 4.19Å; L143-F243 HydrophobicContact CD1-CE2 4.15Å; L143-F243 HydrophobicContact CD1-CG 4.08Å; L143-F243 HydrophobicContact CD1-CZ 4.2Å; C146-F243 VanDerWaalsContact SG-CE2 3.59Å; L240-F243 HydrophobicContact CD2-CD2 4.19Å; L240-F243 HydrophobicContact CD2-CE2 4.25Å; L240-F243 PolarHBondContact O-N 2.78Å; V241-F243 PolarHBondContact O-N 2.75Å
244	V	74.7	Confident	70.9	Confident	39 Å²	39	65.9 Å²	65.9	24%	0.236	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	124.3	178.2	-178.6	0	0	0	0	109.9	L66 I222 I236 V241 W242	L66-V244 WeakPolarHBondContact O-CA 3.49Å; I222-V244 HydrophobicContact CD1-CG1 4.43Å; I222-V244 HydrophobicContact CD1-CG2 4.4Å; I236-V244 HydrophobicContact CD1-CG2 3.61Å; V241-V244 PolarHBondContact O-N 2.95Å; W242-V244 VanDerWaalsContact C-N 3.33Å
245	S	69.1	Low	69.2	Low	37 Å²	37	69 Å²	69	26%	0.259	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	134.3	171.6	174.6	0	0	0	0	110.7	N65 L66 G247	N65-S245 VanDerWaalsContact CG-CB 3.43Å; L66-S245 PolarHBondContact O-N 3.46Å; S245-G247 VanDerWaalsContact C-N 3.35Å; S245-G247 PolarHBondContact O-N 3.48Å; S245-G247 VanDerWaalsContact O-N 3.07Å
246	D	59.5	Low	67.6	Low	127 Å²	127	69.2 Å²	69.2	68%	0.679	35%	0.35	S	S	*	.			trans	-67.5	99.3	155	-75.1	-45	0	0	0	106.5	R223	R223-D246 IonicContact NH2-OD1 2.69Å; R223-D246 PolarHBondContact NH2-OD1 3.21Å
247	G	53.1	Low	66.2	Low	20 Å²	20	70.7 Å²	70.7	21%	0.206	36%	0.36	C	S	.	.			trans	-46.9	146.7	-176.2	0	0	0	0	0	112.2	S245 D249	S245-G247 VanDerWaalsContact C-N 3.35Å; S245-G247 PolarHBondContact O-N 3.48Å; S245-G247 VanDerWaalsContact O-N 3.07Å; G247-D249 PolarHBondContact O-N 3.09Å
248	P	46.2	Very low	65	Low	93 Å²	93	71.1 Å²	71.1	60%	0.604	37%	0.367	S	S	*	.	S	Bend	trans	-63.5	-2.9	-153.4	16.9	-30.3	0	0	0	117.2
249	D	52.6	Low	63.9	Low	92 Å²	92	68.1 Å²	68.1	49%	0.492	36%	0.356	S	S	.	.			trans	-167.2	111.5	178.9	-132.1	-15.9	0	0	0	112.2	G247 L251 P252 R253	G247-D249 PolarHBondContact O-N 3.09Å; D249-L251 PolarHBondContact O-N 3.24Å; D249-P252 HydrophobicContact CB-CG 3.75Å; D249-P252 WeakPolarHBondContact O-CD 3.38Å; D249-R253 WeakPolarHBondContact O-CG 3.1Å
250	I	51.8	Low	63	Low	113 Å²	113	65.7 Å²	65.7	58%	0.579	35%	0.345	S	S	*	.	H	α-helix	trans	-64.5	-27.1	179.6	-166.8	167	0	0	0	112.3	R253 I254	I250-R253 PolarHBondContact O-N 3.49Å; I250-I254 HydrophobicContact CG1-CD1 4.22Å; I250-I254 HydrophobicContact CG1-CG1 4.43Å; I250-I254 WeakPolarHBondContact O-CG1 3.36Å; I250-I254 PolarHBondContact O-N 3.11Å
251	L	53.5	Low	61.9	Low	123 Å²	123	68.1 Å²	68.1	64%	0.644	36%	0.357	S	S	*	.	H	α-helix	trans	-69.4	-50.9	-175	-73.2	173.6	0	0	0	113.1	D249 R253 I254 N255	D249-L251 PolarHBondContact O-N 3.24Å; L251-R253 PolarHBondContact O-N 3.24Å; L251-I254 PolarHBondContact O-N 2.96Å; L251-N255 PolarHBondContact O-N 2.79Å
252	P	54.4	Low	61.1	Low	56 Å²	56	68.4 Å²	68.4	36%	0.364	36%	0.361	S	S	.	.	H	α-helix	trans	-49.4	-38.1	166.5	-32.4	37.2	0	0	0	113.6	D249 N255 D256	D249-P252 HydrophobicContact CB-CG 3.75Å; D249-P252 WeakPolarHBondContact O-CD 3.38Å; P252-N255 WeakPolarHBondContact O-CB 3.23Å; P252-N255 PolarHBondContact O-N 3.22Å; P252-D256 PolarHBondContact O-N 3.18Å
253	R	57.9	Low	60.4	Low	35 Å²	35	61.4 Å²	61.4	13%	0.132	34%	0.335	C	S	.	.	H	α-helix	trans	-74.1	-39.1	-177	-60.8	-71.2	131.3	155.6	-8.2	113.1	D69 D249 I250 L251 N255 D256 C257 D279	D69-R253 WeakPolarHBondContact OD2-CD 3.31Å; D69-R253 IonicContact OD2-CZ 3.65Å; D69-R253 IonicContact OD2-NH1 2.78Å; D69-R253 PolarHBondContact OD2-NH1 3.17Å; D249-R253 WeakPolarHBondContact O-CG 3.1Å; I250-R253 PolarHBondContact O-N 3.49Å; L251-R253 PolarHBondContact O-N 3.24Å; R253-N255 VanDerWaalsContact C-N 3.28Å; R253-N255 PolarHBondContact O-N 2.66Å; R253-D256 IonicContact NE-OD2 2.76Å; R253-D256 PolarHBondContact O-N 2.84Å; R253-C257 PolarHBondContact O-N 2.58Å; R253-D279 IonicContact NH2-OD2 3.67Å
254	I	61.6	Low	59.9	Low	86 Å²	86	63.6 Å²	63.6	44%	0.441	35%	0.345	S	S	.	.	H	α-helix	trans	-60.5	-43	169.2	-68.8	167.4	0	0	0	109.9	I250 L251 D256 C257 N258	I250-I254 HydrophobicContact CG1-CD1 4.22Å; I250-I254 HydrophobicContact CG1-CG1 4.43Å; I250-I254 WeakPolarHBondContact O-CG1 3.36Å; I250-I254 PolarHBondContact O-N 3.11Å; L251-I254 PolarHBondContact O-N 2.96Å; I254-D256 VanDerWaalsContact C-N 3.28Å; I254-D256 PolarHBondContact O-N 3.14Å; I254-C257 PolarHBondContact O-N 3Å; I254-N258 WeakPolarHBondContact O-CB 3.48Å; I254-N258 VanDerWaalsContact O-CG 3.24Å; I254-N258 PolarHBondContact O-N 3.29Å; I254-N258 PolarHBondContact O-ND2 3.17Å
255	N	59.5	Low	59.3	Low	75 Å²	75	69.3 Å²	69.3	40%	0.401	36%	0.362	S	S	.	.	H	α-helix	trans	-62.1	-38.4	176.8	-165.1	34.1	0	0	0	111.5	L251 P252 R253 N258 R259	L251-N255 PolarHBondContact O-N 2.79Å; P252-N255 WeakPolarHBondContact O-CB 3.23Å; P252-N255 PolarHBondContact O-N 3.22Å; R253-N255 VanDerWaalsContact C-N 3.28Å; R253-N255 PolarHBondContact O-N 2.66Å; N255-N258 PolarHBondContact O-N 2.91Å; N255-R259 PolarHBondContact ND2-NH2 2.78Å; N255-R259 VanDerWaalsContact ND2-NH2 3.16Å; N255-R259 WeakPolarHBondContact O-CG 3.32Å; N255-R259 PolarHBondContact O-N 3.12Å
256	D	61	Low	59	Low	5 Å²	5	70.6 Å²	70.6	3%	0.027	37%	0.369	C	S	.	.	H	α-helix	trans	-66.4	-44.3	174.7	-68.3	-30.6	0	0	0	113.1	P252 R253 I254 N258 R259 I260 L276	P252-D256 PolarHBondContact O-N 3.18Å; R253-D256 IonicContact NE-OD2 2.76Å; R253-D256 PolarHBondContact O-N 2.84Å; I254-D256 VanDerWaalsContact C-N 3.28Å; I254-D256 PolarHBondContact O-N 3.14Å; D256-N258 VanDerWaalsContact C-N 3.3Å; D256-N258 PolarHBondContact O-N 2.8Å; D256-R259 CarbonylContact O-C 3.58Å; D256-R259 WeakPolarHBondContact O-CB 3.21Å; D256-R259 PolarHBondContact O-N 2.85Å; D256-R259 VanDerWaalsContact O-N 3.1Å; D256-R259 IonicContact OD1-CZ 3.86Å; D256-R259 IonicContact OD1-NH1 3.72Å; D256-R259 PolarHBondContact OD1-NH1 2.84Å; D256-I260 VanDerWaalsContact O-CG1 3.26Å; D256-I260 WeakPolarHBondContact O-CG1 3.36Å; D256-I260 PolarHBondContact O-N 2.79Å; D256-L276 HydrophobicContact CB-CB 3.4Å; D256-L276 VanDerWaalsContact CG-N 3.29Å; D256-L276 PolarHBondContact OD2-N 2.66Å
257	C	61.8	Low	58.8	Low	33 Å²	33	74.8 Å²	74.8	22%	0.223	38%	0.375	C	S	.	.	H	α-helix	trans	-58.2	-43.7	172.2	-74.2	0	0	0	0	111.1	C71 R253 I254 R259 I260 E261	C71-C257 WeakPolarHBondContact CB-SG 3.36Å; C71-C257 WeakPolarHBondContact SG-CB 3.39Å; C71-C257 CovalentContact SG-SG 2.06Å; C71-C257 PolarHBondContact SG-SG 2.8Å; R253-C257 PolarHBondContact O-N 2.58Å; I254-C257 PolarHBondContact O-N 3Å; C257-R259 VanDerWaalsContact C-N 3.29Å; C257-R259 PolarHBondContact O-N 3.35Å; C257-I260 PolarHBondContact O-N 2.92Å; C257-E261 WeakPolarHBondContact O-CB 3.48Å; C257-E261 PolarHBondContact O-N 2.82Å
258	N	63.7	Low	58.7	Low	74 Å²	74	78.4 Å²	78.4	40%	0.396	39%	0.39	S	S	.	.	H	α-helix	trans	-63.7	-33.9	175.7	-68.8	-17.6	0	0	0	112.3	I254 N255 D256 S262	I254-N258 WeakPolarHBondContact O-CB 3.48Å; I254-N258 VanDerWaalsContact O-CG 3.24Å; I254-N258 PolarHBondContact O-N 3.29Å; I254-N258 PolarHBondContact O-ND2 3.17Å; N255-N258 PolarHBondContact O-N 2.91Å; D256-N258 VanDerWaalsContact C-N 3.3Å; D256-N258 PolarHBondContact O-N 2.8Å; N258-S262 WeakPolarHBondContact O-CB 3.21Å; N258-S262 PolarHBondContact O-N 2.83Å
259	R	63.4	Low	58.9	Low	105 Å²	105	80.5 Å²	80.5	40%	0.396	39%	0.393	S	S	.	.	H	α-helix	trans	-70.3	-41.4	174.2	-72.8	167	-175.1	168.1	-9.7	111.7	N255 D256 C257 S262 F263 L272 G274	N255-R259 PolarHBondContact ND2-NH2 2.78Å; N255-R259 VanDerWaalsContact ND2-NH2 3.16Å; N255-R259 WeakPolarHBondContact O-CG 3.32Å; N255-R259 PolarHBondContact O-N 3.12Å; D256-R259 CarbonylContact O-C 3.58Å; D256-R259 WeakPolarHBondContact O-CB 3.21Å; D256-R259 PolarHBondContact O-N 2.85Å; D256-R259 VanDerWaalsContact O-N 3.1Å; D256-R259 IonicContact OD1-CZ 3.86Å; D256-R259 IonicContact OD1-NH1 3.72Å; D256-R259 PolarHBondContact OD1-NH1 2.84Å; C257-R259 VanDerWaalsContact C-N 3.29Å; C257-R259 PolarHBondContact O-N 3.35Å; R259-S262 PolarHBondContact O-N 2.79Å; R259-F263 VanDerWaalsContact O-CB 3.23Å; R259-F263 WeakPolarHBondContact O-CB 3.43Å; R259-F263 PolarHBondContact O-N 2.84Å; R259-L272 HydrophobicContact CB-CD2 3.69Å; R259-G274 PolarHBondContact NH1-O 2.82Å
260	I	64	Low	58.9	Low	20 Å²	20	82.5 Å²	82.5	10%	0.103	40%	0.403	C	S	.	.	H	α-helix	trans	-59.8	-49.6	173.7	-68.4	167.3	0	0	0	109	D256 C257 S262 F263 F264 L277	D256-I260 VanDerWaalsContact O-CG1 3.26Å; D256-I260 WeakPolarHBondContact O-CG1 3.36Å; D256-I260 PolarHBondContact O-N 2.79Å; C257-I260 PolarHBondContact O-N 2.92Å; I260-S262 PolarHBondContact O-N 2.97Å; I260-F263 WeakPolarHBondContact O-CB 3.14Å; I260-F263 PolarHBondContact O-N 3.28Å; I260-F263 VanDerWaalsContact O-N 3.12Å; I260-F264 HydrophobicContact CG2-CD2 3.75Å; I260-F264 HydrophobicContact CG2-CE2 3.39Å; I260-F264 WeakPolarHBondContact O-CD2 3.38Å; I260-F264 PolarHBondContact O-N 3.44Å; I260-L277 HydrophobicContact CD1-CB 4.19Å
261	E	61.2	Low	58.8	Low	60 Å²	60	81.2 Å²	81.2	28%	0.28	40%	0.402	S	S	.	.	H	α-helix	trans	-59.1	-46.8	176	-172.6	-171.1	-179.8	0	0	111.3	E73 C257 F263 F264 R265	E73-E261 WeakPolarHBondContact OE1-CA 3.48Å; C257-E261 WeakPolarHBondContact O-CB 3.48Å; C257-E261 PolarHBondContact O-N 2.82Å; E261-F263 VanDerWaalsContact C-N 3.3Å; E261-F263 PolarHBondContact O-N 3.32Å; E261-F264 PolarHBondContact O-N 2.85Å; E261-R265 HydrophobicContact CG-CG 4.41Å; E261-R265 WeakPolarHBondContact O-CB 3.48Å; E261-R265 VanDerWaalsContact O-CG 3.28Å; E261-R265 WeakPolarHBondContact O-CG 3.37Å; E261-R265 PolarHBondContact O-N 3.13Å; E261-R265 IonicContact OE1-CZ 3.84Å; E261-R265 IonicContact OE1-NE 3.25Å; E261-R265 PolarHBondContact OE1-NE 3.09Å; E261-R265 IonicContact OE1-NH2 3.78Å; E261-R265 PolarHBondContact OE1-NH2 2.91Å
262	S	62	Low	58.6	Low	58 Å²	58	76.4 Å²	76.4	41%	0.406	38%	0.377	S	S	.	.	H	α-helix	trans	-61.3	-39.1	176.8	177.5	0	0	0	0	111.9	N258 R259 I260 R265 T266	N258-S262 WeakPolarHBondContact O-CB 3.21Å; N258-S262 PolarHBondContact O-N 2.83Å; R259-S262 PolarHBondContact O-N 2.79Å; I260-S262 PolarHBondContact O-N 2.97Å; S262-R265 PolarHBondContact O-N 2.85Å; S262-T266 WeakPolarHBondContact O-CB 3.48Å; S262-T266 WeakPolarHBondContact O-CG2 3.44Å; S262-T266 PolarHBondContact O-N 3.09Å; S262-T266 PolarHBondContact O-OG1 3.01Å
263	F	62.7	Low	58.3	Low	28 Å²	28	81.6 Å²	81.6	12%	0.123	40%	0.396	C	S	.	.	H	α-helix	trans	-62.6	-46.3	176.4	173.6	-111.5	0	0	0	111	R259 I260 E261 R267 L272 P331	R259-F263 VanDerWaalsContact O-CB 3.23Å; R259-F263 WeakPolarHBondContact O-CB 3.43Å; R259-F263 PolarHBondContact O-N 2.84Å; I260-F263 WeakPolarHBondContact O-CB 3.14Å; I260-F263 PolarHBondContact O-N 3.28Å; I260-F263 VanDerWaalsContact O-N 3.12Å; E261-F263 VanDerWaalsContact C-N 3.3Å; E261-F263 PolarHBondContact O-N 3.32Å; F263-R267 PolarHBondContact O-N 2.91Å; F263-L272 HydrophobicContact CB-CD1 3.81Å; F263-L272 HydrophobicContact CB-CG 4.5Å; F263-L272 HydrophobicContact CD1-CD1 3.69Å; F263-L272 HydrophobicContact CD2-CD1 3.78Å; F263-L272 HydrophobicContact CE1-CD1 4.06Å; F263-L272 HydrophobicContact CE2-CD1 4.21Å; F263-L272 HydrophobicContact CG-CD1 3.51Å; F263-L272 HydrophobicContact CG-CG 4.48Å; F263-L272 HydrophobicContact CZ-CD1 4.33Å; F263-P331 HydrophobicContact CD1-CB 4.14Å; F263-P331 HydrophobicContact CD1-CG 4.25Å; F263-P331 HydrophobicContact CE1-CB 3.33Å; F263-P331 HydrophobicContact CE1-CG 3.55Å; F263-P331 HydrophobicContact CE2-CG 4.5Å; F263-P331 HydrophobicContact CZ-CB 3.86Å; F263-P331 HydrophobicContact CZ-CG 3.67Å
264	F	63.2	Low	58.2	Low	57 Å²	57	81.9 Å²	81.9	25%	0.25	41%	0.41	C	S	.	.	H	α-helix	trans	-66.2	-36.7	174.4	-72	-65.4	0	0	0	113	E73 I260 E261 W285 P331 L332	E73-F264 WeakPolarHBondContact OE1-CD2 3.03Å; E73-F264 WeakPolarHBondContact OE2-CD2 3.33Å; I260-F264 HydrophobicContact CG2-CD2 3.75Å; I260-F264 HydrophobicContact CG2-CE2 3.39Å; I260-F264 WeakPolarHBondContact O-CD2 3.38Å; I260-F264 PolarHBondContact O-N 3.44Å; E261-F264 PolarHBondContact O-N 2.85Å; F264-W285 HydrophobicContact CD2-CH2 4.39Å; F264-W285 AromaticContact CE1-CH2 3.87Å; F264-W285 HydrophobicContact CE1-CH2 3.87Å; F264-W285 HydrophobicContact CE1-CZ3 4.02Å; F264-W285 AromaticContact CE2-CH2 3.62Å; F264-W285 HydrophobicContact CE2-CH2 3.62Å; F264-W285 AromaticContact CE2-CZ3 3.88Å; F264-W285 HydrophobicContact CE2-CZ3 3.88Å; F264-W285 AromaticContact CZ-CH2 3.39Å; F264-W285 HydrophobicContact CZ-CH2 3.39Å; F264-W285 AromaticContact CZ-CZ3 3.35Å; F264-W285 HydrophobicContact CZ-CZ3 3.35Å; F264-P331 HydrophobicContact CD1-CB 4Å; F264-P331 HydrophobicContact CD1-CG 4.48Å; F264-P331 HydrophobicContact CE1-CB 3.47Å; F264-P331 VanDerWaalsContact CE1-CB 3.47Å; F264-P331 HydrophobicContact CE1-CG 4.4Å; F264-P331 HydrophobicContact CZ-CB 4.29Å; F264-L332 HydrophobicContact CE1-CD2 3.76Å; F264-L332 HydrophobicContact CE1-CG 4.47Å; F264-L332 HydrophobicContact CZ-CD2 4.02Å
265	R	62.1	Low	58.3	Low	158 Å²	158	77.9 Å²	77.9	60%	0.596	39%	0.389	S	S	*	.	H	α-helix	trans	-72.8	-46.4	-179.9	-77	178.5	179.7	-95.8	7.4	113.7	E261 S262	E261-R265 HydrophobicContact CG-CG 4.41Å; E261-R265 WeakPolarHBondContact O-CB 3.48Å; E261-R265 VanDerWaalsContact O-CG 3.28Å; E261-R265 WeakPolarHBondContact O-CG 3.37Å; E261-R265 PolarHBondContact O-N 3.13Å; E261-R265 IonicContact OE1-CZ 3.84Å; E261-R265 IonicContact OE1-NE 3.25Å; E261-R265 PolarHBondContact OE1-NE 3.09Å; E261-R265 IonicContact OE1-NH2 3.78Å; E261-R265 PolarHBondContact OE1-NH2 2.91Å; S262-R265 PolarHBondContact O-N 2.85Å
266	T	64.1	Low	58.7	Low	65 Å²	65	74.9 Å²	74.9	40%	0.399	37%	0.373	S	S	.	.	H	α-helix	trans	-88	-13.9	-169.6	58.2	0	0	0	0	113.2	S262 N268	S262-T266 WeakPolarHBondContact O-CB 3.48Å; S262-T266 WeakPolarHBondContact O-CG2 3.44Å; S262-T266 PolarHBondContact O-N 3.09Å; S262-T266 PolarHBondContact O-OG1 3.01Å; T266-N268 PolarHBondContact O-N 3.18Å; T266-N268 WeakPolarHBondContact OG1-CB 3.44Å; T266-N268 PolarHBondContact OG1-N 2.71Å
267	R	55.6	Low	59.2	Low	214 Å²	214	75.2 Å²	75.2	81%	0.808	38%	0.375	S	S	*	.			trans	50.3	15	-167.9	-59.4	-179.1	179.3	170.9	-0.7	112.9	F263 M269	F263-R267 PolarHBondContact O-N 2.91Å; R267-M269 PolarHBondContact O-N 3.48Å; R267-M269 VanDerWaalsContact O-N 3.16Å
268	N	50.6	Low	59.9	Low	97 Å²	97	75.6 Å²	75.6	52%	0.519	38%	0.375	S	S	.	.			trans	-76.1	111.7	-178.1	-81.2	-22.3	0	0	0	107.3	T266 L270	T266-N268 PolarHBondContact O-N 3.18Å; T266-N268 WeakPolarHBondContact OG1-CB 3.44Å; T266-N268 PolarHBondContact OG1-N 2.71Å; N268-L270 PolarHBondContact O-N 2.76Å
269	M	51	Low	60.5	Low	137 Å²	137	75.5 Å²	75.5	68%	0.675	37%	0.374	S	S	*	.			trans	-69	26.5	176.3	-61	-70	-172.2	0	0	112.8	R267 P271	R267-M269 PolarHBondContact O-N 3.48Å; R267-M269 VanDerWaalsContact O-N 3.16Å; M269-P271 WeakPolarHBondContact O-CD 3.38Å
270	L	51.7	Low	61.5	Low	133 Å²	133	71.5 Å²	71.5	70%	0.696	36%	0.363	S	S	*	.			trans	-68.2	123.1	168.9	-73.6	174.2	0	0	0	106.4	N268 L272	N268-L270 PolarHBondContact O-N 2.76Å; L270-L272 PolarHBondContact O-N 3.42Å
271	P	49	Very low	62.5	Low	87 Å²	87	73.1 Å²	73.1	57%	0.565	37%	0.372	S	S	*	.			trans	-63.2	126.3	-175.8	25.5	-33	0	0	0	108.7	M269 H273	M269-P271 WeakPolarHBondContact O-CD 3.38Å; P271-H273 WeakPolarHBondContact CB-ND1 3.26Å; P271-H273 WeakPolarHBondContact CG-ND1 3.33Å; P271-H273 PolarHBondContact O-N 2.83Å
272	L	50.6	Low	64	Low	22 Å²	22	72.2 Å²	72.2	12%	0.115	37%	0.366	C	S	.	.			trans	-62.2	60.3	168.8	-85.6	148.5	0	0	0	110.3	R259 F263 L270 G274 S275	R259-L272 HydrophobicContact CB-CD2 3.69Å; F263-L272 HydrophobicContact CB-CD1 3.81Å; F263-L272 HydrophobicContact CB-CG 4.5Å; F263-L272 HydrophobicContact CD1-CD1 3.69Å; F263-L272 HydrophobicContact CD2-CD1 3.78Å; F263-L272 HydrophobicContact CE1-CD1 4.06Å; F263-L272 HydrophobicContact CE2-CD1 4.21Å; F263-L272 HydrophobicContact CG-CD1 3.51Å; F263-L272 HydrophobicContact CG-CG 4.48Å; F263-L272 HydrophobicContact CZ-CD1 4.33Å; L270-L272 PolarHBondContact O-N 3.42Å; L272-G274 PolarHBondContact O-N 2.78Å; L272-G274 VanDerWaalsContact O-N 3.17Å; L272-S275 PolarHBondContact O-N 3.33Å
273	H	48.6	Very low	65.4	Low	164 Å²	164	70.9 Å²	70.9	76%	0.759	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	121.4	173.7	-80.5	71.7	0	0	0	108.7	P271	P271-H273 WeakPolarHBondContact CB-ND1 3.26Å; P271-H273 WeakPolarHBondContact CG-ND1 3.33Å; P271-H273 PolarHBondContact O-N 2.83Å
274	G	55.5	Low	66.9	Low	42 Å²	42	71.8 Å²	71.8	43%	0.433	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.8	45.5	-178.7	0	0	0	0	0	113.7	R259 L272	R259-G274 PolarHBondContact NH1-O 2.82Å; L272-G274 PolarHBondContact O-N 2.78Å; L272-G274 VanDerWaalsContact O-N 3.17Å
275	S	63.6	Low	68.3	Low	1 Å²	1	72 Å²	72	1%	0.007	36%	0.358	C	S	.	.			trans	-93.1	149.8	168.1	69	0	0	0	0	111.3	L272 L277 D278 D279	L272-S275 PolarHBondContact O-N 3.33Å; S275-L277 PolarHBondContact O-N 2.92Å; S275-D278 WeakPolarHBondContact O-CA 3.39Å; S275-D278 PolarHBondContact O-N 3.44Å; S275-D278 PolarHBondContact OG-N 3.16Å; S275-D278 PolarHBondContact OG-OD2 3.01Å; S275-D279 PolarHBondContact O-N 3.25Å
276	L	67.8	Low	69.9	Low	12 Å²	12	66 Å²	66	6%	0.063	34%	0.337	C	S	.	.	H	α-helix	trans	-40.5	-43.7	167.4	170.5	62.8	0	0	0	112.7	D69 C71 D256 D278 S280	D69-L276 HydrophobicContact CB-CD1 3.62Å; D69-L276 HydrophobicContact CB-CD2 4.27Å; D69-L276 WeakPolarHBondContact OD2-CD1 3.45Å; C71-L276 HydrophobicContact CB-CD2 4.42Å; D256-L276 HydrophobicContact CB-CB 3.4Å; D256-L276 VanDerWaalsContact CG-N 3.29Å; D256-L276 PolarHBondContact OD2-N 2.66Å; L276-D278 PolarHBondContact O-N 3.45Å; L276-S280 WeakPolarHBondContact CD1-OG 3.5Å; L276-S280 VanDerWaalsContact O-CB 3.32Å; L276-S280 WeakPolarHBondContact O-CB 3.47Å; L276-S280 PolarHBondContact O-N 3.17Å; L276-S280 VanDerWaalsContact O-N 3.11Å; L276-S280 PolarHBondContact O-OG 3.27Å
277	L	71.4	Confident	71.4	Confident	12 Å²	12	63.3 Å²	63.3	6%	0.063	32%	0.321	C	S	.	.	H	α-helix	trans	-60.4	-46.2	178.5	179	61.5	0	0	0	111.1	I260 S275 V283 F335 R371	I260-L277 HydrophobicContact CD1-CB 4.19Å; S275-L277 PolarHBondContact O-N 2.92Å; L277-V283 HydrophobicContact CD1-CB 3.99Å; L277-V283 HydrophobicContact CD1-CG1 3.78Å; L277-V283 HydrophobicContact CD1-CG2 3.86Å; L277-F335 HydrophobicContact CD1-CE2 4.17Å; L277-F335 HydrophobicContact CD1-CZ 3.68Å; L277-F335 HydrophobicContact CD2-CE2 4.38Å; L277-R371 PolarHBondContact O-NE 3.29Å; L277-R371 PolarHBondContact O-NH1 2.88Å; L277-R371 PolarHBondContact O-NH2 3.16Å
278	D	76.5	Confident	73.3	Confident	41 Å²	41	55.1 Å²	55.1	22%	0.219	29%	0.294	C	S	.	.	H	α-helix	trans	-77.3	-29.6	-177	-72	-36.9	0	0	0	113.5	S275 L276 K334 R371	S275-D278 WeakPolarHBondContact O-CA 3.39Å; S275-D278 PolarHBondContact O-N 3.44Å; S275-D278 PolarHBondContact OG-N 3.16Å; S275-D278 PolarHBondContact OG-OD2 3.01Å; L276-D278 PolarHBondContact O-N 3.45Å; D278-K334 IonicContact OD1-NZ 2.68Å; D278-K334 PolarHBondContact OD1-NZ 3.5Å; D278-K334 IonicContact OD2-NZ 2.72Å; D278-K334 PolarHBondContact OD2-NZ 3.48Å; D278-R371 PolarHBondContact O-NH2 3.4Å; D278-R371 IonicContact OD1-CZ 3.72Å; D278-R371 IonicContact OD1-NH1 2.7Å; D278-R371 PolarHBondContact OD1-NH1 2.92Å
279	D	77	Confident	75.3	Confident	72 Å²	72	52.2 Å²	52.2	39%	0.385	28%	0.277	S	S	.	.	H	α-helix	trans	-81.1	-24.4	-179.9	-65.1	-17.1	0	0	0	113.3	R253 S275 K373	R253-D279 IonicContact NH2-OD2 3.67Å; S275-D279 PolarHBondContact O-N 3.25Å; D279-K373 PolarHBondContact O-NZ 3.49Å
280	S	83.2	Confident	77.2	Confident	22 Å²	22	49.9 Å²	49.9	15%	0.154	27%	0.267	C	S	.	.			trans	-78.1	132.8	-178.6	-58	0	0	0	0	111.9	L276	L276-S280 WeakPolarHBondContact CD1-OG 3.5Å; L276-S280 VanDerWaalsContact O-CB 3.32Å; L276-S280 WeakPolarHBondContact O-CB 3.47Å; L276-S280 PolarHBondContact O-N 3.17Å; L276-S280 VanDerWaalsContact O-N 3.11Å; L276-S280 PolarHBondContact O-OG 3.27Å
281	D	86.1	Confident	79.2	Confident	54 Å²	54	45.8 Å²	45.8	29%	0.289	24%	0.244	S	C	.	.	S	Bend	trans	-63.4	-42.9	179.4	-60.5	-49.9	0	0	0	112.7	E372 K373 N378	D281-E372 CarbonylContact O-C 3.49Å; D281-E372 WeakPolarHBondContact O-CA 3.49Å; D281-K373 PolarHBondContact O-N 2.93Å; D281-K373 IonicContact OD1-NZ 3.91Å; D281-N378 WeakPolarHBondContact CA-ND2 3.47Å; D281-N378 VanDerWaalsContact CB-ND2 3.33Å; D281-N378 WeakPolarHBondContact CB-ND2 2.97Å; D281-N378 PolarHBondContact O-ND2 3.27Å; D281-N378 VanDerWaalsContact O-ND2 3.09Å
282	Y	91.6	Very high	81.4	Confident	40 Å²	40	44.8 Å²	44.8	16%	0.157	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	133.1	176.5	-53.5	-63.7	0	0	0	110	R371 E372 N378 D379 L380 A405 M406	Y282-R371 WeakPolarHBondContact CA-O 3.01Å; Y282-E372 HydrophobicContact CD1-CG 4.06Å; Y282-E372 HydrophobicContact CE1-CG 4.02Å; Y282-N378 HydrophobicContact CE1-CB 3.8Å; Y282-D379 PolarHBondContact OH-N 2.89Å; Y282-D379 VanDerWaalsContact OH-N 3.12Å; Y282-L380 HydrophobicContact CD1-CB 3.99Å; Y282-L380 HydrophobicContact CD1-CD1 4.34Å; Y282-L380 HydrophobicContact CD1-CD2 4.09Å; Y282-L380 HydrophobicContact CD1-CG 4.38Å; Y282-L380 HydrophobicContact CE1-CB 3.77Å; Y282-A405 HydrophobicContact CD2-CB 4.17Å; Y282-A405 HydrophobicContact CE2-CB 3.85Å; Y282-M406 WeakPolarHBondContact CE2-O 3.43Å; Y282-M406 VanDerWaalsContact CZ-O 3.29Å; Y282-M406 PolarHBondContact OH-O 3.02Å
283	V	91	Very high	83.5	Confident	30 Å²	30	44 Å²	44	18%	0.182	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	124.2	173.2	-177.5	0	0	0	0	109.4	L277 F335 Y370 R371	L277-V283 HydrophobicContact CD1-CB 3.99Å; L277-V283 HydrophobicContact CD1-CG1 3.78Å; L277-V283 HydrophobicContact CD1-CG2 3.86Å; V283-F335 HydrophobicContact CB-CE1 4.36Å; V283-F335 HydrophobicContact CG1-CE1 3.97Å; V283-F335 HydrophobicContact CG1-CZ 4.12Å; V283-Y370 CarbonylContact O-C 3.55Å; V283-Y370 WeakPolarHBondContact O-CA 3.48Å; V283-R371 HydrophobicContact CB-CB 4.44Å; V283-R371 PolarHBondContact N-O 3.35Å; V283-R371 PolarHBondContact O-N 3.36Å
284	F	94.5	Very high	85.8	Confident	47 Å²	47	39.4 Å²	39.4	21%	0.206	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	130.2	174	-58.4	-84.5	0	0	0	109.4	I154 V156 F286 L380 F403	I154-F284 HydrophobicContact CD1-CE2 3.88Å; I154-F284 HydrophobicContact CD1-CZ 3.83Å; I154-F284 HydrophobicContact CG2-CE2 4.26Å; I154-F284 HydrophobicContact CG2-CZ 4.24Å; V156-F284 HydrophobicContact CG2-CB 4.4Å; V156-F284 HydrophobicContact CG2-CD1 3.86Å; V156-F284 HydrophobicContact CG2-CE1 4.35Å; V156-F284 HydrophobicContact CG2-CG 4.08Å; F284-F286 HydrophobicContact CB-CD1 4.14Å; F284-F286 HydrophobicContact CB-CE1 4.24Å; F284-L380 HydrophobicContact CE1-CD1 4.36Å; F284-L380 HydrophobicContact CE1-CD2 4.08Å; F284-L380 HydrophobicContact CZ-CD1 3.98Å; F284-L380 HydrophobicContact CZ-CD2 4.18Å; F284-F403 HydrophobicContact CD1-CD2 4.26Å; F284-F403 AromaticContact CD1-CE2 3.91Å; F284-F403 HydrophobicContact CD1-CE2 3.91Å; F284-F403 HydrophobicContact CD1-CZ 4.16Å; F284-F403 HydrophobicContact CE1-CB 4.48Å; F284-F403 HydrophobicContact CE1-CD1 4.04Å; F284-F403 AromaticContact CE1-CD2 3.61Å; F284-F403 HydrophobicContact CE1-CD2 3.61Å; F284-F403 HydrophobicContact CE1-CE1 4.1Å; F284-F403 AromaticContact CE1-CE2 3.67Å; F284-F403 HydrophobicContact CE1-CE2 3.67Å; F284-F403 AromaticContact CE1-CG 3.8Å; F284-F403 HydrophobicContact CE1-CG 3.8Å; F284-F403 AromaticContact CE1-CZ 3.94Å; F284-F403 HydrophobicContact CE1-CZ 3.94Å; F284-F403 HydrophobicContact CZ-CD2 4.42Å; F284-F403 HydrophobicContact CZ-CG 4.41Å
285	W	92.7	Very high	87.7	Confident	63 Å²	63	40.5 Å²	40.5	24%	0.239	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	120.2	171.3	-172.4	2.7	0	0	0	109.3	E73 F264 M289 L332 F335 I369	E73-W285 WeakPolarHBondContact OE2-CZ2 3.38Å; F264-W285 HydrophobicContact CD2-CH2 4.39Å; F264-W285 AromaticContact CE1-CH2 3.87Å; F264-W285 HydrophobicContact CE1-CH2 3.87Å; F264-W285 HydrophobicContact CE1-CZ3 4.02Å; F264-W285 AromaticContact CE2-CH2 3.62Å; F264-W285 HydrophobicContact CE2-CH2 3.62Å; F264-W285 AromaticContact CE2-CZ3 3.88Å; F264-W285 HydrophobicContact CE2-CZ3 3.88Å; F264-W285 AromaticContact CZ-CH2 3.39Å; F264-W285 HydrophobicContact CZ-CH2 3.39Å; F264-W285 AromaticContact CZ-CZ3 3.35Å; F264-W285 HydrophobicContact CZ-CZ3 3.35Å; W285-M289 HydrophobicContact CB-CE 4.42Å; W285-M289 HydrophobicContact CD2-CE 4.33Å; W285-M289 HydrophobicContact CG-CE 3.9Å; W285-M289 WeakPolarHBondContact O-CE 3.4Å; W285-L332 HydrophobicContact CE3-CD2 3.83Å; W285-L332 HydrophobicContact CH2-CD2 3.75Å; W285-L332 HydrophobicContact CZ3-CD2 3.12Å; W285-F335 HydrophobicContact CB-CE1 4.02Å; W285-F335 HydrophobicContact CB-CZ 4.5Å; W285-F335 HydrophobicContact CE3-CE1 4.42Å; W285-F335 HydrophobicContact CE3-CE2 4.07Å; W285-F335 AromaticContact CE3-CZ 3.94Å; W285-F335 HydrophobicContact CE3-CZ 3.94Å; W285-F335 HydrophobicContact CZ3-CE2 4.41Å; W285-I369 HydrophobicContact CB-CD1 4.31Å; W285-I369 HydrophobicContact CB-CG1 3.82Å; W285-I369 HydrophobicContact CD2-CD1 4.4Å; W285-I369 HydrophobicContact CE3-CD1 4.11Å; W285-I369 HydrophobicContact CG-CG1 4.45Å; W285-I369 PolarHBondContact N-O 3.04Å; W285-I369 WeakPolarHBondContact O-CG1 3.42Å; W285-I369 PolarHBondContact O-N 3Å; W285-I369 VanDerWaalsContact O-O 3.04Å
286	F	96.7	Very high	89.2	Confident	32 Å²	32	43 Å²	43	14%	0.14	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	151.5	-174	55	-79.7	0	0	0	111.1	V156 A188 L232 F284 R367 V368	V156-F286 HydrophobicContact CG1-CB 3.88Å; V156-F286 HydrophobicContact CG1-CD1 3.3Å; V156-F286 HydrophobicContact CG1-CD2 3.61Å; V156-F286 HydrophobicContact CG1-CE1 3.59Å; V156-F286 HydrophobicContact CG1-CE2 3.83Å; V156-F286 HydrophobicContact CG1-CG 3.31Å; V156-F286 HydrophobicContact CG1-CZ 3.82Å; A188-F286 HydrophobicContact CB-CE1 4.32Å; A188-F286 HydrophobicContact CB-CZ 3.87Å; L232-F286 HydrophobicContact CD1-CE1 4.45Å; L232-F286 HydrophobicContact CD1-CE2 3.99Å; L232-F286 HydrophobicContact CD1-CZ 3.47Å; L232-F286 VanDerWaalsContact CD1-CZ 3.47Å; F284-F286 HydrophobicContact CB-CD1 4.14Å; F284-F286 HydrophobicContact CB-CE1 4.24Å; F286-R367 CarbonylContact C-O 3.58Å; F286-R367 WeakPolarHBondContact CA-O 3.5Å; F286-R367 WeakPolarHBondContact CB-O 3.3Å; F286-V368 HydrophobicContact CB-CB 4.19Å; F286-V368 HydrophobicContact CB-CG1 4.19Å; F286-V368 HydrophobicContact CB-CG2 3.81Å
287	G	96.1	Very high	90.5	Very high	7 Å²	7	48.7 Å²	48.7	7%	0.072	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	158.2	178.2	-179.5	0	0	0	0	0	113.9	T158 M289 D366 R367	T158-G287 WeakPolarHBondContact OG1-CA 3.5Å; G287-M289 VanDerWaalsContact C-N 3.33Å; G287-M289 PolarHBondContact O-N 3.49Å; G287-D366 WeakPolarHBondContact O-CA 3.24Å; G287-R367 PolarHBondContact N-O 3.5Å; G287-R367 PolarHBondContact O-N 2.8Å
288	D	95.3	Very high	91.7	Very high	43 Å²	43	52.1 Å²	52.1	23%	0.23	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	94.5	155.7	-178.4	-0.9	0	0	0	109.3	N160 Q192 N290 T365 H396	N160-D288 HydrophobicContact CB-CB 4.24Å; N160-D288 PolarHBondContact ND2-OD2 3.35Å; Q192-D288 HydrophobicContact CG-CB 4.41Å; D288-N290 VanDerWaalsContact C-N 3.3Å; D288-N290 WeakPolarHBondContact OD1-CA 3.19Å; D288-N290 PolarHBondContact OD1-N 3.17Å; D288-T365 WeakPolarHBondContact OD1-CB 3.25Å; D288-H396 IonicContact OD2-CE1 3.34Å
289	M	90.8	Very high	92.6	Very high	36 Å²	36	50.1 Å²	50.1	18%	0.177	25%	0.252	C	S	.	.			trans	-86.1	-6.7	177.1	-62.1	-176.8	177.7	0	0	112.1	W285 G287 F291 L322 T365 R367 I369	W285-M289 HydrophobicContact CB-CE 4.42Å; W285-M289 HydrophobicContact CD2-CE 4.33Å; W285-M289 HydrophobicContact CG-CE 3.9Å; W285-M289 WeakPolarHBondContact O-CE 3.4Å; G287-M289 VanDerWaalsContact C-N 3.33Å; G287-M289 PolarHBondContact O-N 3.49Å; M289-F291 HydrophobicContact CB-CD2 3.57Å; M289-F291 HydrophobicContact CB-CE2 3.96Å; M289-F291 PolarHBondContact O-N 2.82Å; M289-F291 HydrophobicContact SD-CD2 4.48Å; M289-F291 HydrophobicContact SD-CE2 4.46Å; M289-L322 HydrophobicContact SD-CD2 3.83Å; M289-T365 PolarHBondContact N-O 2.78Å; M289-R367 HydrophobicContact CE-CB 4.45Å; M289-R367 HydrophobicContact SD-CB 3.96Å; M289-R367 HydrophobicContact SD-CG 4.49Å; M289-I369 HydrophobicContact CE-CD1 3.98Å; M289-I369 HydrophobicContact CE-CG1 3.98Å
290	N	91.6	Very high	93.5	Very high	87 Å²	87	49.6 Å²	49.6	47%	0.465	25%	0.251	S	S	.	.			trans	55.2	23.5	177.3	-178.7	47.9	0	0	0	114.1	D288 R292 T365	D288-N290 VanDerWaalsContact C-N 3.3Å; D288-N290 WeakPolarHBondContact OD1-CA 3.19Å; D288-N290 PolarHBondContact OD1-N 3.17Å; N290-R292 VanDerWaalsContact OD1-CZ 3.26Å; N290-R292 PolarHBondContact OD1-NH2 2.78Å; N290-T365 PolarHBondContact N-O 2.76Å
291	F	93.1	Very high	94.1	Very high	48 Å²	48	56.1 Å²	56.1	21%	0.211	28%	0.279	C	S	.	.			trans	-70	143.5	163.3	-73	-79.7	0	0	0	109.5	M289 Q321 L322 V325 L332	M289-F291 HydrophobicContact CB-CD2 3.57Å; M289-F291 HydrophobicContact CB-CE2 3.96Å; M289-F291 PolarHBondContact O-N 2.82Å; M289-F291 HydrophobicContact SD-CD2 4.48Å; M289-F291 HydrophobicContact SD-CE2 4.46Å; F291-Q321 HydrophobicContact CB-CB 4.41Å; F291-Q321 HydrophobicContact CD1-CB 3.92Å; F291-L322 HydrophobicContact CB-CB 3.85Å; F291-L322 HydrophobicContact CD1-CB 4.11Å; F291-L322 HydrophobicContact CD2-CB 3.83Å; F291-L322 HydrophobicContact CD2-CD1 3.84Å; F291-L322 HydrophobicContact CD2-CD2 4.15Å; F291-L322 HydrophobicContact CD2-CG 4.14Å; F291-L322 HydrophobicContact CE1-CD1 4.45Å; F291-L322 HydrophobicContact CE2-CB 4.44Å; F291-L322 HydrophobicContact CE2-CD1 3.61Å; F291-L322 HydrophobicContact CE2-CG 4.42Å; F291-L322 HydrophobicContact CG-CB 3.66Å; F291-L322 HydrophobicContact CG-CD1 4.38Å; F291-L322 HydrophobicContact CG-CG 4.46Å; F291-L322 HydrophobicContact CZ-CD1 3.94Å; F291-V325 HydrophobicContact CE1-CB 4.48Å; F291-V325 HydrophobicContact CE1-CG2 4.06Å; F291-L332 HydrophobicContact CE2-CD1 4.45Å; F291-L332 HydrophobicContact CZ-CD1 4.16Å
292	R	95.1	Very high	94.6	Very high	66 Å²	66	57 Å²	57	25%	0.249	28%	0.284	C	S	.	.			trans	-127	178.6	-177.3	-60.9	-157.8	178.2	102.5	7.4	111.7	N290 Q321 R360 A363	N290-R292 VanDerWaalsContact OD1-CZ 3.26Å; N290-R292 PolarHBondContact OD1-NH2 2.78Å; R292-Q321 WeakPolarHBondContact O-CB 3.33Å; R292-Q321 WeakPolarHBondContact O-CG 3.29Å; R292-Q321 PolarHBondContact O-N 3.38Å; R292-Q321 PolarHBondContact O-OE1 3.2Å; R292-R360 VanDerWaalsContact NH2-NH2 3.18Å; R292-A363 HydrophobicContact CB-CB 4.08Å; R292-A363 HydrophobicContact CG-CB 3.92Å
293	L	96.3	Very high	94.8	Very high	6 Å²	6	55.7 Å²	55.7	3%	0.031	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-79.7	143.2	167.6	-59.8	176	0	0	0	110	I295 M299 L316 K319 D320 F362 Y364	L293-I295 HydrophobicContact CB-CD1 4.16Å; L293-I295 PolarHBondContact O-N 2.83Å; L293-M299 HydrophobicContact CB-CE 4.28Å; L293-M299 HydrophobicContact CD1-CE 3.81Å; L293-L316 HydrophobicContact CD1-CB 4.46Å; L293-L316 HydrophobicContact CD1-CD2 3.98Å; L293-L316 HydrophobicContact CD2-CB 4.47Å; L293-L316 VanDerWaalsContact CD2-O 3.3Å; L293-L316 WeakPolarHBondContact CD2-O 3.33Å; L293-K319 HydrophobicContact CD2-CB 4.45Å; L293-D320 HydrophobicContact CD2-CB 4.22Å; L293-F362 HydrophobicContact CD1-CD2 3.78Å; L293-F362 HydrophobicContact CD1-CE2 3.58Å; L293-Y364 HydrophobicContact CD2-CD2 3.94Å; L293-Y364 HydrophobicContact CD2-CE2 4.15Å; L293-Y364 HydrophobicContact CG-CD2 4.45Å
294	T	96.4	Very high	94.9	Very high	66 Å²	66	59.4 Å²	59.4	41%	0.405	30%	0.297	S	S	.	.			trans	-74.6	119.9	167.3	-57	0	0	0	0	108.4	K319	T294-K319 PolarHBondContact N-O 3.24Å; T294-K319 PolarHBondContact OG1-O 3.01Å
295	I	94.4	Very high	94.7	Very high	66 Å²	66	59 Å²	59	34%	0.338	31%	0.306	S	S	.	.			trans	-95.2	113.3	-178.1	-50	-54.4	0	0	0	108.8	L293 M299 V300 W361	L293-I295 HydrophobicContact CB-CD1 4.16Å; L293-I295 PolarHBondContact O-N 2.83Å; I295-M299 HydrophobicContact CD1-CE 3.99Å; I295-M299 HydrophobicContact CG2-CB 4.14Å; I295-V300 HydrophobicContact CG2-CG2 3.95Å; I295-W361 HydrophobicContact CD1-CB 4.39Å; I295-W361 HydrophobicContact CD1-CD2 3.82Å; I295-W361 HydrophobicContact CD1-CE3 3.77Å; I295-W361 HydrophobicContact CD1-CG 4.09Å; I295-W361 HydrophobicContact CD1-CZ3 4.38Å; I295-W361 HydrophobicContact CG1-CD2 4.16Å; I295-W361 HydrophobicContact CG1-CG 4.22Å; I295-W361 HydrophobicContact CG2-CD2 4.38Å; I295-W361 HydrophobicContact CG2-CH2 4.18Å; I295-W361 HydrophobicContact CG2-CZ2 3.84Å
296	D	95.1	Very high	94.7	Very high	53 Å²	53	60.9 Å²	60.9	28%	0.283	32%	0.321	S	S	.	.			trans	-118.2	-177.3	173.9	63.2	7.7	0	0	0	111.1	F298 M299 V300 K319	D296-F298 VanDerWaalsContact C-N 3.27Å; D296-F298 PolarHBondContact O-N 2.86Å; D296-F298 PolarHBondContact OD1-N 3.42Å; D296-M299 WeakPolarHBondContact O-CB 3.37Å; D296-M299 PolarHBondContact O-N 2.9Å; D296-M299 VanDerWaalsContact O-N 3.11Å; D296-M299 VanDerWaalsContact OD1-CG 3.31Å; D296-M299 WeakPolarHBondContact OD1-CG 3.5Å; D296-M299 PolarHBondContact OD1-N 2.94Å; D296-V300 WeakPolarHBondContact O-CG2 3.44Å; D296-V300 PolarHBondContact O-N 2.89Å; D296-K319 WeakPolarHBondContact OD2-CE 3.4Å; D296-K319 IonicContact OD2-NZ 3.51Å; D296-K319 PolarHBondContact OD2-NZ 3.34Å
297	D	96.4	Very high	94.7	Very high	132 Å²	132	62.8 Å²	62.8	71%	0.706	34%	0.336	S	S	*	.	H	α-helix	trans	-58.4	-40.1	-177.9	-63.2	-24.4	0	0	0	112	M299 V300 E301	D297-M299 PolarHBondContact O-N 2.96Å; D297-V300 PolarHBondContact O-N 2.84Å; D297-E301 WeakPolarHBondContact O-CG 3.49Å; D297-E301 PolarHBondContact O-N 2.82Å
298	F	95.7	Very high	94.7	Very high	83 Å²	83	62.8 Å²	62.8	36%	0.364	34%	0.335	S	S	.	.	H	α-helix	trans	-59.5	-46.3	175.4	171.7	-87	0	0	0	111.7	D296 V300 E301 N302 F303 V315	D296-F298 VanDerWaalsContact C-N 3.27Å; D296-F298 PolarHBondContact O-N 2.86Å; D296-F298 PolarHBondContact OD1-N 3.42Å; F298-V300 VanDerWaalsContact C-N 3.3Å; F298-V300 PolarHBondContact O-N 2.72Å; F298-E301 PolarHBondContact O-N 3.25Å; F298-N302 WeakPolarHBondContact CD2-ND2 3.49Å; F298-N302 VanDerWaalsContact CE2-ND2 3.33Å; F298-N302 WeakPolarHBondContact CE2-ND2 3.22Å; F298-N302 PolarHBondContact O-N 2.99Å; F298-N302 VanDerWaalsContact O-N 3.14Å; F298-N302 PolarHBondContact O-ND2 2.71Å; F298-F303 HydrophobicContact CE1-CE2 4.2Å; F298-V315 HydrophobicContact CD1-CG1 4.29Å; F298-V315 HydrophobicContact CE1-CG1 3.35Å; F298-V315 HydrophobicContact CZ-CG1 3.75Å
299	M	96	Very high	94.7	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-61.4	-40	177	-72.4	-68.5	-67.2	0	0	111.7	L293 I295 D296 D297 F303 L316 K319 F362	L293-M299 HydrophobicContact CB-CE 4.28Å; L293-M299 HydrophobicContact CD1-CE 3.81Å; I295-M299 HydrophobicContact CD1-CE 3.99Å; I295-M299 HydrophobicContact CG2-CB 4.14Å; D296-M299 WeakPolarHBondContact O-CB 3.37Å; D296-M299 PolarHBondContact O-N 2.9Å; D296-M299 VanDerWaalsContact O-N 3.11Å; D296-M299 VanDerWaalsContact OD1-CG 3.31Å; D296-M299 WeakPolarHBondContact OD1-CG 3.5Å; D296-M299 PolarHBondContact OD1-N 2.94Å; D297-M299 PolarHBondContact O-N 2.96Å; M299-F303 HydrophobicContact CE-CD2 4.16Å; M299-F303 WeakPolarHBondContact O-CB 3.37Å; M299-F303 PolarHBondContact O-N 3.12Å; M299-F303 HydrophobicContact SD-CD2 3.87Å; M299-F303 HydrophobicContact SD-CE2 4.08Å; M299-L316 HydrophobicContact CE-CD2 3.84Å; M299-L316 HydrophobicContact SD-CD2 4Å; M299-K319 HydrophobicContact CG-CG 4.27Å; M299-K319 HydrophobicContact SD-CG 4.1Å; M299-F362 HydrophobicContact CE-CE2 4.31Å; M299-F362 HydrophobicContact CE-CZ 4.41Å
300	V	95.1	Very high	95	Very high	61 Å²	61	71.7 Å²	71.7	37%	0.37	38%	0.375	S	S	.	.	H	α-helix	trans	-64.6	-47.3	177.2	176	0	0	0	0	111.4	I295 D296 D297 F298 N302 N304 W361	I295-V300 HydrophobicContact CG2-CG2 3.95Å; D296-V300 WeakPolarHBondContact O-CG2 3.44Å; D296-V300 PolarHBondContact O-N 2.89Å; D297-V300 PolarHBondContact O-N 2.84Å; F298-V300 VanDerWaalsContact C-N 3.3Å; F298-V300 PolarHBondContact O-N 2.72Å; V300-N302 VanDerWaalsContact C-N 3.32Å; V300-N302 PolarHBondContact O-N 2.81Å; V300-N304 HydrophobicContact CG1-CB 4.31Å; V300-N304 WeakPolarHBondContact O-CB 3.36Å; V300-N304 PolarHBondContact O-N 3.4Å; V300-W361 HydrophobicContact CG2-CH2 4.39Å; V300-W361 HydrophobicContact CG2-CZ2 4.24Å
301	E	96.3	Very high	95.3	Very high	158 Å²	158	71.8 Å²	71.8	74%	0.738	39%	0.387	S	S	*	.	H	α-helix	trans	-62.9	-36.9	-178.5	-73.5	175.6	177.4	0	0	112.9	D297 F298	D297-E301 WeakPolarHBondContact O-CG 3.49Å; D297-E301 PolarHBondContact O-N 2.82Å; F298-E301 PolarHBondContact O-N 3.25Å
302	N	95.8	Very high	95.6	Very high	73 Å²	73	70.7 Å²	70.7	39%	0.39	38%	0.384	S	S	.	.	H	α-helix	trans	-96.3	-27.1	-172.2	-69.5	-84.5	0	0	0	114.1	F298 V300	F298-N302 WeakPolarHBondContact CD2-ND2 3.49Å; F298-N302 VanDerWaalsContact CE2-ND2 3.33Å; F298-N302 WeakPolarHBondContact CE2-ND2 3.22Å; F298-N302 PolarHBondContact O-N 2.99Å; F298-N302 VanDerWaalsContact O-N 3.14Å; F298-N302 PolarHBondContact O-ND2 2.71Å; V300-N302 VanDerWaalsContact C-N 3.32Å; V300-N302 PolarHBondContact O-N 2.81Å
303	F	95.8	Very high	95.7	Very high	12 Å²	12	67.9 Å²	67.9	5%	0.053	37%	0.373	C	S	.	.	H	α-helix	trans	-130.1	0.9	-167.2	-59.1	-69.5	0	0	0	115	F298 M299 G305 L306 P308 D312 L316 W361 F362	F298-F303 HydrophobicContact CE1-CE2 4.2Å; M299-F303 HydrophobicContact CE-CD2 4.16Å; M299-F303 WeakPolarHBondContact O-CB 3.37Å; M299-F303 PolarHBondContact O-N 3.12Å; M299-F303 HydrophobicContact SD-CD2 3.87Å; M299-F303 HydrophobicContact SD-CE2 4.08Å; F303-G305 PolarHBondContact O-N 3Å; F303-L306 PolarHBondContact O-N 3.32Å; F303-L306 VanDerWaalsContact O-N 3.07Å; F303-L306 VanDerWaalsContact O-O 3.1Å; F303-P308 HydrophobicContact CD1-CB 4.5Å; F303-P308 HydrophobicContact CE1-CB 4.36Å; F303-D312 HydrophobicContact CE1-CB 3.98Å; F303-D312 HydrophobicContact CZ-CB 3.81Å; F303-L316 HydrophobicContact CD2-CD2 4.46Å; F303-L316 HydrophobicContact CE2-CD2 4.03Å; F303-L316 HydrophobicContact CZ-CD2 4.22Å; F303-W361 HydrophobicContact CB-CZ3 3.92Å; F303-F362 HydrophobicContact CB-CE1 3.88Å; F303-F362 HydrophobicContact CB-CZ 3.74Å; F303-F362 HydrophobicContact CD1-CE1 4.39Å; F303-F362 AromaticContact CD1-CZ 3.95Å; F303-F362 HydrophobicContact CD1-CZ 3.95Å; F303-F362 HydrophobicContact CD2-CZ 4.44Å; F303-F362 HydrophobicContact CG-CE1 4.32Å; F303-F362 AromaticContact CG-CZ 3.79Å; F303-F362 HydrophobicContact CG-CZ 3.79Å
304	N	92.9	Very high	95.8	Very high	108 Å²	108	75.7 Å²	75.7	58%	0.578	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	110.1	178.8	-176.6	25.8	0	0	0	111.5	V300 L306 W361	V300-N304 HydrophobicContact CG1-CB 4.31Å; V300-N304 WeakPolarHBondContact O-CB 3.36Å; V300-N304 PolarHBondContact O-N 3.4Å; N304-L306 PolarHBondContact O-N 3.02Å; N304-W361 HydrophobicContact CB-CH2 4.13Å; N304-W361 HydrophobicContact CB-CZ2 4.49Å
305	G	90.6	Very high	95.8	Very high	38 Å²	38	74.8 Å²	74.8	39%	0.392	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.7	-4.3	-175.9	0	0	0	0	0	114.8	F303 T357	F303-G305 PolarHBondContact O-N 3Å; G305-T357 PolarHBondContact O-OG1 3.31Å; G305-T357 VanDerWaalsContact O-OG1 3.1Å
306	L	93.7	Very high	96	Very high	103 Å²	103	71.6 Å²	71.6	54%	0.539	39%	0.385	S	S	.	.			trans	-108.4	138.5	-175.9	-63.6	176.4	0	0	0	111.1	F303 N304	F303-L306 PolarHBondContact O-N 3.32Å; F303-L306 VanDerWaalsContact O-N 3.07Å; F303-L306 VanDerWaalsContact O-O 3.1Å; N304-L306 PolarHBondContact O-N 3.02Å
307	P	95.4	Very high	96.1	Very high	73 Å²	73	70.3 Å²	70.3	47%	0.474	38%	0.378	S	S	.	.			trans	-74.9	147.9	177.6	32.3	-35.4	0	0	0	111.4	Y355	P307-Y355 HydrophobicContact CB-CD2 3.64Å; P307-Y355 HydrophobicContact CB-CE2 4.27Å
308	P	96.4	Very high	96.1	Very high	6 Å²	6	70.3 Å²	70.3	4%	0.039	37%	0.374	C	S	.	.			trans	-75.3	157.4	172.8	32.8	-33.4	0	0	0	111.3	F303 L316 L343 P344 Y355 F362	F303-P308 HydrophobicContact CD1-CB 4.5Å; F303-P308 HydrophobicContact CE1-CB 4.36Å; P308-L316 HydrophobicContact CB-CD1 3.77Å; P308-L316 HydrophobicContact CG-CD1 4.47Å; P308-L343 HydrophobicContact CB-CD2 4.34Å; P308-L343 HydrophobicContact CG-CD2 4.4Å; P308-P344 HydrophobicContact CG-CG 3.94Å; P308-Y355 HydrophobicContact CG-CE2 3.97Å; P308-F362 HydrophobicContact CB-CE1 4.35Å; P308-F362 HydrophobicContact CB-CE2 4.1Å; P308-F362 HydrophobicContact CB-CZ 3.94Å; P308-F362 HydrophobicContact CG-CD1 4.06Å; P308-F362 HydrophobicContact CG-CD2 3.98Å; P308-F362 HydrophobicContact CG-CE1 4.02Å; P308-F362 HydrophobicContact CG-CE2 3.92Å; P308-F362 HydrophobicContact CG-CG 4.02Å; P308-F362 HydrophobicContact CG-CZ 3.94Å
309	R	96.7	Very high	96.1	Very high	167 Å²	167	68.6 Å²	68.6	63%	0.63	37%	0.366	S	S	*	.			trans	-121.5	164.1	175	-57.2	167.2	-63.5	179.2	2.5	110.4	A311 D312 L343	R309-A311 PolarHBondContact O-N 3.03Å; R309-A311 VanDerWaalsContact O-N 3.1Å; R309-D312 WeakPolarHBondContact CA-OD2 3.12Å; R309-D312 WeakPolarHBondContact CB-OD2 3.4Å; R309-D312 PolarHBondContact N-OD2 2.98Å; R309-D312 IonicContact NE-OD2 3.72Å; R309-D312 IonicContact NH2-OD1 3.27Å; R309-D312 WeakPolarHBondContact O-CA 3.2Å; R309-D312 VanDerWaalsContact O-CB 3.27Å; R309-D312 WeakPolarHBondContact O-CB 3.02Å; R309-D312 PolarHBondContact O-N 2.85Å; R309-L343 VanDerWaalsContact C-CD2 3.48Å
310	T	97.4	Very high	96.2	Very high	100 Å²	100	68.6 Å²	68.6	61%	0.613	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-55.6	-33.4	-177	-49.1	0	0	0	0	112.9	D312 I313	T310-D312 PolarHBondContact O-N 3.01Å; T310-I313 HydrophobicContact CG2-CD1 3.78Å; T310-I313 WeakPolarHBondContact O-CB 3.32Å; T310-I313 WeakPolarHBondContact O-CD1 3.45Å; T310-I313 VanDerWaalsContact O-CG1 3.25Å; T310-I313 WeakPolarHBondContact O-CG1 3.09Å; T310-I313 PolarHBondContact O-N 2.84Å
311	A	97.8	Very high	96.2	Very high	88 Å²	88	69.1 Å²	69.1	73%	0.727	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-63.5	-23.9	175.8	0	0	0	0	0	113.6	R309	R309-A311 PolarHBondContact O-N 3.03Å; R309-A311 VanDerWaalsContact O-N 3.1Å
312	D	97.8	Very high	96.1	Very high	26 Å²	26	61.6 Å²	61.6	14%	0.139	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-84.1	-14.7	-176.3	-52.8	-45	0	0	0	111.9	F303 R309 T310 K314 V315 L316	F303-D312 HydrophobicContact CE1-CB 3.98Å; F303-D312 HydrophobicContact CZ-CB 3.81Å; R309-D312 WeakPolarHBondContact CA-OD2 3.12Å; R309-D312 WeakPolarHBondContact CB-OD2 3.4Å; R309-D312 PolarHBondContact N-OD2 2.98Å; R309-D312 IonicContact NE-OD2 3.72Å; R309-D312 IonicContact NH2-OD1 3.27Å; R309-D312 WeakPolarHBondContact O-CA 3.2Å; R309-D312 VanDerWaalsContact O-CB 3.27Å; R309-D312 WeakPolarHBondContact O-CB 3.02Å; R309-D312 PolarHBondContact O-N 2.85Å; T310-D312 PolarHBondContact O-N 3.01Å; D312-K314 VanDerWaalsContact C-N 3.3Å; D312-K314 PolarHBondContact O-N 2.75Å; D312-K314 VanDerWaalsContact O-N 3.16Å; D312-V315 PolarHBondContact O-N 2.88Å; D312-L316 HydrophobicContact CB-CD1 4.46Å; D312-L316 HydrophobicContact CB-CG 4.47Å; D312-L316 WeakPolarHBondContact O-CG 3.34Å; D312-L316 PolarHBondContact O-N 3.07Å
313	I	98.1	Very high	96	Very high	6 Å²	6	59.8 Å²	59.8	3%	0.031	32%	0.319	C	S	.	.	H	α-helix	trans	-50.8	-46	-172.9	-69.3	174.4	0	0	0	112.4	T310 V315 L316 M317 I340 Q341 L343	T310-I313 HydrophobicContact CG2-CD1 3.78Å; T310-I313 WeakPolarHBondContact O-CB 3.32Å; T310-I313 WeakPolarHBondContact O-CD1 3.45Å; T310-I313 VanDerWaalsContact O-CG1 3.25Å; T310-I313 WeakPolarHBondContact O-CG1 3.09Å; T310-I313 PolarHBondContact O-N 2.84Å; I313-V315 VanDerWaalsContact C-N 3.31Å; I313-V315 PolarHBondContact O-N 2.87Å; I313-L316 PolarHBondContact O-N 3.02Å; I313-L316 VanDerWaalsContact O-N 3.14Å; I313-M317 HydrophobicContact CG2-CG 4.16Å; I313-M317 VanDerWaalsContact O-CG 3.32Å; I313-M317 WeakPolarHBondContact O-CG 3.21Å; I313-M317 PolarHBondContact O-N 3.28Å; I313-I340 WeakPolarHBondContact CG2-O 3.24Å; I313-Q341 WeakPolarHBondContact CD1-O 3.44Å; I313-L343 HydrophobicContact CD1-CD2 4.38Å; I313-L343 HydrophobicContact CG1-CD2 4.08Å
314	K	97.5	Very high	95.8	Very high	171 Å²	171	61.9 Å²	61.9	74%	0.743	33%	0.331	S	S	*	.	H	α-helix	trans	-56.9	-45.6	-179.1	-68.8	-175.2	178.9	-177.6	0	112.1	D312 M317 E318	D312-K314 VanDerWaalsContact C-N 3.3Å; D312-K314 PolarHBondContact O-N 2.75Å; D312-K314 VanDerWaalsContact O-N 3.16Å; K314-M317 PolarHBondContact O-N 3.35Å; K314-E318 PolarHBondContact O-N 2.86Å
315	V	97	Very high	95.7	Very high	46 Å²	46	57.8 Å²	57.8	28%	0.279	31%	0.31	S	S	.	.	H	α-helix	trans	-70.6	-36.8	179.6	178.8	0	0	0	0	110.9	F298 D312 I313 M317 E318	F298-V315 HydrophobicContact CD1-CG1 4.29Å; F298-V315 HydrophobicContact CE1-CG1 3.35Å; F298-V315 HydrophobicContact CZ-CG1 3.75Å; D312-V315 PolarHBondContact O-N 2.88Å; I313-V315 VanDerWaalsContact C-N 3.31Å; I313-V315 PolarHBondContact O-N 2.87Å; V315-M317 VanDerWaalsContact C-N 3.33Å; V315-M317 PolarHBondContact O-N 2.98Å; V315-E318 WeakPolarHBondContact O-CB 3.4Å; V315-E318 PolarHBondContact O-N 3.11Å
316	L	98	Very high	95.7	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-63.9	-39.2	175.2	-60.3	179.5	0	0	0	111.8	L293 M299 F303 P308 D312 I313 E318 K319 D320 P344 F362 Y364	L293-L316 HydrophobicContact CD1-CB 4.46Å; L293-L316 HydrophobicContact CD1-CD2 3.98Å; L293-L316 HydrophobicContact CD2-CB 4.47Å; L293-L316 VanDerWaalsContact CD2-O 3.3Å; L293-L316 WeakPolarHBondContact CD2-O 3.33Å; M299-L316 HydrophobicContact CE-CD2 3.84Å; M299-L316 HydrophobicContact SD-CD2 4Å; F303-L316 HydrophobicContact CD2-CD2 4.46Å; F303-L316 HydrophobicContact CE2-CD2 4.03Å; F303-L316 HydrophobicContact CZ-CD2 4.22Å; P308-L316 HydrophobicContact CB-CD1 3.77Å; P308-L316 HydrophobicContact CG-CD1 4.47Å; D312-L316 HydrophobicContact CB-CD1 4.46Å; D312-L316 HydrophobicContact CB-CG 4.47Å; D312-L316 WeakPolarHBondContact O-CG 3.34Å; D312-L316 PolarHBondContact O-N 3.07Å; I313-L316 PolarHBondContact O-N 3.02Å; I313-L316 VanDerWaalsContact O-N 3.14Å; L316-E318 VanDerWaalsContact C-N 3.27Å; L316-E318 PolarHBondContact O-N 3.45Å; L316-K319 CarbonylContact O-C 3.6Å; L316-K319 WeakPolarHBondContact O-CA 3.12Å; L316-K319 PolarHBondContact O-N 3.19Å; L316-D320 PolarHBondContact O-N 3.3Å; L316-P344 HydrophobicContact CD1-CG 4.07Å; L316-F362 HydrophobicContact CD1-CE2 4.13Å; L316-F362 HydrophobicContact CD2-CE2 3.87Å; L316-F362 HydrophobicContact CD2-CZ 4.32Å; L316-Y364 HydrophobicContact CB-CE2 4.15Å; L316-Y364 HydrophobicContact CD1-CE2 4.45Å
317	M	97.4	Very high	95.5	Very high	26 Å²	26	59.6 Å²	59.6	13%	0.128	30%	0.304	C	S	.	.	H	α-helix	trans	-64.3	-29.6	177.2	-70	-57.7	101.4	0	0	113.1	I313 K314 V315 K319 D320 I323 I340 Y364	I313-M317 HydrophobicContact CG2-CG 4.16Å; I313-M317 VanDerWaalsContact O-CG 3.32Å; I313-M317 WeakPolarHBondContact O-CG 3.21Å; I313-M317 PolarHBondContact O-N 3.28Å; K314-M317 PolarHBondContact O-N 3.35Å; V315-M317 VanDerWaalsContact C-N 3.33Å; V315-M317 PolarHBondContact O-N 2.98Å; M317-K319 PolarHBondContact O-N 3.03Å; M317-D320 PolarHBondContact O-N 2.94Å; M317-I323 HydrophobicContact CB-CD1 4.26Å; M317-I323 HydrophobicContact CG-CD1 4.41Å; M317-I323 HydrophobicContact SD-CD1 3.51Å; M317-I323 VanDerWaalsContact SD-CD1 3.51Å; M317-I340 HydrophobicContact CE-CB 4.31Å; M317-I340 HydrophobicContact CE-CD1 4.27Å; M317-I340 HydrophobicContact CE-CG2 4.08Å; M317-I340 HydrophobicContact SD-CB 3.71Å; M317-I340 HydrophobicContact SD-CD1 3.91Å; M317-I340 HydrophobicContact SD-CG1 4.27Å; M317-I340 HydrophobicContact SD-CG2 4.13Å; M317-Y364 HydrophobicContact CE-CD1 4.24Å; M317-Y364 HydrophobicContact CE-CD2 3.52Å; M317-Y364 HydrophobicContact CE-CE1 3.87Å; M317-Y364 HydrophobicContact CE-CE2 3.08Å; M317-Y364 HydrophobicContact CE-CG 4.08Å
318	E	96.5	Very high	94.9	Very high	132 Å²	132	60.8 Å²	60.8	62%	0.617	30%	0.303	S	S	*	.	H	α-helix	trans	-65.7	-24	172.1	-65.9	173.1	-175.2	0	0	112.6	K314 V315 L316	K314-E318 PolarHBondContact O-N 2.86Å; V315-E318 WeakPolarHBondContact O-CB 3.4Å; V315-E318 PolarHBondContact O-N 3.11Å; L316-E318 VanDerWaalsContact C-N 3.27Å; L316-E318 PolarHBondContact O-N 3.45Å
319	K	96.7	Very high	93.5	Very high	46 Å²	46	64 Å²	64	20%	0.2	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-2.8	-179.7	-53.4	-60.9	176.6	178.1	0	113.3	L293 T294 D296 M299 L316 M317 Q321	L293-K319 HydrophobicContact CD2-CB 4.45Å; T294-K319 PolarHBondContact N-O 3.24Å; T294-K319 PolarHBondContact OG1-O 3.01Å; D296-K319 WeakPolarHBondContact OD2-CE 3.4Å; D296-K319 IonicContact OD2-NZ 3.51Å; D296-K319 PolarHBondContact OD2-NZ 3.34Å; M299-K319 HydrophobicContact CG-CG 4.27Å; M299-K319 HydrophobicContact SD-CG 4.1Å; L316-K319 CarbonylContact O-C 3.6Å; L316-K319 WeakPolarHBondContact O-CA 3.12Å; L316-K319 PolarHBondContact O-N 3.19Å; M317-K319 PolarHBondContact O-N 3.03Å; K319-Q321 PolarHBondContact O-N 3Å
320	D	97	Very high	92.3	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	33%	0.326	C	S	.	.	B	Isolated β-bridge	trans	-70.6	126.7	-175.2	-174.6	-100.4	0	0	0	112.4	L293 L316 M317 L322 I323 N324 R367	L293-D320 HydrophobicContact CD2-CB 4.22Å; L316-D320 PolarHBondContact O-N 3.3Å; M317-D320 PolarHBondContact O-N 2.94Å; D320-L322 PolarHBondContact OD1-N 3.4Å; D320-L322 VanDerWaalsContact OD1-N 3.12Å; D320-I323 HydrophobicContact CB-CB 4.24Å; D320-I323 HydrophobicContact CB-CD1 4.05Å; D320-I323 HydrophobicContact CB-CG1 4.3Å; D320-I323 WeakPolarHBondContact OD1-CG1 3.22Å; D320-I323 PolarHBondContact OD1-N 2.86Å; D320-N324 VanDerWaalsContact O-CG 3.3Å; D320-N324 PolarHBondContact O-N 3.05Å; D320-N324 PolarHBondContact O-ND2 2.77Å; D320-R367 IonicContact OD1-CZ 2.64Å; D320-R367 IonicContact OD1-NH1 3.78Å; D320-R367 PolarHBondContact OD1-NH1 3.11Å; D320-R367 VanDerWaalsContact OD1-NH1 3.11Å; D320-R367 IonicContact OD1-NH2 3.82Å; D320-R367 PolarHBondContact OD1-NH2 3.12Å; D320-R367 IonicContact OD2-CZ 2.63Å; D320-R367 IonicContact OD2-NH1 3.24Å; D320-R367 PolarHBondContact OD2-NH1 3.01Å; D320-R367 IonicContact OD2-NH2 2.66Å
321	Q	94.7	Very high	91	Very high	73 Å²	73	57 Å²	57	34%	0.341	31%	0.306	S	S	.	.	H	α-helix	trans	-70.4	-36.4	-177.1	-72.8	166.1	-6	0	0	113	F291 R292 K319 N324 V325	F291-Q321 HydrophobicContact CB-CB 4.41Å; F291-Q321 HydrophobicContact CD1-CB 3.92Å; R292-Q321 WeakPolarHBondContact O-CB 3.33Å; R292-Q321 WeakPolarHBondContact O-CG 3.29Å; R292-Q321 PolarHBondContact O-N 3.38Å; R292-Q321 PolarHBondContact O-OE1 3.2Å; K319-Q321 PolarHBondContact O-N 3Å; Q321-N324 PolarHBondContact O-N 3.4Å; Q321-V325 VanDerWaalsContact O-CG2 3.3Å; Q321-V325 WeakPolarHBondContact O-CG2 3.31Å; Q321-V325 PolarHBondContact O-N 3.31Å
322	L	94.5	Very high	90.1	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-69.7	-47.2	-178.3	178	54.9	0	0	0	110.6	M289 F291 D320 N324 V325 L326 L332 R367 I369	M289-L322 HydrophobicContact SD-CD2 3.83Å; F291-L322 HydrophobicContact CB-CB 3.85Å; F291-L322 HydrophobicContact CD1-CB 4.11Å; F291-L322 HydrophobicContact CD2-CB 3.83Å; F291-L322 HydrophobicContact CD2-CD1 3.84Å; F291-L322 HydrophobicContact CD2-CD2 4.15Å; F291-L322 HydrophobicContact CD2-CG 4.14Å; F291-L322 HydrophobicContact CE1-CD1 4.45Å; F291-L322 HydrophobicContact CE2-CB 4.44Å; F291-L322 HydrophobicContact CE2-CD1 3.61Å; F291-L322 HydrophobicContact CE2-CG 4.42Å; F291-L322 HydrophobicContact CG-CB 3.66Å; F291-L322 HydrophobicContact CG-CD1 4.38Å; F291-L322 HydrophobicContact CG-CG 4.46Å; F291-L322 HydrophobicContact CZ-CD1 3.94Å; D320-L322 PolarHBondContact OD1-N 3.4Å; D320-L322 VanDerWaalsContact OD1-N 3.12Å; L322-N324 PolarHBondContact O-N 3.37Å; L322-V325 CarbonylContact O-C 3.58Å; L322-V325 WeakPolarHBondContact O-CA 3.41Å; L322-V325 WeakPolarHBondContact O-CB 3.37Å; L322-V325 PolarHBondContact O-N 3.18Å; L322-L326 HydrophobicContact CD1-CD1 4.43Å; L322-L326 HydrophobicContact CD1-CD2 4.21Å; L322-L326 HydrophobicContact CD1-CG 4.03Å; L322-L326 HydrophobicContact CG-CD1 4.21Å; L322-L326 HydrophobicContact CG-CG 4.27Å; L322-L326 WeakPolarHBondContact O-CG 3.43Å; L322-L326 PolarHBondContact O-N 3.42Å; L322-L332 HydrophobicContact CD1-CD1 4.11Å; L322-R367 HydrophobicContact CD2-CB 3.97Å; L322-R367 HydrophobicContact CD2-CG 3.76Å; L322-I369 HydrophobicContact CD2-CG2 3.99Å
323	I	94	Very high	89.4	Confident	35 Å²	35	54.5 Å²	54.5	18%	0.179	29%	0.286	C	S	.	.	H	α-helix	trans	-55	-41.9	176.8	-71.9	173.5	0	0	0	110.9	M317 D320 L326 K327	M317-I323 HydrophobicContact CB-CD1 4.26Å; M317-I323 HydrophobicContact CG-CD1 4.41Å; M317-I323 HydrophobicContact SD-CD1 3.51Å; M317-I323 VanDerWaalsContact SD-CD1 3.51Å; D320-I323 HydrophobicContact CB-CB 4.24Å; D320-I323 HydrophobicContact CB-CD1 4.05Å; D320-I323 HydrophobicContact CB-CG1 4.3Å; D320-I323 WeakPolarHBondContact OD1-CG1 3.22Å; D320-I323 PolarHBondContact OD1-N 2.86Å; I323-L326 PolarHBondContact O-N 2.85Å; I323-K327 HydrophobicContact CG2-CD 4.26Å; I323-K327 WeakPolarHBondContact O-CG 3.26Å; I323-K327 PolarHBondContact O-N 2.57Å; I323-K327 VanDerWaalsContact O-N 3.17Å
324	N	92.4	Very high	88.8	Confident	55 Å²	55	58.7 Å²	58.7	29%	0.294	30%	0.304	S	S	.	.	H	α-helix	trans	-65.2	-39.2	176	-70.9	-31.6	0	0	0	112	D320 Q321 L322 K327 E328	D320-N324 VanDerWaalsContact O-CG 3.3Å; D320-N324 PolarHBondContact O-N 3.05Å; D320-N324 PolarHBondContact O-ND2 2.77Å; Q321-N324 PolarHBondContact O-N 3.4Å; L322-N324 PolarHBondContact O-N 3.37Å; N324-K327 PolarHBondContact O-N 3.34Å; N324-E328 WeakPolarHBondContact O-CG 3.27Å; N324-E328 PolarHBondContact O-N 2.82Å
325	V	89.7	Confident	88.6	Confident	23 Å²	23	51 Å²	51	14%	0.139	27%	0.27	C	S	.	.	H	α-helix	trans	-66.8	-35.4	175.4	166.9	0	0	0	0	113	F291 Q321 L322 K327 K330 L332	F291-V325 HydrophobicContact CE1-CB 4.48Å; F291-V325 HydrophobicContact CE1-CG2 4.06Å; Q321-V325 VanDerWaalsContact O-CG2 3.3Å; Q321-V325 WeakPolarHBondContact O-CG2 3.31Å; Q321-V325 PolarHBondContact O-N 3.31Å; L322-V325 CarbonylContact O-C 3.58Å; L322-V325 WeakPolarHBondContact O-CA 3.41Å; L322-V325 WeakPolarHBondContact O-CB 3.37Å; L322-V325 PolarHBondContact O-N 3.18Å; V325-K327 VanDerWaalsContact C-N 3.31Å; V325-K330 HydrophobicContact CB-CD 4.45Å; V325-K330 HydrophobicContact CG1-CD 3.86Å; V325-K330 HydrophobicContact CG2-CD 4.32Å; V325-L332 HydrophobicContact CG1-CB 4.18Å; V325-L332 HydrophobicContact CG1-CD1 3.86Å; V325-L332 HydrophobicContact CG1-CG 4.36Å
326	L	91.1	Very high	88.4	Confident	23 Å²	23	54.8 Å²	54.8	12%	0.12	29%	0.285	C	S	.	.	H	α-helix	trans	-68.9	-30	175.6	-64.5	177.2	0	0	0	111.9	L322 I323 L332 A333 F335 E337 I369	L322-L326 HydrophobicContact CD1-CD1 4.43Å; L322-L326 HydrophobicContact CD1-CD2 4.21Å; L322-L326 HydrophobicContact CD1-CG 4.03Å; L322-L326 HydrophobicContact CG-CD1 4.21Å; L322-L326 HydrophobicContact CG-CG 4.27Å; L322-L326 WeakPolarHBondContact O-CG 3.43Å; L322-L326 PolarHBondContact O-N 3.42Å; I323-L326 PolarHBondContact O-N 2.85Å; L326-L332 HydrophobicContact CD2-CB 3.79Å; L326-L332 WeakPolarHBondContact CD2-O 3.46Å; L326-A333 WeakPolarHBondContact O-CA 3.49Å; L326-A333 WeakPolarHBondContact O-CB 3.3Å; L326-F335 HydrophobicContact CD2-CB 4.2Å; L326-E337 HydrophobicContact CD1-CB 3.91Å; L326-I369 HydrophobicContact CD1-CG2 4.36Å; L326-I369 HydrophobicContact CD2-CD1 4.48Å
327	K	89.3	Confident	88.4	Confident	156 Å²	156	56.2 Å²	56.2	68%	0.678	29%	0.292	S	S	*	.	H	α-helix	trans	-78.5	-34.3	176.2	-70.5	170.6	-177.5	173.2	0	113.3	I323 N324 V325	I323-K327 HydrophobicContact CG2-CD 4.26Å; I323-K327 WeakPolarHBondContact O-CG 3.26Å; I323-K327 PolarHBondContact O-N 2.57Å; I323-K327 VanDerWaalsContact O-N 3.17Å; N324-K327 PolarHBondContact O-N 3.34Å; V325-K327 VanDerWaalsContact C-N 3.31Å
328	E	82.9	Confident	88.4	Confident	98 Å²	98	57.7 Å²	57.7	46%	0.458	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76	134	175.4	-70.4	172.7	-173.4	0	0	108.9	N324 K330 A333	N324-E328 WeakPolarHBondContact O-CG 3.27Å; N324-E328 PolarHBondContact O-N 2.82Å; E328-K330 HydrophobicContact CB-CD 4.27Å; E328-K330 HydrophobicContact CB-CG 4.41Å; E328-K330 PolarHBondContact O-N 2.82Å; E328-K330 VanDerWaalsContact OE2-CE 3.22Å; E328-K330 WeakPolarHBondContact OE2-CE 3.25Å; E328-K330 IonicContact OE2-NZ 3.67Å; E328-K330 PolarHBondContact OE2-NZ 2.61Å; E328-A333 WeakPolarHBondContact O-CB 3.41Å
329	G	66.2	Low	88.5	Confident	73 Å²	73	55.3 Å²	55.3	75%	0.753	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	49.3	-176.6	0	0	0	0	0	116.4
330	K	71.6	Confident	88.5	Confident	91 Å²	91	53.4 Å²	53.4	40%	0.396	29%	0.286	S	S	.	.	S	Bend	trans	-86.1	167.5	175.3	-76.5	173	174.1	162.1	0	109.6	V325 E328 L332 A333	V325-K330 HydrophobicContact CB-CD 4.45Å; V325-K330 HydrophobicContact CG1-CD 3.86Å; V325-K330 HydrophobicContact CG2-CD 4.32Å; E328-K330 HydrophobicContact CB-CD 4.27Å; E328-K330 HydrophobicContact CB-CG 4.41Å; E328-K330 PolarHBondContact O-N 2.82Å; E328-K330 VanDerWaalsContact OE2-CE 3.22Å; E328-K330 WeakPolarHBondContact OE2-CE 3.25Å; E328-K330 IonicContact OE2-NZ 3.67Å; E328-K330 PolarHBondContact OE2-NZ 2.61Å; K330-L332 PolarHBondContact O-N 2.68Å; K330-A333 WeakPolarHBondContact O-CB 3.4Å; K330-A333 PolarHBondContact O-N 3.34Å
331	P	70.2	Confident	88.5	Confident	30 Å²	30	59.5 Å²	59.5	20%	0.195	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-38	-42.2	169.4	-40.6	42.1	0	0	0	116	F263 F264 A333	F263-P331 HydrophobicContact CD1-CB 4.14Å; F263-P331 HydrophobicContact CD1-CG 4.25Å; F263-P331 HydrophobicContact CE1-CB 3.33Å; F263-P331 HydrophobicContact CE1-CG 3.55Å; F263-P331 HydrophobicContact CE2-CG 4.5Å; F263-P331 HydrophobicContact CZ-CB 3.86Å; F263-P331 HydrophobicContact CZ-CG 3.67Å; F264-P331 HydrophobicContact CD1-CB 4Å; F264-P331 HydrophobicContact CD1-CG 4.48Å; F264-P331 HydrophobicContact CE1-CB 3.47Å; F264-P331 VanDerWaalsContact CE1-CB 3.47Å; F264-P331 HydrophobicContact CE1-CG 4.4Å; F264-P331 HydrophobicContact CZ-CB 4.29Å; P331-A333 VanDerWaalsContact C-N 3.31Å; P331-A333 PolarHBondContact O-N 3.48Å
332	L	80.1	Confident	88.7	Confident	18 Å²	18	56.3 Å²	56.3	9%	0.094	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-77.2	-11.7	-177.7	-57.2	-174.6	0	0	0	113.8	F264 W285 F291 L322 V325 L326 K330 K334 F335	F264-L332 HydrophobicContact CE1-CD2 3.76Å; F264-L332 HydrophobicContact CE1-CG 4.47Å; F264-L332 HydrophobicContact CZ-CD2 4.02Å; W285-L332 HydrophobicContact CE3-CD2 3.83Å; W285-L332 HydrophobicContact CH2-CD2 3.75Å; W285-L332 HydrophobicContact CZ3-CD2 3.12Å; F291-L332 HydrophobicContact CE2-CD1 4.45Å; F291-L332 HydrophobicContact CZ-CD1 4.16Å; L322-L332 HydrophobicContact CD1-CD1 4.11Å; V325-L332 HydrophobicContact CG1-CB 4.18Å; V325-L332 HydrophobicContact CG1-CD1 3.86Å; V325-L332 HydrophobicContact CG1-CG 4.36Å; L326-L332 HydrophobicContact CD2-CB 3.79Å; L326-L332 WeakPolarHBondContact CD2-O 3.46Å; K330-L332 PolarHBondContact O-N 2.68Å; L332-K334 PolarHBondContact O-N 2.64Å; L332-K334 VanDerWaalsContact O-N 3.07Å; L332-F335 WeakPolarHBondContact O-CB 3.21Å; L332-F335 PolarHBondContact O-N 2.96Å
333	A	82.4	Confident	88.8	Confident	43 Å²	43	58.6 Å²	58.6	36%	0.355	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-66.2	-10.1	179.1	0	0	0	0	0	113.9	L326 E328 K330 P331	L326-A333 WeakPolarHBondContact O-CA 3.49Å; L326-A333 WeakPolarHBondContact O-CB 3.3Å; E328-A333 WeakPolarHBondContact O-CB 3.41Å; K330-A333 WeakPolarHBondContact O-CB 3.4Å; K330-A333 PolarHBondContact O-N 3.34Å; P331-A333 VanDerWaalsContact C-N 3.31Å; P331-A333 PolarHBondContact O-N 3.48Å
334	K	85.7	Confident	89	Confident	94 Å²	94	57 Å²	57	41%	0.409	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-75.9	-13.3	168.7	-67.3	-172.8	173.8	-173.3	0	112.8	D278 L332 R371	D278-K334 IonicContact OD1-NZ 2.68Å; D278-K334 PolarHBondContact OD1-NZ 3.5Å; D278-K334 IonicContact OD2-NZ 2.72Å; D278-K334 PolarHBondContact OD2-NZ 3.48Å; L332-K334 PolarHBondContact O-N 2.64Å; L332-K334 VanDerWaalsContact O-N 3.07Å; K334-R371 WeakPolarHBondContact O-CG 3.29Å
335	F	92.5	Very high	89.3	Confident	10 Å²	10	54.3 Å²	54.3	4%	0.044	29%	0.289	C	S	.	.			trans	-100.7	152.2	179.9	-69.9	-98.7	0	0	0	110.7	L277 V283 W285 L326 L332 I369 Y370 R371	L277-F335 HydrophobicContact CD1-CE2 4.17Å; L277-F335 HydrophobicContact CD1-CZ 3.68Å; L277-F335 HydrophobicContact CD2-CE2 4.38Å; V283-F335 HydrophobicContact CB-CE1 4.36Å; V283-F335 HydrophobicContact CG1-CE1 3.97Å; V283-F335 HydrophobicContact CG1-CZ 4.12Å; W285-F335 HydrophobicContact CB-CE1 4.02Å; W285-F335 HydrophobicContact CB-CZ 4.5Å; W285-F335 HydrophobicContact CE3-CE1 4.42Å; W285-F335 HydrophobicContact CE3-CE2 4.07Å; W285-F335 AromaticContact CE3-CZ 3.94Å; W285-F335 HydrophobicContact CE3-CZ 3.94Å; W285-F335 HydrophobicContact CZ3-CE2 4.41Å; L326-F335 HydrophobicContact CD2-CB 4.2Å; L332-F335 WeakPolarHBondContact O-CB 3.21Å; L332-F335 PolarHBondContact O-N 2.96Å; F335-I369 HydrophobicContact CB-CB 4.19Å; F335-I369 HydrophobicContact CB-CD1 3.85Å; F335-I369 HydrophobicContact CB-CG1 4.03Å; F335-I369 HydrophobicContact CD1-CB 4.46Å; F335-I369 HydrophobicContact CD1-CD1 4.05Å; F335-I369 HydrophobicContact CD1-CG1 3.75Å; F335-I369 HydrophobicContact CD2-CD1 4.43Å; F335-I369 HydrophobicContact CE1-CG1 4.47Å; F335-I369 HydrophobicContact CG-CD1 3.87Å; F335-I369 HydrophobicContact CG-CG1 4.04Å; F335-Y370 CarbonylContact C-O 3.53Å; F335-Y370 WeakPolarHBondContact CA-O 3.34Å; F335-R371 HydrophobicContact CD1-CB 3.79Å; F335-R371 HydrophobicContact CE1-CB 3.97Å; F335-R371 HydrophobicContact CG-CB 4.24Å
336	E	94.2	Very high	89.6	Confident	125 Å²	125	54.3 Å²	54.3	58%	0.584	29%	0.287	S	S	*	.	B	Isolated β-bridge	trans	-112.9	158.5	172.4	-61.3	-172.7	-175.2	0	0	110	I369 Y370	E336-I369 CarbonylContact O-C 3.58Å; E336-I369 VanDerWaalsContact O-CA 3.29Å; E336-I369 WeakPolarHBondContact O-CA 3.3Å; E336-I369 WeakPolarHBondContact O-CB 3.23Å; E336-Y370 HydrophobicContact CB-CD2 4.32Å; E336-Y370 HydrophobicContact CB-CE2 3.87Å; E336-Y370 PolarHBondContact N-O 3.49Å; E336-Y370 PolarHBondContact O-N 3.23Å
337	E	96.9	Very high	89.9	Confident	30 Å²	30	55.1 Å²	55.1	14%	0.14	29%	0.289	C	S	.	.			trans	-135.3	134.3	172.3	-174.6	173.5	-160.2	0	0	109.1	L326 R367 I369 Y385	L326-E337 HydrophobicContact CD1-CB 3.91Å; E337-R367 IonicContact OE1-CZ 3.54Å; E337-R367 IonicContact OE1-NE 3.44Å; E337-R367 PolarHBondContact OE1-NE 3.22Å; E337-R367 IonicContact OE1-NH2 3.01Å; E337-R367 PolarHBondContact OE1-NH2 3.45Å; E337-R367 IonicContact OE2-CZ 3.85Å; E337-R367 IonicContact OE2-NE 2.74Å; E337-R367 PolarHBondContact OE2-NE 2.9Å; E337-R367 IonicContact OE2-NH2 3.93Å; E337-R367 PolarHBondContact OE2-NH2 2.81Å; E337-I369 HydrophobicContact CB-CG2 4.03Å; E337-I369 HydrophobicContact CG-CG2 4.24Å; E337-Y385 HydrophobicContact CG-CE1 3.77Å; E337-Y385 WeakPolarHBondContact OE1-CE1 3.33Å; E337-Y385 PolarHBondContact OE1-OH 2.88Å
338	H	97.9	Very high	90.3	Very high	57 Å²	57	48.4 Å²	48.4	26%	0.264	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-65.5	143.7	176.6	-168.8	82.4	0	0	0	110.2	I340 Y370 C382 Y385	H338-I340 PolarHBondContact O-N 3.02Å; H338-I340 VanDerWaalsContact O-N 3.13Å; H338-Y370 HydrophobicContact CB-CE1 4.27Å; H338-C382 HydrophobicContact CB-CB 3.92Å; H338-C382 PolarHBondContact CE1-O 3.28Å; H338-Y385 HydrophobicContact CB-CD1 3.85Å; H338-Y385 HydrophobicContact CB-CG 4.22Å; H338-Y385 WeakPolarHBondContact O-CD1 3.33Å; H338-Y385 WeakPolarHBondContact O-CE1 3.4Å
339	P	97.7	Very high	90.9	Very high	82 Å²	82	46.5 Å²	46.5	53%	0.532	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-55.2	120.5	-179.1	-28.4	36.1	0	0	0	113.2	Q341	P339-Q341 PolarHBondContact O-N 2.85Å
340	I	98.3	Very high	92.1	Very high	5 Å²	5	47.9 Å²	47.9	3%	0.026	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-68.6	122.8	178.1	-66.4	173.6	0	0	0	110	I313 M317 H338 F342 Y364 Y385	I313-I340 WeakPolarHBondContact CG2-O 3.24Å; M317-I340 HydrophobicContact CE-CB 4.31Å; M317-I340 HydrophobicContact CE-CD1 4.27Å; M317-I340 HydrophobicContact CE-CG2 4.08Å; M317-I340 HydrophobicContact SD-CB 3.71Å; M317-I340 HydrophobicContact SD-CD1 3.91Å; M317-I340 HydrophobicContact SD-CG1 4.27Å; M317-I340 HydrophobicContact SD-CG2 4.13Å; H338-I340 PolarHBondContact O-N 3.02Å; H338-I340 VanDerWaalsContact O-N 3.13Å; I340-F342 HydrophobicContact CB-CE1 4.28Å; I340-F342 HydrophobicContact CD1-CZ 4.3Å; I340-F342 HydrophobicContact CG1-CE1 4.03Å; I340-F342 HydrophobicContact CG1-CZ 4.01Å; I340-F342 HydrophobicContact CG2-CD1 3.85Å; I340-F342 HydrophobicContact CG2-CD2 4.05Å; I340-F342 HydrophobicContact CG2-CE1 3.85Å; I340-F342 HydrophobicContact CG2-CE2 4.01Å; I340-F342 HydrophobicContact CG2-CG 3.97Å; I340-F342 HydrophobicContact CG2-CZ 3.92Å; I340-F342 WeakPolarHBondContact CG2-O 3.45Å; I340-Y364 HydrophobicContact CD1-CD1 4.35Å; I340-Y364 HydrophobicContact CG2-CD1 4.12Å; I340-Y364 HydrophobicContact CG2-CE1 3.7Å; I340-Y385 HydrophobicContact CD1-CE1 4.37Å; I340-Y385 HydrophobicContact CG1-CD1 4.19Å; I340-Y385 HydrophobicContact CG1-CE1 3.57Å
341	Q	96.9	Very high	93.1	Very high	129 Å²	129	46.3 Å²	46.3	60%	0.603	25%	0.248	S	C	*	.			trans	-115.2	4.2	173.3	-60.6	-56.4	-56.1	0	0	113	I313 P339	I313-Q341 WeakPolarHBondContact CD1-O 3.44Å; P339-Q341 PolarHBondContact O-N 2.85Å
342	F	97.9	Very high	94.1	Very high	6 Å²	6	49.6 Å²	49.6	3%	0.026	26%	0.261	C	S	.	.	S	Bend	trans	-101.1	165.3	178.2	56.6	-91.8	0	0	0	112.3	I340 T345 Y364 Y385 D386 V399	I340-F342 HydrophobicContact CB-CE1 4.28Å; I340-F342 HydrophobicContact CD1-CZ 4.3Å; I340-F342 HydrophobicContact CG1-CE1 4.03Å; I340-F342 HydrophobicContact CG1-CZ 4.01Å; I340-F342 HydrophobicContact CG2-CD1 3.85Å; I340-F342 HydrophobicContact CG2-CD2 4.05Å; I340-F342 HydrophobicContact CG2-CE1 3.85Å; I340-F342 HydrophobicContact CG2-CE2 4.01Å; I340-F342 HydrophobicContact CG2-CG 3.97Å; I340-F342 HydrophobicContact CG2-CZ 3.92Å; I340-F342 WeakPolarHBondContact CG2-O 3.45Å; F342-T345 HydrophobicContact CD2-CG2 3.89Å; F342-T345 HydrophobicContact CE2-CG2 3.86Å; F342-Y364 HydrophobicContact CD2-CD1 4.32Å; F342-Y364 HydrophobicContact CD2-CE1 4.21Å; F342-Y364 AromaticContact CE2-CD1 3.97Å; F342-Y364 HydrophobicContact CE2-CD1 3.97Å; F342-Y364 HydrophobicContact CE2-CE1 4.3Å; F342-Y364 WeakPolarHBondContact O-CE1 3.42Å; F342-Y364 PolarHBondContact O-OH 3.39Å; F342-Y385 AromaticContact CE1-CD1 3.93Å; F342-Y385 HydrophobicContact CE1-CD1 3.93Å; F342-Y385 HydrophobicContact CE1-CD2 4.08Å; F342-Y385 AromaticContact CE1-CE1 3.9Å; F342-Y385 HydrophobicContact CE1-CE1 3.9Å; F342-Y385 HydrophobicContact CE1-CE2 4.02Å; F342-Y385 HydrophobicContact CE1-CG 4.04Å; F342-Y385 AromaticContact CE1-CZ 3.95Å; F342-Y385 HydrophobicContact CZ-CE1 4.16Å; F342-Y385 HydrophobicContact CZ-CE2 4.12Å; F342-Y385 AromaticContact CZ-CZ 3.88Å; F342-D386 VanDerWaalsContact CB-OD1 3.25Å; F342-D386 WeakPolarHBondContact CB-OD1 3.44Å; F342-V399 HydrophobicContact CE2-CG2 4.1Å; F342-V399 HydrophobicContact CZ-CG1 4.04Å; F342-V399 HydrophobicContact CZ-CG2 4.29Å
343	L	98	Very high	94.8	Very high	47 Å²	47	53.1 Å²	53.1	25%	0.246	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-81.6	160.3	178	-74.3	176.1	0	0	0	112	P308 R309 I313 T345 Y355 Y364	P308-L343 HydrophobicContact CB-CD2 4.34Å; P308-L343 HydrophobicContact CG-CD2 4.4Å; R309-L343 VanDerWaalsContact C-CD2 3.48Å; I313-L343 HydrophobicContact CD1-CD2 4.38Å; I313-L343 HydrophobicContact CG1-CD2 4.08Å; L343-T345 PolarHBondContact O-N 2.85Å; L343-Y355 WeakPolarHBondContact CB-OH 3.4Å; L343-Y364 VanDerWaalsContact C-CE1 3.41Å
344	P	97.9	Very high	95.4	Very high	1 Å²	1	54 Å²	54	1%	0.006	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-48.6	131.1	177.7	-28.5	36.2	0	0	0	112.8	P308 L316 Y346 F348 Y355 F362 A363 Y364	P308-P344 HydrophobicContact CG-CG 3.94Å; L316-P344 HydrophobicContact CD1-CG 4.07Å; P344-Y346 VanDerWaalsContact C-N 3.34Å; P344-F348 VanDerWaalsContact O-CE2 3.3Å; P344-F348 WeakPolarHBondContact O-CE2 3.13Å; P344-F348 WeakPolarHBondContact O-CZ 3.3Å; P344-Y355 HydrophobicContact CB-CE1 4.15Å; P344-Y355 WeakPolarHBondContact CD-OH 3.22Å; P344-Y355 WeakPolarHBondContact O-CE1 3.33Å; P344-Y355 PolarHBondContact O-OH 2.71Å; P344-F362 HydrophobicContact CB-CB 3.9Å; P344-F362 HydrophobicContact CB-CD2 3.91Å; P344-F362 HydrophobicContact CB-CG 4.3Å; P344-F362 HydrophobicContact CG-CB 4.35Å; P344-F362 HydrophobicContact CG-CD2 3.48Å; P344-F362 VanDerWaalsContact CG-CD2 3.48Å; P344-F362 HydrophobicContact CG-CE2 4.11Å; P344-F362 HydrophobicContact CG-CG 4.21Å; P344-A363 WeakPolarHBondContact CB-O 3.1Å; P344-Y364 HydrophobicContact CB-CD2 4.49Å; P344-Y364 HydrophobicContact CB-CE1 4.37Å; P344-Y364 HydrophobicContact CB-CE2 4.28Å; P344-Y364 VanDerWaalsContact CD-CZ 3.5Å; P344-Y364 VanDerWaalsContact CD-OH 3.28Å; P344-Y364 WeakPolarHBondContact CD-OH 3.17Å; P344-Y364 HydrophobicContact CG-CD2 4.27Å; P344-Y364 HydrophobicContact CG-CE1 4.12Å; P344-Y364 HydrophobicContact CG-CE2 3.62Å; P344-Y364 VanDerWaalsContact N-CE1 3.3Å
345	T	97.2	Very high	95.9	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.267	C	S	.	.			trans	-91	1.2	-172.9	51.3	0	0	0	0	114	F342 L343 F348 A363 H396 K397 V399	F342-T345 HydrophobicContact CD2-CG2 3.89Å; F342-T345 HydrophobicContact CE2-CG2 3.86Å; L343-T345 PolarHBondContact O-N 2.85Å; T345-F348 WeakPolarHBondContact O-CE2 3.43Å; T345-A363 PolarHBondContact N-O 2.75Å; T345-A363 VanDerWaalsContact N-O 3.15Å; T345-H396 CarbonylContact O-C 3.33Å; T345-H396 VanDerWaalsContact O-CA 3.24Å; T345-H396 WeakPolarHBondContact O-CA 3.32Å; T345-K397 HydrophobicContact CG2-CB 4Å; T345-K397 PolarHBondContact O-N 3.16Å; T345-V399 HydrophobicContact CG2-CG2 3.6Å
346	Y	97.4	Very high	96	Very high	23 Å²	23	50.6 Å²	50.6	9%	0.09	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-142	151.4	176.9	173.6	-104.2	0	0	0	109.6	P344 R360 F362 A363 T365 H396	P344-Y346 VanDerWaalsContact C-N 3.34Å; Y346-R360 HydrophobicContact CE1-CG 4.44Å; Y346-R360 VanDerWaalsContact OH-CD 3.29Å; Y346-R360 WeakPolarHBondContact OH-CD 3.44Å; Y346-F362 CarbonylContact O-C 3.57Å; Y346-F362 WeakPolarHBondContact O-CA 3.29Å; Y346-F362 WeakPolarHBondContact O-CB 3.45Å; Y346-A363 HydrophobicContact CD1-CB 4.22Å; Y346-A363 PolarHBondContact N-O 3.1Å; Y346-A363 VanDerWaalsContact N-O 3.1Å; Y346-A363 PolarHBondContact O-N 2.62Å; Y346-T365 VanDerWaalsContact CB-OG1 3.29Å; Y346-T365 WeakPolarHBondContact CB-OG1 3.36Å; Y346-T365 HydrophobicContact CD1-CG2 3.83Å; Y346-T365 HydrophobicContact CG-CG2 4.05Å; Y346-H396 AromaticContact CD2-CD2 3.6Å; Y346-H396 AromaticContact CD2-CE1 3.36Å; Y346-H396 WeakPolarHBondContact CD2-CE1 3.3Å; Y346-H396 AromaticContact CD2-CG 3.94Å; Y346-H396 AromaticContact CD2-ND1 3.81Å; Y346-H396 AromaticContact CD2-NE2 3.17Å; Y346-H396 WeakPolarHBondContact CD2-NE2 3.5Å; Y346-H396 AromaticContact CE2-CD2 4Å; Y346-H396 AromaticContact CE2-CE1 3.86Å; Y346-H396 AromaticContact CE2-NE2 3.33Å; Y346-H396 VanDerWaalsContact CE2-NE2 3.33Å; Y346-H396 WeakPolarHBondContact CE2-NE2 3.41Å; Y346-H396 AromaticContact CG-CE1 3.94Å
347	K	96.6	Very high	95.6	Very high	40 Å²	40	46.7 Å²	46.7	17%	0.174	25%	0.251	C	S	.	.			cis	-106.6	128.7	-9.7	-174.2	-175.2	176.5	78.3	0	109.2	A356 R360 D395	K347-A356 HydrophobicContact CD-CB 4.4Å; K347-A356 HydrophobicContact CG-CB 4.31Å; K347-A356 PolarHBondContact O-N 3.36Å; K347-R360 HydrophobicContact CD-CB 4.16Å; K347-D395 CarbonylContact C-O 3.6Å; K347-D395 WeakPolarHBondContact CA-O 3.28Å; K347-D395 HydrophobicContact CG-CB 3.95Å; K347-D395 IonicContact NZ-OD2 2.9Å; K347-D395 PolarHBondContact NZ-OD2 3.07Å
348	F	97	Very high	95	Very high	15 Å²	15	54.4 Å²	54.4	7%	0.066	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-99.7	160	178.8	-70.4	-96.1	0	0	0	112.2	P344 T345 T354 Y355 D395 K397	P344-F348 VanDerWaalsContact O-CE2 3.3Å; P344-F348 WeakPolarHBondContact O-CE2 3.13Å; P344-F348 WeakPolarHBondContact O-CZ 3.3Å; T345-F348 WeakPolarHBondContact O-CE2 3.43Å; F348-T354 WeakPolarHBondContact CA-O 3.44Å; F348-Y355 HydrophobicContact CD1-CD1 4.46Å; F348-Y355 HydrophobicContact CD2-CE1 4.4Å; F348-Y355 HydrophobicContact CE1-CD1 4.12Å; F348-Y355 HydrophobicContact CE1-CD2 4.3Å; F348-Y355 AromaticContact CE1-CE1 3.91Å; F348-Y355 HydrophobicContact CE1-CE1 3.91Å; F348-Y355 HydrophobicContact CE1-CE2 4.09Å; F348-Y355 HydrophobicContact CE1-CG 4.33Å; F348-Y355 AromaticContact CE1-CZ 3.9Å; F348-Y355 HydrophobicContact CE2-CD1 4.14Å; F348-Y355 AromaticContact CE2-CE1 3.62Å; F348-Y355 HydrophobicContact CE2-CE1 3.62Å; F348-Y355 AromaticContact CZ-CD1 3.95Å; F348-Y355 HydrophobicContact CZ-CD1 3.95Å; F348-Y355 AromaticContact CZ-CE1 3.34Å; F348-Y355 HydrophobicContact CZ-CE1 3.34Å; F348-Y355 HydrophobicContact CZ-CE2 4.09Å; F348-Y355 AromaticContact CZ-CZ 3.43Å; F348-Y355 VanDerWaalsContact CZ-CZ 3.43Å; F348-D395 PolarHBondContact N-O 3.31Å; F348-D395 VanDerWaalsContact O-CB 3.23Å; F348-D395 WeakPolarHBondContact O-CB 3.49Å; F348-K397 HydrophobicContact CD2-CD 4.32Å; F348-K397 HydrophobicContact CD2-CG 3.94Å; F348-K397 HydrophobicContact CE2-CD 4.35Å; F348-K397 HydrophobicContact CE2-CG 3.59Å; F348-K397 HydrophobicContact CZ-CG 3.98Å
349	N	95.6	Very high	94.4	Very high	58 Å²	58	57.9 Å²	57.9	31%	0.31	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-73.4	138.7	162.2	-64.1	-49.5	0	0	0	109.2	G351 E352 T354 A356	N349-G351 PolarHBondContact O-N 3.43Å; N349-E352 HydrophobicContact CB-CB 4.28Å; N349-E352 PolarHBondContact O-N 3.22Å; N349-T354 PolarHBondContact N-O 3.01Å; N349-T354 PolarHBondContact ND2-OG1 3.06Å; N349-A356 VanDerWaalsContact OD1-CB 3.3Å; N349-A356 WeakPolarHBondContact OD1-CB 3.41Å
350	F	92.6	Very high	94.1	Very high	102 Å²	102	59 Å²	59	45%	0.447	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	134.5	179.1	-70.2	-77.8	0	0	0	111.4	A162 K164 E352 S393 D395	A162-F350 HydrophobicContact CB-CE1 4.23Å; A162-F350 HydrophobicContact CB-CZ 4.41Å; K164-F350 HydrophobicContact CD-CE1 4.34Å; K164-F350 HydrophobicContact CG-CD1 4.21Å; K164-F350 HydrophobicContact CG-CE1 3.83Å; F350-E352 PolarHBondContact O-N 3.33Å; F350-S393 WeakPolarHBondContact CD1-O 3.25Å; F350-D395 HydrophobicContact CE1-CB 4.19Å; F350-D395 HydrophobicContact CE2-CB 4.44Å; F350-D395 HydrophobicContact CZ-CB 4.06Å
351	G	91.7	Very high	93.9	Very high	58 Å²	58	62.5 Å²	62.5	60%	0.598	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.4	0.5	179.7	0	0	0	0	0	114.4	N349 C392	N349-G351 PolarHBondContact O-N 3.43Å; G351-C392 VanDerWaalsContact CA-O 3.22Å; G351-C392 WeakPolarHBondContact CA-O 3.46Å; G351-C392 PolarHBondContact N-O 2.95Å
352	E	92.5	Very high	93.9	Very high	99 Å²	99	56.6 Å²	56.6	46%	0.463	29%	0.286	S	S	.	.	S	Bend	trans	-130.4	160.7	-172.3	-60.9	-177.5	-170.3	0	0	112.7	N349 F350 T354 K397	N349-E352 HydrophobicContact CB-CB 4.28Å; N349-E352 PolarHBondContact O-N 3.22Å; F350-E352 PolarHBondContact O-N 3.33Å; E352-T354 VanDerWaalsContact C-N 3.29Å; E352-T354 HydrophobicContact CB-CG2 4.44Å; E352-T354 PolarHBondContact OE2-OG1 3.2Å; E352-K397 PolarHBondContact O-NZ 3.37Å
353	N	93.6	Very high	93.9	Very high	91 Å²	91	56.4 Å²	56.4	49%	0.487	29%	0.285	S	S	.	.	S	Bend	trans	-98.1	35.1	168.1	-82.4	-37.1	0	0	0	111.6	P389 C392 K397	N353-P389 PolarHBondContact ND2-O 3.2Å; N353-P389 PolarHBondContact OD1-O 3Å; N353-C392 PolarHBondContact OD1-SG 2.78Å; N353-C392 VanDerWaalsContact OD1-SG 3.37Å; N353-K397 WeakPolarHBondContact OD1-CE 3.17Å; N353-K397 PolarHBondContact OD1-NZ 3.44Å
354	T	95.8	Very high	93.9	Very high	63 Å²	63	54.1 Å²	54.1	39%	0.387	27%	0.273	S	S	.	.	S	Bend	trans	-112.5	133.5	177.8	63.4	0	0	0	0	109.6	F348 N349 E352	F348-T354 WeakPolarHBondContact CA-O 3.44Å; N349-T354 PolarHBondContact N-O 3.01Å; N349-T354 PolarHBondContact ND2-OG1 3.06Å; E352-T354 VanDerWaalsContact C-N 3.29Å; E352-T354 HydrophobicContact CB-CG2 4.44Å; E352-T354 PolarHBondContact OE2-OG1 3.2Å
355	Y	96.7	Very high	93.7	Very high	27 Å²	27	54.1 Å²	54.1	11%	0.106	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	-69	137.7	175.5	-72.1	-81.9	0	0	0	110.7	P307 P308 L343 P344 F348 T357 F362	P307-Y355 HydrophobicContact CB-CD2 3.64Å; P307-Y355 HydrophobicContact CB-CE2 4.27Å; P308-Y355 HydrophobicContact CG-CE2 3.97Å; L343-Y355 WeakPolarHBondContact CB-OH 3.4Å; P344-Y355 HydrophobicContact CB-CE1 4.15Å; P344-Y355 WeakPolarHBondContact CD-OH 3.22Å; P344-Y355 WeakPolarHBondContact O-CE1 3.33Å; P344-Y355 PolarHBondContact O-OH 2.71Å; F348-Y355 HydrophobicContact CD1-CD1 4.46Å; F348-Y355 HydrophobicContact CD2-CE1 4.4Å; F348-Y355 HydrophobicContact CE1-CD1 4.12Å; F348-Y355 HydrophobicContact CE1-CD2 4.3Å; F348-Y355 AromaticContact CE1-CE1 3.91Å; F348-Y355 HydrophobicContact CE1-CE1 3.91Å; F348-Y355 HydrophobicContact CE1-CE2 4.09Å; F348-Y355 HydrophobicContact CE1-CG 4.33Å; F348-Y355 AromaticContact CE1-CZ 3.9Å; F348-Y355 HydrophobicContact CE2-CD1 4.14Å; F348-Y355 AromaticContact CE2-CE1 3.62Å; F348-Y355 HydrophobicContact CE2-CE1 3.62Å; F348-Y355 AromaticContact CZ-CD1 3.95Å; F348-Y355 HydrophobicContact CZ-CD1 3.95Å; F348-Y355 AromaticContact CZ-CE1 3.34Å; F348-Y355 HydrophobicContact CZ-CE1 3.34Å; F348-Y355 HydrophobicContact CZ-CE2 4.09Å; F348-Y355 AromaticContact CZ-CZ 3.43Å; F348-Y355 VanDerWaalsContact CZ-CZ 3.43Å; Y355-T357 PolarHBondContact O-N 3.47Å; Y355-F362 HydrophobicContact CD1-CB 3.69Å; Y355-F362 HydrophobicContact CE1-CB 3.7Å
356	A	93.4	Very high	93.8	Very high	5 Å²	5	54.1 Å²	54.1	4%	0.041	27%	0.273	C	S	.	.			trans	-80	54.9	173.5	0	0	0	0	0	111.1	K347 N349 Q358 L359 R360	K347-A356 HydrophobicContact CD-CB 4.4Å; K347-A356 HydrophobicContact CG-CB 4.31Å; K347-A356 PolarHBondContact O-N 3.36Å; N349-A356 VanDerWaalsContact OD1-CB 3.3Å; N349-A356 WeakPolarHBondContact OD1-CB 3.41Å; A356-Q358 PolarHBondContact O-N 3.34Å; A356-L359 HydrophobicContact CB-CB 4.36Å; A356-L359 HydrophobicContact CB-CD1 4.12Å; A356-L359 HydrophobicContact CB-CG 4.38Å; A356-L359 PolarHBondContact O-N 3.13Å; A356-R360 PolarHBondContact O-N 2.86Å
357	T	86.4	Confident	93.8	Very high	43 Å²	43	53 Å²	53	26%	0.264	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-25	-168.3	58.7	0	0	0	0	114	G305 Y355 L359	G305-T357 PolarHBondContact O-OG1 3.31Å; G305-T357 VanDerWaalsContact O-OG1 3.1Å; Y355-T357 PolarHBondContact O-N 3.47Å; T357-L359 VanDerWaalsContact C-N 3.35Å
358	Q	84.8	Confident	93.9	Very high	192 Å²	192	51.2 Å²	51.2	90%	0.897	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-21.7	176.1	-62.1	-176.8	0.7	0	0	113.6	A356	A356-Q358 PolarHBondContact O-N 3.34Å
359	L	85.3	Confident	93.8	Very high	129 Å²	129	50.5 Å²	50.5	68%	0.675	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-38.8	-176.6	-60.4	-177.4	0	0	0	111.9	A356 T357	A356-L359 HydrophobicContact CB-CB 4.36Å; A356-L359 HydrophobicContact CB-CD1 4.12Å; A356-L359 HydrophobicContact CB-CG 4.38Å; A356-L359 PolarHBondContact O-N 3.13Å; T357-L359 VanDerWaalsContact C-N 3.35Å
360	R	91.5	Very high	93.8	Very high	105 Å²	105	48.6 Å²	48.6	40%	0.396	25%	0.247	S	C	.	.			trans	-162.2	152.1	-177.6	-154.5	166.2	-175.1	101.7	10.1	112.1	R292 Y346 K347 A356	R292-R360 VanDerWaalsContact NH2-NH2 3.18Å; Y346-R360 HydrophobicContact CE1-CG 4.44Å; Y346-R360 VanDerWaalsContact OH-CD 3.29Å; Y346-R360 WeakPolarHBondContact OH-CD 3.44Å; K347-R360 HydrophobicContact CD-CB 4.16Å; A356-R360 PolarHBondContact O-N 2.86Å
361	W	94.2	Very high	93.8	Very high	79 Å²	79	44.2 Å²	44.2	30%	0.299	23%	0.227	S	C	.	.			trans	-57.9	140.4	165.2	-72	90.8	0	0	0	111.1	I295 V300 F303 N304	I295-W361 HydrophobicContact CD1-CB 4.39Å; I295-W361 HydrophobicContact CD1-CD2 3.82Å; I295-W361 HydrophobicContact CD1-CE3 3.77Å; I295-W361 HydrophobicContact CD1-CG 4.09Å; I295-W361 HydrophobicContact CD1-CZ3 4.38Å; I295-W361 HydrophobicContact CG1-CD2 4.16Å; I295-W361 HydrophobicContact CG1-CG 4.22Å; I295-W361 HydrophobicContact CG2-CD2 4.38Å; I295-W361 HydrophobicContact CG2-CH2 4.18Å; I295-W361 HydrophobicContact CG2-CZ2 3.84Å; V300-W361 HydrophobicContact CG2-CH2 4.39Å; V300-W361 HydrophobicContact CG2-CZ2 4.24Å; F303-W361 HydrophobicContact CB-CZ3 3.92Å; N304-W361 HydrophobicContact CB-CH2 4.13Å; N304-W361 HydrophobicContact CB-CZ2 4.49Å
362	F	96.5	Very high	93.8	Very high	6 Å²	6	44.5 Å²	44.5	3%	0.026	21%	0.213	C	C	.	.			trans	-67.1	151.3	171	55.5	-102.9	0	0	0	111.2	L293 M299 F303 P308 L316 P344 Y346 Y355	L293-F362 HydrophobicContact CD1-CD2 3.78Å; L293-F362 HydrophobicContact CD1-CE2 3.58Å; M299-F362 HydrophobicContact CE-CE2 4.31Å; M299-F362 HydrophobicContact CE-CZ 4.41Å; F303-F362 HydrophobicContact CB-CE1 3.88Å; F303-F362 HydrophobicContact CB-CZ 3.74Å; F303-F362 HydrophobicContact CD1-CE1 4.39Å; F303-F362 AromaticContact CD1-CZ 3.95Å; F303-F362 HydrophobicContact CD1-CZ 3.95Å; F303-F362 HydrophobicContact CD2-CZ 4.44Å; F303-F362 HydrophobicContact CG-CE1 4.32Å; F303-F362 AromaticContact CG-CZ 3.79Å; F303-F362 HydrophobicContact CG-CZ 3.79Å; P308-F362 HydrophobicContact CB-CE1 4.35Å; P308-F362 HydrophobicContact CB-CE2 4.1Å; P308-F362 HydrophobicContact CB-CZ 3.94Å; P308-F362 HydrophobicContact CG-CD1 4.06Å; P308-F362 HydrophobicContact CG-CD2 3.98Å; P308-F362 HydrophobicContact CG-CE1 4.02Å; P308-F362 HydrophobicContact CG-CE2 3.92Å; P308-F362 HydrophobicContact CG-CG 4.02Å; P308-F362 HydrophobicContact CG-CZ 3.94Å; L316-F362 HydrophobicContact CD1-CE2 4.13Å; L316-F362 HydrophobicContact CD2-CE2 3.87Å; L316-F362 HydrophobicContact CD2-CZ 4.32Å; P344-F362 HydrophobicContact CB-CB 3.9Å; P344-F362 HydrophobicContact CB-CD2 3.91Å; P344-F362 HydrophobicContact CB-CG 4.3Å; P344-F362 HydrophobicContact CG-CB 4.35Å; P344-F362 HydrophobicContact CG-CD2 3.48Å; P344-F362 VanDerWaalsContact CG-CD2 3.48Å; P344-F362 HydrophobicContact CG-CE2 4.11Å; P344-F362 HydrophobicContact CG-CG 4.21Å; Y346-F362 CarbonylContact O-C 3.57Å; Y346-F362 WeakPolarHBondContact O-CA 3.29Å; Y346-F362 WeakPolarHBondContact O-CB 3.45Å; Y355-F362 HydrophobicContact CD1-CB 3.69Å; Y355-F362 HydrophobicContact CE1-CB 3.7Å
363	A	96.5	Very high	93.6	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.008	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-157.1	160.3	-176.4	0	0	0	0	0	112.6	R292 P344 T345 Y346 T365	R292-A363 HydrophobicContact CB-CB 4.08Å; R292-A363 HydrophobicContact CG-CB 3.92Å; P344-A363 WeakPolarHBondContact CB-O 3.1Å; T345-A363 PolarHBondContact N-O 2.75Å; T345-A363 VanDerWaalsContact N-O 3.15Å; Y346-A363 HydrophobicContact CD1-CB 4.22Å; Y346-A363 PolarHBondContact N-O 3.1Å; Y346-A363 VanDerWaalsContact N-O 3.1Å; Y346-A363 PolarHBondContact O-N 2.62Å; A363-T365 HydrophobicContact CB-CG2 4.06Å; A363-T365 PolarHBondContact O-N 3.15Å
364	Y	97.7	Very high	93.2	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.209	C	C	.	.			trans	-96.4	75.4	171.7	-62.1	-86.2	0	0	0	109.8	L293 L316 M317 I340 F342 L343 P344 R367	L293-Y364 HydrophobicContact CD2-CD2 3.94Å; L293-Y364 HydrophobicContact CD2-CE2 4.15Å; L293-Y364 HydrophobicContact CG-CD2 4.45Å; L316-Y364 HydrophobicContact CB-CE2 4.15Å; L316-Y364 HydrophobicContact CD1-CE2 4.45Å; M317-Y364 HydrophobicContact CE-CD1 4.24Å; M317-Y364 HydrophobicContact CE-CD2 3.52Å; M317-Y364 HydrophobicContact CE-CE1 3.87Å; M317-Y364 HydrophobicContact CE-CE2 3.08Å; M317-Y364 HydrophobicContact CE-CG 4.08Å; I340-Y364 HydrophobicContact CD1-CD1 4.35Å; I340-Y364 HydrophobicContact CG2-CD1 4.12Å; I340-Y364 HydrophobicContact CG2-CE1 3.7Å; F342-Y364 HydrophobicContact CD2-CD1 4.32Å; F342-Y364 HydrophobicContact CD2-CE1 4.21Å; F342-Y364 AromaticContact CE2-CD1 3.97Å; F342-Y364 HydrophobicContact CE2-CD1 3.97Å; F342-Y364 HydrophobicContact CE2-CE1 4.3Å; F342-Y364 WeakPolarHBondContact O-CE1 3.42Å; F342-Y364 PolarHBondContact O-OH 3.39Å; L343-Y364 VanDerWaalsContact C-CE1 3.41Å; P344-Y364 HydrophobicContact CB-CD2 4.49Å; P344-Y364 HydrophobicContact CB-CE1 4.37Å; P344-Y364 HydrophobicContact CB-CE2 4.28Å; P344-Y364 VanDerWaalsContact CD-CZ 3.5Å; P344-Y364 VanDerWaalsContact CD-OH 3.28Å; P344-Y364 WeakPolarHBondContact CD-OH 3.17Å; P344-Y364 HydrophobicContact CG-CD2 4.27Å; P344-Y364 HydrophobicContact CG-CE1 4.12Å; P344-Y364 HydrophobicContact CG-CE2 3.62Å; P344-Y364 VanDerWaalsContact N-CE1 3.3Å; Y364-R367 PolarHBondContact O-NH1 2.9Å
365	T	95.6	Very high	92.5	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.006	23%	0.233	C	C	.	.			trans	-80.2	-39.3	-175.4	45.7	0	0	0	0	112.7	D288 M289 N290 Y346 A363 H396	D288-T365 WeakPolarHBondContact OD1-CB 3.25Å; M289-T365 PolarHBondContact N-O 2.78Å; N290-T365 PolarHBondContact N-O 2.76Å; Y346-T365 VanDerWaalsContact CB-OG1 3.29Å; Y346-T365 WeakPolarHBondContact CB-OG1 3.36Å; Y346-T365 HydrophobicContact CD1-CG2 3.83Å; Y346-T365 HydrophobicContact CG-CG2 4.05Å; A363-T365 HydrophobicContact CB-CG2 4.06Å; A363-T365 PolarHBondContact O-N 3.15Å; T365-H396 PolarHBondContact OG1-CE1 3.03Å; T365-H396 PolarHBondContact OG1-ND1 3.02Å
366	D	98.1	Very high	91.9	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	121.3	-175.9	-60.8	-101.1	0	0	0	109.5	T158 G287 H396 V399	T158-D366 HydrophobicContact CG2-CB 4.12Å; G287-D366 WeakPolarHBondContact O-CA 3.24Å; D366-H396 IonicContact OD2-CE1 3.11Å; D366-H396 IonicContact OD2-CG 3.6Å; D366-H396 IonicContact OD2-ND1 2.65Å; D366-H396 PolarHBondContact OD2-ND1 3.14Å; D366-V399 HydrophobicContact CB-CB 4.28Å; D366-V399 HydrophobicContact CB-CG2 3.84Å
367	R	97.6	Very high	91.4	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	153.8	-168.3	-53.4	-65.3	-82.5	-93.8	2.6	111.8	F286 G287 M289 D320 L322 E337 Y364 Y385	F286-R367 CarbonylContact C-O 3.58Å; F286-R367 WeakPolarHBondContact CA-O 3.5Å; F286-R367 WeakPolarHBondContact CB-O 3.3Å; G287-R367 PolarHBondContact N-O 3.5Å; G287-R367 PolarHBondContact O-N 2.8Å; M289-R367 HydrophobicContact CE-CB 4.45Å; M289-R367 HydrophobicContact SD-CB 3.96Å; M289-R367 HydrophobicContact SD-CG 4.49Å; D320-R367 IonicContact OD1-CZ 2.64Å; D320-R367 IonicContact OD1-NH1 3.78Å; D320-R367 PolarHBondContact OD1-NH1 3.11Å; D320-R367 VanDerWaalsContact OD1-NH1 3.11Å; D320-R367 IonicContact OD1-NH2 3.82Å; D320-R367 PolarHBondContact OD1-NH2 3.12Å; D320-R367 IonicContact OD2-CZ 2.63Å; D320-R367 IonicContact OD2-NH1 3.24Å; D320-R367 PolarHBondContact OD2-NH1 3.01Å; D320-R367 IonicContact OD2-NH2 2.66Å; L322-R367 HydrophobicContact CD2-CB 3.97Å; L322-R367 HydrophobicContact CD2-CG 3.76Å; E337-R367 IonicContact OE1-CZ 3.54Å; E337-R367 IonicContact OE1-NE 3.44Å; E337-R367 PolarHBondContact OE1-NE 3.22Å; E337-R367 IonicContact OE1-NH2 3.01Å; E337-R367 PolarHBondContact OE1-NH2 3.45Å; E337-R367 IonicContact OE2-CZ 3.85Å; E337-R367 IonicContact OE2-NE 2.74Å; E337-R367 PolarHBondContact OE2-NE 2.9Å; E337-R367 IonicContact OE2-NH2 3.93Å; E337-R367 PolarHBondContact OE2-NH2 2.81Å; Y364-R367 PolarHBondContact O-NH1 2.9Å; R367-Y385 WeakPolarHBondContact CA-OH 3.44Å
368	V	98	Very high	91.5	Very high	1 Å²	1	55 Å²	55	1%	0.006	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	113.6	166.1	-176.9	0	0	0	0	108.2	V156 F286 Y385 V399 A401 F403	V156-V368 HydrophobicContact CB-CG1 4.16Å; V156-V368 HydrophobicContact CG1-CG1 3.82Å; V156-V368 HydrophobicContact CG1-CG2 3.99Å; F286-V368 HydrophobicContact CB-CB 4.19Å; F286-V368 HydrophobicContact CB-CG1 4.19Å; F286-V368 HydrophobicContact CB-CG2 3.81Å; V368-Y385 HydrophobicContact CB-CE2 3.89Å; V368-Y385 HydrophobicContact CG2-CE2 4.09Å; V368-Y385 PolarHBondContact N-OH 3.28Å; V368-V399 HydrophobicContact CG2-CG1 4.41Å; V368-A401 HydrophobicContact CB-CB 3.98Å; V368-A401 HydrophobicContact CG1-CB 3.87Å; V368-A401 HydrophobicContact CG2-CB 4.12Å; V368-F403 HydrophobicContact CG1-CE2 4.05Å; V368-F403 HydrophobicContact CG1-CZ 4.03Å
369	I	96.5	Very high	91.8	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	151.7	171	72.5	-177.5	0	0	0	108.9	W285 M289 L322 L326 F335 E336 E337	W285-I369 HydrophobicContact CB-CD1 4.31Å; W285-I369 HydrophobicContact CB-CG1 3.82Å; W285-I369 HydrophobicContact CD2-CD1 4.4Å; W285-I369 HydrophobicContact CE3-CD1 4.11Å; W285-I369 HydrophobicContact CG-CG1 4.45Å; W285-I369 PolarHBondContact N-O 3.04Å; W285-I369 WeakPolarHBondContact O-CG1 3.42Å; W285-I369 PolarHBondContact O-N 3Å; W285-I369 VanDerWaalsContact O-O 3.04Å; M289-I369 HydrophobicContact CE-CD1 3.98Å; M289-I369 HydrophobicContact CE-CG1 3.98Å; L322-I369 HydrophobicContact CD2-CG2 3.99Å; L326-I369 HydrophobicContact CD1-CG2 4.36Å; L326-I369 HydrophobicContact CD2-CD1 4.48Å; F335-I369 HydrophobicContact CB-CB 4.19Å; F335-I369 HydrophobicContact CB-CD1 3.85Å; F335-I369 HydrophobicContact CB-CG1 4.03Å; F335-I369 HydrophobicContact CD1-CB 4.46Å; F335-I369 HydrophobicContact CD1-CD1 4.05Å; F335-I369 HydrophobicContact CD1-CG1 3.75Å; F335-I369 HydrophobicContact CD2-CD1 4.43Å; F335-I369 HydrophobicContact CE1-CG1 4.47Å; F335-I369 HydrophobicContact CG-CD1 3.87Å; F335-I369 HydrophobicContact CG-CG1 4.04Å; E336-I369 CarbonylContact O-C 3.58Å; E336-I369 VanDerWaalsContact O-CA 3.29Å; E336-I369 WeakPolarHBondContact O-CA 3.3Å; E336-I369 WeakPolarHBondContact O-CB 3.23Å; E337-I369 HydrophobicContact CB-CG2 4.03Å; E337-I369 HydrophobicContact CG-CG2 4.24Å
370	Y	95.8	Very high	92.3	Very high	19 Å²	19	42.1 Å²	42.1	8%	0.075	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	161.1	-174.1	56.3	-89.6	0	0	0	111.2	V283 F335 E336 H338 L380 C382 F403	V283-Y370 CarbonylContact O-C 3.55Å; V283-Y370 WeakPolarHBondContact O-CA 3.48Å; F335-Y370 CarbonylContact C-O 3.53Å; F335-Y370 WeakPolarHBondContact CA-O 3.34Å; E336-Y370 HydrophobicContact CB-CD2 4.32Å; E336-Y370 HydrophobicContact CB-CE2 3.87Å; E336-Y370 PolarHBondContact N-O 3.49Å; E336-Y370 PolarHBondContact O-N 3.23Å; H338-Y370 HydrophobicContact CB-CE1 4.27Å; Y370-L380 HydrophobicContact CD2-CD2 3.56Å; Y370-L380 HydrophobicContact CE2-CD2 4.28Å; Y370-L380 HydrophobicContact CG-CD2 4.06Å; Y370-C382 HydrophobicContact CE1-CB 4.33Å; Y370-F403 AromaticContact CD1-CE1 3.35Å; Y370-F403 HydrophobicContact CD1-CE1 3.35Å; Y370-F403 AromaticContact CD1-CZ 3.52Å; Y370-F403 HydrophobicContact CD1-CZ 3.52Å; Y370-F403 HydrophobicContact CD2-CE1 4.3Å; Y370-F403 AromaticContact CE1-CE1 3.58Å; Y370-F403 HydrophobicContact CE1-CE1 3.58Å; Y370-F403 HydrophobicContact CE1-CZ 4.02Å; Y370-F403 HydrophobicContact CE2-CE1 4.49Å; Y370-F403 AromaticContact CG-CE1 3.73Å; Y370-F403 HydrophobicContact CG-CE1 3.73Å; Y370-F403 HydrophobicContact CG-CZ 4.09Å
371	R	91.8	Very high	92.6	Very high	9 Å²	9	41.6 Å²	41.6	3%	0.034	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	138.4	178.9	175.6	-168.5	105.9	123.4	25.6	109.4	L277 D278 Y282 V283 K334 F335	L277-R371 PolarHBondContact O-NE 3.29Å; L277-R371 PolarHBondContact O-NH1 2.88Å; L277-R371 PolarHBondContact O-NH2 3.16Å; D278-R371 PolarHBondContact O-NH2 3.4Å; D278-R371 IonicContact OD1-CZ 3.72Å; D278-R371 IonicContact OD1-NH1 2.7Å; D278-R371 PolarHBondContact OD1-NH1 2.92Å; Y282-R371 WeakPolarHBondContact CA-O 3.01Å; V283-R371 HydrophobicContact CB-CB 4.44Å; V283-R371 PolarHBondContact N-O 3.35Å; V283-R371 PolarHBondContact O-N 3.36Å; K334-R371 WeakPolarHBondContact O-CG 3.29Å; F335-R371 HydrophobicContact CD1-CB 3.79Å; F335-R371 HydrophobicContact CE1-CB 3.97Å; F335-R371 HydrophobicContact CG-CB 4.24Å
372	E	91.1	Very high	92.7	Very high	64 Å²	64	38.6 Å²	38.6	30%	0.299	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	148.1	162.3	-61.1	179.9	-170.9	0	0	111.3	D281 Y282 V374 L380	D281-E372 CarbonylContact O-C 3.49Å; D281-E372 WeakPolarHBondContact O-CA 3.49Å; Y282-E372 HydrophobicContact CD1-CG 4.06Å; Y282-E372 HydrophobicContact CE1-CG 4.02Å; E372-V374 PolarHBondContact O-N 3.05Å; E372-L380 HydrophobicContact CG-CB 3.8Å; E372-L380 HydrophobicContact CG-CD2 4.35Å; E372-L380 VanDerWaalsContact OE1-CA 3.32Å; E372-L380 WeakPolarHBondContact OE1-CA 3.42Å; E372-L380 WeakPolarHBondContact OE1-CB 2.99Å; E372-L380 PolarHBondContact OE1-N 3.38Å
373	K	88.4	Confident	92.7	Very high	52 Å²	52	43 Å²	43	23%	0.226	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-65.2	126.4	170.4	-172	173.6	169.2	-172.2	0	110.9	D279 D281 T376	D279-K373 PolarHBondContact O-NZ 3.49Å; D281-K373 PolarHBondContact O-N 2.93Å; D281-K373 IonicContact OD1-NZ 3.91Å; K373-T376 HydrophobicContact CB-CG2 3.93Å; K373-T376 HydrophobicContact CD-CG2 3.84Å; K373-T376 HydrophobicContact CG-CG2 3.69Å; K373-T376 PolarHBondContact O-OG1 3.04Å
374	V	85	Confident	92.7	Very high	107 Å²	107	44.3 Å²	44.3	65%	0.648	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.8	147.7	-176.6	-172.1	0	0	0	0	111.3	E372 T376	E372-V374 PolarHBondContact O-N 3.05Å; V374-T376 VanDerWaalsContact C-N 3.31Å; V374-T376 PolarHBondContact O-N 3.32Å
375	N	82.4	Confident	92.7	Very high	165 Å²	165	44.8 Å²	44.8	88%	0.882	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	63	30.9	178.9	-51.9	-50.4	0	0	0	114.5
376	T	82.7	Confident	92.8	Very high	45 Å²	45	47.1 Å²	47.1	28%	0.276	25%	0.249	S	C	.	.	S	Bend	trans	-114.2	171.2	173.7	62.9	0	0	0	0	109.8	K373 V374 N378	K373-T376 HydrophobicContact CB-CG2 3.93Å; K373-T376 HydrophobicContact CD-CG2 3.84Å; K373-T376 HydrophobicContact CG-CG2 3.69Å; K373-T376 PolarHBondContact O-OG1 3.04Å; V374-T376 VanDerWaalsContact C-N 3.31Å; V374-T376 PolarHBondContact O-N 3.32Å; T376-N378 PolarHBondContact O-N 3.17Å; T376-N378 VanDerWaalsContact OG1-CB 3.23Å; T376-N378 WeakPolarHBondContact OG1-CB 3.34Å; T376-N378 PolarHBondContact OG1-N 2.63Å; T376-N378 PolarHBondContact OG1-ND2 2.67Å; T376-N378 PolarHBondContact OG1-OD1 2.89Å
377	N	83.8	Confident	92.8	Very high	155 Å²	155	47.6 Å²	47.6	83%	0.829	25%	0.252	S	S	*	.			trans	-88.2	24.2	168.2	-66	-35.6	0	0	0	111.6
378	N	88.5	Confident	92.8	Very high	25 Å²	25	48 Å²	48	13%	0.134	25%	0.254	C	S	.	.			trans	-62.2	148.8	177.8	-67.8	-1.6	0	0	0	110	D281 Y282 T376	D281-N378 WeakPolarHBondContact CA-ND2 3.47Å; D281-N378 VanDerWaalsContact CB-ND2 3.33Å; D281-N378 WeakPolarHBondContact CB-ND2 2.97Å; D281-N378 PolarHBondContact O-ND2 3.27Å; D281-N378 VanDerWaalsContact O-ND2 3.09Å; Y282-N378 HydrophobicContact CE1-CB 3.8Å; T376-N378 PolarHBondContact O-N 3.17Å; T376-N378 VanDerWaalsContact OG1-CB 3.23Å; T376-N378 WeakPolarHBondContact OG1-CB 3.34Å; T376-N378 PolarHBondContact OG1-N 2.63Å; T376-N378 PolarHBondContact OG1-ND2 2.67Å; T376-N378 PolarHBondContact OG1-OD1 2.89Å
379	D	91.8	Very high	92.6	Very high	41 Å²	41	51 Å²	51	22%	0.219	27%	0.274	C	S	.	.			trans	-146.5	93.8	-176.1	-179.4	38.7	0	0	0	108.8	R151 Y282 H381 A405 M406	R151-D379 IonicContact CZ-OD2 2.91Å; R151-D379 IonicContact NH1-OD2 3.48Å; R151-D379 PolarHBondContact NH1-OD2 2.93Å; R151-D379 IonicContact NH2-OD2 3.73Å; Y282-D379 PolarHBondContact OH-N 2.89Å; Y282-D379 VanDerWaalsContact OH-N 3.12Å; D379-H381 IonicContact OD1-CE1 2.64Å; D379-H381 PolarHBondContact OD1-CE1 2.83Å; D379-H381 IonicContact OD1-ND1 3.4Å; D379-H381 IonicContact OD1-NE2 3.42Å; D379-H381 PolarHBondContact OD1-NE2 3.25Å; D379-H381 IonicContact OD2-NE2 2.68Å; D379-A405 CarbonylContact O-C 3.58Å; D379-A405 WeakPolarHBondContact O-CA 3.44Å; D379-M406 HydrophobicContact CB-CB 3.92Å; D379-M406 HydrophobicContact CB-CE 4.16Å; D379-M406 PolarHBondContact O-N 3.2Å
380	L	95.8	Very high	92.5	Very high	10 Å²	10	53.3 Å²	53.3	5%	0.052	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	126.9	175.7	-173.5	66.6	0	0	0	109.8	Y282 F284 Y370 E372 F403 E404 A405	Y282-L380 HydrophobicContact CD1-CB 3.99Å; Y282-L380 HydrophobicContact CD1-CD1 4.34Å; Y282-L380 HydrophobicContact CD1-CD2 4.09Å; Y282-L380 HydrophobicContact CD1-CG 4.38Å; Y282-L380 HydrophobicContact CE1-CB 3.77Å; F284-L380 HydrophobicContact CE1-CD1 4.36Å; F284-L380 HydrophobicContact CE1-CD2 4.08Å; F284-L380 HydrophobicContact CZ-CD1 3.98Å; F284-L380 HydrophobicContact CZ-CD2 4.18Å; Y370-L380 HydrophobicContact CD2-CD2 3.56Å; Y370-L380 HydrophobicContact CE2-CD2 4.28Å; Y370-L380 HydrophobicContact CG-CD2 4.06Å; E372-L380 HydrophobicContact CG-CB 3.8Å; E372-L380 HydrophobicContact CG-CD2 4.35Å; E372-L380 VanDerWaalsContact OE1-CA 3.32Å; E372-L380 WeakPolarHBondContact OE1-CA 3.42Å; E372-L380 WeakPolarHBondContact OE1-CB 2.99Å; E372-L380 PolarHBondContact OE1-N 3.38Å; L380-F403 HydrophobicContact CD1-CB 3.8Å; L380-F403 HydrophobicContact CD1-CD1 3.93Å; L380-F403 HydrophobicContact CD1-CG 4.16Å; L380-F403 HydrophobicContact CD2-CD1 4.19Å; L380-F403 HydrophobicContact CD2-CE1 4.46Å; L380-F403 HydrophobicContact CG-CD1 3.94Å; L380-E404 WeakPolarHBondContact CA-O 3.33Å; L380-A405 HydrophobicContact CD1-CB 3.56Å
381	H	95.8	Very high	92.5	Very high	93 Å²	93	52.4 Å²	52.4	43%	0.431	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	119.3	175.4	-68.6	-19.1	0	0	0	110.1	R151 D379 I383 F403 E404	R151-H381 PolarHBondContact NH2-CD2 3.48Å; D379-H381 IonicContact OD1-CE1 2.64Å; D379-H381 PolarHBondContact OD1-CE1 2.83Å; D379-H381 IonicContact OD1-ND1 3.4Å; D379-H381 IonicContact OD1-NE2 3.42Å; D379-H381 PolarHBondContact OD1-NE2 3.25Å; D379-H381 IonicContact OD2-NE2 2.68Å; H381-I383 PolarHBondContact O-N 2.87Å; H381-F403 CarbonylContact O-C 3.56Å; H381-F403 WeakPolarHBondContact O-CA 3.04Å; H381-E404 PolarHBondContact N-O 2.85Å; H381-E404 PolarHBondContact O-N 2.98Å
382	C	97.7	Very high	92.6	Very high	16 Å²	16	52.9 Å²	52.9	11%	0.108	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	108.9	166.5	-171	0	0	0	0	109	H338 Y370 F402 F403	H338-C382 HydrophobicContact CB-CB 3.92Å; H338-C382 PolarHBondContact CE1-O 3.28Å; Y370-C382 HydrophobicContact CE1-CB 4.33Å; C382-F402 CarbonylContact C-O 3.53Å; C382-F403 HydrophobicContact CB-CD1 3.69Å; C382-F403 HydrophobicContact CB-CE1 3.51Å; C382-F403 HydrophobicContact CB-CZ 4.37Å
383	I	96.4	Very high	92.7	Very high	100 Å²	100	50.9 Å²	50.9	51%	0.513	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	-38.2	-178.1	-65.5	172.2	0	0	0	110.8	H381 F402 E404	H381-I383 PolarHBondContact O-N 2.87Å; I383-F402 HydrophobicContact CB-CD1 4.07Å; I383-F402 HydrophobicContact CD1-CD1 3.82Å; I383-F402 HydrophobicContact CD1-CE1 3.87Å; I383-F402 HydrophobicContact CG1-CD1 4.39Å; I383-F402 PolarHBondContact N-O 2.66Å; I383-E404 HydrophobicContact CD1-CB 3.72Å; I383-E404 HydrophobicContact CG1-CB 4.43Å
384	S	96.7	Very high	93	Very high	27 Å²	27	48.4 Å²	48.4	19%	0.189	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	142.1	178.1	64.9	0	0	0	0	110.8	Y400 A401 F402	S384-Y400 WeakPolarHBondContact OG-CE2 3.39Å; S384-A401 CarbonylContact O-C 3.53Å; S384-A401 VanDerWaalsContact O-CA 3.26Å; S384-A401 WeakPolarHBondContact O-CA 3.14Å; S384-F402 PolarHBondContact N-O 3.25Å; S384-F402 PolarHBondContact O-N 3.3Å; S384-F402 VanDerWaalsContact OG-CB 3.24Å; S384-F402 WeakPolarHBondContact OG-CB 3.31Å
385	Y	98.2	Very high	93.5	Very high	11 Å²	11	43.8 Å²	43.8	4%	0.043	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	108	174.4	-179.4	-145	0	0	0	108.8	E337 H338 I340 F342 R367 V368 V399 Y400 A401	E337-Y385 HydrophobicContact CG-CE1 3.77Å; E337-Y385 WeakPolarHBondContact OE1-CE1 3.33Å; E337-Y385 PolarHBondContact OE1-OH 2.88Å; H338-Y385 HydrophobicContact CB-CD1 3.85Å; H338-Y385 HydrophobicContact CB-CG 4.22Å; H338-Y385 WeakPolarHBondContact O-CD1 3.33Å; H338-Y385 WeakPolarHBondContact O-CE1 3.4Å; I340-Y385 HydrophobicContact CD1-CE1 4.37Å; I340-Y385 HydrophobicContact CG1-CD1 4.19Å; I340-Y385 HydrophobicContact CG1-CE1 3.57Å; F342-Y385 AromaticContact CE1-CD1 3.93Å; F342-Y385 HydrophobicContact CE1-CD1 3.93Å; F342-Y385 HydrophobicContact CE1-CD2 4.08Å; F342-Y385 AromaticContact CE1-CE1 3.9Å; F342-Y385 HydrophobicContact CE1-CE1 3.9Å; F342-Y385 HydrophobicContact CE1-CE2 4.02Å; F342-Y385 HydrophobicContact CE1-CG 4.04Å; F342-Y385 AromaticContact CE1-CZ 3.95Å; F342-Y385 HydrophobicContact CZ-CE1 4.16Å; F342-Y385 HydrophobicContact CZ-CE2 4.12Å; F342-Y385 AromaticContact CZ-CZ 3.88Å; R367-Y385 WeakPolarHBondContact CA-OH 3.44Å; V368-Y385 HydrophobicContact CB-CE2 3.89Å; V368-Y385 HydrophobicContact CG2-CE2 4.09Å; V368-Y385 PolarHBondContact N-OH 3.28Å; Y385-V399 HydrophobicContact CD2-CG1 4.15Å; Y385-V399 HydrophobicContact CE2-CG1 3.4Å; Y385-V399 VanDerWaalsContact CE2-CG1 3.4Å; Y385-Y400 WeakPolarHBondContact CA-O 3.39Å; Y385-Y400 VanDerWaalsContact CD2-O 3.3Å; Y385-Y400 WeakPolarHBondContact CD2-O 3.47Å; Y385-A401 HydrophobicContact CD2-CB 3.79Å; Y385-A401 HydrophobicContact CE2-CB 4.45Å; Y385-A401 HydrophobicContact CG-CB 4.47Å
386	D	97.8	Very high	94.3	Very high	50 Å²	50	36.4 Å²	36.4	27%	0.267	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	166.4	-173.5	-144.8	-40.5	0	0	0	112.1	F342 V399 Y400	F342-D386 VanDerWaalsContact CB-OD1 3.25Å; F342-D386 WeakPolarHBondContact CB-OD1 3.44Å; D386-V399 WeakPolarHBondContact O-CA 3.27Å; D386-Y400 HydrophobicContact CB-CE1 3.74Å; D386-Y400 PolarHBondContact N-O 3.05Å; D386-Y400 WeakPolarHBondContact O-CD1 3.46Å; D386-Y400 PolarHBondContact O-N 3.34Å
387	S	97.5	Very high	95	Very high	9 Å²	9	34.4 Å²	34.4	6%	0.063	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	166.9	166.8	67.9	0	0	0	0	111.1	P389 P398	S387-P389 VanDerWaalsContact O-CD 3.31Å; S387-P389 WeakPolarHBondContact O-CD 3.42Å; S387-P398 CarbonylContact C-O 3.52Å; S387-P398 VanDerWaalsContact CA-O 3.25Å; S387-P398 WeakPolarHBondContact CA-O 3.49Å
388	V	96.8	Very high	95.6	Very high	8 Å²	8	27 Å²	27	5%	0.048	16%	0.157	C	C	.	.			trans	-116.5	83.7	174.7	-169.2	0	0	0	0	110.4	E173 A390 V391 P398 Y400	E173-V388 HydrophobicContact CB-CG1 4.12Å; V388-A390 HydrophobicContact CG1-CB 4.49Å; V388-A390 PolarHBondContact O-N 3.36Å; V388-V391 HydrophobicContact CG1-CG2 3.9Å; V388-V391 PolarHBondContact O-N 3.33Å; V388-P398 HydrophobicContact CB-CB 4.1Å; V388-P398 HydrophobicContact CB-CG 4.18Å; V388-P398 HydrophobicContact CG2-CB 4.15Å; V388-P398 PolarHBondContact N-O 3.37Å; V388-Y400 HydrophobicContact CG2-CD1 3.75Å; V388-Y400 HydrophobicContact CG2-CE1 4.23Å
389	P	95.2	Very high	96.1	Very high	65 Å²	65	25.9 Å²	25.9	42%	0.422	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-21.1	-176	-22.6	33.5	0	0	0	114.4	N353 S387 V391 C392	N353-P389 PolarHBondContact ND2-O 3.2Å; N353-P389 PolarHBondContact OD1-O 3Å; S387-P389 VanDerWaalsContact O-CD 3.31Å; S387-P389 WeakPolarHBondContact O-CD 3.42Å; P389-V391 PolarHBondContact O-N 3.48Å; P389-C392 PolarHBondContact O-SG 3.3Å; P389-C392 VanDerWaalsContact O-SG 3.33Å
390	A	94.1	Very high	96.4	Very high	49 Å²	49	23.9 Å²	23.9	41%	0.405	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-30.8	177.1	0	0	0	0	0	112	E173 V388 C392	E173-A390 HydrophobicContact CB-CB 4.35Å; E173-A390 HydrophobicContact CG-CB 4.11Å; V388-A390 HydrophobicContact CG1-CB 4.49Å; V388-A390 PolarHBondContact O-N 3.36Å; A390-C392 PolarHBondContact O-N 2.82Å
391	V	95.2	Very high	96.5	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.138	C	C	.	.			trans	-83.1	113.2	178.4	-176.5	0	0	0	0	109.8	F159 H170 E173 V388 P389 K397 P398	F159-V391 HydrophobicContact CE1-CG1 3.78Å; F159-V391 HydrophobicContact CZ-CG1 3.65Å; H170-V391 HydrophobicContact CB-CG1 4.21Å; H170-V391 HydrophobicContact CB-CG2 3.94Å; H170-V391 WeakPolarHBondContact O-CG2 3.49Å; E173-V391 HydrophobicContact CB-CG2 4.26Å; V388-V391 HydrophobicContact CG1-CG2 3.9Å; V388-V391 PolarHBondContact O-N 3.33Å; P389-V391 PolarHBondContact O-N 3.48Å; V391-K397 VanDerWaalsContact O-CD 3.27Å; V391-K397 WeakPolarHBondContact O-CD 3.33Å; V391-K397 PolarHBondContact O-NZ 3.36Å; V391-P398 HydrophobicContact CB-CG 3.73Å; V391-P398 HydrophobicContact CG1-CG 3.88Å; V391-P398 HydrophobicContact CG2-CG 4Å
392	C	94.4	Very high	96.6	Very high	18 Å²	18	19.8 Å²	19.8	12%	0.122	12%	0.12	C	C	.	.			trans	-121.4	9.4	-175.6	-56.9	0	0	0	0	114.2	G351 N353 P389 A390 S394 K397	G351-C392 VanDerWaalsContact CA-O 3.22Å; G351-C392 WeakPolarHBondContact CA-O 3.46Å; G351-C392 PolarHBondContact N-O 2.95Å; N353-C392 PolarHBondContact OD1-SG 2.78Å; N353-C392 VanDerWaalsContact OD1-SG 3.37Å; P389-C392 PolarHBondContact O-SG 3.3Å; P389-C392 VanDerWaalsContact O-SG 3.33Å; A390-C392 PolarHBondContact O-N 2.82Å; C392-S394 VanDerWaalsContact C-N 3.27Å; C392-S394 PolarHBondContact O-N 2.83Å; C392-K397 PolarHBondContact SG-NZ 3.25Å
393	S	92.3	Very high	96.7	Very high	22 Å²	22	19 Å²	19	15%	0.154	12%	0.115	C	C	.	.	S	Bend	trans	-68.3	-24	-177.6	45.9	0	0	0	0	114	K164 I166 F350	K164-S393 WeakPolarHBondContact CB-O 3.16Å; K164-S393 WeakPolarHBondContact CG-O 3.46Å; I166-S393 WeakPolarHBondContact CG2-OG 3.17Å; F350-S393 WeakPolarHBondContact CD1-O 3.25Å
394	S	95.3	Very high	96.6	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.104	C	C	.	.	S	Bend	trans	-110.7	165.6	-179.8	-177.3	0	0	0	0	110.8	N160 C392 H396	N160-S394 WeakPolarHBondContact O-CB 3.43Å; N160-S394 PolarHBondContact O-OG 3.1Å; C392-S394 VanDerWaalsContact C-N 3.27Å; C392-S394 PolarHBondContact O-N 2.83Å; S394-H396 PolarHBondContact OG-N 3.1Å; S394-H396 VanDerWaalsContact OG-N 3.12Å
395	D	96	Very high	96.5	Very high	11 Å²	11	15.8 Å²	15.8	6%	0.059	10%	0.095	C	C	.	.	S	Bend	trans	-78.4	-1.6	164.6	62.5	-36.5	0	0	0	112.8	A162 K347 F348 F350	A162-D395 WeakPolarHBondContact CB-OD1 3.47Å; K347-D395 CarbonylContact C-O 3.6Å; K347-D395 WeakPolarHBondContact CA-O 3.28Å; K347-D395 HydrophobicContact CG-CB 3.95Å; K347-D395 IonicContact NZ-OD2 2.9Å; K347-D395 PolarHBondContact NZ-OD2 3.07Å; F348-D395 PolarHBondContact N-O 3.31Å; F348-D395 VanDerWaalsContact O-CB 3.23Å; F348-D395 WeakPolarHBondContact O-CB 3.49Å; F350-D395 HydrophobicContact CE1-CB 4.19Å; F350-D395 HydrophobicContact CE2-CB 4.44Å; F350-D395 HydrophobicContact CZ-CB 4.06Å
396	H	97.5	Very high	96.1	Very high	9 Å²	9	18.4 Å²	18.4	4%	0.042	11%	0.108	C	C	.	.	B	Isolated β-bridge	trans	-106.1	160.5	165.9	-67.8	-114.4	0	0	0	111.5	N160 D288 T345 Y346 T365 D366 S394	N160-H396 HydrophobicContact CB-CB 4.14Å; N160-H396 WeakPolarHBondContact O-CB 3.31Å; D288-H396 IonicContact OD2-CE1 3.34Å; T345-H396 CarbonylContact O-C 3.33Å; T345-H396 VanDerWaalsContact O-CA 3.24Å; T345-H396 WeakPolarHBondContact O-CA 3.32Å; Y346-H396 AromaticContact CD2-CD2 3.6Å; Y346-H396 AromaticContact CD2-CE1 3.36Å; Y346-H396 WeakPolarHBondContact CD2-CE1 3.3Å; Y346-H396 AromaticContact CD2-CG 3.94Å; Y346-H396 AromaticContact CD2-ND1 3.81Å; Y346-H396 AromaticContact CD2-NE2 3.17Å; Y346-H396 WeakPolarHBondContact CD2-NE2 3.5Å; Y346-H396 AromaticContact CE2-CD2 4Å; Y346-H396 AromaticContact CE2-CE1 3.86Å; Y346-H396 AromaticContact CE2-NE2 3.33Å; Y346-H396 VanDerWaalsContact CE2-NE2 3.33Å; Y346-H396 WeakPolarHBondContact CE2-NE2 3.41Å; Y346-H396 AromaticContact CG-CE1 3.94Å; T365-H396 PolarHBondContact OG1-CE1 3.03Å; T365-H396 PolarHBondContact OG1-ND1 3.02Å; D366-H396 IonicContact OD2-CE1 3.11Å; D366-H396 IonicContact OD2-CG 3.6Å; D366-H396 IonicContact OD2-ND1 2.65Å; D366-H396 PolarHBondContact OD2-ND1 3.14Å; S394-H396 PolarHBondContact OG-N 3.1Å; S394-H396 VanDerWaalsContact OG-N 3.12Å
397	K	97.4	Very high	95.5	Very high	4 Å²	4	16.9 Å²	16.9	2%	0.017	10%	0.1	C	C	.	.			trans	-105.8	138.7	166.3	-57.8	-55.1	-172	-177.7	0	110.1	T345 F348 E352 N353 V391 C392	T345-K397 HydrophobicContact CG2-CB 4Å; T345-K397 PolarHBondContact O-N 3.16Å; F348-K397 HydrophobicContact CD2-CD 4.32Å; F348-K397 HydrophobicContact CD2-CG 3.94Å; F348-K397 HydrophobicContact CE2-CD 4.35Å; F348-K397 HydrophobicContact CE2-CG 3.59Å; F348-K397 HydrophobicContact CZ-CG 3.98Å; E352-K397 PolarHBondContact O-NZ 3.37Å; N353-K397 WeakPolarHBondContact OD1-CE 3.17Å; N353-K397 PolarHBondContact OD1-NZ 3.44Å; V391-K397 VanDerWaalsContact O-CD 3.27Å; V391-K397 WeakPolarHBondContact O-CD 3.33Å; V391-K397 PolarHBondContact O-NZ 3.36Å; C392-K397 PolarHBondContact SG-NZ 3.25Å
398	P	97.9	Very high	94.4	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	12%	0.115	C	C	.	.			trans	-57.1	146.7	169.5	-16.7	27.2	0	0	0	110.5	T158 F159 M174 S387 V388 V391	T158-P398 WeakPolarHBondContact O-CA 3.47Å; F159-P398 HydrophobicContact CB-CB 4.06Å; F159-P398 HydrophobicContact CB-CG 4.28Å; F159-P398 HydrophobicContact CD1-CG 3.95Å; F159-P398 HydrophobicContact CD2-CB 4.11Å; F159-P398 HydrophobicContact CD2-CG 3.65Å; F159-P398 HydrophobicContact CE1-CG 4.12Å; F159-P398 HydrophobicContact CE2-CG 3.87Å; F159-P398 HydrophobicContact CG-CB 4.04Å; F159-P398 HydrophobicContact CG-CG 3.72Å; F159-P398 HydrophobicContact CZ-CG 4.11Å; M174-P398 HydrophobicContact CG-CB 3.87Å; M174-P398 HydrophobicContact CG-CG 4.25Å; M174-P398 HydrophobicContact SD-CB 4.2Å; M174-P398 HydrophobicContact SD-CG 4.36Å; S387-P398 CarbonylContact C-O 3.52Å; S387-P398 VanDerWaalsContact CA-O 3.25Å; S387-P398 WeakPolarHBondContact CA-O 3.49Å; V388-P398 HydrophobicContact CB-CB 4.1Å; V388-P398 HydrophobicContact CB-CG 4.18Å; V388-P398 HydrophobicContact CG2-CB 4.15Å; V388-P398 PolarHBondContact N-O 3.37Å; V391-P398 HydrophobicContact CB-CG 3.73Å; V391-P398 HydrophobicContact CG1-CG 3.88Å; V391-P398 HydrophobicContact CG2-CG 4Å
399	V	98.4	Very high	92.9	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	140.6	172.2	171.6	0	0	0	0	107.8	S157 T158 F342 T345 D366 V368 Y385 D386	S157-V399 CarbonylContact C-O 3.45Å; S157-V399 WeakPolarHBondContact CA-O 3.48Å; T158-V399 HydrophobicContact CG2-CB 3.96Å; T158-V399 PolarHBondContact N-O 3.33Å; T158-V399 PolarHBondContact O-N 2.85Å; F342-V399 HydrophobicContact CE2-CG2 4.1Å; F342-V399 HydrophobicContact CZ-CG1 4.04Å; F342-V399 HydrophobicContact CZ-CG2 4.29Å; T345-V399 HydrophobicContact CG2-CG2 3.6Å; D366-V399 HydrophobicContact CB-CB 4.28Å; D366-V399 HydrophobicContact CB-CG2 3.84Å; V368-V399 HydrophobicContact CG2-CG1 4.41Å; Y385-V399 HydrophobicContact CD2-CG1 4.15Å; Y385-V399 HydrophobicContact CE2-CG1 3.4Å; Y385-V399 VanDerWaalsContact CE2-CG1 3.4Å; D386-V399 WeakPolarHBondContact O-CA 3.27Å
400	Y	98.4	Very high	91	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	153.8	175.7	79.7	-87.1	0	0	0	111.2	F155 V156 P177 H179 V180 S384 Y385 D386 V388	F155-Y400 HydrophobicContact CD2-CD2 4.11Å; F155-Y400 AromaticContact CE2-CD2 3.23Å; F155-Y400 HydrophobicContact CE2-CD2 3.23Å; F155-Y400 AromaticContact CE2-CE2 3.87Å; F155-Y400 HydrophobicContact CE2-CE2 3.87Å; F155-Y400 AromaticContact CE2-CG 3.8Å; F155-Y400 HydrophobicContact CE2-CG 3.8Å; F155-Y400 AromaticContact CZ-CD2 3.6Å; F155-Y400 HydrophobicContact CZ-CD2 3.6Å; F155-Y400 HydrophobicContact CZ-CE2 4.46Å; F155-Y400 AromaticContact CZ-CG 3.62Å; F155-Y400 HydrophobicContact CZ-CG 3.62Å; V156-Y400 CarbonylContact O-C 3.42Å; V156-Y400 WeakPolarHBondContact O-CA 3.39Å; V156-Y400 WeakPolarHBondContact O-CB 3.39Å; P177-Y400 HydrophobicContact CB-CD1 4.49Å; P177-Y400 HydrophobicContact CB-CE1 3.75Å; P177-Y400 HydrophobicContact CG-CD1 3.73Å; P177-Y400 HydrophobicContact CG-CD2 4.22Å; P177-Y400 HydrophobicContact CG-CE1 3.45Å; P177-Y400 VanDerWaalsContact CG-CE1 3.45Å; P177-Y400 HydrophobicContact CG-CE2 3.99Å; P177-Y400 HydrophobicContact CG-CG 4.1Å; H179-Y400 PolarHBondContact CD2-OH 3.38Å; H179-Y400 PolarHBondContact NE2-OH 2.06Å; V180-Y400 HydrophobicContact CG2-CE2 3.8Å; S384-Y400 WeakPolarHBondContact OG-CE2 3.39Å; Y385-Y400 WeakPolarHBondContact CA-O 3.39Å; Y385-Y400 VanDerWaalsContact CD2-O 3.3Å; Y385-Y400 WeakPolarHBondContact CD2-O 3.47Å; D386-Y400 HydrophobicContact CB-CE1 3.74Å; D386-Y400 PolarHBondContact N-O 3.05Å; D386-Y400 WeakPolarHBondContact O-CD1 3.46Å; D386-Y400 PolarHBondContact O-N 3.34Å; V388-Y400 HydrophobicContact CG2-CD1 3.75Å; V388-Y400 HydrophobicContact CG2-CE1 4.23Å
401	A	98.5	Very high	89	Confident	1 Å²	1	23.1 Å²	23.1	1%	0.008	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	136.2	168.1	0	0	0	0	0	109.8	V156 V368 S384 Y385 F403	V156-A401 PolarHBondContact N-O 3.29Å; V156-A401 PolarHBondContact O-N 2.99Å; V368-A401 HydrophobicContact CB-CB 3.98Å; V368-A401 HydrophobicContact CG1-CB 3.87Å; V368-A401 HydrophobicContact CG2-CB 4.12Å; S384-A401 CarbonylContact O-C 3.53Å; S384-A401 VanDerWaalsContact O-CA 3.26Å; S384-A401 WeakPolarHBondContact O-CA 3.14Å; Y385-A401 HydrophobicContact CD2-CB 3.79Å; Y385-A401 HydrophobicContact CE2-CB 4.45Å; Y385-A401 HydrophobicContact CG-CB 4.47Å; A401-F403 HydrophobicContact CB-CD2 4.17Å; A401-F403 HydrophobicContact CB-CE2 3.29Å; A401-F403 HydrophobicContact CB-CZ 3.6Å
402	F	98	Very high	87	Confident	15 Å²	15	27.5 Å²	27.5	7%	0.066	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	124.2	176.3	-167.5	-72.1	0	0	0	108.2	F155 V180 H182 A184 C382 I383 S384	F155-F402 HydrophobicContact CD2-CB 4.41Å; F155-F402 AromaticContact CD2-CD2 3.76Å; F155-F402 HydrophobicContact CD2-CD2 3.76Å; V180-F402 HydrophobicContact CG1-CD2 3.5Å; V180-F402 VanDerWaalsContact CG1-CD2 3.5Å; V180-F402 HydrophobicContact CG1-CE2 3.59Å; V180-F402 HydrophobicContact CG1-CG 4.47Å; V180-F402 HydrophobicContact CG2-CD2 4.4Å; H182-F402 WeakPolarHBondContact O-CE2 3.38Å; A184-F402 HydrophobicContact CB-CE2 3.95Å; A184-F402 HydrophobicContact CB-CZ 4.3Å; C382-F402 CarbonylContact C-O 3.53Å; I383-F402 HydrophobicContact CB-CD1 4.07Å; I383-F402 HydrophobicContact CD1-CD1 3.82Å; I383-F402 HydrophobicContact CD1-CE1 3.87Å; I383-F402 HydrophobicContact CG1-CD1 4.39Å; I383-F402 PolarHBondContact N-O 2.66Å; S384-F402 PolarHBondContact N-O 3.25Å; S384-F402 PolarHBondContact O-N 3.3Å; S384-F402 VanDerWaalsContact OG-CB 3.24Å; S384-F402 WeakPolarHBondContact OG-CB 3.31Å
403	F	97.9	Very high	84.6	Confident	1 Å²	1	34.5 Å²	34.5	0%	0.004	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	158.2	-178.2	-59.7	-93.9	0	0	0	111.8	S153 I154 V156 F284 V368 Y370 L380 H381 C382 A401	S153-F403 CarbonylContact C-O 3.59Å; S153-F403 VanDerWaalsContact CA-O 3.29Å; S153-F403 WeakPolarHBondContact CA-O 3.25Å; I154-F403 HydrophobicContact CB-CB 4.29Å; I154-F403 PolarHBondContact N-O 3.39Å; I154-F403 PolarHBondContact O-N 3.27Å; V156-F403 HydrophobicContact CB-CE2 4.29Å; V156-F403 HydrophobicContact CG2-CD2 4.13Å; V156-F403 HydrophobicContact CG2-CE2 3.93Å; F284-F403 HydrophobicContact CD1-CD2 4.26Å; F284-F403 AromaticContact CD1-CE2 3.91Å; F284-F403 HydrophobicContact CD1-CE2 3.91Å; F284-F403 HydrophobicContact CD1-CZ 4.16Å; F284-F403 HydrophobicContact CE1-CB 4.48Å; F284-F403 HydrophobicContact CE1-CD1 4.04Å; F284-F403 AromaticContact CE1-CD2 3.61Å; F284-F403 HydrophobicContact CE1-CD2 3.61Å; F284-F403 HydrophobicContact CE1-CE1 4.1Å; F284-F403 AromaticContact CE1-CE2 3.67Å; F284-F403 HydrophobicContact CE1-CE2 3.67Å; F284-F403 AromaticContact CE1-CG 3.8Å; F284-F403 HydrophobicContact CE1-CG 3.8Å; F284-F403 AromaticContact CE1-CZ 3.94Å; F284-F403 HydrophobicContact CE1-CZ 3.94Å; F284-F403 HydrophobicContact CZ-CD2 4.42Å; F284-F403 HydrophobicContact CZ-CG 4.41Å; V368-F403 HydrophobicContact CG1-CE2 4.05Å; V368-F403 HydrophobicContact CG1-CZ 4.03Å; Y370-F403 AromaticContact CD1-CE1 3.35Å; Y370-F403 HydrophobicContact CD1-CE1 3.35Å; Y370-F403 AromaticContact CD1-CZ 3.52Å; Y370-F403 HydrophobicContact CD1-CZ 3.52Å; Y370-F403 HydrophobicContact CD2-CE1 4.3Å; Y370-F403 AromaticContact CE1-CE1 3.58Å; Y370-F403 HydrophobicContact CE1-CE1 3.58Å; Y370-F403 HydrophobicContact CE1-CZ 4.02Å; Y370-F403 HydrophobicContact CE2-CE1 4.49Å; Y370-F403 AromaticContact CG-CE1 3.73Å; Y370-F403 HydrophobicContact CG-CE1 3.73Å; Y370-F403 HydrophobicContact CG-CZ 4.09Å; L380-F403 HydrophobicContact CD1-CB 3.8Å; L380-F403 HydrophobicContact CD1-CD1 3.93Å; L380-F403 HydrophobicContact CD1-CG 4.16Å; L380-F403 HydrophobicContact CD2-CD1 4.19Å; L380-F403 HydrophobicContact CD2-CE1 4.46Å; L380-F403 HydrophobicContact CG-CD1 3.94Å; H381-F403 CarbonylContact O-C 3.56Å; H381-F403 WeakPolarHBondContact O-CA 3.04Å; C382-F403 HydrophobicContact CB-CD1 3.69Å; C382-F403 HydrophobicContact CB-CE1 3.51Å; C382-F403 HydrophobicContact CB-CZ 4.37Å; A401-F403 HydrophobicContact CB-CD2 4.17Å; A401-F403 HydrophobicContact CB-CE2 3.29Å; A401-F403 HydrophobicContact CB-CZ 3.6Å
404	E	95.1	Very high	84.3	Confident	58 Å²	58	35.1 Å²	35.1	27%	0.271	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	125.6	163.4	-170.7	-178	-159.6	0	0	107.9	R151 L152 L380 H381 I383	R151-E404 HydrophobicContact CB-CG 3.91Å; R151-E404 WeakPolarHBondContact CB-OE1 3.47Å; R151-E404 WeakPolarHBondContact CD-OE1 3.3Å; R151-E404 VanDerWaalsContact CZ-CD 3.46Å; R151-E404 IonicContact CZ-OE1 2.82Å; R151-E404 IonicContact CZ-OE2 3.58Å; R151-E404 IonicContact NE-OE1 3.8Å; R151-E404 PolarHBondContact NE-OE1 3.14Å; R151-E404 IonicContact NE-OE2 3.52Å; R151-E404 PolarHBondContact NE-OE2 3.39Å; R151-E404 VanDerWaalsContact NE-OE2 3.17Å; R151-E404 IonicContact NH2-OE1 2.57Å; R151-E404 IonicContact NH2-OE2 2.9Å; R151-E404 PolarHBondContact NH2-OE2 3.44Å; L152-E404 CarbonylContact O-C 3.51Å; L152-E404 WeakPolarHBondContact O-CA 3.3Å; L380-E404 WeakPolarHBondContact CA-O 3.33Å; H381-E404 PolarHBondContact N-O 2.85Å; H381-E404 PolarHBondContact O-N 2.98Å; I383-E404 HydrophobicContact CD1-CB 3.72Å; I383-E404 HydrophobicContact CG1-CB 4.43Å
405	A	94.3	Very high	83.7	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	131.1	-173.4	0	0	0	0	0	110.1	R151 L152 I154 Y282 D379 L380	R151-A405 CarbonylContact C-O 3.49Å; R151-A405 WeakPolarHBondContact CA-O 3.44Å; L152-A405 PolarHBondContact N-O 3.5Å; L152-A405 PolarHBondContact O-N 2.9Å; I154-A405 HydrophobicContact CD1-CB 3.91Å; Y282-A405 HydrophobicContact CD2-CB 4.17Å; Y282-A405 HydrophobicContact CE2-CB 3.85Å; D379-A405 CarbonylContact O-C 3.58Å; D379-A405 WeakPolarHBondContact O-CA 3.44Å; L380-A405 HydrophobicContact CD1-CB 3.56Å
406	M	90.9	Very high	83	Confident	66 Å²	66	38.4 Å²	38.4	33%	0.325	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	131.1	170	-171.5	177.7	-61.2	0	0	110.2	R150 Y282 D379	R150-M406 CarbonylContact O-C 3.48Å; R150-M406 WeakPolarHBondContact O-CA 3.25Å; Y282-M406 WeakPolarHBondContact CE2-O 3.43Å; Y282-M406 VanDerWaalsContact CZ-O 3.29Å; Y282-M406 PolarHBondContact OH-O 3.02Å; D379-M406 HydrophobicContact CB-CB 3.92Å; D379-M406 HydrophobicContact CB-CE 4.16Å; D379-M406 PolarHBondContact O-N 3.2Å
407	I	84.6	Confident	82.1	Confident	19 Å²	19	40.1 Å²	40.1	10%	0.097	21%	0.205	C	C	.	.			trans	-112.6	143.2	176.5	60.3	171.4	0	0	0	110.7	L66 L143 L147 R150 L152	L66-I407 HydrophobicContact CD1-CG2 4Å; L143-I407 HydrophobicContact CD1-CD1 4.23Å; L143-I407 HydrophobicContact CD2-CD1 4.07Å; L147-I407 HydrophobicContact CD1-CD1 4.33Å; R150-I407 HydrophobicContact CB-CG1 4.17Å; R150-I407 WeakPolarHBondContact CB-O 3.33Å; R150-I407 WeakPolarHBondContact O-CG1 3.35Å; R150-I407 PolarHBondContact O-N 3.45Å; L152-I407 HydrophobicContact CB-CG2 4.04Å; L152-I407 HydrophobicContact CD2-CG2 4.24Å
408	V	73.8	Confident	81.2	Confident	61 Å²	61	42.4 Å²	42.4	37%	0.37	22%	0.216	S	C	.	.			trans	-124.6	128	174.3	-176.6	0	0	0	0	107.7	E412 E413	V408-E412 HydrophobicContact CG1-CB 3.97Å; V408-E413 HydrophobicContact CG1-CG 4.37Å
409	P	65.2	Low	80.1	Confident	7 Å²	7	45.2 Å²	45.2	5%	0.045	23%	0.231	C	C	.	.			trans	-59.6	141.2	172.9	-24.2	34.7	0	0	0	111.9	E64 L143 S411 E412	E64-P409 HydrophobicContact CB-CB 4.18Å; E64-P409 HydrophobicContact CG-CB 4.32Å; L143-P409 HydrophobicContact CD2-CG 4.02Å; P409-S411 PolarHBondContact O-N 2.93Å; P409-E412 HydrophobicContact CB-CG 4.49Å; P409-E412 PolarHBondContact O-N 3.32Å
410	E	56.5	Low	78.8	Confident	120 Å²	120	48.4 Å²	48.4	56%	0.561	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-23.6	179.5	-171.2	173.5	-166.8	0	0	113.3	E412	E410-E412 VanDerWaalsContact C-N 3.31Å; E410-E412 PolarHBondContact O-N 3.11Å
411	S	52.1	Low	77.2	Confident	74 Å²	74	52.2 Å²	52.2	52%	0.517	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-13.8	176.5	58.3	0	0	0	0	114.8	P409	P409-S411 PolarHBondContact O-N 2.93Å
412	E	52.1	Low	75.5	Confident	92 Å²	92	56.4 Å²	56.4	43%	0.43	29%	0.288	S	S	.	.			trans	-101.3	-8.7	-177.9	-65.8	-171.3	-173.6	0	0	113.8	S140 R150 V408 P409 E410	S140-E412 WeakPolarHBondContact CB-OE1 3.41Å; S140-E412 PolarHBondContact OG-OE1 2.81Å; R150-E412 IonicContact CZ-OE1 3.47Å; R150-E412 IonicContact CZ-OE2 3.62Å; R150-E412 IonicContact NH1-OE1 2.76Å; R150-E412 IonicContact NH1-OE2 3.82Å; R150-E412 PolarHBondContact NH1-OE2 3.36Å; R150-E412 IonicContact NH2-OE1 3.53Å; R150-E412 PolarHBondContact NH2-OE1 3.02Å; R150-E412 IonicContact NH2-OE2 3.66Å; V408-E412 HydrophobicContact CG1-CB 3.97Å; P409-E412 HydrophobicContact CB-CG 4.49Å; P409-E412 PolarHBondContact O-N 3.32Å; E410-E412 VanDerWaalsContact C-N 3.31Å; E410-E412 PolarHBondContact O-N 3.11Å
413	E	45.3	Very low	73.4	Confident	164 Å²	164	60.2 Å²	60.2	77%	0.766	31%	0.308	S	S	*	.			trans	-80.4	0	168.6	-64.8	-163.4	156.3	0	0	111.9	V408	V408-E413 HydrophobicContact CG1-CG 4.37Å

Retrieved 413 of 413 residues in 157 ms (Link to these results)

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