A0A077ZBL1_TRITR Loading...

Nucleolar GTP-binding protein 2

GTPase that associates with pre-60S ribosomal subunits in the nucleolus and is required for their nuclear export and maturation. May promote cell proliferation possibly by increasing p53/TP53 protein levels, and consequently those of its downstream product CDKN1A/p21, and decreasing RPL23A protein levels.

AlphaFold DB , UniProt , Accession A0A077ZBL1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 624 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.6	Very low	44.6	Very low	253 Å²	253	176.3 Å²	176.3	100%	1.246	89%	0.885	S	S	*	*				0	110.2	0	-66.1	-158.8	-150	0	0	109.1
2	G	41.8	Very low	45.2	Very low	75 Å²	75	174.1 Å²	174.1	77%	0.773	88%	0.878	S	S	*	*			trans	-129.9	103	178.9	0	0	0	0	0	109.9	R4	G2-R4 PolarHBondContact O-N 3.33Å
3	T	45.1	Very low	46.1	Very low	139 Å²	139	179.2 Å²	179.2	85%	0.853	88%	0.88	S	S	*	*			trans	-72.3	95.4	179.9	42.9	0	0	0	0	110	K5	T3-K5 PolarHBondContact O-N 3.25Å
4	R	45.1	Very low	47.3	Very low	252 Å²	252	172.3 Å²	172.3	95%	0.951	85%	0.853	S	S	*	*			trans	-60.8	97.1	168.9	-107.5	178.5	165.5	179	-3.1	109.3	G2 K6	G2-R4 PolarHBondContact O-N 3.33Å; R4-K6 PolarHBondContact O-N 3.45Å
5	K	45.6	Very low	48.5	Very low	203 Å²	203	164.2 Å²	164.2	88%	0.883	82%	0.82	S	S	*	*			trans	-59.2	105.9	169	-82.2	179.6	176.9	171.9	0	109.1	T3 A7	T3-K5 PolarHBondContact O-N 3.25Å; K5-A7 PolarHBondContact O-N 3.04Å
6	K	46.4	Very low	49.6	Very low	198 Å²	198	163.4 Å²	163.4	86%	0.861	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-54.3	128.5	164.7	-92.1	177.3	174.9	171.6	0	108.6	R4 R8	R4-K6 PolarHBondContact O-N 3.45Å; K6-R8 PolarHBondContact O-N 3.32Å; K6-R8 VanDerWaalsContact O-N 3.08Å
7	A	41.9	Very low	50.8	Low	99 Å²	99	156.3 Å²	156.3	82%	0.818	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-53.7	116.4	172	0	0	0	0	0	109.4	K5 K9	K5-A7 PolarHBondContact O-N 3.04Å; A7-K9 PolarHBondContact O-N 3.11Å
8	R	43.2	Very low	52	Low	243 Å²	243	157.7 Å²	157.7	92%	0.917	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-59.9	120.5	173.7	-78.7	179.8	156	-178.3	-6.5	107.7	K6	K6-R8 PolarHBondContact O-N 3.32Å; K6-R8 VanDerWaalsContact O-N 3.08Å
9	K	46.2	Very low	53.3	Low	189 Å²	189	154.9 Å²	154.9	82%	0.822	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-51.5	137.3	165.9	-79.6	-178.8	174.5	-179.5	0	107.7	A7 M11	A7-K9 PolarHBondContact O-N 3.11Å; K9-M11 PolarHBondContact O-N 3.45Å
10	P	46.5	Very low	54.4	Low	120 Å²	120	150.7 Å²	150.7	78%	0.779	76%	0.756	S	S	*	*			trans	-58.2	112.6	170.6	24.9	-29.5	0	0	0	106.5	D12	P10-D12 PolarHBondContact O-N 3.21Å; P10-D12 VanDerWaalsContact O-N 3.16Å
11	M	45.9	Very low	55.5	Low	168 Å²	168	146 Å²	146	83%	0.828	73%	0.733	S	S	*	*			trans	-65.4	115.6	166	-72	-165.7	-57.6	0	0	105.1	K9 R13	K9-M11 PolarHBondContact O-N 3.45Å; M11-R13 VanDerWaalsContact C-N 3.3Å; M11-R13 PolarHBondContact O-N 3.34Å
12	D	52.3	Low	57.3	Low	150 Å²	150	134.3 Å²	134.3	80%	0.802	68%	0.676	S	S	*	*			trans	-51.2	103.3	163.1	-74.7	-39	0	0	0	106.3	P10 V14	P10-D12 PolarHBondContact O-N 3.21Å; P10-D12 VanDerWaalsContact O-N 3.16Å; D12-V14 VanDerWaalsContact C-N 3.26Å; D12-V14 PolarHBondContact O-N 3.23Å
13	R	56.6	Low	59	Low	241 Å²	241	132 Å²	132	91%	0.909	65%	0.647	S	S	*	*			trans	-66.4	95.6	176.4	-85.4	-175.8	172.1	-179.6	-2.6	106	M11 S15	M11-R13 VanDerWaalsContact C-N 3.3Å; M11-R13 PolarHBondContact O-N 3.34Å; R13-S15 PolarHBondContact O-N 3.19Å
14	V	63.1	Low	60.5	Low	82 Å²	82	128.3 Å²	128.3	50%	0.497	62%	0.622	S	S	.	*			trans	-52.3	108.8	170.2	-178.4	0	0	0	0	106.6	D12 H16 D24	D12-V14 VanDerWaalsContact C-N 3.26Å; D12-V14 PolarHBondContact O-N 3.23Å; V14-H16 PolarHBondContact O-N 3.06Å; V14-D24 HydrophobicContact CG1-CB 3.75Å
15	S	64.5	Low	61.9	Low	51 Å²	51	117.8 Å²	117.8	36%	0.357	58%	0.582	S	S	.	*			trans	-74.7	120.8	-178.3	172.6	0	0	0	0	108.3	R13 A17 N22	R13-S15 PolarHBondContact O-N 3.19Å; S15-A17 PolarHBondContact O-N 3.48Å; S15-A17 WeakPolarHBondContact OG-CB 3.42Å; S15-A17 PolarHBondContact OG-N 3.35Å; S15-N22 PolarHBondContact O-ND2 3.47Å; S15-N22 PolarHBondContact OG-ND2 2.98Å
16	H	66.9	Low	62.9	Low	151 Å²	151	111.5 Å²	111.5	70%	0.699	56%	0.564	S	S	*	*			trans	-83	8.3	173	-67.4	-59.6	0	0	0	113.2	V14 K18	V14-H16 PolarHBondContact O-N 3.06Å; H16-K18 PolarHBondContact O-N 3.22Å
17	A	70.7	Confident	63.6	Low	43 Å²	43	107.3 Å²	107.3	36%	0.355	55%	0.551	S	S	.	*			trans	-62.1	133.1	-178.6	0	0	0	0	0	111.8	S15 H19 N22	S15-A17 PolarHBondContact O-N 3.48Å; S15-A17 WeakPolarHBondContact OG-CB 3.42Å; S15-A17 PolarHBondContact OG-N 3.35Å; A17-H19 VanDerWaalsContact C-N 3.3Å; A17-H19 PolarHBondContact O-N 3.25Å; A17-N22 PolarHBondContact N-ND2 2.98Å; A17-N22 WeakPolarHBondContact O-CB 3.37Å; A17-N22 PolarHBondContact O-ND2 3.29Å
18	K	72.1	Confident	64.3	Low	182 Å²	182	112.2 Å²	112.2	79%	0.791	55%	0.554	S	S	*	*			trans	-81.7	2.6	-173.2	-64	-179.5	-179.1	176.6	0	115.3	H16	H16-K18 PolarHBondContact O-N 3.22Å
19	H	75.4	Confident	64.7	Low	104 Å²	104	102.7 Å²	102.7	48%	0.481	53%	0.531	S	S	.	.	S	Bend	trans	-65.5	153.2	-176.7	77.3	-63.1	0	0	0	113.5	A17 L21 N22	A17-H19 VanDerWaalsContact C-N 3.3Å; A17-H19 PolarHBondContact O-N 3.25Å; H19-L21 PolarHBondContact O-N 2.87Å; H19-L21 VanDerWaalsContact O-N 3.14Å; H19-N22 VanDerWaalsContact CE1-CB 3.42Å; H19-N22 WeakPolarHBondContact CE1-CB 3.49Å; H19-N22 WeakPolarHBondContact O-CB 3.42Å; H19-N22 PolarHBondContact O-N 2.94Å; H19-N22 VanDerWaalsContact O-N 3.07Å
20	S	76.2	Confident	64.6	Low	70 Å²	70	96.7 Å²	96.7	49%	0.49	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-15.2	-170.2	62.6	0	0	0	0	115.6
21	L	77.9	Confident	64.5	Low	53 Å²	53	102 Å²	102	28%	0.277	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	2.9	177.1	-65.4	175.2	0	0	0	113.2	H19 P23 V42 L46	H19-L21 PolarHBondContact O-N 2.87Å; H19-L21 VanDerWaalsContact O-N 3.14Å; L21-P23 VanDerWaalsContact O-CD 3.29Å; L21-P23 WeakPolarHBondContact O-CD 3.45Å; L21-V42 VanDerWaalsContact C-CG1 3.45Å; L21-V42 WeakPolarHBondContact O-CG1 3.1Å; L21-L46 HydrophobicContact CB-CD2 4.39Å
22	N	79.2	Confident	64.7	Low	8 Å²	8	97.6 Å²	97.6	4%	0.043	53%	0.531	C	S	.	.			trans	-80.3	116.8	172.9	-165.1	-2.9	0	0	0	110.8	S15 A17 H19 D24 R25	S15-N22 PolarHBondContact O-ND2 3.47Å; S15-N22 PolarHBondContact OG-ND2 2.98Å; A17-N22 PolarHBondContact N-ND2 2.98Å; A17-N22 WeakPolarHBondContact O-CB 3.37Å; A17-N22 PolarHBondContact O-ND2 3.29Å; H19-N22 VanDerWaalsContact CE1-CB 3.42Å; H19-N22 WeakPolarHBondContact CE1-CB 3.49Å; H19-N22 WeakPolarHBondContact O-CB 3.42Å; H19-N22 PolarHBondContact O-N 2.94Å; H19-N22 VanDerWaalsContact O-N 3.07Å; N22-D24 PolarHBondContact O-N 2.86Å; N22-D24 PolarHBondContact OD1-N 3.33Å; N22-R25 HydrophobicContact CB-CB 4.22Å
23	P	78.4	Confident	64.6	Low	27 Å²	27	99.5 Å²	99.5	18%	0.175	53%	0.533	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-18.7	173.7	29.2	-35.1	0	0	0	113	L21 S39 V42 R43 L46	L21-P23 VanDerWaalsContact O-CD 3.29Å; L21-P23 WeakPolarHBondContact O-CD 3.45Å; P23-S39 WeakPolarHBondContact O-CB 3.47Å; P23-S39 PolarHBondContact O-OG 2.87Å; P23-V42 HydrophobicContact CB-CB 4.4Å; P23-V42 HydrophobicContact CB-CG1 4.08Å; P23-R43 HydrophobicContact CB-CG 3.76Å; P23-R43 HydrophobicContact CG-CG 4.41Å; P23-L46 HydrophobicContact CG-CD1 4.39Å
24	D	76.9	Confident	64.4	Low	60 Å²	60	91.3 Å²	91.3	32%	0.321	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	11.1	-172.4	-55.1	-33.7	0	0	0	113.6	V14 N22 R43	V14-D24 HydrophobicContact CG1-CB 3.75Å; N22-D24 PolarHBondContact O-N 2.86Å; N22-D24 PolarHBondContact OD1-N 3.33Å; D24-R43 IonicContact OD1-NH2 3.32Å
25	R	74.3	Confident	64.2	Low	31 Å²	31	91.5 Å²	91.5	12%	0.117	52%	0.519	C	S	.	.	S	Bend	trans	-57.7	141.8	173.4	66.5	-176.5	-176.5	172	-2.8	110.6	N22 N27 Q35 R37	N22-R25 HydrophobicContact CB-CB 4.22Å; R25-N27 PolarHBondContact O-N 3.1Å; R25-Q35 VanDerWaalsContact CZ-CG 3.42Å; R25-R37 PolarHBondContact NH2-O 3.12Å
26	S	66.8	Low	64.3	Low	71 Å²	71	97 Å²	97	50%	0.497	54%	0.543	S	S	.	.			trans	-65	121.4	176.8	60.8	0	0	0	0	110.4	K28	S26-K28 PolarHBondContact O-N 2.75Å; S26-K28 VanDerWaalsContact O-N 3.16Å
27	N	60.7	Low	64.8	Low	110 Å²	110	95 Å²	95	59%	0.588	53%	0.529	S	S	*	.			trans	-75.4	9.5	176.7	-78.7	-16.8	0	0	0	113.2	R25 G29	R25-N27 PolarHBondContact O-N 3.1Å; N27-G29 PolarHBondContact O-N 2.96Å
28	K	57	Low	65.3	Low	202 Å²	202	95.5 Å²	95.5	88%	0.878	53%	0.53	S	S	*	.			trans	-86.9	24.9	-175.2	-69.2	-170.9	175.6	-175.6	0	113.7	S26	S26-K28 PolarHBondContact O-N 2.75Å; S26-K28 VanDerWaalsContact O-N 3.16Å
29	G	51.4	Low	65.9	Low	44 Å²	44	88.6 Å²	88.6	45%	0.454	51%	0.505	S	S	.	.			trans	-82.9	126.5	169.5	0	0	0	0	0	110	N27	N27-G29 PolarHBondContact O-N 2.96Å
30	G	44.9	Very low	66.4	Low	62 Å²	62	87.5 Å²	87.5	64%	0.639	51%	0.509	S	S	*	.			trans	-55.8	160.4	-167.2	0	0	0	0	0	116.4	G32	G30-G32 PolarHBondContact O-N 3.03Å
31	K	43	Very low	66.9	Low	232 Å²	232	86 Å²	86	100%	1.009	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.6	100.3	170.6	-70.5	177.9	176.7	178.2	0	109.3
32	G	51.3	Low	67.3	Low	75 Å²	75	83.4 Å²	83.4	77%	0.773	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	146.2	-25.8	173.1	0	0	0	0	0	117.1	G30	G30-G32 PolarHBondContact O-N 3.03Å
33	F	48.5	Very low	67.8	Low	191 Å²	191	90 Å²	90	84%	0.838	51%	0.507	S	S	*	.	S	Bend	trans	-111.6	86.2	-176.5	-112.5	-94.6	0	0	0	113	Q35	F33-Q35 PolarHBondContact O-N 3.22Å; F33-Q35 PolarHBondContact O-OE1 2.92Å
34	G	53.3	Low	68.2	Low	68 Å²	68	95.4 Å²	95.4	70%	0.701	52%	0.524	S	S	*	.			trans	56	19	139.4	0	0	0	0	0	122.7	L36	G34-L36 VanDerWaalsContact C-N 3.31Å; G34-L36 PolarHBondContact O-N 3.15Å
35	Q	58	Low	68.8	Low	87 Å²	87	95 Å²	95	41%	0.407	52%	0.522	S	S	.	.			trans	-76.3	76.2	175.3	-111.7	112.8	-32.9	0	0	112.6	R25 F33 R37	R25-Q35 VanDerWaalsContact CZ-CG 3.42Å; F33-Q35 PolarHBondContact O-N 3.22Å; F33-Q35 PolarHBondContact O-OE1 2.92Å; Q35-R37 PolarHBondContact O-N 2.92Å
36	L	68.4	Low	69.5	Low	166 Å²	166	95.1 Å²	95.1	87%	0.869	53%	0.525	S	S	*	.			trans	-61.2	-12	-173.7	-72.3	154.2	0	0	0	116.5	G34	G34-L36 VanDerWaalsContact C-N 3.31Å; G34-L36 PolarHBondContact O-N 3.15Å
37	R	76	Confident	70.5	Confident	109 Å²	109	96 Å²	96	41%	0.411	52%	0.522	S	S	.	.			trans	-141	129.4	-166.9	-62.2	179.4	-179.2	165.2	1.7	112.9	R25 Q35 T41 V42	R25-R37 PolarHBondContact NH2-O 3.12Å; Q35-R37 PolarHBondContact O-N 2.92Å; R37-T41 HydrophobicContact CB-CG2 4.27Å; R37-T41 HydrophobicContact CG-CG2 4.23Å; R37-V42 HydrophobicContact CB-CG2 3.99Å
38	S	82	Confident	71.8	Confident	54 Å²	54	99 Å²	99	38%	0.378	53%	0.526	S	S	.	.			trans	-72.8	160.6	171.6	79.4	0	0	0	0	111.8	S40 T41 V42	S38-S40 VanDerWaalsContact C-N 3.25Å; S38-S40 PolarHBondContact O-N 2.96Å; S38-S40 PolarHBondContact OG-OG 3.04Å; S38-T41 WeakPolarHBondContact O-CB 3.34Å; S38-T41 PolarHBondContact O-N 2.96Å; S38-T41 PolarHBondContact OG-N 3.23Å; S38-T41 PolarHBondContact OG-OG1 3.16Å; S38-V42 WeakPolarHBondContact O-CG2 3.45Å; S38-V42 PolarHBondContact O-N 3.49Å
39	S	83.5	Confident	73.2	Confident	36 Å²	36	96 Å²	96	25%	0.252	51%	0.514	S	S	.	.	H	α-helix	trans	-53.3	-42.4	175	-178.4	0	0	0	0	112.3	P23 T41 V42 R43	P23-S39 WeakPolarHBondContact O-CB 3.47Å; P23-S39 PolarHBondContact O-OG 2.87Å; S39-T41 PolarHBondContact O-N 3.25Å; S39-V42 PolarHBondContact O-N 3.04Å; S39-R43 WeakPolarHBondContact O-CG 3.23Å; S39-R43 PolarHBondContact O-N 3.33Å
40	S	87	Confident	74.6	Confident	82 Å²	82	98.7 Å²	98.7	57%	0.573	52%	0.517	S	S	*	.	H	α-helix	trans	-62.5	-41.8	176.3	72.6	0	0	0	0	112.6	S38 V42 R43 R44	S38-S40 VanDerWaalsContact C-N 3.25Å; S38-S40 PolarHBondContact O-N 2.96Å; S38-S40 PolarHBondContact OG-OG 3.04Å; S40-V42 VanDerWaalsContact C-N 3.34Å; S40-V42 PolarHBondContact O-N 3.44Å; S40-R43 PolarHBondContact O-N 2.77Å; S40-R44 WeakPolarHBondContact O-CB 3.37Å; S40-R44 PolarHBondContact O-N 3.2Å
41	T	86.6	Confident	76.4	Confident	37 Å²	37	100.2 Å²	100.2	23%	0.227	51%	0.506	C	S	.	.	H	α-helix	trans	-63.9	-41.7	176.5	-48.8	0	0	0	0	110.8	R37 S38 S39 R44 L45	R37-T41 HydrophobicContact CB-CG2 4.27Å; R37-T41 HydrophobicContact CG-CG2 4.23Å; S38-T41 WeakPolarHBondContact O-CB 3.34Å; S38-T41 PolarHBondContact O-N 2.96Å; S38-T41 PolarHBondContact OG-N 3.23Å; S38-T41 PolarHBondContact OG-OG1 3.16Å; S39-T41 PolarHBondContact O-N 3.25Å; T41-R44 PolarHBondContact O-N 3.14Å; T41-L45 HydrophobicContact CG2-CD1 4.27Å; T41-L45 VanDerWaalsContact O-CG 3.31Å; T41-L45 WeakPolarHBondContact O-CG 3.32Å; T41-L45 PolarHBondContact O-N 3.19Å
42	V	86.7	Confident	78.5	Confident	0 Å²	0	96.8 Å²	96.8	0%	0	49%	0.492	C	S	.	.	H	α-helix	trans	-62.7	-49.3	176.5	174.5	0	0	0	0	110.5	L21 P23 R37 S38 S39 S40 R44 L45 L46	L21-V42 VanDerWaalsContact C-CG1 3.45Å; L21-V42 WeakPolarHBondContact O-CG1 3.1Å; P23-V42 HydrophobicContact CB-CB 4.4Å; P23-V42 HydrophobicContact CB-CG1 4.08Å; R37-V42 HydrophobicContact CB-CG2 3.99Å; S38-V42 WeakPolarHBondContact O-CG2 3.45Å; S38-V42 PolarHBondContact O-N 3.49Å; S39-V42 PolarHBondContact O-N 3.04Å; S40-V42 VanDerWaalsContact C-N 3.34Å; S40-V42 PolarHBondContact O-N 3.44Å; V42-R44 VanDerWaalsContact C-N 3.3Å; V42-R44 PolarHBondContact O-N 3.24Å; V42-L45 PolarHBondContact O-N 2.66Å; V42-L45 VanDerWaalsContact O-N 3.12Å; V42-L46 HydrophobicContact CG1-CD1 3.92Å; V42-L46 HydrophobicContact CG1-CG 4.26Å; V42-L46 WeakPolarHBondContact O-CB 3.33Å; V42-L46 VanDerWaalsContact O-CG 3.29Å; V42-L46 WeakPolarHBondContact O-CG 3.48Å; V42-L46 PolarHBondContact O-N 2.82Å
43	R	88.5	Confident	80.4	Confident	145 Å²	145	94.4 Å²	94.4	55%	0.547	46%	0.464	S	S	.	.	H	α-helix	trans	-57	-42.7	176.1	-69.7	179.3	-173.2	163.2	3.4	112.2	P23 D24 S39 S40 L46 M47	P23-R43 HydrophobicContact CB-CG 3.76Å; P23-R43 HydrophobicContact CG-CG 4.41Å; D24-R43 IonicContact OD1-NH2 3.32Å; S39-R43 WeakPolarHBondContact O-CG 3.23Å; S39-R43 PolarHBondContact O-N 3.33Å; S40-R43 PolarHBondContact O-N 2.77Å; R43-L46 PolarHBondContact O-N 3.38Å; R43-M47 PolarHBondContact O-N 3.3Å; R43-M47 VanDerWaalsContact O-N 3.12Å
44	R	88.1	Confident	82.4	Confident	142 Å²	142	91 Å²	91	54%	0.536	45%	0.449	S	S	.	.	H	α-helix	trans	-63.3	-40.8	175.8	-173.9	-179.2	65.5	-176	1.1	112.6	S40 T41 V42 M47 Y48	S40-R44 WeakPolarHBondContact O-CB 3.37Å; S40-R44 PolarHBondContact O-N 3.2Å; T41-R44 PolarHBondContact O-N 3.14Å; V42-R44 VanDerWaalsContact C-N 3.3Å; V42-R44 PolarHBondContact O-N 3.24Å; R44-M47 WeakPolarHBondContact O-CB 3.11Å; R44-M47 PolarHBondContact O-N 3.16Å; R44-Y48 WeakPolarHBondContact O-CD2 3.48Å
45	L	88.8	Confident	84.2	Confident	50 Å²	50	94.6 Å²	94.6	26%	0.262	44%	0.443	S	S	.	.	H	α-helix	trans	-70.9	-35.3	177.2	-70.2	172.9	0	0	0	112.3	T41 V42 M47 Y48	T41-L45 HydrophobicContact CG2-CD1 4.27Å; T41-L45 VanDerWaalsContact O-CG 3.31Å; T41-L45 WeakPolarHBondContact O-CG 3.32Å; T41-L45 PolarHBondContact O-N 3.19Å; V42-L45 PolarHBondContact O-N 2.66Å; V42-L45 VanDerWaalsContact O-N 3.12Å; L45-M47 PolarHBondContact O-N 3.3Å; L45-Y48 PolarHBondContact O-N 3.2Å
46	L	88.1	Confident	85.9	Confident	35 Å²	35	93.3 Å²	93.3	18%	0.183	44%	0.438	C	S	.	.	H	α-helix	trans	-62.8	-28	173.2	-71.9	172	0	0	0	111.8	L21 P23 V42 R43 Y48 K49 N50	L21-L46 HydrophobicContact CB-CD2 4.39Å; P23-L46 HydrophobicContact CG-CD1 4.39Å; V42-L46 HydrophobicContact CG1-CD1 3.92Å; V42-L46 HydrophobicContact CG1-CG 4.26Å; V42-L46 WeakPolarHBondContact O-CB 3.33Å; V42-L46 VanDerWaalsContact O-CG 3.29Å; V42-L46 WeakPolarHBondContact O-CG 3.48Å; V42-L46 PolarHBondContact O-N 2.82Å; R43-L46 PolarHBondContact O-N 3.38Å; L46-Y48 VanDerWaalsContact C-N 3.3Å; L46-Y48 PolarHBondContact O-N 2.96Å; L46-K49 PolarHBondContact O-N 3.43Å; L46-N50 WeakPolarHBondContact CD2-ND2 3.4Å; L46-N50 WeakPolarHBondContact O-CA 3.36Å; L46-N50 WeakPolarHBondContact O-CB 3.49Å; L46-N50 PolarHBondContact O-N 3.39Å
47	M	88.9	Confident	87.1	Confident	89 Å²	89	96.3 Å²	96.3	44%	0.438	44%	0.438	S	S	.	.	H	α-helix	trans	-56.4	-43	172.4	-169.2	-173.8	74.5	0	0	111.9	R43 R44 L45 F51	R43-M47 PolarHBondContact O-N 3.3Å; R43-M47 VanDerWaalsContact O-N 3.12Å; R44-M47 WeakPolarHBondContact O-CB 3.11Å; R44-M47 PolarHBondContact O-N 3.16Å; L45-M47 PolarHBondContact O-N 3.3Å; M47-F51 HydrophobicContact CB-CD2 4.42Å; M47-F51 HydrophobicContact CG-CD2 3.83Å; M47-F51 HydrophobicContact CG-CE2 3.7Å; M47-F51 HydrophobicContact CG-CZ 4.47Å; M47-F51 WeakPolarHBondContact O-CB 3.25Å; M47-F51 WeakPolarHBondContact O-CD2 3.09Å
48	Y	88.4	Confident	87.9	Confident	173 Å²	173	97.4 Å²	97.4	68%	0.678	45%	0.448	S	S	*	.	H	α-helix	trans	-73.7	-26.9	-179.3	-63.8	-72.5	0	0	0	113.7	R44 L45 L46	R44-Y48 WeakPolarHBondContact O-CD2 3.48Å; L45-Y48 PolarHBondContact O-N 3.2Å; L46-Y48 VanDerWaalsContact C-N 3.3Å; L46-Y48 PolarHBondContact O-N 2.96Å
49	K	84.9	Confident	88.2	Confident	140 Å²	140	97.4 Å²	97.4	61%	0.609	46%	0.457	S	S	*	.	H	α-helix	trans	-99.4	-41	-174.8	-68.4	-166.6	173.7	-165.3	0	114.1	L46	L46-K49 PolarHBondContact O-N 3.43Å
50	N	81.5	Confident	88.5	Confident	99 Å²	99	103 Å²	103	53%	0.529	48%	0.476	S	S	.	.	H	α-helix	trans	-113.5	19.3	-164	-70.8	2.9	0	0	0	113.6	L46 K52	L46-N50 WeakPolarHBondContact CD2-ND2 3.4Å; L46-N50 WeakPolarHBondContact O-CA 3.36Å; L46-N50 WeakPolarHBondContact O-CB 3.49Å; L46-N50 PolarHBondContact O-N 3.39Å; N50-K52 PolarHBondContact O-N 3.01Å
51	F	83.7	Confident	88.5	Confident	94 Å²	94	103.7 Å²	103.7	41%	0.412	47%	0.472	S	S	.	.			trans	-76.3	46.8	172.9	-120.6	-109.1	0	0	0	112.6	M47 P66 F67	M47-F51 HydrophobicContact CB-CD2 4.42Å; M47-F51 HydrophobicContact CG-CD2 3.83Å; M47-F51 HydrophobicContact CG-CE2 3.7Å; M47-F51 HydrophobicContact CG-CZ 4.47Å; M47-F51 WeakPolarHBondContact O-CB 3.25Å; M47-F51 WeakPolarHBondContact O-CD2 3.09Å; F51-P66 HydrophobicContact CD1-CB 4.12Å; F51-P66 HydrophobicContact CD1-CG 4.06Å; F51-P66 HydrophobicContact CD2-CB 4.43Å; F51-P66 HydrophobicContact CD2-CG 3.89Å; F51-P66 HydrophobicContact CE1-CB 3.56Å; F51-P66 HydrophobicContact CE1-CG 3.96Å; F51-P66 HydrophobicContact CE2-CB 3.89Å; F51-P66 HydrophobicContact CE2-CG 3.76Å; F51-P66 HydrophobicContact CG-CG 4.05Å; F51-P66 HydrophobicContact CZ-CB 3.42Å; F51-P66 VanDerWaalsContact CZ-CB 3.42Å; F51-P66 HydrophobicContact CZ-CG 3.81Å; F51-F67 AromaticContact CE1-CD2 3.69Å; F51-F67 HydrophobicContact CE1-CD2 3.69Å; F51-F67 AromaticContact CE1-CE2 3.68Å; F51-F67 HydrophobicContact CE1-CE2 3.68Å; F51-F67 AromaticContact CZ-CD2 4Å; F51-F67 HydrophobicContact CZ-CD2 4Å; F51-F67 AromaticContact CZ-CE2 3.54Å; F51-F67 HydrophobicContact CZ-CE2 3.54Å; F51-F67 HydrophobicContact CZ-CZ 4.49Å
52	K	87.4	Confident	88.7	Confident	161 Å²	161	107 Å²	107	70%	0.7	49%	0.492	S	S	*	.	S	Bend	trans	-125.8	151.5	-176.8	-61.7	-174.5	-179.7	-175.2	0	110.1	N50	N50-K52 PolarHBondContact O-N 3.01Å
53	A	90.5	Very high	88.7	Confident	24 Å²	24	112.2 Å²	112.2	20%	0.198	52%	0.516	C	S	.	.			trans	-64.8	145.6	170.1	0	0	0	0	0	110.2	Y55 M61 Q63 A65	A53-Y55 HydrophobicContact CB-CD2 4.47Å; A53-Y55 HydrophobicContact CB-CE2 3.59Å; A53-M61 HydrophobicContact CB-CG 4.44Å; A53-M61 HydrophobicContact CB-SD 4.19Å; A53-Q63 CarbonylContact C-O 3.55Å; A53-Q63 WeakPolarHBondContact CA-O 3.32Å; A53-A65 HydrophobicContact CB-CB 4.3Å
54	K	89.7	Confident	88.7	Confident	121 Å²	121	106.6 Å²	106.6	53%	0.526	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	132.5	175.6	-60	-178.3	-174	159.2	0	109.5	V62 Q63	K54-V62 PolarHBondContact O-N 3.36Å; K54-Q63 HydrophobicContact CB-CB 4.11Å; K54-Q63 HydrophobicContact CD-CB 4.46Å; K54-Q63 HydrophobicContact CG-CB 4.47Å; K54-Q63 PolarHBondContact N-O 3.17Å; K54-Q63 PolarHBondContact O-N 3.26Å; K54-Q63 VanDerWaalsContact O-N 3.1Å
55	Y	91.4	Very high	88.8	Confident	143 Å²	143	100.3 Å²	100.3	56%	0.561	48%	0.479	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.8	152.7	-179.2	-61.2	-92.1	0	0	0	109.9	A53 G59 K60 M61	A53-Y55 HydrophobicContact CB-CD2 4.47Å; A53-Y55 HydrophobicContact CB-CE2 3.59Å; Y55-G59 WeakPolarHBondContact CD1-O 3.29Å; Y55-K60 WeakPolarHBondContact CA-O 3.49Å; Y55-M61 HydrophobicContact CD1-CB 3.89Å; Y55-M61 HydrophobicContact CD1-CG 4.43Å; Y55-M61 HydrophobicContact CE1-CB 3.65Å; Y55-M61 HydrophobicContact CE1-CG 4.03Å
56	N	94	Very high	88.7	Confident	59 Å²	59	100.6 Å²	100.6	32%	0.316	48%	0.484	S	S	.	.			trans	-81	174.6	168.6	67.6	11.6	0	0	0	110.2	H58 G59 K60 V62	N56-H58 PolarHBondContact O-N 3.22Å; N56-H58 WeakPolarHBondContact OD1-CA 3.42Å; N56-H58 WeakPolarHBondContact OD1-CB 3.36Å; N56-H58 PolarHBondContact OD1-N 3.07Å; N56-G59 PolarHBondContact O-N 2.76Å; N56-G59 PolarHBondContact OD1-N 2.92Å; N56-G59 VanDerWaalsContact OD1-N 3.14Å; N56-K60 PolarHBondContact N-O 3.24Å; N56-K60 PolarHBondContact OD1-N 2.72Å; N56-K60 PolarHBondContact OD1-O 2.89Å; N56-V62 HydrophobicContact CB-CG2 3.67Å
57	R	93.8	Very high	88.7	Confident	230 Å²	230	108.3 Å²	108.3	87%	0.868	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-18.7	175.2	66.9	-178.8	-179.8	-175.6	-1.1	114.7
58	H	92.2	Very high	88.7	Confident	131 Å²	131	110.7 Å²	110.7	61%	0.606	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	9.1	179.3	-56.6	-69.4	0	0	0	112.5	N56 K60	N56-H58 PolarHBondContact O-N 3.22Å; N56-H58 WeakPolarHBondContact OD1-CA 3.42Å; N56-H58 WeakPolarHBondContact OD1-CB 3.36Å; N56-H58 PolarHBondContact OD1-N 3.07Å; H58-K60 PolarHBondContact O-N 2.84Å
59	G	89	Confident	88.6	Confident	55 Å²	55	105.5 Å²	105.5	57%	0.567	53%	0.525	S	S	*	.	S	Bend	trans	73.4	4.7	-178.7	0	0	0	0	0	115	Y55 N56	Y55-G59 WeakPolarHBondContact CD1-O 3.29Å; N56-G59 PolarHBondContact O-N 2.76Å; N56-G59 PolarHBondContact OD1-N 2.92Å; N56-G59 VanDerWaalsContact OD1-N 3.14Å
60	K	89.5	Confident	88.5	Confident	152 Å²	152	105 Å²	105	66%	0.661	54%	0.535	S	S	*	.			trans	-80	131.2	174.1	-64.7	-176.4	174.4	179.3	0	110	Y55 N56 H58 V62	Y55-K60 WeakPolarHBondContact CA-O 3.49Å; N56-K60 PolarHBondContact N-O 3.24Å; N56-K60 PolarHBondContact OD1-N 2.72Å; N56-K60 PolarHBondContact OD1-O 2.89Å; H58-K60 PolarHBondContact O-N 2.84Å; K60-V62 PolarHBondContact O-N 3.17Å
61	M	87.6	Confident	88.5	Confident	97 Å²	97	106.9 Å²	106.9	48%	0.478	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	116.3	178.2	-170.5	173.4	63	0	0	110.1	A53 Y55 A64	A53-M61 HydrophobicContact CB-CG 4.44Å; A53-M61 HydrophobicContact CB-SD 4.19Å; Y55-M61 HydrophobicContact CD1-CB 3.89Å; Y55-M61 HydrophobicContact CD1-CG 4.43Å; Y55-M61 HydrophobicContact CE1-CB 3.65Å; Y55-M61 HydrophobicContact CE1-CG 4.03Å; M61-A64 HydrophobicContact CE-CB 4.01Å; M61-A64 VanDerWaalsContact SD-CA 3.59Å; M61-A64 HydrophobicContact SD-CB 3.95Å
62	V	89.5	Confident	88.5	Confident	108 Å²	108	111.1 Å²	111.1	66%	0.655	56%	0.562	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-85.9	-40.5	176	178.8	0	0	0	0	110.1	K54 N56 K60	K54-V62 PolarHBondContact O-N 3.36Å; N56-V62 HydrophobicContact CB-CG2 3.67Å; K60-V62 PolarHBondContact O-N 3.17Å
63	Q	86.8	Confident	88.3	Confident	108 Å²	108	110 Å²	110	51%	0.505	57%	0.574	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-139.6	121.8	-179.4	-171.1	178.8	5.7	0	0	108.6	A53 K54	A53-Q63 CarbonylContact C-O 3.55Å; A53-Q63 WeakPolarHBondContact CA-O 3.32Å; K54-Q63 HydrophobicContact CB-CB 4.11Å; K54-Q63 HydrophobicContact CD-CB 4.46Å; K54-Q63 HydrophobicContact CG-CB 4.47Å; K54-Q63 PolarHBondContact N-O 3.17Å; K54-Q63 PolarHBondContact O-N 3.26Å; K54-Q63 VanDerWaalsContact O-N 3.1Å
64	A	89	Confident	88	Confident	27 Å²	27	112 Å²	112	22%	0.223	60%	0.598	C	S	.	*	P	Polyproline II helix	trans	-62.7	154.5	172.5	0	0	0	0	0	111.1	M61 Q68	M61-A64 HydrophobicContact CE-CB 4.01Å; M61-A64 VanDerWaalsContact SD-CA 3.59Å; M61-A64 HydrophobicContact SD-CB 3.95Å; A64-Q68 WeakPolarHBondContact CB-O 3.47Å
65	A	90.2	Very high	87.9	Confident	10 Å²	10	110.1 Å²	110.1	8%	0.083	60%	0.597	C	S	.	*	P	Polyproline II helix	trans	-60.6	151	170.8	0	0	0	0	0	109.6	A53 F67 Q68	A53-A65 HydrophobicContact CB-CB 4.3Å; A65-F67 PolarHBondContact O-N 2.77Å; A65-Q68 HydrophobicContact CB-CB 4.36Å; A65-Q68 HydrophobicContact CB-CG 4.38Å; A65-Q68 PolarHBondContact O-N 3.3Å
66	P	87.8	Confident	87.6	Confident	57 Å²	57	109.5 Å²	109.5	37%	0.37	60%	0.601	S	S	.	*	T	Hydrogen-bonded Turn	trans	-55.8	138.9	174.9	-20.7	31.9	0	0	0	110.8	F51 Q68	F51-P66 HydrophobicContact CD1-CB 4.12Å; F51-P66 HydrophobicContact CD1-CG 4.06Å; F51-P66 HydrophobicContact CD2-CB 4.43Å; F51-P66 HydrophobicContact CD2-CG 3.89Å; F51-P66 HydrophobicContact CE1-CB 3.56Å; F51-P66 HydrophobicContact CE1-CG 3.96Å; F51-P66 HydrophobicContact CE2-CB 3.89Å; F51-P66 HydrophobicContact CE2-CG 3.76Å; F51-P66 HydrophobicContact CG-CG 4.05Å; F51-P66 HydrophobicContact CZ-CB 3.42Å; F51-P66 VanDerWaalsContact CZ-CB 3.42Å; F51-P66 HydrophobicContact CZ-CG 3.81Å; P66-Q68 PolarHBondContact O-N 3.33Å
67	F	87.4	Confident	87.3	Confident	197 Å²	197	112 Å²	112	86%	0.864	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	66.8	8.5	-172.4	-44.4	-67.3	0	0	0	116.8	F51 A65	F51-F67 AromaticContact CE1-CD2 3.69Å; F51-F67 HydrophobicContact CE1-CD2 3.69Å; F51-F67 AromaticContact CE1-CE2 3.68Å; F51-F67 HydrophobicContact CE1-CE2 3.68Å; F51-F67 AromaticContact CZ-CD2 4Å; F51-F67 HydrophobicContact CZ-CD2 4Å; F51-F67 AromaticContact CZ-CE2 3.54Å; F51-F67 HydrophobicContact CZ-CE2 3.54Å; F51-F67 HydrophobicContact CZ-CZ 4.49Å; A65-F67 PolarHBondContact O-N 2.77Å
68	Q	88.6	Confident	87.1	Confident	138 Å²	138	110.4 Å²	110.4	65%	0.645	62%	0.623	S	S	*	*			trans	-117.3	28	174.2	-63.3	-173.1	-24.9	0	0	112.5	A64 A65 P66	A64-Q68 WeakPolarHBondContact CB-O 3.47Å; A65-Q68 HydrophobicContact CB-CB 4.36Å; A65-Q68 HydrophobicContact CB-CG 4.38Å; A65-Q68 PolarHBondContact O-N 3.3Å; P66-Q68 PolarHBondContact O-N 3.33Å
69	G	85.2	Confident	87	Confident	64 Å²	64	110.1 Å²	110.1	66%	0.66	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-76	125.7	178	0	0	0	0	0	111.7
70	T	82.8	Confident	87.1	Confident	131 Å²	131	114.9 Å²	114.9	80%	0.804	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-84.9	131.6	172.9	-3.2	0	0	0	0	110.5
71	L	83.3	Confident	87.3	Confident	138 Å²	138	113.6 Å²	113.6	72%	0.723	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-73.9	150.4	171	-66.2	175.6	0	0	0	109.9	T75	L71-T75 HydrophobicContact CD1-CG2 4.17Å; L71-T75 HydrophobicContact CD2-CG2 4.42Å
72	K	83.3	Confident	87.6	Confident	183 Å²	183	112 Å²	112	80%	0.796	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-67.8	141.6	174.1	-66.7	-176.9	178.6	-177	0	109.2	G74 T75	K72-G74 PolarHBondContact O-N 3.02Å; K72-T75 WeakPolarHBondContact O-CB 3.39Å; K72-T75 PolarHBondContact O-N 3.11Å; K72-T75 VanDerWaalsContact O-N 3.07Å; K72-T75 PolarHBondContact O-OG1 3.14Å
73	S	82.3	Confident	87.7	Confident	136 Å²	136	117.8 Å²	117.8	95%	0.951	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.1	132.6	170.8	-172.9	0	0	0	0	109.8
74	G	83.7	Confident	87.9	Confident	68 Å²	68	122.4 Å²	122.4	70%	0.701	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	89.9	4.5	-174.1	0	0	0	0	0	115.9	K72 M76	K72-G74 PolarHBondContact O-N 3.02Å; G74-M76 PolarHBondContact O-N 3.22Å
75	T	87.5	Confident	88	Confident	81 Å²	81	129 Å²	129	50%	0.497	68%	0.68	S	S	.	*			trans	-67	105.8	170.5	-52	0	0	0	0	109.3	L71 K72	L71-T75 HydrophobicContact CD1-CG2 4.17Å; L71-T75 HydrophobicContact CD2-CG2 4.42Å; K72-T75 WeakPolarHBondContact O-CB 3.39Å; K72-T75 PolarHBondContact O-N 3.11Å; K72-T75 VanDerWaalsContact O-N 3.07Å; K72-T75 PolarHBondContact O-OG1 3.14Å
76	M	85.6	Confident	88.1	Confident	130 Å²	130	137 Å²	137	64%	0.64	71%	0.713	S	S	*	*			trans	-85.1	123.3	-178.3	-58.2	-174.7	79.8	0	0	111.1	G74 R78	G74-M76 PolarHBondContact O-N 3.22Å; M76-R78 HydrophobicContact CB-CG 4.27Å; M76-R78 PolarHBondContact SD-NH2 2.92Å
77	A	87.4	Confident	88.3	Confident	110 Å²	110	136.1 Å²	136.1	91%	0.909	72%	0.715	S	S	*	*			trans	-86.1	107.4	166.4	0	0	0	0	0	109
78	R	89.5	Confident	88.6	Confident	198 Å²	198	133.8 Å²	133.8	75%	0.747	71%	0.712	S	S	*	*			trans	-113.9	135.1	178.6	-62.3	-174.6	-178.2	-166.3	-0.4	110.1	M76	M76-R78 HydrophobicContact CB-CG 4.27Å; M76-R78 PolarHBondContact SD-NH2 2.92Å
79	V	91.3	Very high	88.6	Confident	125 Å²	125	133.2 Å²	133.2	76%	0.758	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-94.4	120.9	168.8	-177.7	0	0	0	0	108.1
80	E	91.5	Very high	88.7	Confident	154 Å²	154	140.3 Å²	140.3	72%	0.72	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-70.9	128.5	179.2	-171.7	-179.1	-178.2	0	0	110.5	N82 W85	E80-N82 PolarHBondContact O-N 2.99Å; E80-W85 PolarHBondContact O-NE1 2.89Å
81	P	92.9	Very high	88.9	Confident	125 Å²	125	139.8 Å²	139.8	81%	0.812	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-65.9	120.7	176.1	27.3	-33.3	0	0	0	109.8
82	N	94.2	Very high	89.1	Confident	63 Å²	63	136.9 Å²	136.9	34%	0.337	71%	0.705	S	S	.	*			trans	-133.2	134.2	-179.7	-162.7	-35.6	0	0	0	110.3	E80 R84 W85	E80-N82 PolarHBondContact O-N 2.99Å; N82-R84 PolarHBondContact O-N 3.4Å; N82-R84 WeakPolarHBondContact OD1-CB 3.42Å; N82-R84 WeakPolarHBondContact OD1-CG 3.23Å; N82-R84 PolarHBondContact OD1-N 3.49Å; N82-W85 HydrophobicContact CB-CG 4.29Å; N82-W85 VanDerWaalsContact CB-NE1 3.3Å; N82-W85 VanDerWaalsContact N-CD1 3.32Å; N82-W85 PolarHBondContact O-N 3.47Å
83	R	92.2	Very high	89.4	Confident	231 Å²	231	129.9 Å²	129.9	87%	0.872	69%	0.685	S	S	*	*	G	3₁₀ helix	trans	-60.8	-26.9	176.3	-67.7	179.1	69	173.7	1.7	112.3	W85 F86	R83-W85 PolarHBondContact O-N 3.05Å; R83-F86 PolarHBondContact O-N 3.38Å
84	R	90.9	Very high	89.7	Confident	204 Å²	204	130.4 Å²	130.4	77%	0.77	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-60.6	-25.4	178.8	-68.6	179.4	177.7	-175.3	-1.5	113.8	N82 F86 G87	N82-R84 PolarHBondContact O-N 3.4Å; N82-R84 WeakPolarHBondContact OD1-CB 3.42Å; N82-R84 WeakPolarHBondContact OD1-CG 3.23Å; N82-R84 PolarHBondContact OD1-N 3.49Å; R84-F86 PolarHBondContact O-N 3.27Å; R84-G87 PolarHBondContact O-N 3.03Å
85	W	91	Very high	90.2	Very high	167 Å²	167	133.8 Å²	133.8	63%	0.633	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-63.4	-29.4	178.5	-58.6	129.5	0	0	0	112.8	E80 N82 R83	E80-W85 PolarHBondContact O-NE1 2.89Å; N82-W85 HydrophobicContact CB-CG 4.29Å; N82-W85 VanDerWaalsContact CB-NE1 3.3Å; N82-W85 VanDerWaalsContact N-CD1 3.32Å; N82-W85 PolarHBondContact O-N 3.47Å; R83-W85 PolarHBondContact O-N 3.05Å
86	F	91.5	Very high	90.2	Very high	176 Å²	176	134.6 Å²	134.6	77%	0.772	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-101	3.2	-174	-50.4	-74.7	0	0	0	113.3	R83 R84	R83-F86 PolarHBondContact O-N 3.38Å; R84-F86 PolarHBondContact O-N 3.27Å
87	G	92.5	Very high	90.3	Very high	40 Å²	40	129.5 Å²	129.5	41%	0.412	65%	0.647	S	S	.	*	S	Bend	trans	-88.7	149.1	174.7	0	0	0	0	0	111.4	R84 T89	R84-G87 PolarHBondContact O-N 3.03Å; G87-T89 PolarHBondContact O-N 3.48Å; G87-T89 VanDerWaalsContact O-N 3.11Å
88	N	92.3	Very high	90.3	Very high	147 Å²	147	129.4 Å²	129.4	79%	0.786	63%	0.627	S	S	*	*			trans	-56.4	118.5	173.4	-63.4	-10.4	0	0	0	109.7	V91	N88-V91 HydrophobicContact CB-CG2 3.71Å
89	T	90.1	Very high	90.3	Very high	126 Å²	126	125.1 Å²	125.1	77%	0.773	61%	0.614	S	S	*	*	S	Bend	trans	-87.3	-26.1	-175.8	56.4	0	0	0	0	112.9	G87	G87-T89 PolarHBondContact O-N 3.48Å; G87-T89 VanDerWaalsContact O-N 3.11Å
90	R	86.2	Confident	90.1	Very high	213 Å²	213	121.2 Å²	121.2	80%	0.804	59%	0.587	S	S	*	*			trans	-138.3	125.6	177.7	-61.4	-177	-177.3	-173.1	1.2	108.4
91	V	87.9	Confident	89.9	Confident	120 Å²	120	117.5 Å²	117.5	73%	0.727	57%	0.57	S	S	*	*			trans	-133.8	141.5	177.6	-176.7	0	0	0	0	107.1	N88	N88-V91 HydrophobicContact CB-CG2 3.71Å
92	I	87.1	Confident	89.6	Confident	77 Å²	77	116 Å²	116	40%	0.395	55%	0.552	S	S	.	*			trans	-132	138.9	175.4	-170.2	163.2	0	0	0	108.5	D96 L97 L125	I92-D96 HydrophobicContact CG1-CB 4.25Å; I92-L97 HydrophobicContact CD1-CB 4.26Å; I92-L97 HydrophobicContact CD1-CD1 4.12Å; I92-L97 HydrophobicContact CG1-CB 4.36Å; I92-L125 HydrophobicContact CG2-CD1 4.29Å
93	G	90.2	Very high	89.4	Confident	36 Å²	36	117.1 Å²	117.1	37%	0.371	56%	0.558	S	S	.	*			trans	-75.5	151.7	173.3	0	0	0	0	0	111.2	E95 D96 L97	G93-E95 PolarHBondContact O-N 3.42Å; G93-D96 PolarHBondContact O-N 3.31Å; G93-L97 WeakPolarHBondContact O-CB 3.42Å; G93-L97 PolarHBondContact O-N 2.74Å
94	Q	89	Confident	89.1	Confident	147 Å²	147	106.4 Å²	106.4	69%	0.687	52%	0.518	S	S	*	.	H	α-helix	trans	-63.3	-40.4	-177.9	-171.9	63.7	16.3	0	0	112.6	L97 Q98	Q94-L97 WeakPolarHBondContact O-CB 3.42Å; Q94-L97 PolarHBondContact O-N 3.43Å; Q94-Q98 PolarHBondContact O-N 3.12Å
95	E	92.5	Very high	88.7	Confident	140 Å²	140	98.3 Å²	98.3	65%	0.654	50%	0.498	S	S	*	.	H	α-helix	trans	-64.5	-42.4	176.8	-63.9	-179.6	-165.4	0	0	112.1	G93 L97 Q98 K99	G93-E95 PolarHBondContact O-N 3.42Å; E95-L97 VanDerWaalsContact C-N 3.29Å; E95-L97 PolarHBondContact O-N 3.08Å; E95-Q98 PolarHBondContact O-N 2.98Å; E95-K99 WeakPolarHBondContact O-CB 3.03Å; E95-K99 VanDerWaalsContact O-CG 3.32Å; E95-K99 WeakPolarHBondContact O-CG 3.34Å; E95-K99 PolarHBondContact O-N 3.1Å
96	D	89.2	Confident	88.4	Confident	97 Å²	97	97.2 Å²	97.2	52%	0.519	50%	0.497	S	S	.	.	H	α-helix	trans	-66.5	-35.2	177.7	-67.5	-28.6	0	0	0	111.1	I92 G93 F100	I92-D96 HydrophobicContact CG1-CB 4.25Å; G93-D96 PolarHBondContact O-N 3.31Å; D96-F100 WeakPolarHBondContact O-CB 3.5Å; D96-F100 PolarHBondContact O-N 3.16Å
97	L	86.3	Confident	88.1	Confident	23 Å²	23	89.2 Å²	89.2	12%	0.12	46%	0.464	C	S	.	.	H	α-helix	trans	-63.3	-47.5	174.6	-179.3	66.2	0	0	0	111.2	I92 G93 Q94 E95 F100 Q101 L125	I92-L97 HydrophobicContact CD1-CB 4.26Å; I92-L97 HydrophobicContact CD1-CD1 4.12Å; I92-L97 HydrophobicContact CG1-CB 4.36Å; G93-L97 WeakPolarHBondContact O-CB 3.42Å; G93-L97 PolarHBondContact O-N 2.74Å; Q94-L97 WeakPolarHBondContact O-CB 3.42Å; Q94-L97 PolarHBondContact O-N 3.43Å; E95-L97 VanDerWaalsContact C-N 3.29Å; E95-L97 PolarHBondContact O-N 3.08Å; L97-F100 WeakPolarHBondContact O-CB 3.27Å; L97-F100 PolarHBondContact O-N 3.35Å; L97-Q101 WeakPolarHBondContact O-CG 3.36Å; L97-Q101 PolarHBondContact O-N 3.36Å; L97-L125 HydrophobicContact CD1-CB 3.86Å; L97-L125 HydrophobicContact CD1-CD1 3.54Å; L97-L125 HydrophobicContact CD1-CG 4.3Å
98	Q	87.5	Confident	87.6	Confident	108 Å²	108	92.4 Å²	92.4	51%	0.505	47%	0.471	S	S	.	.	H	α-helix	trans	-63.1	-48.1	178.4	-176.2	175.7	-3	0	0	111.3	Q94 E95 F100 Q101 E102	Q94-Q98 PolarHBondContact O-N 3.12Å; E95-Q98 PolarHBondContact O-N 2.98Å; Q98-F100 PolarHBondContact O-N 3.15Å; Q98-Q101 PolarHBondContact O-N 3.4Å; Q98-Q101 VanDerWaalsContact O-N 3.15Å; Q98-E102 WeakPolarHBondContact CG-OE1 3.39Å; Q98-E102 PolarHBondContact NE2-OE1 3.21Å; Q98-E102 WeakPolarHBondContact O-CG 3.45Å; Q98-E102 PolarHBondContact O-N 3.05Å
99	K	90.1	Very high	87.1	Confident	109 Å²	109	89.2 Å²	89.2	47%	0.474	47%	0.465	S	S	.	.	H	α-helix	trans	-58.1	-38.5	174.7	-71.5	170.7	-174.6	165	0	111.8	E95 N103	E95-K99 WeakPolarHBondContact O-CB 3.03Å; E95-K99 VanDerWaalsContact O-CG 3.32Å; E95-K99 WeakPolarHBondContact O-CG 3.34Å; E95-K99 PolarHBondContact O-N 3.1Å; K99-N103 WeakPolarHBondContact O-CB 3.11Å; K99-N103 VanDerWaalsContact O-CG 3.29Å; K99-N103 PolarHBondContact O-N 3.4Å; K99-N103 VanDerWaalsContact O-N 3.12Å; K99-N103 PolarHBondContact O-ND2 3.35Å
100	F	87.2	Confident	86.8	Confident	42 Å²	42	85.7 Å²	85.7	18%	0.184	44%	0.441	C	S	.	.	H	α-helix	trans	-66.7	-44.9	176.8	175.4	-100.4	0	0	0	111.7	D96 L97 Q98 L104 L121 P122	D96-F100 WeakPolarHBondContact O-CB 3.5Å; D96-F100 PolarHBondContact O-N 3.16Å; L97-F100 WeakPolarHBondContact O-CB 3.27Å; L97-F100 PolarHBondContact O-N 3.35Å; Q98-F100 PolarHBondContact O-N 3.15Å; F100-L104 HydrophobicContact CE1-CD2 3.68Å; F100-L104 HydrophobicContact CE2-CD2 3.84Å; F100-L104 HydrophobicContact CZ-CD2 3.25Å; F100-L104 HydrophobicContact CZ-CG 4.5Å; F100-L104 WeakPolarHBondContact O-CB 3.39Å; F100-L104 PolarHBondContact O-N 3.43Å; F100-L121 HydrophobicContact CE2-CD2 4.26Å; F100-L121 HydrophobicContact CZ-CB 4.25Å; F100-P122 HydrophobicContact CE1-CG 3.97Å; F100-P122 HydrophobicContact CZ-CG 4.03Å
101	Q	86.2	Confident	86.6	Confident	76 Å²	76	77.1 Å²	77.1	36%	0.355	41%	0.413	S	S	.	.	H	α-helix	trans	-61.2	-46	177.9	-74.6	175.8	-18.3	0	0	111.7	L97 Q98 G105 L125 L126	L97-Q101 WeakPolarHBondContact O-CG 3.36Å; L97-Q101 PolarHBondContact O-N 3.36Å; Q98-Q101 PolarHBondContact O-N 3.4Å; Q98-Q101 VanDerWaalsContact O-N 3.15Å; Q101-G105 WeakPolarHBondContact O-CA 3.35Å; Q101-G105 PolarHBondContact O-N 2.89Å; Q101-L125 PolarHBondContact NE2-O 3.32Å; Q101-L126 HydrophobicContact CB-CD2 4.3Å; Q101-L126 HydrophobicContact CG-CD2 4.13Å
102	E	88.2	Confident	86.4	Confident	95 Å²	95	73 Å²	73	44%	0.444	39%	0.385	S	S	.	.	H	α-helix	trans	-64	-49.3	179.5	-70.8	173.9	-165.2	0	0	112.2	Q98 G105 K106	Q98-E102 WeakPolarHBondContact CG-OE1 3.39Å; Q98-E102 PolarHBondContact NE2-OE1 3.21Å; Q98-E102 WeakPolarHBondContact O-CG 3.45Å; Q98-E102 PolarHBondContact O-N 3.05Å; E102-G105 PolarHBondContact O-N 3.09Å; E102-K106 WeakPolarHBondContact O-CG 3.32Å; E102-K106 PolarHBondContact O-N 3.02Å
103	N	88.5	Confident	86.2	Confident	85 Å²	85	70 Å²	70	46%	0.455	37%	0.37	S	S	.	.	H	α-helix	trans	-69.1	-41.2	-177.7	-71.4	-37.2	0	0	0	112.3	K99 K106 A107	K99-N103 WeakPolarHBondContact O-CB 3.11Å; K99-N103 VanDerWaalsContact O-CG 3.29Å; K99-N103 PolarHBondContact O-N 3.4Å; K99-N103 VanDerWaalsContact O-N 3.12Å; K99-N103 PolarHBondContact O-ND2 3.35Å; N103-K106 PolarHBondContact O-N 2.82Å; N103-A107 WeakPolarHBondContact O-CB 3.36Å; N103-A107 PolarHBondContact O-N 2.9Å
104	L	85.6	Confident	85.5	Confident	6 Å²	6	69.8 Å²	69.8	3%	0.031	36%	0.359	C	S	.	.	H	α-helix	trans	-72.9	-33.8	179.2	-170.9	58.1	0	0	0	111.3	F100 A107 I108 V115 L126	F100-L104 HydrophobicContact CE1-CD2 3.68Å; F100-L104 HydrophobicContact CE2-CD2 3.84Å; F100-L104 HydrophobicContact CZ-CD2 3.25Å; F100-L104 HydrophobicContact CZ-CG 4.5Å; F100-L104 WeakPolarHBondContact O-CB 3.39Å; F100-L104 PolarHBondContact O-N 3.43Å; L104-A107 PolarHBondContact O-N 2.97Å; L104-I108 HydrophobicContact CD1-CD1 4.19Å; L104-I108 HydrophobicContact CD1-CG1 4.28Å; L104-I108 HydrophobicContact CG-CD1 3.84Å; L104-I108 HydrophobicContact CG-CG1 4.37Å; L104-I108 WeakPolarHBondContact O-CB 3.33Å; L104-I108 VanDerWaalsContact O-CG1 3.23Å; L104-I108 WeakPolarHBondContact O-CG1 3.41Å; L104-I108 PolarHBondContact O-N 3.5Å; L104-V115 HydrophobicContact CD1-CB 4.46Å; L104-V115 HydrophobicContact CD1-CG1 4.03Å; L104-V115 HydrophobicContact CD1-CG2 3.58Å; L104-L126 HydrophobicContact CB-CD1 4.47Å; L104-L126 HydrophobicContact CB-CD2 4.3Å; L104-L126 HydrophobicContact CD2-CD1 3.23Å; L104-L126 HydrophobicContact CD2-CD2 4.27Å; L104-L126 HydrophobicContact CD2-CG 4.05Å; L104-L126 HydrophobicContact CG-CD1 3.74Å; L104-L126 HydrophobicContact CG-CD2 4.45Å
105	G	83	Confident	85	Confident	34 Å²	34	63.6 Å²	63.6	35%	0.351	33%	0.331	S	S	.	.	H	α-helix	trans	-59.8	-47.2	171.1	0	0	0	0	0	112.1	Q101 E102 A107 I108 A109	Q101-G105 WeakPolarHBondContact O-CA 3.35Å; Q101-G105 PolarHBondContact O-N 2.89Å; E102-G105 PolarHBondContact O-N 3.09Å; G105-A107 PolarHBondContact O-N 3.17Å; G105-I108 PolarHBondContact O-N 2.93Å; G105-A109 WeakPolarHBondContact O-CB 3.3Å; G105-A109 PolarHBondContact O-N 3.41Å
106	K	85.8	Confident	84.3	Confident	144 Å²	144	58.3 Å²	58.3	63%	0.626	31%	0.307	S	S	*	.	H	α-helix	trans	-60.1	-44.4	174.8	-71.6	173.1	-174.6	176.9	0	112.2	E102 N103 A109 D110	E102-K106 WeakPolarHBondContact O-CG 3.32Å; E102-K106 PolarHBondContact O-N 3.02Å; N103-K106 PolarHBondContact O-N 2.82Å; K106-A109 PolarHBondContact O-N 2.84Å; K106-D110 PolarHBondContact O-N 3.39Å
107	A	84.1	Confident	83.8	Confident	9 Å²	9	57.6 Å²	57.6	7%	0.074	30%	0.297	C	S	.	.	H	α-helix	trans	-66.2	-41.6	178.9	0	0	0	0	0	112.6	N103 L104 G105 A109 D110 S113 V115 I601	N103-A107 WeakPolarHBondContact O-CB 3.36Å; N103-A107 PolarHBondContact O-N 2.9Å; L104-A107 PolarHBondContact O-N 2.97Å; G105-A107 PolarHBondContact O-N 3.17Å; A107-A109 VanDerWaalsContact C-N 3.28Å; A107-A109 PolarHBondContact O-N 2.64Å; A107-D110 PolarHBondContact O-N 3.32Å; A107-S113 WeakPolarHBondContact CA-OG 3.49Å; A107-S113 PolarHBondContact O-OG 3.02Å; A107-V115 HydrophobicContact CB-CG2 4.47Å; A107-I601 HydrophobicContact CB-CG2 4.31Å
108	I	82.6	Confident	83.3	Confident	107 Å²	107	58 Å²	58	55%	0.549	30%	0.299	S	S	.	.	H	α-helix	trans	-67.8	-31	178.4	-69.5	168.7	0	0	0	111.6	L104 G105 V115 L126	L104-I108 HydrophobicContact CD1-CD1 4.19Å; L104-I108 HydrophobicContact CD1-CG1 4.28Å; L104-I108 HydrophobicContact CG-CD1 3.84Å; L104-I108 HydrophobicContact CG-CG1 4.37Å; L104-I108 WeakPolarHBondContact O-CB 3.33Å; L104-I108 VanDerWaalsContact O-CG1 3.23Å; L104-I108 WeakPolarHBondContact O-CG1 3.41Å; L104-I108 PolarHBondContact O-N 3.5Å; G105-I108 PolarHBondContact O-N 2.93Å; I108-V115 HydrophobicContact CG1-CG2 4.44Å; I108-L126 HydrophobicContact CD1-CD1 3.88Å
109	A	82.1	Confident	82.7	Confident	80 Å²	80	59 Å²	59	66%	0.661	31%	0.312	S	S	*	.	H	α-helix	trans	-71.9	-28.9	177.4	0	0	0	0	0	113.2	G105 K106 A107 P111	G105-A109 WeakPolarHBondContact O-CB 3.3Å; G105-A109 PolarHBondContact O-N 3.41Å; K106-A109 PolarHBondContact O-N 2.84Å; A107-A109 VanDerWaalsContact C-N 3.28Å; A107-A109 PolarHBondContact O-N 2.64Å; A109-P111 WeakPolarHBondContact O-CD 3.22Å
110	D	84.5	Confident	82.1	Confident	52 Å²	52	60.8 Å²	60.8	28%	0.278	32%	0.32	S	S	.	.			trans	-79.6	116	176.5	-179	8.6	0	0	0	111.2	K106 A107 Y112 S113	K106-D110 PolarHBondContact O-N 3.39Å; A107-D110 PolarHBondContact O-N 3.32Å; D110-Y112 PolarHBondContact O-N 3.02Å; D110-Y112 PolarHBondContact OD1-N 2.91Å; D110-S113 PolarHBondContact O-N 3.04Å
111	P	81.9	Confident	81.8	Confident	32 Å²	32	60.8 Å²	60.8	21%	0.208	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-17.9	-179.6	28.1	-37	0	0	0	114.2	A109 E278 P280	A109-P111 WeakPolarHBondContact O-CD 3.22Å; P111-E278 VanDerWaalsContact CB-O 3.29Å; P111-E278 WeakPolarHBondContact CB-O 3.38Å; P111-P280 WeakPolarHBondContact O-CD 3.29Å; P111-P280 WeakPolarHBondContact O-CG 3.19Å
112	Y	82.4	Confident	81.6	Confident	35 Å²	35	59.3 Å²	59.3	14%	0.137	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-11.4	180	-66.2	-82.6	0	0	0	113.7	D110 S276 P280 F604	D110-Y112 PolarHBondContact O-N 3.02Å; D110-Y112 PolarHBondContact OD1-N 2.91Å; Y112-S276 WeakPolarHBondContact OH-CB 3.11Å; Y112-P280 HydrophobicContact CD1-CB 4.26Å; Y112-P280 HydrophobicContact CD1-CG 3.86Å; Y112-P280 HydrophobicContact CE1-CB 4.01Å; Y112-P280 HydrophobicContact CE1-CG 4.02Å; Y112-F604 WeakPolarHBondContact O-CD2 3.34Å
113	S	82.6	Confident	81.2	Confident	13 Å²	13	57.5 Å²	57.5	9%	0.091	31%	0.312	C	S	.	.			trans	-94.6	138.1	179.1	107.2	0	0	0	0	110.3	A107 D110	A107-S113 WeakPolarHBondContact CA-OG 3.49Å; A107-S113 PolarHBondContact O-OG 3.02Å; D110-S113 PolarHBondContact O-N 3.04Å
114	F	77.2	Confident	80.8	Confident	31 Å²	31	59 Å²	59	14%	0.136	32%	0.324	C	S	.	.	B	Isolated β-bridge	trans	-125.5	123.1	-176	-63.3	-78.7	0	0	0	111.4	L116 H252 P280 F604	F114-L116 PolarHBondContact O-N 3.08Å; F114-H252 HydrophobicContact CD1-CB 4.38Å; F114-H252 AromaticContact CD1-CE1 3.76Å; F114-H252 AromaticContact CD1-CG 3.96Å; F114-H252 AromaticContact CD1-ND1 3.21Å; F114-H252 WeakPolarHBondContact CD1-ND1 3.44Å; F114-H252 HydrophobicContact CE1-CB 4.1Å; F114-H252 AromaticContact CE1-ND1 3.82Å; F114-H252 AromaticContact CG-CE1 3.88Å; F114-H252 AromaticContact CG-ND1 3.79Å; F114-P280 HydrophobicContact CZ-CG 4.22Å; F114-F604 HydrophobicContact CD2-CD2 4.31Å; F114-F604 AromaticContact CD2-CE2 3.77Å; F114-F604 HydrophobicContact CD2-CE2 3.77Å; F114-F604 HydrophobicContact CE2-CE2 4.45Å
115	V	78.3	Confident	80.4	Confident	18 Å²	18	60.8 Å²	60.8	11%	0.109	33%	0.334	C	S	.	.			trans	-80.7	110.8	177.6	-176.5	0	0	0	0	110.1	L104 A107 I108 Q118 L121	L104-V115 HydrophobicContact CD1-CB 4.46Å; L104-V115 HydrophobicContact CD1-CG1 4.03Å; L104-V115 HydrophobicContact CD1-CG2 3.58Å; A107-V115 HydrophobicContact CB-CG2 4.47Å; I108-V115 HydrophobicContact CG1-CG2 4.44Å; V115-Q118 HydrophobicContact CB-CG 4.31Å; V115-Q118 HydrophobicContact CG1-CG 3.92Å; V115-L121 HydrophobicContact CG1-CD1 3.62Å
116	L	78.2	Confident	80	Confident	28 Å²	28	61.8 Å²	61.8	15%	0.147	33%	0.331	C	S	.	.			trans	-84.9	152.1	175.4	-63.7	177.2	0	0	0	112.6	F114 Q118 L307 V602	F114-L116 PolarHBondContact O-N 3.08Å; L116-Q118 VanDerWaalsContact C-N 3.32Å; L116-Q118 PolarHBondContact O-N 2.99Å; L116-L307 HydrophobicContact CD1-CD1 3.56Å; L116-L307 HydrophobicContact CD1-CD2 4.13Å; L116-L307 HydrophobicContact CD1-CG 3.52Å; L116-L307 HydrophobicContact CD2-CD2 3.66Å; L116-L307 HydrophobicContact CD2-CG 3.8Å; L116-L307 HydrophobicContact CG-CD1 4.42Å; L116-L307 HydrophobicContact CG-CD2 4.17Å; L116-L307 HydrophobicContact CG-CG 4.09Å; L116-V602 HydrophobicContact CD1-CG2 4.19Å
117	R	77.7	Confident	79.1	Confident	82 Å²	82	58.4 Å²	58.4	31%	0.309	33%	0.329	S	S	.	.			trans	56.3	41.3	173.3	-55.4	-179.2	-178.4	148.6	11.4	114.2	T119 K120 K597 Q598	R117-T119 PolarHBondContact O-N 2.84Å; R117-K120 PolarHBondContact O-N 3.35Å; R117-K597 PolarHBondContact NH1-O 3.06Å; R117-Q598 PolarHBondContact NH1-O 2.74Å; R117-Q598 VanDerWaalsContact NH1-O 3.12Å
118	Q	75.2	Confident	78.2	Confident	31 Å²	31	65.9 Å²	65.9	15%	0.145	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-47.9	-33	176.3	-73.4	-179.4	3.7	0	0	114.4	V115 L116 K120 L121 I123 P249	V115-Q118 HydrophobicContact CB-CG 4.31Å; V115-Q118 HydrophobicContact CG1-CG 3.92Å; L116-Q118 VanDerWaalsContact C-N 3.32Å; L116-Q118 PolarHBondContact O-N 2.99Å; Q118-K120 PolarHBondContact O-N 3.38Å; Q118-K120 VanDerWaalsContact O-N 3.08Å; Q118-L121 PolarHBondContact O-N 2.74Å; Q118-I123 HydrophobicContact CB-CD1 3.45Å; Q118-I123 VanDerWaalsContact CB-CD1 3.45Å; Q118-I123 HydrophobicContact CG-CD1 3.7Å; Q118-P249 VanDerWaalsContact NE2-C 3.33Å; Q118-P249 PolarHBondContact NE2-O 3.42Å; Q118-P249 PolarHBondContact OE1-O 2.95Å
119	T	75.6	Confident	77.3	Confident	130 Å²	130	70 Å²	70	80%	0.798	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-61.4	-18.3	178.5	55.4	0	0	0	0	115	R117	R117-T119 PolarHBondContact O-N 2.84Å
120	K	77.7	Confident	76.4	Confident	146 Å²	146	77 Å²	77	64%	0.635	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-95.5	-15.1	175.7	-66.7	-172.5	178.4	-177.5	0	113.3	R117 Q118	R117-K120 PolarHBondContact O-N 3.35Å; Q118-K120 PolarHBondContact O-N 3.38Å; Q118-K120 VanDerWaalsContact O-N 3.08Å
121	L	80.5	Confident	75.5	Confident	42 Å²	42	84.5 Å²	84.5	22%	0.22	42%	0.416	C	S	.	.	S	Bend	trans	-93	143.5	-175.3	-60.8	177.1	0	0	0	110.2	F100 V115 Q118 I123 A599	F100-L121 HydrophobicContact CE2-CD2 4.26Å; F100-L121 HydrophobicContact CZ-CB 4.25Å; V115-L121 HydrophobicContact CG1-CD1 3.62Å; Q118-L121 PolarHBondContact O-N 2.74Å; L121-I123 HydrophobicContact CB-CG1 4.08Å; L121-I123 PolarHBondContact O-N 3.18Å; L121-A599 HydrophobicContact CD2-CB 4.42Å
122	P	81.7	Confident	74.7	Confident	45 Å²	45	88.3 Å²	88.3	29%	0.292	43%	0.434	S	S	.	.			trans	-80.2	63.1	179.1	34.9	-36.4	0	0	0	111.6	F100 T124 L125	F100-P122 HydrophobicContact CE1-CG 3.97Å; F100-P122 HydrophobicContact CZ-CG 4.03Å; P122-T124 PolarHBondContact O-N 3.23Å; P122-L125 HydrophobicContact CB-CD1 3.81Å; P122-L125 HydrophobicContact CB-CG 4.2Å; P122-L125 HydrophobicContact CG-CD1 4.24Å; P122-L125 WeakPolarHBondContact O-CB 3.45Å; P122-L125 PolarHBondContact O-N 3.34Å; P122-L125 VanDerWaalsContact O-N 3.14Å
123	I	79.6	Confident	74.1	Confident	58 Å²	58	93.4 Å²	93.4	30%	0.297	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-62.5	-28.3	-174.1	-65.1	169.4	0	0	0	112.5	Q118 L121 L125 L126	Q118-I123 HydrophobicContact CB-CD1 3.45Å; Q118-I123 VanDerWaalsContact CB-CD1 3.45Å; Q118-I123 HydrophobicContact CG-CD1 3.7Å; L121-I123 HydrophobicContact CB-CG1 4.08Å; L121-I123 PolarHBondContact O-N 3.18Å; I123-L125 PolarHBondContact O-N 2.66Å; I123-L125 VanDerWaalsContact O-N 3.11Å; I123-L126 HydrophobicContact CG2-CD1 4.25Å; I123-L126 WeakPolarHBondContact O-CB 3.27Å; I123-L126 PolarHBondContact O-N 2.82Å
124	T	80.9	Confident	73.6	Confident	115 Å²	115	101.4 Å²	101.4	71%	0.706	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-56.5	-28.3	176.9	51.2	0	0	0	0	112.7	P122 L126 A127	P122-T124 PolarHBondContact O-N 3.23Å; T124-L126 PolarHBondContact O-N 3.34Å; T124-A127 PolarHBondContact O-N 2.95Å
125	L	77.5	Confident	73.5	Confident	45 Å²	45	104.9 Å²	104.9	24%	0.236	53%	0.525	C	S	.	.	G	3₁₀ helix	trans	-76.3	-5.7	180	-56.6	178.7	0	0	0	114.1	I92 L97 Q101 P122 I123	I92-L125 HydrophobicContact CG2-CD1 4.29Å; L97-L125 HydrophobicContact CD1-CB 3.86Å; L97-L125 HydrophobicContact CD1-CD1 3.54Å; L97-L125 HydrophobicContact CD1-CG 4.3Å; Q101-L125 PolarHBondContact NE2-O 3.32Å; P122-L125 HydrophobicContact CB-CD1 3.81Å; P122-L125 HydrophobicContact CB-CG 4.2Å; P122-L125 HydrophobicContact CG-CD1 4.24Å; P122-L125 WeakPolarHBondContact O-CB 3.45Å; P122-L125 PolarHBondContact O-N 3.34Å; P122-L125 VanDerWaalsContact O-N 3.14Å; I123-L125 PolarHBondContact O-N 2.66Å; I123-L125 VanDerWaalsContact O-N 3.11Å
126	L	73.6	Confident	73.7	Confident	55 Å²	55	108.5 Å²	108.5	29%	0.288	54%	0.541	S	S	.	.	G	3₁₀ helix	trans	-84	-22.7	171.3	-70.6	166.6	0	0	0	112.7	Q101 L104 I108 I123 T124	Q101-L126 HydrophobicContact CB-CD2 4.3Å; Q101-L126 HydrophobicContact CG-CD2 4.13Å; L104-L126 HydrophobicContact CB-CD1 4.47Å; L104-L126 HydrophobicContact CB-CD2 4.3Å; L104-L126 HydrophobicContact CD2-CD1 3.23Å; L104-L126 HydrophobicContact CD2-CD2 4.27Å; L104-L126 HydrophobicContact CD2-CG 4.05Å; L104-L126 HydrophobicContact CG-CD1 3.74Å; L104-L126 HydrophobicContact CG-CD2 4.45Å; I108-L126 HydrophobicContact CD1-CD1 3.88Å; I123-L126 HydrophobicContact CG2-CD1 4.25Å; I123-L126 WeakPolarHBondContact O-CB 3.27Å; I123-L126 PolarHBondContact O-N 2.82Å; T124-L126 PolarHBondContact O-N 3.34Å
127	A	66.8	Low	73.9	Confident	72 Å²	72	111.2 Å²	111.2	60%	0.595	56%	0.558	S	S	*	*			trans	-105.7	11	-160.6	0	0	0	0	0	114.3	T124 K129	T124-A127 PolarHBondContact O-N 2.95Å; A127-K129 VanDerWaalsContact C-N 3.27Å; A127-K129 PolarHBondContact O-N 3.43Å
128	E	65.4	Low	74.3	Confident	167 Å²	167	110.8 Å²	110.8	78%	0.78	56%	0.562	S	S	*	*			trans	-68.6	85.3	178.4	-71.5	-170.8	177.2	0	0	110.8
129	K	65	Low	74.7	Confident	192 Å²	192	115.4 Å²	115.4	84%	0.835	59%	0.587	S	S	*	*			trans	-75.5	146.4	164.5	-65.8	-173.9	178.9	-174.7	0	108.8	A127 K131	A127-K129 VanDerWaalsContact C-N 3.27Å; A127-K129 PolarHBondContact O-N 3.43Å; K129-K131 PolarHBondContact O-N 3.43Å
130	R	62.9	Low	75.1	Confident	228 Å²	228	114 Å²	114	86%	0.86	58%	0.579	S	S	*	*			trans	-53	122.8	172.9	-67.6	-176.4	179.3	-175.4	0.3	108.9	N132	R130-N132 VanDerWaalsContact C-N 3.26Å; R130-N132 PolarHBondContact O-N 3.4Å
131	K	65.8	Low	75.4	Confident	210 Å²	210	108.9 Å²	108.9	91%	0.913	56%	0.557	S	S	*	*	S	Bend	trans	-57.8	-36.6	-174.2	-75.1	-175.8	176.6	-178.3	0	113.2	K129	K129-K131 PolarHBondContact O-N 3.43Å
132	N	63.5	Low	75.8	Confident	111 Å²	111	108.2 Å²	108.2	59%	0.594	56%	0.557	S	S	*	*			trans	-124.8	118.1	-178.9	-63.6	-9.2	0	0	0	109.6	R130	R130-N132 VanDerWaalsContact C-N 3.26Å; R130-N132 PolarHBondContact O-N 3.4Å
133	V	69.8	Low	76.3	Confident	143 Å²	143	113.5 Å²	113.5	87%	0.867	58%	0.576	S	S	*	*	S	Bend	trans	-81	-32.8	172.5	177.6	0	0	0	0	110.8
134	R	72.2	Confident	76.7	Confident	181 Å²	181	116 Å²	116	68%	0.683	59%	0.586	S	S	*	*	S	Bend	trans	-115.7	149.1	178.6	-66.2	179.1	175.4	151.4	-1.6	109.8	H136 D558	R134-H136 PolarHBondContact O-N 3.47Å; R134-D558 IonicContact NH1-OD2 2.66Å; R134-D558 PolarHBondContact NH1-OD2 2.76Å
135	S	76.7	Confident	77.1	Confident	103 Å²	103	113.6 Å²	113.6	72%	0.72	57%	0.569	S	S	*	*			trans	-57.3	129.4	169.5	52.1	0	0	0	0	109.4	V137	S135-V137 VanDerWaalsContact C-N 3.35Å; S135-V137 PolarHBondContact O-N 3.2Å
136	H	81	Confident	77.6	Confident	94 Å²	94	113 Å²	113	44%	0.435	57%	0.567	S	S	.	*			trans	-71.4	91.5	179.2	-165.1	-102.6	0	0	0	108.7	R134 L138 D139	R134-H136 PolarHBondContact O-N 3.47Å; H136-L138 PolarHBondContact O-N 3.03Å; H136-D139 IonicContact CE1-OD1 3.2Å; H136-D139 IonicContact CG-OD1 2.68Å; H136-D139 IonicContact CG-OD2 3.25Å; H136-D139 IonicContact ND1-OD1 2.92Å; H136-D139 PolarHBondContact ND1-OD1 3.47Å; H136-D139 IonicContact ND1-OD2 3.96Å; H136-D139 WeakPolarHBondContact O-CB 3.27Å; H136-D139 PolarHBondContact O-N 2.9Å
137	V	82.9	Confident	78.4	Confident	85 Å²	85	118.9 Å²	118.9	52%	0.515	59%	0.591	S	S	.	*	H	α-helix	trans	-54.9	-30.9	-174.6	177.5	0	0	0	0	111.5	S135 D139 T140 E141	S135-V137 VanDerWaalsContact C-N 3.35Å; S135-V137 PolarHBondContact O-N 3.2Å; V137-D139 PolarHBondContact O-N 3.34Å; V137-T140 PolarHBondContact O-N 3.37Å; V137-T140 PolarHBondContact O-OG1 3.18Å; V137-E141 HydrophobicContact CG1-CB 4.28Å; V137-E141 PolarHBondContact O-N 2.98Å
138	L	85.5	Confident	79.5	Confident	73 Å²	73	117.1 Å²	117.1	38%	0.382	58%	0.579	S	S	.	*	H	α-helix	trans	-61.9	-23.2	177.2	-67.8	167.4	0	0	0	113.8	H136 T140 F143	H136-L138 PolarHBondContact O-N 3.03Å; L138-T140 VanDerWaalsContact C-N 3.28Å; L138-F143 HydrophobicContact CD1-CE2 4.4Å; L138-F143 HydrophobicContact CD2-CD1 4.41Å; L138-F143 HydrophobicContact CD2-CD2 3.76Å; L138-F143 HydrophobicContact CD2-CE1 4.1Å; L138-F143 HydrophobicContact CD2-CE2 3.41Å; L138-F143 VanDerWaalsContact CD2-CE2 3.41Å; L138-F143 HydrophobicContact CD2-CG 4.26Å; L138-F143 HydrophobicContact CD2-CZ 3.6Å
139	D	85.1	Confident	80.8	Confident	128 Å²	128	116 Å²	116	68%	0.684	59%	0.587	S	S	*	*	H	α-helix	trans	-72.1	-28.1	174.4	-62.5	-8.8	0	0	0	111.1	H136 V137	H136-D139 IonicContact CE1-OD1 3.2Å; H136-D139 IonicContact CG-OD1 2.68Å; H136-D139 IonicContact CG-OD2 3.25Å; H136-D139 IonicContact ND1-OD1 2.92Å; H136-D139 PolarHBondContact ND1-OD1 3.47Å; H136-D139 IonicContact ND1-OD2 3.96Å; H136-D139 WeakPolarHBondContact O-CB 3.27Å; H136-D139 PolarHBondContact O-N 2.9Å; V137-D139 PolarHBondContact O-N 3.34Å
140	T	83.3	Confident	82	Confident	100 Å²	100	114 Å²	114	61%	0.613	58%	0.578	S	S	*	*	H	α-helix	trans	-94.4	-35	178.1	61	0	0	0	0	113.1	V137 L138	V137-T140 PolarHBondContact O-N 3.37Å; V137-T140 PolarHBondContact O-OG1 3.18Å; L138-T140 VanDerWaalsContact C-N 3.28Å
141	E	84.5	Confident	83.4	Confident	40 Å²	40	104.7 Å²	104.7	19%	0.187	55%	0.55	C	S	.	.	S	Bend	trans	-140.6	81.9	-167.6	-88.9	-176.7	-131.7	0	0	109.5	V137 T146 R153 K157	V137-E141 HydrophobicContact CG1-CB 4.28Å; V137-E141 PolarHBondContact O-N 2.98Å; E141-T146 HydrophobicContact CB-CG2 3.55Å; E141-T146 HydrophobicContact CG-CG2 3.82Å; E141-T146 VanDerWaalsContact OE2-CG2 3.25Å; E141-T146 WeakPolarHBondContact OE2-CG2 3.28Å; E141-R153 IonicContact OE2-NH1 2.8Å; E141-K157 WeakPolarHBondContact OE1-CE 3.46Å; E141-K157 IonicContact OE1-NZ 2.82Å; E141-K157 PolarHBondContact OE1-NZ 3.37Å
142	A	88.5	Confident	84.4	Confident	27 Å²	27	101.3 Å²	101.3	22%	0.223	54%	0.537	C	S	.	.			trans	-64.3	144.9	173.3	0	0	0	0	0	111	H144 L145 T146	A142-H144 VanDerWaalsContact C-N 3.25Å; A142-H144 PolarHBondContact O-N 3.02Å; A142-H144 VanDerWaalsContact O-N 3.09Å; A142-L145 HydrophobicContact CB-CD1 4.38Å; A142-L145 HydrophobicContact CB-CG 4.46Å; A142-L145 PolarHBondContact O-N 2.98Å; A142-T146 PolarHBondContact O-N 3.22Å; A142-T146 VanDerWaalsContact O-N 3.16Å; A142-T146 PolarHBondContact O-OG1 2.94Å
143	F	91.3	Very high	85.5	Confident	157 Å²	157	102.1 Å²	102.1	69%	0.689	53%	0.532	S	S	*	.	H	α-helix	trans	-51.2	-39.5	-174.8	-69.1	-63.9	0	0	0	114.6	L138 L145 T146 F147	L138-F143 HydrophobicContact CD1-CE2 4.4Å; L138-F143 HydrophobicContact CD2-CD1 4.41Å; L138-F143 HydrophobicContact CD2-CD2 3.76Å; L138-F143 HydrophobicContact CD2-CE1 4.1Å; L138-F143 HydrophobicContact CD2-CE2 3.41Å; L138-F143 VanDerWaalsContact CD2-CE2 3.41Å; L138-F143 HydrophobicContact CD2-CG 4.26Å; L138-F143 HydrophobicContact CD2-CZ 3.6Å; F143-L145 VanDerWaalsContact C-N 3.28Å; F143-L145 PolarHBondContact O-N 3.37Å; F143-T146 WeakPolarHBondContact CA-OG1 3.45Å; F143-T146 PolarHBondContact O-N 3.07Å; F143-T146 PolarHBondContact O-OG1 3.15Å; F143-F147 PolarHBondContact O-N 3.27Å; F143-F147 VanDerWaalsContact O-N 3.1Å; F143-F147 VanDerWaalsContact O-O 3.14Å
144	H	89.3	Confident	86.5	Confident	109 Å²	109	104.1 Å²	104.1	51%	0.505	53%	0.529	S	S	.	.	H	α-helix	trans	-73.4	-18.5	-178.9	66.5	-85.5	0	0	0	113.7	A142 K150	A142-H144 VanDerWaalsContact C-N 3.25Å; A142-H144 PolarHBondContact O-N 3.02Å; A142-H144 VanDerWaalsContact O-N 3.09Å; H144-K150 CarbonylContact O-C 3.56Å; H144-K150 VanDerWaalsContact O-C 3.32Å
145	L	88.2	Confident	87.2	Confident	66 Å²	66	103.9 Å²	103.9	35%	0.346	53%	0.533	S	S	.	.	H	α-helix	trans	-92.3	-21.3	174.9	-58.5	178.6	0	0	0	111.9	A142 F143 A151 Q152 R153	A142-L145 HydrophobicContact CB-CD1 4.38Å; A142-L145 HydrophobicContact CB-CG 4.46Å; A142-L145 PolarHBondContact O-N 2.98Å; F143-L145 VanDerWaalsContact C-N 3.28Å; F143-L145 PolarHBondContact O-N 3.37Å; L145-A151 CarbonylContact O-C 3.5Å; L145-A151 WeakPolarHBondContact O-CA 3.44Å; L145-Q152 HydrophobicContact CD2-CG 3.97Å; L145-Q152 PolarHBondContact O-N 3.02Å; L145-R153 PolarHBondContact O-N 2.68Å
146	T	88.7	Confident	87.7	Confident	31 Å²	31	102.9 Å²	102.9	19%	0.19	52%	0.524	C	S	.	.	H	α-helix	trans	-87.8	-41	178	46.6	0	0	0	0	113	E141 A142 F143	E141-T146 HydrophobicContact CB-CG2 3.55Å; E141-T146 HydrophobicContact CG-CG2 3.82Å; E141-T146 VanDerWaalsContact OE2-CG2 3.25Å; E141-T146 WeakPolarHBondContact OE2-CG2 3.28Å; A142-T146 PolarHBondContact O-N 3.22Å; A142-T146 VanDerWaalsContact O-N 3.16Å; A142-T146 PolarHBondContact O-OG1 2.94Å; F143-T146 WeakPolarHBondContact CA-OG1 3.45Å; F143-T146 PolarHBondContact O-N 3.07Å; F143-T146 PolarHBondContact O-OG1 3.15Å
147	F	89.7	Confident	87.9	Confident	179 Å²	179	105.3 Å²	105.3	79%	0.785	53%	0.534	S	S	*	.	S	Bend	trans	-141.5	148.9	179.7	-169.6	-99.3	0	0	0	111.8	F143	F143-F147 PolarHBondContact O-N 3.27Å; F143-F147 VanDerWaalsContact O-N 3.1Å; F143-F147 VanDerWaalsContact O-O 3.14Å
148	G	90.4	Very high	87.9	Confident	35 Å²	35	106.6 Å²	106.6	36%	0.361	54%	0.536	S	S	.	.	S	Bend	trans	105	-171.7	-178.3	0	0	0	0	0	113.9	K150 A151	G148-K150 PolarHBondContact O-N 3.3Å; G148-A151 WeakPolarHBondContact O-CB 3.49Å; G148-A151 PolarHBondContact O-N 2.83Å
149	P	92	Very high	87.8	Confident	144 Å²	144	110 Å²	110	94%	0.935	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	-21.7	-170.5	24.3	-32.9	0	0	0	114.1
150	K	90.9	Very high	88	Confident	149 Å²	149	105.1 Å²	105.1	65%	0.648	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	13.7	175.5	-63.2	-175.5	-179.4	-179.5	0	112.9	H144 G148 Q152	H144-K150 CarbonylContact O-C 3.56Å; H144-K150 VanDerWaalsContact O-C 3.32Å; G148-K150 PolarHBondContact O-N 3.3Å; K150-Q152 PolarHBondContact O-N 3.04Å
151	A	91.3	Very high	88.2	Confident	33 Å²	33	107.5 Å²	107.5	27%	0.273	54%	0.544	S	S	.	.			trans	-61.1	119.9	-176.9	0	0	0	0	0	111.7	L145 G148	L145-A151 CarbonylContact O-C 3.5Å; L145-A151 WeakPolarHBondContact O-CA 3.44Å; G148-A151 WeakPolarHBondContact O-CB 3.49Å; G148-A151 PolarHBondContact O-N 2.83Å
152	Q	87.5	Confident	88.5	Confident	139 Å²	139	110.5 Å²	110.5	65%	0.65	56%	0.561	S	S	*	*			trans	-95.1	-17	173.4	-61.7	-63.4	-18.8	0	0	111.8	L145 K150 K154	L145-Q152 HydrophobicContact CD2-CG 3.97Å; L145-Q152 PolarHBondContact O-N 3.02Å; K150-Q152 PolarHBondContact O-N 3.04Å; Q152-K154 PolarHBondContact O-N 3.07Å; Q152-K154 VanDerWaalsContact O-N 3.14Å
153	R	87.7	Confident	88.7	Confident	129 Å²	129	114.7 Å²	114.7	49%	0.487	58%	0.579	S	S	.	*			trans	-71.6	107.4	-178.2	-164	173.9	95.6	170	6.9	111.5	E141 L145 K155	E141-R153 IonicContact OE2-NH1 2.8Å; L145-R153 PolarHBondContact O-N 2.68Å; R153-K155 WeakPolarHBondContact CG-O 3.38Å
154	K	88.9	Confident	88.8	Confident	185 Å²	185	114.7 Å²	114.7	80%	0.804	58%	0.581	S	S	*	*			trans	-95	-25	178.8	-63.2	-60.6	-174.9	-176.6	0	114.6	Q152	Q152-K154 PolarHBondContact O-N 3.07Å; Q152-K154 VanDerWaalsContact O-N 3.14Å
155	K	88.3	Confident	88.9	Confident	175 Å²	175	113.7 Å²	113.7	76%	0.761	58%	0.577	S	S	*	*	S	Bend	trans	-128.6	142	-179.7	-65.6	-176.6	177.8	-176.4	0	109.7	R153	R153-K155 WeakPolarHBondContact CG-O 3.38Å
156	P	87.3	Confident	89.1	Confident	82 Å²	82	114.7 Å²	114.7	53%	0.532	58%	0.581	S	S	.	*			trans	-68.1	152.6	169	29.9	-32.5	0	0	0	109.7	I158	P156-I158 HydrophobicContact CB-CG1 4.45Å; P156-I158 HydrophobicContact CG-CD1 4.34Å; P156-I158 HydrophobicContact CG-CG1 3.89Å; P156-I158 PolarHBondContact O-N 3.21Å
157	K	84.1	Confident	89.4	Confident	146 Å²	146	117.2 Å²	117.2	64%	0.635	59%	0.592	S	S	*	*			trans	-77.6	97.1	163.1	-74.9	174.8	169.9	164.8	0	106.8	E141	E141-K157 WeakPolarHBondContact OE1-CE 3.46Å; E141-K157 IonicContact OE1-NZ 2.82Å; E141-K157 PolarHBondContact OE1-NZ 3.37Å
158	I	83.4	Confident	89.5	Confident	112 Å²	112	112.5 Å²	112.5	57%	0.574	58%	0.578	S	S	*	*			trans	-78.5	137.7	176.2	-51	177.4	0	0	0	107.1	P156 T160	P156-I158 HydrophobicContact CB-CG1 4.45Å; P156-I158 HydrophobicContact CG-CD1 4.34Å; P156-I158 HydrophobicContact CG-CG1 3.89Å; P156-I158 PolarHBondContact O-N 3.21Å; I158-T160 VanDerWaalsContact CG2-O 3.23Å; I158-T160 WeakPolarHBondContact CG2-O 3.5Å; I158-T160 VanDerWaalsContact CG2-OG1 3.29Å; I158-T160 WeakPolarHBondContact CG2-OG1 3.36Å
159	V	84.5	Confident	89.6	Confident	143 Å²	143	113.7 Å²	113.7	87%	0.867	58%	0.576	S	S	*	*	S	Bend	trans	-89.6	-28	178.9	-180	0	0	0	0	111.4
160	T	89	Confident	89.7	Confident	27 Å²	27	109.5 Å²	109.5	17%	0.166	55%	0.554	C	S	.	*			trans	-89.6	141	178.2	55.7	0	0	0	0	110.9	I158 E165	I158-T160 VanDerWaalsContact CG2-O 3.23Å; I158-T160 WeakPolarHBondContact CG2-O 3.5Å; I158-T160 VanDerWaalsContact CG2-OG1 3.29Å; I158-T160 WeakPolarHBondContact CG2-OG1 3.36Å; T160-E165 HydrophobicContact CG2-CB 4.05Å
161	D	87.1	Confident	89.9	Confident	150 Å²	150	107.7 Å²	107.7	80%	0.802	55%	0.548	S	S	*	.	S	Bend	trans	-84.8	-37.7	179.1	-70.9	-35.3	0	0	0	111.2	E165	D161-E165 PolarHBondContact N-OE2 3.35Å; D161-E165 VanDerWaalsContact N-OE2 3.1Å
162	D	90.5	Very high	90	Very high	102 Å²	102	107.4 Å²	107.4	55%	0.545	54%	0.544	S	S	.	.	S	Bend	trans	-114.5	155.6	-174.9	-71.7	-32.7	0	0	0	113.7	Q164 E165 M166	D162-Q164 VanDerWaalsContact C-N 3.25Å; D162-Q164 PolarHBondContact O-N 3.38Å; D162-E165 HydrophobicContact CB-CG 4.43Å; D162-E165 PolarHBondContact O-N 3.49Å; D162-M166 PolarHBondContact O-N 3.25Å; D162-M166 VanDerWaalsContact O-N 3.16Å
163	L	93	Very high	90.2	Very high	116 Å²	116	106.6 Å²	106.6	61%	0.607	54%	0.538	S	S	*	.	H	α-helix	trans	-62.8	-34.9	174.6	179.9	62.7	0	0	0	111.7	M166 I167	L163-M166 HydrophobicContact CD1-CE 3.77Å; L163-M166 WeakPolarHBondContact O-CB 3.37Å; L163-M166 PolarHBondContact O-N 2.76Å; L163-I167 HydrophobicContact CG-CD1 4.14Å; L163-I167 WeakPolarHBondContact O-CG1 3.46Å; L163-I167 PolarHBondContact O-N 3.08Å
164	Q	92.3	Very high	90.4	Very high	157 Å²	157	107.5 Å²	107.5	73%	0.734	55%	0.547	S	S	*	.	H	α-helix	trans	-62.6	-45.6	176.8	-71.9	-176.3	-25.4	0	0	111	D162 M166 I167 T168	D162-Q164 VanDerWaalsContact C-N 3.25Å; D162-Q164 PolarHBondContact O-N 3.38Å; Q164-M166 VanDerWaalsContact C-N 3.3Å; Q164-M166 PolarHBondContact O-N 3.19Å; Q164-I167 PolarHBondContact O-N 3.47Å; Q164-T168 WeakPolarHBondContact O-CG2 3.14Å; Q164-T168 PolarHBondContact O-N 2.88Å; Q164-T168 PolarHBondContact O-OG1 3.49Å
165	E	91.8	Very high	90.5	Very high	88 Å²	88	106.4 Å²	106.4	41%	0.411	55%	0.545	S	S	.	.	H	α-helix	trans	-59.9	-41.5	175.3	-70	-171.4	156.2	0	0	111.9	T160 D161 D162 I167 T168 D169	T160-E165 HydrophobicContact CG2-CB 4.05Å; D161-E165 PolarHBondContact N-OE2 3.35Å; D161-E165 VanDerWaalsContact N-OE2 3.1Å; D162-E165 HydrophobicContact CB-CG 4.43Å; D162-E165 PolarHBondContact O-N 3.49Å; E165-I167 VanDerWaalsContact C-N 3.33Å; E165-I167 PolarHBondContact O-N 3.46Å; E165-T168 VanDerWaalsContact CA-OG1 3.32Å; E165-T168 WeakPolarHBondContact CA-OG1 3.43Å; E165-T168 PolarHBondContact O-N 2.91Å; E165-T168 PolarHBondContact O-OG1 3.18Å; E165-D169 WeakPolarHBondContact O-CB 3.47Å; E165-D169 PolarHBondContact O-N 3.13Å
166	M	92.7	Very high	90.6	Very high	87 Å²	87	107.3 Å²	107.3	43%	0.429	54%	0.544	S	S	.	.	H	α-helix	trans	-62.3	-39.9	177.4	-163.1	-167.1	-28.3	0	0	112.6	D162 L163 Q164 D169 A170	D162-M166 PolarHBondContact O-N 3.25Å; D162-M166 VanDerWaalsContact O-N 3.16Å; L163-M166 HydrophobicContact CD1-CE 3.77Å; L163-M166 WeakPolarHBondContact O-CB 3.37Å; L163-M166 PolarHBondContact O-N 2.76Å; Q164-M166 VanDerWaalsContact C-N 3.3Å; Q164-M166 PolarHBondContact O-N 3.19Å; M166-D169 PolarHBondContact O-N 3.46Å; M166-A170 WeakPolarHBondContact O-CB 3.5Å; M166-A170 PolarHBondContact O-N 3.04Å
167	I	94.1	Very high	90.8	Very high	83 Å²	83	108.8 Å²	108.8	43%	0.426	54%	0.539	S	S	.	.	H	α-helix	trans	-64.8	-46.5	175	-68.1	167	0	0	0	109.5	L163 Q164 E165 D169 A170 E171	L163-I167 HydrophobicContact CG-CD1 4.14Å; L163-I167 WeakPolarHBondContact O-CG1 3.46Å; L163-I167 PolarHBondContact O-N 3.08Å; Q164-I167 PolarHBondContact O-N 3.47Å; E165-I167 VanDerWaalsContact C-N 3.33Å; E165-I167 PolarHBondContact O-N 3.46Å; I167-D169 VanDerWaalsContact C-N 3.34Å; I167-D169 PolarHBondContact O-N 3.05Å; I167-A170 PolarHBondContact O-N 3.23Å; I167-A170 VanDerWaalsContact O-N 3.17Å; I167-E171 HydrophobicContact CG2-CG 4.36Å; I167-E171 WeakPolarHBondContact O-CG 3.46Å; I167-E171 PolarHBondContact O-N 2.63Å
168	T	93.1	Very high	90.8	Very high	80 Å²	80	105.4 Å²	105.4	49%	0.491	53%	0.529	S	S	.	.	H	α-helix	trans	-63	-37.7	178.2	59.8	0	0	0	0	112.9	Q164 E165 S172	Q164-T168 WeakPolarHBondContact O-CG2 3.14Å; Q164-T168 PolarHBondContact O-N 2.88Å; Q164-T168 PolarHBondContact O-OG1 3.49Å; E165-T168 VanDerWaalsContact CA-OG1 3.32Å; E165-T168 WeakPolarHBondContact CA-OG1 3.43Å; E165-T168 PolarHBondContact O-N 2.91Å; E165-T168 PolarHBondContact O-OG1 3.18Å; T168-S172 WeakPolarHBondContact O-CB 2.96Å; T168-S172 PolarHBondContact O-N 3.24Å
169	D	93	Very high	90.8	Very high	60 Å²	60	105.1 Å²	105.1	32%	0.321	53%	0.525	S	S	.	.	H	α-helix	trans	-67.4	-40.2	175	-179.4	52.1	0	0	0	111.1	E165 M166 I167 S172 K173	E165-D169 WeakPolarHBondContact O-CB 3.47Å; E165-D169 PolarHBondContact O-N 3.13Å; M166-D169 PolarHBondContact O-N 3.46Å; I167-D169 VanDerWaalsContact C-N 3.34Å; I167-D169 PolarHBondContact O-N 3.05Å; D169-S172 PolarHBondContact O-N 3.47Å; D169-S172 PolarHBondContact O-OG 3.35Å; D169-K173 WeakPolarHBondContact O-CB 3.45Å; D169-K173 WeakPolarHBondContact O-CG 3.49Å; D169-K173 PolarHBondContact O-N 2.89Å; D169-K173 WeakPolarHBondContact OD1-CE 3.37Å; D169-K173 IonicContact OD1-NZ 3.56Å; D169-K173 VanDerWaalsContact OD2-CE 3.3Å; D169-K173 WeakPolarHBondContact OD2-CE 3.29Å; D169-K173 IonicContact OD2-NZ 3.99Å; D169-K173 PolarHBondContact OD2-NZ 3.23Å
170	A	93.4	Very high	90.7	Very high	57 Å²	57	104.4 Å²	104.4	47%	0.471	52%	0.516	S	S	.	.	H	α-helix	trans	-64.9	-43.9	175.6	0	0	0	0	0	112.5	M166 I167 K173 H174	M166-A170 WeakPolarHBondContact O-CB 3.5Å; M166-A170 PolarHBondContact O-N 3.04Å; I167-A170 PolarHBondContact O-N 3.23Å; I167-A170 VanDerWaalsContact O-N 3.17Å; A170-K173 PolarHBondContact O-N 3.02Å; A170-H174 WeakPolarHBondContact O-CB 3.5Å; A170-H174 PolarHBondContact O-N 2.81Å
171	E	94.9	Very high	90.3	Very high	110 Å²	110	110.4 Å²	110.4	51%	0.514	54%	0.542	S	S	.	.	H	α-helix	trans	-60.6	-47.5	173.4	-73.4	174	168.3	0	0	110.4	I167 K173 H174 E175	I167-E171 HydrophobicContact CG2-CG 4.36Å; I167-E171 WeakPolarHBondContact O-CG 3.46Å; I167-E171 PolarHBondContact O-N 2.63Å; E171-K173 VanDerWaalsContact C-N 3.28Å; E171-K173 PolarHBondContact O-N 3.13Å; E171-H174 WeakPolarHBondContact O-CB 3.39Å; E171-H174 PolarHBondContact O-N 2.98Å; E171-E175 WeakPolarHBondContact O-CG 3.21Å; E171-E175 PolarHBondContact O-N 3.28Å
172	S	93.5	Very high	90.1	Very high	27 Å²	27	105.3 Å²	105.3	19%	0.189	52%	0.515	C	S	.	.	H	α-helix	trans	-61.7	-34.3	177.5	82	0	0	0	0	113.2	T168 D169 R176	T168-S172 WeakPolarHBondContact O-CB 2.96Å; T168-S172 PolarHBondContact O-N 3.24Å; D169-S172 PolarHBondContact O-N 3.47Å; D169-S172 PolarHBondContact O-OG 3.35Å; S172-R176 WeakPolarHBondContact O-CB 3.36Å; S172-R176 WeakPolarHBondContact O-CD 3.38Å; S172-R176 WeakPolarHBondContact O-CG 3.36Å; S172-R176 PolarHBondContact O-N 3.36Å
173	K	92.1	Very high	89.5	Confident	123 Å²	123	106.6 Å²	106.6	54%	0.535	53%	0.526	S	S	.	.	H	α-helix	trans	-72.3	-35.4	175.1	-78.3	169.5	179.5	161.7	0	112	D169 A170 E171 Y177	D169-K173 WeakPolarHBondContact O-CB 3.45Å; D169-K173 WeakPolarHBondContact O-CG 3.49Å; D169-K173 PolarHBondContact O-N 2.89Å; D169-K173 WeakPolarHBondContact OD1-CE 3.37Å; D169-K173 IonicContact OD1-NZ 3.56Å; D169-K173 VanDerWaalsContact OD2-CE 3.3Å; D169-K173 WeakPolarHBondContact OD2-CE 3.29Å; D169-K173 IonicContact OD2-NZ 3.99Å; D169-K173 PolarHBondContact OD2-NZ 3.23Å; A170-K173 PolarHBondContact O-N 3.02Å; E171-K173 VanDerWaalsContact C-N 3.28Å; E171-K173 PolarHBondContact O-N 3.13Å; K173-Y177 PolarHBondContact O-N 3.37Å
174	H	91.7	Very high	88.7	Confident	147 Å²	147	111.2 Å²	111.2	68%	0.681	54%	0.537	S	S	*	.	H	α-helix	trans	-69.4	-42.3	175	-171.5	54.2	0	0	0	111.1	A170 E171 R176 Y177	A170-H174 WeakPolarHBondContact O-CB 3.5Å; A170-H174 PolarHBondContact O-N 2.81Å; E171-H174 WeakPolarHBondContact O-CB 3.39Å; E171-H174 PolarHBondContact O-N 2.98Å; H174-R176 VanDerWaalsContact C-N 3.3Å; H174-R176 PolarHBondContact O-N 3.11Å; H174-Y177 WeakPolarHBondContact O-CB 3.45Å; H174-Y177 PolarHBondContact O-N 3.27Å; H174-Y177 VanDerWaalsContact O-N 3.08Å
175	E	91.3	Very high	88	Confident	163 Å²	163	109.5 Å²	109.5	76%	0.762	52%	0.524	S	S	*	.	H	α-helix	trans	-63.1	-34.7	173.7	-71.6	177.1	175.8	0	0	112.7	E171 Y177	E171-E175 WeakPolarHBondContact O-CG 3.21Å; E171-E175 PolarHBondContact O-N 3.28Å; E175-Y177 VanDerWaalsContact C-N 3.31Å
176	R	90.4	Very high	87	Confident	194 Å²	194	115 Å²	115	73%	0.732	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-15.1	173.8	-72.6	172.3	-165.9	-179.7	8.8	113.7	S172 H174 D178	S172-R176 WeakPolarHBondContact O-CB 3.36Å; S172-R176 WeakPolarHBondContact O-CD 3.38Å; S172-R176 WeakPolarHBondContact O-CG 3.36Å; S172-R176 PolarHBondContact O-N 3.36Å; H174-R176 VanDerWaalsContact C-N 3.3Å; H174-R176 PolarHBondContact O-N 3.11Å; R176-D178 PolarHBondContact O-N 3.26Å
177	Y	90.9	Very high	85.9	Confident	112 Å²	112	119.6 Å²	119.6	44%	0.439	56%	0.559	S	S	.	*			trans	-80.4	106.4	178.4	176	-100.6	0	0	0	108.7	K173 H174 E175 E179 D182	K173-Y177 PolarHBondContact O-N 3.37Å; H174-Y177 WeakPolarHBondContact O-CB 3.45Å; H174-Y177 PolarHBondContact O-N 3.27Å; H174-Y177 VanDerWaalsContact O-N 3.08Å; E175-Y177 VanDerWaalsContact C-N 3.31Å; Y177-E179 HydrophobicContact CE1-CG 3.85Å; Y177-D182 HydrophobicContact CE2-CB 4.2Å; Y177-D182 PolarHBondContact OH-OD2 2.77Å
178	D	85.1	Confident	84.4	Confident	76 Å²	76	119.6 Å²	119.6	41%	0.406	58%	0.58	S	S	.	*			trans	-92.8	122.4	171.1	-169.2	-13.8	0	0	0	109.8	R176 D180 E181 D182	R176-D178 PolarHBondContact O-N 3.26Å; D178-D180 PolarHBondContact O-N 3.26Å; D178-D180 PolarHBondContact OD1-N 3.42Å; D178-E181 HydrophobicContact CB-CB 4.14Å; D178-E181 HydrophobicContact CB-CG 3.99Å; D178-E181 PolarHBondContact O-N 3.4Å; D178-D182 PolarHBondContact O-N 3.08Å
179	E	83	Confident	82.9	Confident	105 Å²	105	121.8 Å²	121.8	49%	0.491	59%	0.593	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.3	-27	177.1	-88.9	-167.3	-161.4	0	0	113.2	Y177 R185	Y177-E179 HydrophobicContact CE1-CG 3.85Å; E179-R185 IonicContact OE2-CZ 3.88Å; E179-R185 IonicContact OE2-NH1 2.88Å; E179-R185 PolarHBondContact OE2-NH1 3.03Å; E179-R185 IonicContact OE2-NH2 3.83Å; E179-R185 PolarHBondContact OE2-NH2 2.86Å
180	D	81.8	Confident	81.3	Confident	129 Å²	129	124.8 Å²	124.8	69%	0.69	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-27.5	-178.9	-72.4	-31.2	0	0	0	112.3	D178 D182	D178-D180 PolarHBondContact O-N 3.26Å; D178-D180 PolarHBondContact OD1-N 3.42Å; D180-D182 VanDerWaalsContact C-N 3.33Å
181	E	81.1	Confident	80.1	Confident	152 Å²	152	131.5 Å²	131.5	71%	0.71	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	-10.3	174.9	-63.4	-165.5	157.3	0	0	113.2	D178 V183	D178-E181 HydrophobicContact CB-CB 4.14Å; D178-E181 HydrophobicContact CB-CG 3.99Å; D178-E181 PolarHBondContact O-N 3.4Å; E181-V183 PolarHBondContact O-N 3.07Å
182	D	82.7	Confident	79.2	Confident	44 Å²	44	133.3 Å²	133.3	24%	0.235	64%	0.641	C	S	.	*			trans	-72.9	90.2	177.7	-169.1	-10.7	0	0	0	112	Y177 D178 D180 Y184 R185	Y177-D182 HydrophobicContact CE2-CB 4.2Å; Y177-D182 PolarHBondContact OH-OD2 2.77Å; D178-D182 PolarHBondContact O-N 3.08Å; D180-D182 VanDerWaalsContact C-N 3.33Å; D182-Y184 PolarHBondContact O-N 3.28Å; D182-Y184 VanDerWaalsContact O-N 3.1Å; D182-Y184 WeakPolarHBondContact OD1-CB 3.46Å; D182-Y184 PolarHBondContact OD1-N 3.34Å; D182-R185 HydrophobicContact CB-CB 4.27Å; D182-R185 WeakPolarHBondContact O-CB 3.46Å; D182-R185 PolarHBondContact O-N 3.36Å; D182-R185 VanDerWaalsContact O-N 3.09Å; D182-R185 PolarHBondContact OD1-N 3.42Å
183	V	77	Confident	78.5	Confident	128 Å²	128	143.5 Å²	143.5	78%	0.776	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.1	-25.7	176.9	-174.6	0	0	0	0	112.8	E181	E181-V183 PolarHBondContact O-N 3.07Å
184	Y	76.7	Confident	78	Confident	213 Å²	213	147.8 Å²	147.8	84%	0.835	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	-8.3	-176.7	-59.4	-72.6	0	0	0	113.3	D182 K186	D182-Y184 PolarHBondContact O-N 3.28Å; D182-Y184 VanDerWaalsContact O-N 3.1Å; D182-Y184 WeakPolarHBondContact OD1-CB 3.46Å; D182-Y184 PolarHBondContact OD1-N 3.34Å; Y184-K186 PolarHBondContact O-N 2.99Å; Y184-K186 VanDerWaalsContact O-N 3.14Å
185	R	78	Confident	77.6	Confident	121 Å²	121	147.3 Å²	147.3	46%	0.457	69%	0.687	S	S	.	*	S	Bend	trans	-64.9	115.7	173.8	-168.3	179.1	-174.1	173.6	12.2	109.5	E179 D182 R187	E179-R185 IonicContact OE2-CZ 3.88Å; E179-R185 IonicContact OE2-NH1 2.88Å; E179-R185 PolarHBondContact OE2-NH1 3.03Å; E179-R185 IonicContact OE2-NH2 3.83Å; E179-R185 PolarHBondContact OE2-NH2 2.86Å; D182-R185 HydrophobicContact CB-CB 4.27Å; D182-R185 WeakPolarHBondContact O-CB 3.46Å; D182-R185 PolarHBondContact O-N 3.36Å; D182-R185 VanDerWaalsContact O-N 3.09Å; D182-R185 PolarHBondContact OD1-N 3.42Å; R185-R187 PolarHBondContact O-N 2.87Å
186	K	71.3	Confident	77.3	Confident	203 Å²	203	144.8 Å²	144.8	88%	0.883	69%	0.685	S	S	*	*			trans	-67.9	93.3	173.5	-71.6	-176.8	179	176.8	0	109.6	Y184 G188	Y184-K186 PolarHBondContact O-N 2.99Å; Y184-K186 VanDerWaalsContact O-N 3.14Å; K186-G188 PolarHBondContact O-N 2.84Å
187	R	69.3	Low	76.9	Confident	184 Å²	184	139.8 Å²	139.8	69%	0.694	67%	0.67	S	S	*	*			trans	-66.8	113.1	168	-67.2	-175	-75.7	-135.8	-1.5	108.2	R185 V189	R185-R187 PolarHBondContact O-N 2.87Å; R187-V189 PolarHBondContact O-N 3.21Å
188	G	62.6	Low	76.6	Confident	84 Å²	84	136.4 Å²	136.4	87%	0.866	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	24.9	-168.4	0	0	0	0	0	116.9	K186	K186-G188 PolarHBondContact O-N 2.84Å
189	V	60.3	Low	76.7	Confident	125 Å²	125	137.3 Å²	137.3	76%	0.758	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.7	-23.6	-163.8	-169.5	0	0	0	0	115.1	R187 K191	R187-V189 PolarHBondContact O-N 3.21Å; V189-K191 PolarHBondContact O-N 2.88Å
190	D	60.4	Low	76.9	Confident	123 Å²	123	132.6 Å²	132.6	66%	0.658	65%	0.648	S	S	*	*			trans	-95.9	85.7	-170.4	-60	-28.2	0	0	0	112.8	D192	D190-D192 VanDerWaalsContact C-N 3.3Å
191	K	68.6	Low	77.1	Confident	199 Å²	199	127 Å²	127	87%	0.865	62%	0.617	S	S	*	*			trans	-77.5	-18.4	162.9	-76.6	-176.9	-178.6	173.7	0	112.5	V189	V189-K191 PolarHBondContact O-N 2.88Å
192	D	76.6	Confident	77.2	Confident	148 Å²	148	127.1 Å²	127.1	79%	0.791	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-82.6	129.5	-179.4	-63.3	-28	0	0	0	110.3	D190	D190-D192 VanDerWaalsContact C-N 3.3Å
193	R	77.6	Confident	77	Confident	240 Å²	240	130.7 Å²	130.7	91%	0.906	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-97.3	132.2	176.3	-65.2	-179	-178.2	178.3	0.8	108.7
194	Y	81	Confident	77.1	Confident	214 Å²	214	125 Å²	125	84%	0.839	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-56	143.1	169.9	-65	-80.1	0	0	0	111.5
195	E	83.5	Confident	77.5	Confident	136 Å²	136	117.7 Å²	117.7	64%	0.636	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-59.3	139.4	174.3	-171.4	-179.1	168.7	0	0	109.9	Q197 K391	E195-Q197 PolarHBondContact O-N 3.06Å; E195-K391 IonicContact OE1-NZ 2.73Å; E195-K391 PolarHBondContact OE1-NZ 2.99Å
196	P	84.5	Confident	78.1	Confident	111 Å²	111	114.8 Å²	114.8	72%	0.721	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-58.9	129.1	173.3	-22.9	33.2	0	0	0	111.6	D198	P196-D198 PolarHBondContact O-N 2.98Å
197	Q	82.8	Confident	79	Confident	88 Å²	88	113.4 Å²	113.4	41%	0.411	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-49.5	132.4	174.3	168.8	166	78.1	0	0	112.2	E195 F201 E376	E195-Q197 PolarHBondContact O-N 3.06Å; Q197-F201 HydrophobicContact CG-CB 4.28Å; Q197-F201 HydrophobicContact CG-CD2 4.01Å; Q197-E376 WeakPolarHBondContact CG-OE1 3.37Å; Q197-E376 PolarHBondContact NE2-OE1 2.93Å
198	D	85.4	Confident	80.2	Confident	41 Å²	41	110.1 Å²	110.1	22%	0.219	55%	0.545	C	S	.	.	P	Polyproline II helix	trans	-60.6	129.8	-179.7	-166.5	-41.8	0	0	0	110.8	P196 L200 F201	P196-D198 PolarHBondContact O-N 2.98Å; D198-L200 HydrophobicContact CB-CB 4.24Å; D198-L200 PolarHBondContact O-N 2.69Å; D198-L200 WeakPolarHBondContact OD1-CB 3.4Å; D198-L200 PolarHBondContact OD1-N 2.88Å; D198-F201 HydrophobicContact CB-CD2 3.85Å; D198-F201 HydrophobicContact CB-CE2 3.88Å; D198-F201 WeakPolarHBondContact O-CD2 3.39Å; D198-F201 PolarHBondContact O-N 3.14Å
199	P	87	Confident	81.6	Confident	95 Å²	95	107 Å²	107	62%	0.617	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-51	-20.4	171.9	-27.7	34.7	0	0	0	114.8	F201 R202	P199-F201 VanDerWaalsContact C-N 3.27Å; P199-F201 PolarHBondContact O-N 3.15Å; P199-R202 WeakPolarHBondContact O-CB 3.11Å; P199-R202 PolarHBondContact O-N 2.85Å; P199-R202 VanDerWaalsContact O-N 3.17Å
200	L	86.6	Confident	83.2	Confident	7 Å²	7	102.7 Å²	102.7	4%	0.037	48%	0.478	C	S	.	.	G	3₁₀ helix	trans	-53.1	-40.8	172.8	-176.2	65.6	0	0	0	112.9	D198 R202 K203 V385 N389 V390	D198-L200 HydrophobicContact CB-CB 4.24Å; D198-L200 PolarHBondContact O-N 2.69Å; D198-L200 WeakPolarHBondContact OD1-CB 3.4Å; D198-L200 PolarHBondContact OD1-N 2.88Å; L200-R202 PolarHBondContact O-N 2.63Å; L200-K203 HydrophobicContact CD1-CD 3.91Å; L200-K203 VanDerWaalsContact O-CB 3.25Å; L200-K203 WeakPolarHBondContact O-CB 3.49Å; L200-K203 WeakPolarHBondContact O-CG 3.49Å; L200-K203 PolarHBondContact O-N 3.01Å; L200-K203 VanDerWaalsContact O-N 3.08Å; L200-V385 HydrophobicContact CD1-CG1 3.98Å; L200-V385 HydrophobicContact CD2-CG1 3.37Å; L200-V385 HydrophobicContact CG-CG1 3.48Å; L200-V385 VanDerWaalsContact CG-CG1 3.48Å; L200-N389 HydrophobicContact CD1-CB 3.85Å; L200-N389 HydrophobicContact CD2-CB 3.78Å; L200-N389 WeakPolarHBondContact CD2-O 3.31Å; L200-N389 HydrophobicContact CG-CB 4.49Å; L200-V390 HydrophobicContact CD2-CG2 4.11Å
201	F	85.1	Confident	84.8	Confident	10 Å²	10	102.1 Å²	102.1	4%	0.044	48%	0.475	C	S	.	.	G	3₁₀ helix	trans	-71.5	-17.7	-178.8	-63.7	-71.5	0	0	0	113.4	Q197 D198 P199 K203 E376 L379 I380 V385	Q197-F201 HydrophobicContact CG-CB 4.28Å; Q197-F201 HydrophobicContact CG-CD2 4.01Å; D198-F201 HydrophobicContact CB-CD2 3.85Å; D198-F201 HydrophobicContact CB-CE2 3.88Å; D198-F201 WeakPolarHBondContact O-CD2 3.39Å; D198-F201 PolarHBondContact O-N 3.14Å; P199-F201 VanDerWaalsContact C-N 3.27Å; P199-F201 PolarHBondContact O-N 3.15Å; F201-K203 VanDerWaalsContact C-N 3.27Å; F201-K203 PolarHBondContact O-N 3.05Å; F201-E376 HydrophobicContact CD1-CB 4.19Å; F201-E376 HydrophobicContact CD1-CG 4.24Å; F201-E376 HydrophobicContact CD2-CG 4.12Å; F201-E376 HydrophobicContact CE1-CB 3.76Å; F201-E376 HydrophobicContact CE1-CG 4.18Å; F201-E376 HydrophobicContact CE2-CB 4.31Å; F201-E376 VanDerWaalsContact CE2-CD 3.47Å; F201-E376 HydrophobicContact CE2-CG 4.06Å; F201-E376 VanDerWaalsContact CE2-OE2 3.28Å; F201-E376 WeakPolarHBondContact CE2-OE2 3.43Å; F201-E376 HydrophobicContact CG-CG 4.21Å; F201-E376 HydrophobicContact CZ-CB 3.83Å; F201-E376 HydrophobicContact CZ-CG 4.1Å; F201-L379 HydrophobicContact CB-CD1 4.23Å; F201-L379 HydrophobicContact CD1-CB 4.42Å; F201-L379 HydrophobicContact CD1-CD1 4.25Å; F201-I380 HydrophobicContact CE1-CD1 3.8Å; F201-I380 HydrophobicContact CE1-CG1 3.79Å; F201-I380 HydrophobicContact CZ-CD1 4.05Å; F201-V385 HydrophobicContact CD1-CG2 3.95Å; F201-V385 HydrophobicContact CE1-CG2 4.33Å
202	R	85.1	Confident	86.1	Confident	155 Å²	155	94.1 Å²	94.1	59%	0.585	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-80.6	-7.3	172.8	-59	-178.7	-179.5	177.8	0.1	112.5	P199 L200 G204 Q205	P199-R202 WeakPolarHBondContact O-CB 3.11Å; P199-R202 PolarHBondContact O-N 2.85Å; P199-R202 VanDerWaalsContact O-N 3.17Å; L200-R202 PolarHBondContact O-N 2.63Å; R202-G204 PolarHBondContact O-N 3.16Å; R202-Q205 WeakPolarHBondContact O-CB 3.33Å; R202-Q205 PolarHBondContact O-N 3.14Å; R202-Q205 VanDerWaalsContact O-N 3.09Å
203	K	78.7	Confident	86.9	Confident	120 Å²	120	87.1 Å²	87.1	52%	0.522	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	127.2	175.7	-66.5	-172.5	-171.7	165.2	0	109.5	L200 F201	L200-K203 HydrophobicContact CD1-CD 3.91Å; L200-K203 VanDerWaalsContact O-CB 3.25Å; L200-K203 WeakPolarHBondContact O-CB 3.49Å; L200-K203 WeakPolarHBondContact O-CG 3.49Å; L200-K203 PolarHBondContact O-N 3.01Å; L200-K203 VanDerWaalsContact O-N 3.08Å; F201-K203 VanDerWaalsContact C-N 3.27Å; F201-K203 PolarHBondContact O-N 3.05Å
204	G	77.8	Confident	87.8	Confident	9 Å²	9	80.4 Å²	80.4	9%	0.093	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	106.4	-22	-170.9	0	0	0	0	0	113.6	R202	R202-G204 PolarHBondContact O-N 3.16Å
205	Q	86.2	Confident	88.5	Confident	59 Å²	59	74.5 Å²	74.5	28%	0.276	36%	0.358	S	S	.	.			trans	-97.8	3.8	179.8	-59.6	172.2	-2.7	0	0	113.2	R202 W210 V369	R202-Q205 WeakPolarHBondContact O-CB 3.33Å; R202-Q205 PolarHBondContact O-N 3.14Å; R202-Q205 VanDerWaalsContact O-N 3.09Å; Q205-W210 VanDerWaalsContact O-CD1 3.31Å; Q205-W210 PolarHBondContact O-NE1 3.48Å; Q205-V369 WeakPolarHBondContact CG-O 3.15Å
206	S	89	Confident	89.1	Confident	59 Å²	59	68 Å²	68	41%	0.413	33%	0.328	S	S	.	.			trans	-64.4	139.4	-176.2	-179.9	0	0	0	0	112.5	R208 I209 W210	S206-R208 PolarHBondContact O-N 2.93Å; S206-R208 PolarHBondContact OG-N 3.02Å; S206-I209 PolarHBondContact O-N 3.2Å; S206-W210 VanDerWaalsContact O-CD1 3.3Å; S206-W210 PolarHBondContact O-N 3.4Å; S206-W210 VanDerWaalsContact O-N 3.15Å
207	K	91.9	Very high	89.7	Confident	174 Å²	174	62.8 Å²	62.8	76%	0.757	29%	0.294	S	S	*	.	H	α-helix	trans	-48.6	-35.7	173	-66.9	-174.6	179.4	-178.6	0	112.8	I209 W210 N211	K207-I209 PolarHBondContact O-N 2.95Å; K207-W210 PolarHBondContact O-N 2.98Å; K207-N211 WeakPolarHBondContact O-CB 3.43Å; K207-N211 PolarHBondContact O-N 2.94Å; K207-N211 PolarHBondContact O-OD1 3.38Å
208	R	93.4	Very high	90.3	Very high	115 Å²	115	63.7 Å²	63.7	43%	0.434	30%	0.301	S	S	.	.	H	α-helix	trans	-59.3	-44.9	176.7	-171.8	-173.4	72.3	81.4	4.5	112.1	S206 E212 K349	S206-R208 PolarHBondContact O-N 2.93Å; S206-R208 PolarHBondContact OG-N 3.02Å; R208-E212 WeakPolarHBondContact O-CG 3.44Å; R208-E212 PolarHBondContact O-N 2.76Å; R208-K349 PolarHBondContact NH1-O 3.24Å; R208-K349 PolarHBondContact NH2-O 2.95Å
209	I	92.6	Very high	90.8	Very high	19 Å²	19	63.5 Å²	63.5	10%	0.097	30%	0.303	C	S	.	.	H	α-helix	trans	-71.4	-40.3	-178.6	-63.3	173	0	0	0	109.9	S206 K207 N211 E212 L213 P366 I368	S206-I209 PolarHBondContact O-N 3.2Å; K207-I209 PolarHBondContact O-N 2.95Å; I209-N211 PolarHBondContact O-N 2.66Å; I209-E212 WeakPolarHBondContact O-CB 3.45Å; I209-E212 PolarHBondContact O-N 2.82Å; I209-L213 PolarHBondContact O-N 3.45Å; I209-P366 HydrophobicContact CG2-CB 4.22Å; I209-P366 HydrophobicContact CG2-CG 4.1Å; I209-I368 HydrophobicContact CG2-CG2 3.93Å
210	W	92.8	Very high	91.2	Very high	34 Å²	34	59 Å²	59	13%	0.129	27%	0.274	C	S	.	.	H	α-helix	trans	-60.3	-42.4	174.1	-75.6	104.6	0	0	0	112.8	Q205 S206 K207 E212 L213 Y214 Y370	Q205-W210 VanDerWaalsContact O-CD1 3.31Å; Q205-W210 PolarHBondContact O-NE1 3.48Å; S206-W210 VanDerWaalsContact O-CD1 3.3Å; S206-W210 PolarHBondContact O-N 3.4Å; S206-W210 VanDerWaalsContact O-N 3.15Å; K207-W210 PolarHBondContact O-N 2.98Å; W210-E212 VanDerWaalsContact C-N 3.32Å; W210-E212 PolarHBondContact O-N 3.4Å; W210-L213 HydrophobicContact CE3-CD2 3.64Å; W210-L213 HydrophobicContact CH2-CD2 4.38Å; W210-L213 HydrophobicContact CZ3-CD2 3.44Å; W210-L213 VanDerWaalsContact CZ3-CD2 3.44Å; W210-L213 WeakPolarHBondContact O-CB 3.02Å; W210-L213 PolarHBondContact O-N 3.49Å; W210-Y214 HydrophobicContact CB-CE2 4.45Å; W210-Y214 AromaticContact CE3-CE2 3.85Å; W210-Y214 HydrophobicContact CE3-CE2 3.85Å; W210-Y214 WeakPolarHBondContact O-CD2 3.46Å; W210-Y214 PolarHBondContact O-N 3.16Å; W210-Y370 AromaticContact CH2-CD2 3.35Å; W210-Y370 HydrophobicContact CH2-CD2 3.35Å; W210-Y370 AromaticContact CH2-CE2 3.79Å; W210-Y370 HydrophobicContact CH2-CE2 3.79Å; W210-Y370 HydrophobicContact CH2-CG 4.27Å; W210-Y370 AromaticContact CZ2-CD2 3.86Å; W210-Y370 HydrophobicContact CZ2-CD2 3.86Å; W210-Y370 HydrophobicContact CZ2-CE2 4.3Å; W210-Y370 HydrophobicContact CZ2-CG 4.44Å; W210-Y370 HydrophobicContact CZ3-CD2 4.28Å; W210-Y370 HydrophobicContact CZ3-CE2 4.39Å
211	N	94.7	Very high	91.5	Very high	111 Å²	111	59.6 Å²	59.6	59%	0.594	28%	0.277	S	S	*	.	H	α-helix	trans	-62.3	-40.4	176.2	-71.1	-5.6	0	0	0	111.9	K207 I209 K215	K207-N211 WeakPolarHBondContact O-CB 3.43Å; K207-N211 PolarHBondContact O-N 2.94Å; K207-N211 PolarHBondContact O-OD1 3.38Å; I209-N211 PolarHBondContact O-N 2.66Å; N211-K215 VanDerWaalsContact O-CB 3.31Å; N211-K215 WeakPolarHBondContact O-CB 3.46Å; N211-K215 PolarHBondContact O-N 2.85Å; N211-K215 VanDerWaalsContact O-N 3.08Å
212	E	94.7	Very high	91.9	Very high	32 Å²	32	59.1 Å²	59.1	15%	0.15	28%	0.275	C	S	.	.	H	α-helix	trans	-64.2	-42.3	174.2	-67.9	-73.5	131.5	0	0	111.3	R208 I209 W210 K215 V216 W351 P366	R208-E212 WeakPolarHBondContact O-CG 3.44Å; R208-E212 PolarHBondContact O-N 2.76Å; I209-E212 WeakPolarHBondContact O-CB 3.45Å; I209-E212 PolarHBondContact O-N 2.82Å; W210-E212 VanDerWaalsContact C-N 3.32Å; W210-E212 PolarHBondContact O-N 3.4Å; E212-K215 WeakPolarHBondContact O-CB 3.45Å; E212-K215 PolarHBondContact O-N 3.27Å; E212-V216 WeakPolarHBondContact O-CG2 3.49Å; E212-V216 PolarHBondContact O-N 3.48Å; E212-W351 PolarHBondContact OE2-N 3.34Å; E212-P366 HydrophobicContact CB-CG 3.89Å
213	L	94.8	Very high	92.4	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-58.3	-55.1	174.6	174.8	69.9	0	0	0	111.4	I209 W210 K215 V216 L217 V240 V319 I368	I209-L213 PolarHBondContact O-N 3.45Å; W210-L213 HydrophobicContact CE3-CD2 3.64Å; W210-L213 HydrophobicContact CH2-CD2 4.38Å; W210-L213 HydrophobicContact CZ3-CD2 3.44Å; W210-L213 VanDerWaalsContact CZ3-CD2 3.44Å; W210-L213 WeakPolarHBondContact O-CB 3.02Å; W210-L213 PolarHBondContact O-N 3.49Å; L213-K215 PolarHBondContact O-N 3Å; L213-V216 WeakPolarHBondContact O-CB 3.47Å; L213-V216 PolarHBondContact O-N 2.98Å; L213-L217 HydrophobicContact CD1-CD1 4.14Å; L213-L217 HydrophobicContact CD1-CG 4.06Å; L213-L217 HydrophobicContact CD2-CD1 4.33Å; L213-L217 HydrophobicContact CG-CD1 3.92Å; L213-L217 HydrophobicContact CG-CG 4.19Å; L213-L217 WeakPolarHBondContact O-CB 3.3Å; L213-L217 WeakPolarHBondContact O-CG 3Å; L213-L217 PolarHBondContact O-N 3.1Å; L213-V240 HydrophobicContact CD2-CG2 4.12Å; L213-V319 HydrophobicContact CD1-CB 4.4Å; L213-V319 HydrophobicContact CD1-CG1 3.64Å; L213-V319 HydrophobicContact CD1-CG2 3.83Å; L213-I368 HydrophobicContact CB-CG2 4.05Å; L213-I368 HydrophobicContact CD1-CD1 4.06Å; L213-I368 HydrophobicContact CD1-CG2 4.12Å; L213-I368 HydrophobicContact CD2-CD1 3.81Å; L213-I368 HydrophobicContact CD2-CG2 4.03Å; L213-I368 HydrophobicContact CG-CG2 4.26Å
214	Y	95.6	Very high	93.3	Very high	99 Å²	99	46 Å²	46	39%	0.388	22%	0.222	S	C	.	.	H	α-helix	trans	-62.4	-31.6	-177.1	-75.3	-64	0	0	0	112.3	W210 L217 D218 F243	W210-Y214 HydrophobicContact CB-CE2 4.45Å; W210-Y214 AromaticContact CE3-CE2 3.85Å; W210-Y214 HydrophobicContact CE3-CE2 3.85Å; W210-Y214 WeakPolarHBondContact O-CD2 3.46Å; W210-Y214 PolarHBondContact O-N 3.16Å; Y214-L217 HydrophobicContact CD1-CD1 4.3Å; Y214-L217 CarbonylContact O-C 3.49Å; Y214-D218 WeakPolarHBondContact O-CB 3.45Å; Y214-D218 PolarHBondContact O-N 3.16Å; Y214-F243 AromaticContact CD1-CE1 3.95Å; Y214-F243 HydrophobicContact CD1-CE1 3.95Å; Y214-F243 AromaticContact CD1-CZ 3.9Å; Y214-F243 HydrophobicContact CD1-CZ 3.9Å; Y214-F243 HydrophobicContact CE1-CD1 4.14Å; Y214-F243 HydrophobicContact CE1-CD2 4.3Å; Y214-F243 AromaticContact CE1-CE1 3.76Å; Y214-F243 HydrophobicContact CE1-CE1 3.76Å; Y214-F243 AromaticContact CE1-CE2 3.94Å; Y214-F243 HydrophobicContact CE1-CE2 3.94Å; Y214-F243 HydrophobicContact CE1-CG 4.39Å; Y214-F243 AromaticContact CE1-CZ 3.66Å; Y214-F243 HydrophobicContact CE1-CZ 3.66Å
215	K	96.2	Very high	94.2	Very high	90 Å²	90	45.7 Å²	45.7	39%	0.391	22%	0.218	S	C	.	.	H	α-helix	trans	-65.7	-43.6	172.6	-171	-175.7	-167.3	-172.3	0	112.5	N211 E212 L213 D218 S219 W351	N211-K215 VanDerWaalsContact O-CB 3.31Å; N211-K215 WeakPolarHBondContact O-CB 3.46Å; N211-K215 PolarHBondContact O-N 2.85Å; N211-K215 VanDerWaalsContact O-N 3.08Å; E212-K215 WeakPolarHBondContact O-CB 3.45Å; E212-K215 PolarHBondContact O-N 3.27Å; L213-K215 PolarHBondContact O-N 3Å; K215-D218 PolarHBondContact O-N 2.92Å; K215-S219 WeakPolarHBondContact O-CB 3.49Å; K215-S219 PolarHBondContact O-N 3.4Å; K215-S219 PolarHBondContact O-OG 3.01Å; K215-W351 HydrophobicContact CD-CD2 4.05Å; K215-W351 HydrophobicContact CD-CE3 4.41Å; K215-W351 HydrophobicContact CD-CH2 4.05Å; K215-W351 HydrophobicContact CD-CZ2 3.7Å; K215-W351 HydrophobicContact CD-CZ3 4.4Å; K215-W351 VanDerWaalsContact CE-CE2 3.45Å; K215-W351 HydrophobicContact CG-CE3 4.4Å; K215-W351 HydrophobicContact CG-CH2 4.07Å; K215-W351 HydrophobicContact CG-CZ2 4.24Å; K215-W351 HydrophobicContact CG-CZ3 4.17Å; K215-W351 VanDerWaalsContact NZ-CE2 3.28Å; K215-W351 VanDerWaalsContact NZ-NE1 3.13Å
216	V	96.3	Very high	94.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.9	-49.3	174.3	174.2	0	0	0	0	109.7	E212 L213 D218 S219 S220 W351 I363 C365	E212-V216 WeakPolarHBondContact O-CG2 3.49Å; E212-V216 PolarHBondContact O-N 3.48Å; L213-V216 WeakPolarHBondContact O-CB 3.47Å; L213-V216 PolarHBondContact O-N 2.98Å; V216-D218 PolarHBondContact O-N 3.21Å; V216-S219 PolarHBondContact O-N 2.9Å; V216-S220 VanDerWaalsContact O-CB 3.31Å; V216-S220 WeakPolarHBondContact O-CB 3.49Å; V216-S220 PolarHBondContact O-N 2.96Å; V216-S220 PolarHBondContact O-OG 3.06Å; V216-S220 VanDerWaalsContact O-OG 3.06Å; V216-W351 HydrophobicContact CG2-CB 3.78Å; V216-W351 HydrophobicContact CG2-CD2 4.43Å; V216-W351 HydrophobicContact CG2-CE3 3.89Å; V216-W351 HydrophobicContact CG2-CG 4.41Å; V216-I363 HydrophobicContact CB-CG2 4.34Å; V216-I363 HydrophobicContact CG1-CB 4.3Å; V216-I363 HydrophobicContact CG1-CG2 3.88Å; V216-I363 HydrophobicContact CG2-CG2 3.8Å; V216-C365 HydrophobicContact CG1-CB 4.36Å; V216-C365 HydrophobicContact CG2-CB 4.01Å
217	L	96.2	Very high	95.2	Very high	1 Å²	1	40 Å²	40	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-63.3	-17.3	176.7	-68.4	-178.1	0	0	0	113.2	L213 Y214 V223 V240 F243 L244 K248 K251 V319	L213-L217 HydrophobicContact CD1-CD1 4.14Å; L213-L217 HydrophobicContact CD1-CG 4.06Å; L213-L217 HydrophobicContact CD2-CD1 4.33Å; L213-L217 HydrophobicContact CG-CD1 3.92Å; L213-L217 HydrophobicContact CG-CG 4.19Å; L213-L217 WeakPolarHBondContact O-CB 3.3Å; L213-L217 WeakPolarHBondContact O-CG 3Å; L213-L217 PolarHBondContact O-N 3.1Å; Y214-L217 HydrophobicContact CD1-CD1 4.3Å; Y214-L217 CarbonylContact O-C 3.49Å; L217-V223 HydrophobicContact CD2-CG1 4Å; L217-V223 HydrophobicContact CD2-CG2 3.84Å; L217-V240 HydrophobicContact CD1-CG1 4.02Å; L217-V240 HydrophobicContact CD2-CG1 4.31Å; L217-F243 HydrophobicContact CD1-CD1 4.24Å; L217-F243 HydrophobicContact CD1-CE1 4.21Å; L217-L244 HydrophobicContact CD2-CD1 4.39Å; L217-L244 HydrophobicContact CD2-CD2 4.3Å; L217-K248 PolarHBondContact O-NZ 3.37Å; L217-K248 VanDerWaalsContact O-NZ 3.16Å; L217-K251 WeakPolarHBondContact O-CD 3.41Å; L217-K251 VanDerWaalsContact O-CE 3.27Å; L217-K251 WeakPolarHBondContact O-CE 3.43Å; L217-K251 PolarHBondContact O-NZ 2.95Å; L217-V319 HydrophobicContact CD2-CG2 3.97Å
218	D	96	Very high	95.3	Very high	106 Å²	106	32.2 Å²	32.2	57%	0.567	15%	0.152	S	C	*	.	H	α-helix	trans	-90.5	-40.6	173.9	-159.1	45.6	0	0	0	112.2	Y214 K215 V216 S220 K248 K251	Y214-D218 WeakPolarHBondContact O-CB 3.45Å; Y214-D218 PolarHBondContact O-N 3.16Å; K215-D218 PolarHBondContact O-N 2.92Å; V216-D218 PolarHBondContact O-N 3.21Å; D218-S220 VanDerWaalsContact C-N 3.35Å; D218-S220 PolarHBondContact O-N 3.34Å; D218-K248 VanDerWaalsContact CA-NZ 3.26Å; D218-K248 IonicContact OD1-NZ 2.89Å; D218-K248 PolarHBondContact OD1-NZ 2.86Å; D218-K251 VanDerWaalsContact C-NZ 3.31Å; D218-K251 PolarHBondContact O-NZ 2.81Å
219	S	95.3	Very high	95.5	Very high	37 Å²	37	26.7 Å²	26.7	26%	0.259	13%	0.131	S	C	.	.	H	α-helix	trans	-76.6	-20.9	-178.5	-52.6	0	0	0	0	113.6	K215 V216 S315 Y353	K215-S219 WeakPolarHBondContact O-CB 3.49Å; K215-S219 PolarHBondContact O-N 3.4Å; K215-S219 PolarHBondContact O-OG 3.01Å; V216-S219 PolarHBondContact O-N 2.9Å; S219-S315 VanDerWaalsContact O-CB 3.27Å; S219-S315 WeakPolarHBondContact O-CB 3.31Å; S219-Y353 WeakPolarHBondContact CB-OH 3.39Å
220	S	95.2	Very high	95.5	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.128	C	C	.	.			trans	-83.1	145.4	179.5	64.3	0	0	0	0	113	V216 D218 V222 V223 K251	V216-S220 VanDerWaalsContact O-CB 3.31Å; V216-S220 WeakPolarHBondContact O-CB 3.49Å; V216-S220 PolarHBondContact O-N 2.96Å; V216-S220 PolarHBondContact O-OG 3.06Å; V216-S220 VanDerWaalsContact O-OG 3.06Å; D218-S220 VanDerWaalsContact C-N 3.35Å; D218-S220 PolarHBondContact O-N 3.34Å; S220-V222 WeakPolarHBondContact CB-O 3.36Å; S220-V223 WeakPolarHBondContact OG-CG2 3.27Å; S220-K251 WeakPolarHBondContact O-CE 3.49Å; S220-K251 PolarHBondContact O-NZ 2.87Å
221	D	93.6	Very high	95.6	Very high	20 Å²	20	25.6 Å²	25.6	11%	0.107	13%	0.127	C	C	.	.	S	Bend	trans	-96.1	-31.2	167.3	-57.4	-64.9	0	0	0	110.9	H252 R311 I314 S315	D221-H252 PolarHBondContact O-N 3.47Å; D221-R311 IonicContact OD1-CZ 2.64Å; D221-R311 VanDerWaalsContact OD1-CZ 3.3Å; D221-R311 IonicContact OD1-NE 3.71Å; D221-R311 IonicContact OD1-NH1 3.7Å; D221-R311 PolarHBondContact OD1-NH1 3.35Å; D221-R311 IonicContact OD1-NH2 3.74Å; D221-I314 HydrophobicContact CB-CG2 3.96Å; D221-I314 WeakPolarHBondContact OD2-CA 3.37Å; D221-S315 PolarHBondContact N-O 3.27Å; D221-S315 PolarHBondContact OD2-N 3.28Å
222	V	94	Very high	95.6	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	132.9	176.8	-176.8	0	0	0	0	108.2	S220 L224 H252 L254 L304 I314 S315 V316 G317	S220-V222 WeakPolarHBondContact CB-O 3.36Å; V222-L224 HydrophobicContact CG1-CD2 4.27Å; V222-H252 CarbonylContact C-O 3.32Å; V222-H252 WeakPolarHBondContact CA-O 3.34Å; V222-H252 HydrophobicContact CG1-CB 4.3Å; V222-H252 HydrophobicContact CG2-CB 4.28Å; V222-L254 HydrophobicContact CG1-CD1 3.46Å; V222-L254 VanDerWaalsContact CG1-CD1 3.46Å; V222-L304 HydrophobicContact CG1-CD1 3.85Å; V222-L304 HydrophobicContact CG2-CB 4.41Å; V222-L304 HydrophobicContact CG2-CD1 3.8Å; V222-I314 HydrophobicContact CG2-CG2 4.22Å; V222-S315 PolarHBondContact N-O 3.4Å; V222-V316 HydrophobicContact CB-CG1 4.37Å; V222-V316 HydrophobicContact CB-CG2 4.3Å; V222-V316 HydrophobicContact CG1-CG1 4.37Å; V222-V316 CarbonylContact O-C 3.56Å; V222-V316 VanDerWaalsContact O-CA 3.31Å; V222-V316 WeakPolarHBondContact O-CA 3.49Å; V222-G317 PolarHBondContact O-N 3.4Å
223	V	96.3	Very high	95.5	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.006	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	121.4	175.1	-179.4	0	0	0	0	108.2	L217 S220 L244 H252 L253 L254 G317 V319	L217-V223 HydrophobicContact CD2-CG1 4Å; L217-V223 HydrophobicContact CD2-CG2 3.84Å; S220-V223 WeakPolarHBondContact OG-CG2 3.27Å; V223-L244 HydrophobicContact CB-CD1 4.24Å; V223-L244 HydrophobicContact CG1-CD1 4.17Å; V223-L244 HydrophobicContact CG2-CD1 4.22Å; V223-H252 PolarHBondContact N-O 3.04Å; V223-L253 HydrophobicContact CB-CD1 4.21Å; V223-L253 HydrophobicContact CG1-CD1 4.02Å; V223-L253 WeakPolarHBondContact O-CA 3.48Å; V223-L254 PolarHBondContact O-N 2.86Å; V223-G317 WeakPolarHBondContact CA-O 3.32Å; V223-V319 HydrophobicContact CG1-CB 4.3Å; V223-V319 HydrophobicContact CG1-CG2 3.94Å
224	L	97	Very high	95.3	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	113.3	171	-60.6	-178.5	0	0	0	108.2	V222 L254 V256 L297 V316 G317 F318 V319	V222-L224 HydrophobicContact CG1-CD2 4.27Å; L224-L254 WeakPolarHBondContact CA-O 3.47Å; L224-L254 HydrophobicContact CD2-CB 3.72Å; L224-L254 HydrophobicContact CD2-CD1 3.99Å; L224-L254 HydrophobicContact CD2-CG 4.3Å; L224-V256 HydrophobicContact CB-CG2 4.25Å; L224-V256 HydrophobicContact CD1-CG2 4.47Å; L224-V256 HydrophobicContact CD2-CG2 4.36Å; L224-L297 HydrophobicContact CD1-CD1 3.99Å; L224-L297 HydrophobicContact CD1-CD2 4.48Å; L224-L297 HydrophobicContact CD2-CD1 4.48Å; L224-V316 HydrophobicContact CD1-CG1 3.56Å; L224-V316 HydrophobicContact CG-CG1 3.65Å; L224-G317 PolarHBondContact N-O 3.49Å; L224-F318 HydrophobicContact CB-CD1 4.24Å; L224-F318 HydrophobicContact CB-CE1 4.38Å; L224-F318 HydrophobicContact CD1-CD1 4.31Å; L224-F318 HydrophobicContact CD1-CE1 3.66Å; L224-F318 HydrophobicContact CD1-CE2 4.39Å; L224-F318 HydrophobicContact CD1-CZ 3.71Å; L224-F318 WeakPolarHBondContact O-CA 3.44Å; L224-V319 PolarHBondContact O-N 3.3Å
225	E	97.1	Very high	95.2	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.005	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	115.5	172	-179.2	167.5	-176.8	0	0	109.4	L227 C237 L253 L254 L255 V256 V319	E225-L227 HydrophobicContact CG-CD2 4.03Å; E225-C237 WeakPolarHBondContact OE1-CB 3.31Å; E225-C237 PolarHBondContact OE1-N 3.06Å; E225-L253 HydrophobicContact CB-CD1 4.17Å; E225-L254 PolarHBondContact N-O 3.49Å; E225-L255 HydrophobicContact CB-CD2 3.84Å; E225-L255 HydrophobicContact CG-CD2 4.2Å; E225-L255 CarbonylContact O-C 3.58Å; E225-L255 WeakPolarHBondContact O-CA 3.49Å; E225-V256 PolarHBondContact O-N 3.29Å; E225-V319 WeakPolarHBondContact CA-O 3.4Å
226	V	97.4	Very high	95	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	120.3	-177.5	-175.7	0	0	0	0	109.2	V256 N258 F318 V319 V324 K326 I329	V226-V256 WeakPolarHBondContact CA-O 3.34Å; V226-V256 HydrophobicContact CG2-CB 4.45Å; V226-N258 HydrophobicContact CG1-CB 3.89Å; V226-F318 HydrophobicContact CG2-CD1 3.86Å; V226-V319 PolarHBondContact N-O 3.19Å; V226-V324 HydrophobicContact CB-CG2 3.87Å; V226-V324 HydrophobicContact CG1-CB 4.1Å; V226-V324 HydrophobicContact CG1-CG2 3.71Å; V226-K326 HydrophobicContact CB-CG 4.1Å; V226-K326 HydrophobicContact CG2-CG 4.02Å; V226-I329 HydrophobicContact CB-CD1 4.27Å; V226-I329 HydrophobicContact CG1-CD1 3.45Å; V226-I329 VanDerWaalsContact CG1-CD1 3.45Å; V226-I329 HydrophobicContact CG2-CD1 3.73Å
227	L	97	Very high	94.8	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	148.7	178.8	-55.3	179.4	0	0	0	110.1	E225 P232 T235 R236 L255 V256 L257 N258 L275	E225-L227 HydrophobicContact CG-CD2 4.03Å; L227-P232 HydrophobicContact CB-CB 4.28Å; L227-P232 HydrophobicContact CD1-CB 4.2Å; L227-T235 WeakPolarHBondContact CD2-O 3.28Å; L227-R236 HydrophobicContact CD2-CB 3.9Å; L227-R236 HydrophobicContact CD2-CG 4.23Å; L227-L255 HydrophobicContact CD1-CB 4.44Å; L227-L255 HydrophobicContact CD1-CD1 4.27Å; L227-L255 HydrophobicContact CD1-CD2 4.32Å; L227-V256 PolarHBondContact N-O 3.43Å; L227-L257 HydrophobicContact CB-CD1 4.24Å; L227-N258 PolarHBondContact O-N 3.4Å; L227-L275 HydrophobicContact CD1-CD1 4.11Å
228	D	95.8	Very high	94.6	Very high	9 Å²	9	19.3 Å²	19.3	5%	0.048	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	123.2	168.3	-165.4	-40.4	0	0	0	108	R230 D231 P232 T235 K259 V324	D228-R230 PolarHBondContact O-N 2.65Å; D228-R230 IonicContact OD1-CZ 3.32Å; D228-R230 PolarHBondContact OD1-N 2.95Å; D228-R230 IonicContact OD1-NE 3.11Å; D228-R230 PolarHBondContact OD1-NE 3.43Å; D228-R230 IonicContact OD1-NH2 3.96Å; D228-R230 IonicContact OD2-CZ 3.87Å; D228-R230 IonicContact OD2-NE 3.76Å; D228-R230 PolarHBondContact OD2-NE 3.35Å; D228-R230 IonicContact OD2-NH2 2.63Å; D228-R230 PolarHBondContact OD2-NH2 3.02Å; D228-D231 CarbonylContact O-C 3.46Å; D228-D231 VanDerWaalsContact O-C 3.31Å; D228-D231 PolarHBondContact O-N 3.4Å; D228-P232 WeakPolarHBondContact O-CA 3.47Å; D228-T235 HydrophobicContact CB-CG2 3.95Å; D228-T235 PolarHBondContact N-OG1 3.27Å; D228-T235 VanDerWaalsContact N-OG1 3.08Å; D228-K259 WeakPolarHBondContact OD2-CE 3.39Å; D228-K259 IonicContact OD2-NZ 3.81Å; D228-K259 PolarHBondContact OD2-NZ 3.4Å; D228-V324 HydrophobicContact CB-CG1 4.43Å
229	A	95.8	Very high	94.5	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-25.4	-175.9	0	0	0	0	0	112.8	D231 P232 L257 N258 V260 I263	A229-D231 VanDerWaalsContact C-N 3.34Å; A229-P232 WeakPolarHBondContact O-CD 3.27Å; A229-L257 HydrophobicContact CB-CD1 4.07Å; A229-L257 HydrophobicContact CB-CD2 4.2Å; A229-L257 HydrophobicContact CB-CG 3.74Å; A229-N258 WeakPolarHBondContact CB-O 3.13Å; A229-N258 PolarHBondContact N-O 2.72Å; A229-V260 HydrophobicContact CB-CG1 4.19Å; A229-I263 HydrophobicContact CB-CD1 3.35Å; A229-I263 HydrophobicContact CB-CG1 4.45Å; A229-I263 WeakPolarHBondContact O-CD1 3.31Å
230	R	94.3	Very high	94.4	Very high	7 Å²	7	15.5 Å²	15.5	3%	0.026	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-33.7	-172.7	-65.4	175.3	-68	171.7	5.9	112.2	D228 L262 I263 F454 Q455 Y461 V463	D228-R230 PolarHBondContact O-N 2.65Å; D228-R230 IonicContact OD1-CZ 3.32Å; D228-R230 PolarHBondContact OD1-N 2.95Å; D228-R230 IonicContact OD1-NE 3.11Å; D228-R230 PolarHBondContact OD1-NE 3.43Å; D228-R230 IonicContact OD1-NH2 3.96Å; D228-R230 IonicContact OD2-CZ 3.87Å; D228-R230 IonicContact OD2-NE 3.76Å; D228-R230 PolarHBondContact OD2-NE 3.35Å; D228-R230 IonicContact OD2-NH2 2.63Å; D228-R230 PolarHBondContact OD2-NH2 3.02Å; R230-L262 HydrophobicContact CG-CB 4.14Å; R230-L262 HydrophobicContact CG-CD1 4.4Å; R230-I263 HydrophobicContact CB-CD1 4.23Å; R230-I263 HydrophobicContact CG-CD1 3.9Å; R230-I263 HydrophobicContact CG-CG1 3.95Å; R230-F454 PolarHBondContact NH1-O 3.33Å; R230-F454 VanDerWaalsContact NH1-O 3.16Å; R230-Q455 PolarHBondContact NH1-O 3.36Å; R230-Y461 HydrophobicContact CB-CE2 3.85Å; R230-Y461 VanDerWaalsContact NH1-CE1 3.34Å; R230-V463 WeakPolarHBondContact O-CB 3.49Å; R230-V463 PolarHBondContact O-N 3.02Å
231	D	93.8	Very high	94.3	Very high	22 Å²	22	15.9 Å²	15.9	12%	0.118	8%	0.082	C	C	.	.	S	Bend	trans	-149.7	75.4	177.7	179.2	13.6	0	0	0	108.3	D228 A229 M233 G234 T235 V463	D228-D231 CarbonylContact O-C 3.46Å; D228-D231 VanDerWaalsContact O-C 3.31Å; D228-D231 PolarHBondContact O-N 3.4Å; A229-D231 VanDerWaalsContact C-N 3.34Å; D231-M233 VanDerWaalsContact C-N 3.33Å; D231-M233 PolarHBondContact O-N 3.29Å; D231-G234 PolarHBondContact O-N 3.48Å; D231-G234 WeakPolarHBondContact OD1-CA 3.28Å; D231-G234 PolarHBondContact OD1-N 3.29Å; D231-G234 WeakPolarHBondContact OD2-CA 3.37Å; D231-T235 PolarHBondContact O-N 2.92Å; D231-T235 VanDerWaalsContact O-N 3.09Å; D231-T235 PolarHBondContact O-OG1 2.9Å; D231-V463 HydrophobicContact CB-CG2 3.92Å
232	P	94.7	Very high	94.3	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-36.9	-175.5	24.1	-30	0	0	0	111.1	L227 D228 A229 T235 R236 L257 W271 L275	L227-P232 HydrophobicContact CB-CB 4.28Å; L227-P232 HydrophobicContact CD1-CB 4.2Å; D228-P232 WeakPolarHBondContact O-CA 3.47Å; A229-P232 WeakPolarHBondContact O-CD 3.27Å; P232-T235 PolarHBondContact O-N 2.86Å; P232-T235 PolarHBondContact O-OG1 3Å; P232-R236 VanDerWaalsContact O-CB 3.3Å; P232-R236 WeakPolarHBondContact O-CB 3.41Å; P232-R236 PolarHBondContact O-N 3.18Å; P232-R236 VanDerWaalsContact O-N 3.08Å; P232-L257 HydrophobicContact CB-CD1 3.73Å; P232-L257 HydrophobicContact CG-CD1 4.3Å; P232-W271 HydrophobicContact CG-CD2 3.37Å; P232-W271 HydrophobicContact CG-CE3 3.43Å; P232-W271 VanDerWaalsContact CG-CE3 3.43Å; P232-W271 HydrophobicContact CG-CG 4.01Å; P232-W271 HydrophobicContact CG-CH2 3.78Å; P232-W271 HydrophobicContact CG-CZ2 3.72Å; P232-W271 HydrophobicContact CG-CZ3 3.64Å; P232-L275 HydrophobicContact CB-CD1 4.24Å
233	M	92.4	Very high	94.4	Very high	71 Å²	71	25.3 Å²	25.3	35%	0.35	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-40.6	178.3	-65.3	-58.6	-74.5	0	0	111.8	D231 T235 R236 F238 W271 L275	D231-M233 VanDerWaalsContact C-N 3.33Å; D231-M233 PolarHBondContact O-N 3.29Å; M233-T235 VanDerWaalsContact C-N 3.32Å; M233-T235 PolarHBondContact O-N 3.16Å; M233-R236 PolarHBondContact O-N 2.64Å; M233-F238 HydrophobicContact CE-CZ 3.81Å; M233-W271 HydrophobicContact CG-CH2 3.93Å; M233-W271 HydrophobicContact CG-CZ3 3.8Å; M233-L275 HydrophobicContact SD-CD2 4.49Å
234	G	91	Very high	94.2	Very high	16 Å²	16	25.7 Å²	25.7	17%	0.165	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-23.5	176.4	0	0	0	0	0	114.2	D231 K382	D231-G234 PolarHBondContact O-N 3.48Å; D231-G234 WeakPolarHBondContact OD1-CA 3.28Å; D231-G234 PolarHBondContact OD1-N 3.29Å; D231-G234 WeakPolarHBondContact OD2-CA 3.37Å; G234-K382 WeakPolarHBondContact O-CE 3.27Å; G234-K382 PolarHBondContact O-NZ 2.87Å
235	T	93.2	Very high	93.9	Very high	5 Å²	5	31.9 Å²	31.9	3%	0.031	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	7.5	177.7	57.7	0	0	0	0	114	L227 D228 D231 P232 M233 F321	L227-T235 WeakPolarHBondContact CD2-O 3.28Å; D228-T235 HydrophobicContact CB-CG2 3.95Å; D228-T235 PolarHBondContact N-OG1 3.27Å; D228-T235 VanDerWaalsContact N-OG1 3.08Å; D231-T235 PolarHBondContact O-N 2.92Å; D231-T235 VanDerWaalsContact O-N 3.09Å; D231-T235 PolarHBondContact O-OG1 2.9Å; P232-T235 PolarHBondContact O-N 2.86Å; P232-T235 PolarHBondContact O-OG1 3Å; M233-T235 VanDerWaalsContact C-N 3.32Å; M233-T235 PolarHBondContact O-N 3.16Å; T235-F321 WeakPolarHBondContact O-CD2 3.46Å; T235-F321 WeakPolarHBondContact O-CE2 3.41Å
236	R	93	Very high	93.5	Very high	10 Å²	10	39.6 Å²	39.6	4%	0.038	19%	0.185	C	C	.	.			trans	-88.4	142.3	177.5	-168.7	167.1	-179.4	-160.7	-11.6	112.1	L227 P232 M233 F238 E241 E278 Y279	L227-R236 HydrophobicContact CD2-CB 3.9Å; L227-R236 HydrophobicContact CD2-CG 4.23Å; P232-R236 VanDerWaalsContact O-CB 3.3Å; P232-R236 WeakPolarHBondContact O-CB 3.41Å; P232-R236 PolarHBondContact O-N 3.18Å; P232-R236 VanDerWaalsContact O-N 3.08Å; M233-R236 PolarHBondContact O-N 2.64Å; R236-F238 HydrophobicContact CB-CE2 4.38Å; R236-F238 HydrophobicContact CB-CZ 4.41Å; R236-F238 HydrophobicContact CG-CD1 4.5Å; R236-F238 HydrophobicContact CG-CE1 4.2Å; R236-F238 HydrophobicContact CG-CE2 4.46Å; R236-F238 HydrophobicContact CG-CZ 4.18Å; R236-E241 WeakPolarHBondContact CG-OE1 3.49Å; R236-E241 IonicContact CZ-OE1 3.86Å; R236-E241 IonicContact CZ-OE2 3.95Å; R236-E241 IonicContact NE-OE1 2.69Å; R236-E241 PolarHBondContact NE-OE1 2.68Å; R236-E241 IonicContact NE-OE2 2.84Å; R236-E241 IonicContact NH2-OE1 3.6Å; R236-E241 PolarHBondContact NH2-OE1 2.73Å; R236-E241 VanDerWaalsContact NH2-OE1 3.15Å; R236-E241 IonicContact NH2-OE2 2.76Å; R236-E241 PolarHBondContact NH2-OE2 2.82Å; R236-E278 IonicContact CZ-OE1 3.82Å; R236-E278 IonicContact CZ-OE2 3.25Å; R236-E278 VanDerWaalsContact NH1-CD 3.32Å; R236-E278 IonicContact NH1-OE1 2.87Å; R236-E278 PolarHBondContact NH1-OE1 3.1Å; R236-E278 IonicContact NH1-OE2 3.41Å; R236-E278 PolarHBondContact NH1-OE2 2.83Å; R236-E278 VanDerWaalsContact NH1-OE2 3.14Å; R236-E278 IonicContact NH2-OE1 2.71Å; R236-E278 IonicContact NH2-OE2 2.99Å; R236-E278 PolarHBondContact NH2-OE2 3.06Å; R236-Y279 VanDerWaalsContact NH2-CE2 3.34Å
237	C	91.6	Very high	93.1	Very high	6 Å²	6	44.8 Å²	44.8	4%	0.041	21%	0.209	C	C	.	.			trans	-110.4	71.8	-176.3	-66.8	0	0	0	0	111.5	E225 N239 V240 E241 F321 I368	E225-C237 WeakPolarHBondContact OE1-CB 3.31Å; E225-C237 PolarHBondContact OE1-N 3.06Å; C237-N239 PolarHBondContact O-N 3.35Å; C237-V240 HydrophobicContact CB-CB 4.21Å; C237-V240 HydrophobicContact CB-CG2 4.08Å; C237-V240 PolarHBondContact O-N 3.5Å; C237-E241 PolarHBondContact O-N 2.92Å; C237-F321 WeakPolarHBondContact SG-CE2 3.39Å; C237-I368 HydrophobicContact CB-CD1 4.44Å
238	F	93.2	Very high	92.8	Very high	94 Å²	94	46.1 Å²	46.1	41%	0.412	22%	0.215	S	C	.	.	H	α-helix	trans	-50.5	-33.7	-179.6	-64	-72	0	0	0	114.4	M233 R236 V240 E241 K242	M233-F238 HydrophobicContact CE-CZ 3.81Å; R236-F238 HydrophobicContact CB-CE2 4.38Å; R236-F238 HydrophobicContact CB-CZ 4.41Å; R236-F238 HydrophobicContact CG-CD1 4.5Å; R236-F238 HydrophobicContact CG-CE1 4.2Å; R236-F238 HydrophobicContact CG-CE2 4.46Å; R236-F238 HydrophobicContact CG-CZ 4.18Å; F238-V240 PolarHBondContact O-N 3.23Å; F238-E241 WeakPolarHBondContact O-CB 3.34Å; F238-E241 PolarHBondContact O-N 2.82Å; F238-K242 WeakPolarHBondContact O-CB 3.28Å; F238-K242 PolarHBondContact O-N 2.97Å
239	N	92.7	Very high	92.3	Very high	57 Å²	57	48.7 Å²	48.7	31%	0.305	23%	0.232	S	C	.	.	H	α-helix	trans	-66.7	-36.5	179.7	-62	54.3	0	0	0	112.4	C237 F243 Y370	C237-N239 PolarHBondContact O-N 3.35Å; N239-F243 VanDerWaalsContact O-CB 3.31Å; N239-F243 WeakPolarHBondContact O-CB 3.26Å; N239-F243 PolarHBondContact O-N 2.99Å; N239-Y370 HydrophobicContact CB-CD1 4.48Å; N239-Y370 HydrophobicContact CB-CD2 3.4Å; N239-Y370 VanDerWaalsContact CB-CD2 3.4Å; N239-Y370 HydrophobicContact CB-CE1 4.44Å; N239-Y370 HydrophobicContact CB-CE2 3.39Å; N239-Y370 HydrophobicContact CB-CG 4.03Å; N239-Y370 WeakPolarHBondContact ND2-CD1 3.39Å; N239-Y370 WeakPolarHBondContact ND2-CE1 3.42Å; N239-Y370 WeakPolarHBondContact ND2-CE2 3.4Å; N239-Y370 PolarHBondContact ND2-OH 3.02Å
240	V	93.1	Very high	91.9	Very high	7 Å²	7	52.8 Å²	52.8	4%	0.042	25%	0.251	C	S	.	.	H	α-helix	trans	-69.9	-39.7	175.4	176.3	0	0	0	0	109.8	L213 L217 C237 F238 F243 L244 V319 I368	L213-V240 HydrophobicContact CD2-CG2 4.12Å; L217-V240 HydrophobicContact CD1-CG1 4.02Å; L217-V240 HydrophobicContact CD2-CG1 4.31Å; C237-V240 HydrophobicContact CB-CB 4.21Å; C237-V240 HydrophobicContact CB-CG2 4.08Å; C237-V240 PolarHBondContact O-N 3.5Å; F238-V240 PolarHBondContact O-N 3.23Å; V240-F243 PolarHBondContact O-N 2.81Å; V240-L244 HydrophobicContact CG1-CD1 4.16Å; V240-L244 HydrophobicContact CG1-CG 4.46Å; V240-L244 WeakPolarHBondContact O-CB 3.37Å; V240-L244 WeakPolarHBondContact O-CG 3.41Å; V240-L244 PolarHBondContact O-N 2.76Å; V240-V319 HydrophobicContact CG1-CG1 4.48Å; V240-I368 HydrophobicContact CG2-CD1 3.73Å
241	E	94	Very high	91.7	Very high	7 Å²	7	53.4 Å²	53.4	3%	0.033	25%	0.254	C	S	.	.	H	α-helix	trans	-62.8	-47	175.3	-55.9	-173.3	-162.6	0	0	112.2	R236 C237 F238 F243 L244 K245 L253 Y279	R236-E241 WeakPolarHBondContact CG-OE1 3.49Å; R236-E241 IonicContact CZ-OE1 3.86Å; R236-E241 IonicContact CZ-OE2 3.95Å; R236-E241 IonicContact NE-OE1 2.69Å; R236-E241 PolarHBondContact NE-OE1 2.68Å; R236-E241 IonicContact NE-OE2 2.84Å; R236-E241 IonicContact NH2-OE1 3.6Å; R236-E241 PolarHBondContact NH2-OE1 2.73Å; R236-E241 VanDerWaalsContact NH2-OE1 3.15Å; R236-E241 IonicContact NH2-OE2 2.76Å; R236-E241 PolarHBondContact NH2-OE2 2.82Å; C237-E241 PolarHBondContact O-N 2.92Å; F238-E241 WeakPolarHBondContact O-CB 3.34Å; F238-E241 PolarHBondContact O-N 2.82Å; E241-F243 VanDerWaalsContact C-N 3.3Å; E241-F243 PolarHBondContact O-N 2.84Å; E241-L244 PolarHBondContact O-N 3.2Å; E241-K245 WeakPolarHBondContact O-CB 3.19Å; E241-K245 WeakPolarHBondContact O-CG 3.37Å; E241-K245 PolarHBondContact O-N 2.81Å; E241-L253 HydrophobicContact CB-CD2 4.17Å; E241-L253 HydrophobicContact CG-CD2 3.85Å; E241-Y279 WeakPolarHBondContact OE2-CE2 3.43Å; E241-Y279 PolarHBondContact OE2-OH 2.94Å; E241-Y279 VanDerWaalsContact OE2-OH 3.05Å
242	K	93.8	Very high	91.6	Very high	162 Å²	162	52.7 Å²	52.7	70%	0.704	25%	0.25	S	C	*	.	H	α-helix	trans	-59.6	-42.7	176.1	-173.6	177.4	-179.2	179	0	111	F238 K246	F238-K242 WeakPolarHBondContact O-CB 3.28Å; F238-K242 PolarHBondContact O-N 2.97Å; K242-K246 WeakPolarHBondContact O-CB 3.48Å; K242-K246 PolarHBondContact O-N 2.89Å
243	F	94.7	Very high	91.5	Very high	57 Å²	57	53.4 Å²	53.4	25%	0.25	25%	0.253	C	S	.	.	H	α-helix	trans	-62	-46.2	174.8	173	-98.8	0	0	0	112	Y214 L217 N239 V240 E241 K246 E247 K248	Y214-F243 AromaticContact CD1-CE1 3.95Å; Y214-F243 HydrophobicContact CD1-CE1 3.95Å; Y214-F243 AromaticContact CD1-CZ 3.9Å; Y214-F243 HydrophobicContact CD1-CZ 3.9Å; Y214-F243 HydrophobicContact CE1-CD1 4.14Å; Y214-F243 HydrophobicContact CE1-CD2 4.3Å; Y214-F243 AromaticContact CE1-CE1 3.76Å; Y214-F243 HydrophobicContact CE1-CE1 3.76Å; Y214-F243 AromaticContact CE1-CE2 3.94Å; Y214-F243 HydrophobicContact CE1-CE2 3.94Å; Y214-F243 HydrophobicContact CE1-CG 4.39Å; Y214-F243 AromaticContact CE1-CZ 3.66Å; Y214-F243 HydrophobicContact CE1-CZ 3.66Å; L217-F243 HydrophobicContact CD1-CD1 4.24Å; L217-F243 HydrophobicContact CD1-CE1 4.21Å; N239-F243 VanDerWaalsContact O-CB 3.31Å; N239-F243 WeakPolarHBondContact O-CB 3.26Å; N239-F243 PolarHBondContact O-N 2.99Å; V240-F243 PolarHBondContact O-N 2.81Å; E241-F243 VanDerWaalsContact C-N 3.3Å; E241-F243 PolarHBondContact O-N 2.84Å; F243-K246 PolarHBondContact O-N 2.95Å; F243-E247 HydrophobicContact CD2-CB 4.28Å; F243-E247 HydrophobicContact CD2-CG 3.77Å; F243-E247 HydrophobicContact CE2-CB 3.97Å; F243-E247 HydrophobicContact CE2-CG 3.62Å; F243-E247 HydrophobicContact CZ-CB 4.2Å; F243-E247 HydrophobicContact CZ-CG 4.35Å; F243-E247 WeakPolarHBondContact O-CB 3.26Å; F243-E247 PolarHBondContact O-N 3.32Å; F243-K248 HydrophobicContact CE1-CD 4.07Å; F243-K248 HydrophobicContact CZ-CD 4.49Å
244	L	93.2	Very high	91.6	Very high	9 Å²	9	50.2 Å²	50.2	5%	0.047	24%	0.238	C	C	.	.	H	α-helix	trans	-63.8	-43.4	178.1	-75	174.3	0	0	0	112.1	L217 V223 V240 E241 K246 K248 K251 L253	L217-L244 HydrophobicContact CD2-CD1 4.39Å; L217-L244 HydrophobicContact CD2-CD2 4.3Å; V223-L244 HydrophobicContact CB-CD1 4.24Å; V223-L244 HydrophobicContact CG1-CD1 4.17Å; V223-L244 HydrophobicContact CG2-CD1 4.22Å; V240-L244 HydrophobicContact CG1-CD1 4.16Å; V240-L244 HydrophobicContact CG1-CG 4.46Å; V240-L244 WeakPolarHBondContact O-CB 3.37Å; V240-L244 WeakPolarHBondContact O-CG 3.41Å; V240-L244 PolarHBondContact O-N 2.76Å; E241-L244 PolarHBondContact O-N 3.2Å; L244-K246 PolarHBondContact O-N 3.44Å; L244-K248 HydrophobicContact CD2-CB 4.01Å; L244-K248 HydrophobicContact CD2-CD 4.35Å; L244-K248 CarbonylContact O-C 3.59Å; L244-K248 VanDerWaalsContact O-CA 3.31Å; L244-K248 WeakPolarHBondContact O-CA 3.45Å; L244-K248 PolarHBondContact O-N 3.01Å; L244-K251 HydrophobicContact CD2-CD 4.32Å; L244-L253 HydrophobicContact CD1-CD1 4.14Å; L244-L253 HydrophobicContact CD1-CD2 4.46Å
245	K	89.1	Confident	91.8	Very high	130 Å²	130	49.4 Å²	49.4	57%	0.565	23%	0.23	S	C	*	.	H	α-helix	trans	-60.7	-42	176.3	-79.7	176	162.2	166	0	112.4	E241 Y279	E241-K245 WeakPolarHBondContact O-CB 3.19Å; E241-K245 WeakPolarHBondContact O-CG 3.37Å; E241-K245 PolarHBondContact O-N 2.81Å; K245-Y279 WeakPolarHBondContact CE-OH 3.42Å; K245-Y279 PolarHBondContact NZ-OH 2.98Å
246	K	88.8	Confident	92	Very high	163 Å²	163	49.2 Å²	49.2	71%	0.709	23%	0.229	S	C	*	.	H	α-helix	trans	-78.2	-53.2	-177.7	-174	-179.9	173.6	179.3	0	112.9	K242 F243 L244	K242-K246 WeakPolarHBondContact O-CB 3.48Å; K242-K246 PolarHBondContact O-N 2.89Å; F243-K246 PolarHBondContact O-N 2.95Å; L244-K246 PolarHBondContact O-N 3.44Å
247	E	90.1	Very high	92.2	Very high	109 Å²	109	48.7 Å²	48.7	51%	0.509	23%	0.227	S	C	.	.	H	α-helix	trans	-95.9	-30	-167.9	-60.5	-61.4	142.6	0	0	113	F243 P249	F243-E247 HydrophobicContact CD2-CB 4.28Å; F243-E247 HydrophobicContact CD2-CG 3.77Å; F243-E247 HydrophobicContact CE2-CB 3.97Å; F243-E247 HydrophobicContact CE2-CG 3.62Å; F243-E247 HydrophobicContact CZ-CB 4.2Å; F243-E247 HydrophobicContact CZ-CG 4.35Å; F243-E247 WeakPolarHBondContact O-CB 3.26Å; F243-E247 PolarHBondContact O-N 3.32Å; E247-P249 VanDerWaalsContact C-CD 3.42Å
248	K	89.8	Confident	92.4	Very high	28 Å²	28	48.7 Å²	48.7	12%	0.122	23%	0.226	C	C	.	.			trans	-132.5	52.1	-170.2	-68	176.5	165.1	-171.9	0	113.2	L217 D218 F243 L244 H250 K251	L217-K248 PolarHBondContact O-NZ 3.37Å; L217-K248 VanDerWaalsContact O-NZ 3.16Å; D218-K248 VanDerWaalsContact CA-NZ 3.26Å; D218-K248 IonicContact OD1-NZ 2.89Å; D218-K248 PolarHBondContact OD1-NZ 2.86Å; F243-K248 HydrophobicContact CE1-CD 4.07Å; F243-K248 HydrophobicContact CZ-CD 4.49Å; L244-K248 HydrophobicContact CD2-CB 4.01Å; L244-K248 HydrophobicContact CD2-CD 4.35Å; L244-K248 CarbonylContact O-C 3.59Å; L244-K248 VanDerWaalsContact O-CA 3.31Å; L244-K248 WeakPolarHBondContact O-CA 3.45Å; L244-K248 PolarHBondContact O-N 3.01Å; K248-H250 PolarHBondContact O-N 2.95Å; K248-K251 HydrophobicContact CB-CD 3.98Å; K248-K251 HydrophobicContact CB-CG 4.14Å; K248-K251 HydrophobicContact CD-CD 4.01Å; K248-K251 HydrophobicContact CG-CD 4.42Å; K248-K251 PolarHBondContact O-N 3.45Å
249	P	86.2	Confident	92.5	Very high	63 Å²	63	45.9 Å²	45.9	41%	0.409	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-14.2	-176.7	24.3	-34	0	0	0	114.5	Q118 E247 K251	Q118-P249 VanDerWaalsContact NE2-C 3.33Å; Q118-P249 PolarHBondContact NE2-O 3.42Å; Q118-P249 PolarHBondContact OE1-O 2.95Å; E247-P249 VanDerWaalsContact C-CD 3.42Å; P249-K251 VanDerWaalsContact C-N 3.27Å; P249-K251 PolarHBondContact O-N 3.1Å
250	H	86.9	Confident	92.6	Very high	86 Å²	86	43.1 Å²	43.1	40%	0.398	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-5.9	178.5	62.3	-88.7	0	0	0	113.4	K248	K248-H250 PolarHBondContact O-N 2.95Å
251	K	91.1	Very high	92.6	Very high	19 Å²	19	44 Å²	44	8%	0.083	20%	0.204	C	C	.	.	S	Bend	trans	-94.9	139	178.6	-60.4	-168.4	-178.1	-134.2	0	109.7	L217 D218 S220 L244 K248 P249	L217-K251 WeakPolarHBondContact O-CD 3.41Å; L217-K251 VanDerWaalsContact O-CE 3.27Å; L217-K251 WeakPolarHBondContact O-CE 3.43Å; L217-K251 PolarHBondContact O-NZ 2.95Å; D218-K251 VanDerWaalsContact C-NZ 3.31Å; D218-K251 PolarHBondContact O-NZ 2.81Å; S220-K251 WeakPolarHBondContact O-CE 3.49Å; S220-K251 PolarHBondContact O-NZ 2.87Å; L244-K251 HydrophobicContact CD2-CD 4.32Å; K248-K251 HydrophobicContact CB-CD 3.98Å; K248-K251 HydrophobicContact CB-CG 4.14Å; K248-K251 HydrophobicContact CD-CD 4.01Å; K248-K251 HydrophobicContact CG-CD 4.42Å; K248-K251 PolarHBondContact O-N 3.45Å; P249-K251 VanDerWaalsContact C-N 3.27Å; P249-K251 PolarHBondContact O-N 3.1Å
252	H	90.8	Very high	92.6	Very high	7 Å²	7	44.8 Å²	44.8	3%	0.032	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	122	-178.4	-56.5	-40.5	0	0	0	109.6	F114 D221 V222 V223 L254 H308	F114-H252 HydrophobicContact CD1-CB 4.38Å; F114-H252 AromaticContact CD1-CE1 3.76Å; F114-H252 AromaticContact CD1-CG 3.96Å; F114-H252 AromaticContact CD1-ND1 3.21Å; F114-H252 WeakPolarHBondContact CD1-ND1 3.44Å; F114-H252 HydrophobicContact CE1-CB 4.1Å; F114-H252 AromaticContact CE1-ND1 3.82Å; F114-H252 AromaticContact CG-CE1 3.88Å; F114-H252 AromaticContact CG-ND1 3.79Å; D221-H252 PolarHBondContact O-N 3.47Å; V222-H252 CarbonylContact C-O 3.32Å; V222-H252 WeakPolarHBondContact CA-O 3.34Å; V222-H252 HydrophobicContact CG1-CB 4.3Å; V222-H252 HydrophobicContact CG2-CB 4.28Å; V223-H252 PolarHBondContact N-O 3.04Å; H252-L254 HydrophobicContact CB-CD1 4.27Å; H252-H308 AromaticContact CD2-NE2 3.54Å; H252-H308 AromaticContact NE2-CE1 3.88Å; H252-H308 AromaticContact NE2-NE2 3.05Å; H252-H308 PolarHBondContact NE2-NE2 3.18Å
253	L	93.7	Very high	92.6	Very high	15 Å²	15	37 Å²	37	8%	0.079	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	128.2	176.1	179.5	61.5	0	0	0	109.6	V223 E225 E241 L244 Y279	V223-L253 HydrophobicContact CB-CD1 4.21Å; V223-L253 HydrophobicContact CG1-CD1 4.02Å; V223-L253 WeakPolarHBondContact O-CA 3.48Å; E225-L253 HydrophobicContact CB-CD1 4.17Å; E241-L253 HydrophobicContact CB-CD2 4.17Å; E241-L253 HydrophobicContact CG-CD2 3.85Å; L244-L253 HydrophobicContact CD1-CD1 4.14Å; L244-L253 HydrophobicContact CD1-CD2 4.46Å; L253-Y279 HydrophobicContact CB-CD1 4.31Å; L253-Y279 HydrophobicContact CB-CE1 4.29Å; L253-Y279 HydrophobicContact CD2-CD1 4.08Å; L253-Y279 HydrophobicContact CD2-CE1 3.59Å; L253-Y279 HydrophobicContact CD2-CE2 4.21Å; L253-Y279 HydrophobicContact CG-CD1 4.2Å; L253-Y279 HydrophobicContact CG-CE1 4.18Å
254	L	93.7	Very high	92.4	Very high	4 Å²	4	34.6 Å²	34.6	2%	0.021	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	147.9	173.7	-55.9	87.3	0	0	0	109.9	V222 V223 L224 E225 H252 P280 V300 L304	V222-L254 HydrophobicContact CG1-CD1 3.46Å; V222-L254 VanDerWaalsContact CG1-CD1 3.46Å; V223-L254 PolarHBondContact O-N 2.86Å; L224-L254 WeakPolarHBondContact CA-O 3.47Å; L224-L254 HydrophobicContact CD2-CB 3.72Å; L224-L254 HydrophobicContact CD2-CD1 3.99Å; L224-L254 HydrophobicContact CD2-CG 4.3Å; E225-L254 PolarHBondContact N-O 3.49Å; H252-L254 HydrophobicContact CB-CD1 4.27Å; L254-P280 HydrophobicContact CD2-CB 4.22Å; L254-P280 HydrophobicContact CG-CB 4.43Å; L254-V300 HydrophobicContact CD2-CG1 3.52Å; L254-L304 HydrophobicContact CD1-CD1 4.06Å
255	L	95.9	Very high	92.3	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	138	177.8	-57.5	-179.6	0	0	0	110.3	E225 L227 L275 Y279 P280 T281 I282	E225-L255 HydrophobicContact CB-CD2 3.84Å; E225-L255 HydrophobicContact CG-CD2 4.2Å; E225-L255 CarbonylContact O-C 3.58Å; E225-L255 WeakPolarHBondContact O-CA 3.49Å; L227-L255 HydrophobicContact CD1-CB 4.44Å; L227-L255 HydrophobicContact CD1-CD1 4.27Å; L227-L255 HydrophobicContact CD1-CD2 4.32Å; L255-L275 HydrophobicContact CD1-CB 4.09Å; L255-L275 HydrophobicContact CD1-CD2 4.14Å; L255-Y279 HydrophobicContact CD1-CD2 4.12Å; L255-Y279 HydrophobicContact CG-CD2 4.36Å; L255-P280 PolarHBondContact N-O 3.27Å; L255-T281 HydrophobicContact CB-CG2 4.13Å; L255-T281 WeakPolarHBondContact O-CA 3.44Å; L255-I282 PolarHBondContact O-N 2.8Å
256	V	96.7	Very high	92.3	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	107.8	174.5	-177.8	0	0	0	0	108.6	L224 E225 V226 L227 N258 I282 F284 I329	L224-V256 HydrophobicContact CB-CG2 4.25Å; L224-V256 HydrophobicContact CD1-CG2 4.47Å; L224-V256 HydrophobicContact CD2-CG2 4.36Å; E225-V256 PolarHBondContact O-N 3.29Å; V226-V256 WeakPolarHBondContact CA-O 3.34Å; V226-V256 HydrophobicContact CG2-CB 4.45Å; L227-V256 PolarHBondContact N-O 3.43Å; V256-N258 PolarHBondContact O-N 2.92Å; V256-I282 CarbonylContact C-O 3.53Å; V256-I282 WeakPolarHBondContact CA-O 3.39Å; V256-F284 HydrophobicContact CG1-CB 3.7Å; V256-F284 HydrophobicContact CG1-CG 4.29Å; V256-I329 HydrophobicContact CG1-CD1 4.11Å
257	L	96.4	Very high	92.4	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	100.6	177.5	-165.1	71.3	0	0	0	108.7	L227 A229 P232 V260 T268 W271 I272 L275 T281 I282 A283 F284	L227-L257 HydrophobicContact CB-CD1 4.24Å; A229-L257 HydrophobicContact CB-CD1 4.07Å; A229-L257 HydrophobicContact CB-CD2 4.2Å; A229-L257 HydrophobicContact CB-CG 3.74Å; P232-L257 HydrophobicContact CB-CD1 3.73Å; P232-L257 HydrophobicContact CG-CD1 4.3Å; L257-V260 HydrophobicContact CD2-CG1 4.43Å; L257-V260 HydrophobicContact CG-CG1 4.43Å; L257-V260 WeakPolarHBondContact O-CG1 3.36Å; L257-T268 HydrophobicContact CD2-CG2 4.37Å; L257-W271 HydrophobicContact CD2-CB 3.9Å; L257-I272 HydrophobicContact CD2-CG1 4.47Å; L257-L275 HydrophobicContact CD1-CD1 4.24Å; L257-T281 HydrophobicContact CB-CG2 4.4Å; L257-I282 PolarHBondContact N-O 3.39Å; L257-A283 CarbonylContact O-C 3.53Å; L257-A283 WeakPolarHBondContact O-CA 3.49Å; L257-F284 PolarHBondContact O-N 3.26Å
258	N	96.9	Very high	92.5	Very high	5 Å²	5	17.9 Å²	17.9	3%	0.027	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	161.2	-176.3	-170.1	37.5	0	0	0	112	V226 L227 A229 V256 F284 A286 V324 I329	V226-N258 HydrophobicContact CG1-CB 3.89Å; L227-N258 PolarHBondContact O-N 3.4Å; A229-N258 WeakPolarHBondContact CB-O 3.13Å; A229-N258 PolarHBondContact N-O 2.72Å; V256-N258 PolarHBondContact O-N 2.92Å; N258-F284 WeakPolarHBondContact CA-O 3.47Å; N258-F284 PolarHBondContact OD1-O 3.01Å; N258-A286 PolarHBondContact OD1-N 3.34Å; N258-V324 PolarHBondContact ND2-O 2.99Å; N258-I329 HydrophobicContact CB-CD1 4.08Å
259	K	95.4	Very high	92.5	Very high	35 Å²	35	20 Å²	20	15%	0.152	10%	0.098	C	C	.	.			trans	66.9	34.3	-177	-46.1	-176	-171.5	168.4	0	114	D228 D261 L262 F284 N323	D228-K259 WeakPolarHBondContact OD2-CE 3.39Å; D228-K259 IonicContact OD2-NZ 3.81Å; D228-K259 PolarHBondContact OD2-NZ 3.4Å; K259-D261 WeakPolarHBondContact CA-OD1 3.36Å; K259-D261 PolarHBondContact O-N 2.8Å; K259-L262 HydrophobicContact CB-CD1 3.89Å; K259-L262 HydrophobicContact CB-CG 4.15Å; K259-L262 HydrophobicContact CD-CD1 3.86Å; K259-L262 HydrophobicContact CG-CD1 4.46Å; K259-L262 WeakPolarHBondContact O-CB 3.46Å; K259-L262 PolarHBondContact O-N 2.82Å; K259-F284 PolarHBondContact N-O 3.37Å; K259-N323 WeakPolarHBondContact CE-O 3.5Å; K259-N323 PolarHBondContact NZ-O 2.94Å
260	V	94.4	Very high	92.7	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	9%	0.089	C	C	.	.	G	3₁₀ helix	trans	-63.1	-10.7	176.2	-59.9	0	0	0	0	113.6	A229 L257 L262 T268 A283 F284 R285 F292 V496	A229-V260 HydrophobicContact CB-CG1 4.19Å; L257-V260 HydrophobicContact CD2-CG1 4.43Å; L257-V260 HydrophobicContact CG-CG1 4.43Å; L257-V260 WeakPolarHBondContact O-CG1 3.36Å; V260-L262 VanDerWaalsContact C-N 3.29Å; V260-T268 HydrophobicContact CB-CG2 4.13Å; V260-T268 HydrophobicContact CG1-CG2 3.83Å; V260-A283 HydrophobicContact CG1-CB 3.82Å; V260-F284 WeakPolarHBondContact CG2-O 3.39Å; V260-R285 HydrophobicContact CG2-CB 4.2Å; V260-F292 HydrophobicContact CG2-CD1 4.19Å; V260-V496 HydrophobicContact CG2-CG1 3.91Å; V260-V496 HydrophobicContact CG2-CG2 4.26Å
261	D	93.6	Very high	93	Very high	26 Å²	26	15.9 Å²	15.9	14%	0.139	7%	0.071	C	C	.	.	G	3₁₀ helix	trans	-76.9	-11.7	172.3	55.9	-40.8	0	0	0	114.3	K259 R285 T497 S499	K259-D261 WeakPolarHBondContact CA-OD1 3.36Å; K259-D261 PolarHBondContact O-N 2.8Å; D261-R285 HydrophobicContact CB-CG 4.16Å; D261-R285 VanDerWaalsContact CG-NE 3.3Å; D261-R285 IonicContact OD2-CZ 2.69Å; D261-R285 IonicContact OD2-NE 2.7Å; D261-R285 PolarHBondContact OD2-NE 3.5Å; D261-R285 IonicContact OD2-NH2 3.35Å; D261-R285 PolarHBondContact OD2-NH2 3.01Å; D261-T497 WeakPolarHBondContact CB-O 3.45Å; D261-S499 WeakPolarHBondContact O-CB 3.42Å; D261-S499 PolarHBondContact O-N 3.12Å; D261-S499 PolarHBondContact O-OG 3.33Å
262	L	93.7	Very high	93	Very high	22 Å²	22	15.4 Å²	15.4	12%	0.115	7%	0.07	C	C	.	.	G	3₁₀ helix	trans	-90.7	0.8	178.6	-60	-177.1	0	0	0	113.5	R230 K259 V260 S499 F502	R230-L262 HydrophobicContact CG-CB 4.14Å; R230-L262 HydrophobicContact CG-CD1 4.4Å; K259-L262 HydrophobicContact CB-CD1 3.89Å; K259-L262 HydrophobicContact CB-CG 4.15Å; K259-L262 HydrophobicContact CD-CD1 3.86Å; K259-L262 HydrophobicContact CG-CD1 4.46Å; K259-L262 WeakPolarHBondContact O-CB 3.46Å; K259-L262 PolarHBondContact O-N 2.82Å; V260-L262 VanDerWaalsContact C-N 3.29Å; L262-S499 WeakPolarHBondContact CD2-OG 3.28Å; L262-F502 WeakPolarHBondContact O-CZ 3.38Å
263	I	92.5	Very high	92.9	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	8%	0.082	C	C	.	.	S	Bend	trans	-139.8	149.9	-167.7	-54.4	176.8	0	0	0	110.1	A229 R230 A267 Y462 L498	A229-I263 HydrophobicContact CB-CD1 3.35Å; A229-I263 HydrophobicContact CB-CG1 4.45Å; A229-I263 WeakPolarHBondContact O-CD1 3.31Å; R230-I263 HydrophobicContact CB-CD1 4.23Å; R230-I263 HydrophobicContact CG-CD1 3.9Å; R230-I263 HydrophobicContact CG-CG1 3.95Å; I263-A267 HydrophobicContact CG2-CB 3.62Å; I263-Y462 HydrophobicContact CG2-CD2 4.31Å; I263-Y462 HydrophobicContact CG2-CG 4.04Å; I263-L498 WeakPolarHBondContact O-CD2 3.36Å
264	P	91.9	Very high	92.7	Very high	5 Å²	5	20 Å²	20	3%	0.032	9%	0.087	C	C	.	.			trans	-54.8	152.5	171.6	-26.1	36.3	0	0	0	113.8	W266 A267 T268 Y462 F502 D506	P264-W266 HydrophobicContact CB-CG 4.42Å; P264-W266 VanDerWaalsContact CB-NE1 3.29Å; P264-A267 PolarHBondContact O-N 2.98Å; P264-T268 PolarHBondContact O-N 3.41Å; P264-T268 PolarHBondContact O-OG1 2.8Å; P264-Y462 HydrophobicContact CG-CD1 4.33Å; P264-Y462 HydrophobicContact CG-CE1 3.89Å; P264-F502 HydrophobicContact CG-CD1 3.78Å; P264-F502 HydrophobicContact CG-CD2 4.11Å; P264-F502 HydrophobicContact CG-CE1 3.93Å; P264-F502 HydrophobicContact CG-CE2 4.24Å; P264-F502 HydrophobicContact CG-CG 3.89Å; P264-F502 HydrophobicContact CG-CZ 4.16Å; P264-D506 HydrophobicContact CG-CB 4.41Å
265	K	90.4	Very high	92.6	Very high	57 Å²	57	19.8 Å²	19.8	25%	0.248	9%	0.086	C	C	.	.	H	α-helix	trans	-65.8	-43.6	-176.4	-66.9	179.3	-175.5	177.5	0	112.2	A267 T268 K269 I493 A494 V496 L498	K265-A267 VanDerWaalsContact C-N 3.32Å; K265-A267 PolarHBondContact O-N 3.05Å; K265-T268 WeakPolarHBondContact O-CB 3.3Å; K265-T268 PolarHBondContact O-N 3.05Å; K265-K269 PolarHBondContact O-N 3.21Å; K265-I493 HydrophobicContact CB-CG2 4.19Å; K265-A494 PolarHBondContact NZ-O 3.48Å; K265-V496 WeakPolarHBondContact CE-O 3.47Å; K265-L498 HydrophobicContact CG-CD1 4.38Å; K265-L498 HydrophobicContact CG-CD2 4.34Å
266	W	89.2	Confident	92.3	Very high	1 Å²	1	20 Å²	20	0%	0.004	9%	0.088	C	C	.	.	H	α-helix	trans	-56.8	-43.4	175.6	68.3	-92.5	0	0	0	112.4	P264 T268 K269 R270 Y462 P465 D506 N509 D510	P264-W266 HydrophobicContact CB-CG 4.42Å; P264-W266 VanDerWaalsContact CB-NE1 3.29Å; W266-T268 VanDerWaalsContact C-N 3.31Å; W266-T268 PolarHBondContact O-N 3Å; W266-K269 WeakPolarHBondContact O-CB 3.45Å; W266-K269 PolarHBondContact O-N 3Å; W266-K269 VanDerWaalsContact O-N 3.12Å; W266-R270 HydrophobicContact CE3-CG 4.41Å; W266-R270 PolarHBondContact O-N 3.14Å; W266-Y462 HydrophobicContact CH2-CE2 4.12Å; W266-Y462 AromaticContact CZ2-CE2 3.83Å; W266-Y462 HydrophobicContact CZ2-CE2 3.83Å; W266-P465 HydrophobicContact CZ3-CG 4.27Å; W266-D506 PolarHBondContact NE1-O 3.43Å; W266-N509 HydrophobicContact CD2-CB 3.71Å; W266-N509 HydrophobicContact CE3-CB 4.06Å; W266-N509 HydrophobicContact CG-CB 4.11Å; W266-N509 HydrophobicContact CH2-CB 4.37Å; W266-N509 WeakPolarHBondContact CH2-ND2 3.45Å; W266-N509 HydrophobicContact CZ2-CB 4.03Å; W266-N509 HydrophobicContact CZ3-CB 4.37Å; W266-D510 HydrophobicContact CB-CB 4.15Å; W266-D510 WeakPolarHBondContact CB-OD1 3.38Å; W266-D510 HydrophobicContact CG-CB 4.43Å
267	A	90.9	Very high	91.9	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-65.6	-37.8	179.8	0	0	0	0	0	111	I263 P264 K265 R270 W271 Y462	I263-A267 HydrophobicContact CG2-CB 3.62Å; P264-A267 PolarHBondContact O-N 2.98Å; K265-A267 VanDerWaalsContact C-N 3.32Å; K265-A267 PolarHBondContact O-N 3.05Å; A267-R270 PolarHBondContact O-N 3.43Å; A267-W271 PolarHBondContact O-N 3.24Å; A267-Y462 HydrophobicContact CB-CD2 4.33Å; A267-Y462 HydrophobicContact CB-CE2 4.43Å
268	T	91.6	Very high	91.5	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.012	13%	0.132	C	C	.	.	H	α-helix	trans	-60.7	-44.7	171.5	-58.3	0	0	0	0	111.6	L257 V260 P264 K265 W266 R270 W271 I272 A283 I493	L257-T268 HydrophobicContact CD2-CG2 4.37Å; V260-T268 HydrophobicContact CB-CG2 4.13Å; V260-T268 HydrophobicContact CG1-CG2 3.83Å; P264-T268 PolarHBondContact O-N 3.41Å; P264-T268 PolarHBondContact O-OG1 2.8Å; K265-T268 WeakPolarHBondContact O-CB 3.3Å; K265-T268 PolarHBondContact O-N 3.05Å; W266-T268 VanDerWaalsContact C-N 3.31Å; W266-T268 PolarHBondContact O-N 3Å; T268-R270 PolarHBondContact O-N 3.17Å; T268-W271 PolarHBondContact O-N 3.33Å; T268-I272 HydrophobicContact CG2-CD1 3.96Å; T268-I272 WeakPolarHBondContact O-CD1 3.44Å; T268-I272 VanDerWaalsContact O-CG1 3.26Å; T268-I272 WeakPolarHBondContact O-CG1 3.04Å; T268-I272 PolarHBondContact O-N 3.16Å; T268-A283 HydrophobicContact CG2-CB 4.06Å; T268-I493 HydrophobicContact CG2-CG2 4.47Å
269	K	90.5	Very high	91.2	Very high	72 Å²	72	28.1 Å²	28.1	31%	0.313	13%	0.134	S	C	.	.	H	α-helix	trans	-58.5	-47.6	175.9	-70.5	-179.7	178.1	-177	0	111.6	K265 W266 I272 R273 I493	K265-K269 PolarHBondContact O-N 3.21Å; W266-K269 WeakPolarHBondContact O-CB 3.45Å; W266-K269 PolarHBondContact O-N 3Å; W266-K269 VanDerWaalsContact O-N 3.12Å; K269-I272 PolarHBondContact O-N 3.35Å; K269-R273 PolarHBondContact O-N 3.29Å; K269-I493 HydrophobicContact CB-CD1 4.36Å; K269-I493 HydrophobicContact CG-CB 4.42Å; K269-I493 HydrophobicContact CG-CD1 3.53Å; K269-I493 HydrophobicContact CG-CG2 4.21Å
270	R	90.7	Very high	91	Very high	59 Å²	59	26.9 Å²	26.9	22%	0.223	13%	0.13	C	C	.	.	H	α-helix	trans	-62.7	-45.3	179.5	-72.7	-169.3	-176.7	-173	1.6	112.4	W266 A267 T268 I272 R273 Q274 P465 D467 E513	W266-R270 HydrophobicContact CE3-CG 4.41Å; W266-R270 PolarHBondContact O-N 3.14Å; A267-R270 PolarHBondContact O-N 3.43Å; T268-R270 PolarHBondContact O-N 3.17Å; R270-I272 VanDerWaalsContact C-N 3.35Å; R270-I272 PolarHBondContact O-N 2.86Å; R270-R273 WeakPolarHBondContact O-CB 3.04Å; R270-R273 PolarHBondContact O-N 2.94Å; R270-R273 VanDerWaalsContact O-N 3.16Å; R270-Q274 PolarHBondContact O-N 3.16Å; R270-P465 HydrophobicContact CB-CB 4.04Å; R270-P465 HydrophobicContact CB-CG 3.66Å; R270-P465 HydrophobicContact CG-CG 4.38Å; R270-D467 IonicContact NH1-OD1 3.67Å; R270-E513 IonicContact CZ-OE1 3.35Å; R270-E513 VanDerWaalsContact CZ-OE1 3.25Å; R270-E513 IonicContact NE-OE1 3.82Å; R270-E513 PolarHBondContact NE-OE1 2.84Å; R270-E513 IonicContact NH2-OE1 3.14Å; R270-E513 PolarHBondContact NH2-OE1 3.19Å
271	W	93	Very high	90.9	Very high	4 Å²	4	27.1 Å²	27.1	2%	0.015	13%	0.131	C	C	.	.	H	α-helix	trans	-60.4	-43.1	175.4	-79.3	124.1	0	0	0	112.5	P232 M233 L257 A267 T268 R273 Q274 L275 P465	P232-W271 HydrophobicContact CG-CD2 3.37Å; P232-W271 HydrophobicContact CG-CE3 3.43Å; P232-W271 VanDerWaalsContact CG-CE3 3.43Å; P232-W271 HydrophobicContact CG-CG 4.01Å; P232-W271 HydrophobicContact CG-CH2 3.78Å; P232-W271 HydrophobicContact CG-CZ2 3.72Å; P232-W271 HydrophobicContact CG-CZ3 3.64Å; M233-W271 HydrophobicContact CG-CH2 3.93Å; M233-W271 HydrophobicContact CG-CZ3 3.8Å; L257-W271 HydrophobicContact CD2-CB 3.9Å; A267-W271 PolarHBondContact O-N 3.24Å; T268-W271 PolarHBondContact O-N 3.33Å; W271-R273 VanDerWaalsContact C-N 3.34Å; W271-R273 PolarHBondContact O-N 3.26Å; W271-Q274 PolarHBondContact O-N 3.01Å; W271-L275 WeakPolarHBondContact O-CB 3.34Å; W271-L275 VanDerWaalsContact O-CG 3.28Å; W271-L275 WeakPolarHBondContact O-CG 3.49Å; W271-L275 PolarHBondContact O-N 3.42Å; W271-P465 HydrophobicContact CD2-CB 3.92Å; W271-P465 HydrophobicContact CE3-CB 4.23Å; W271-P465 HydrophobicContact CG-CB 4.41Å; W271-P465 HydrophobicContact CH2-CB 4.36Å; W271-P465 HydrophobicContact CZ2-CB 4.06Å; W271-P465 HydrophobicContact CZ3-CB 4.43Å
272	I	91.6	Very high	90.9	Very high	10 Å²	10	25.9 Å²	25.9	5%	0.051	12%	0.124	C	C	.	.	H	α-helix	trans	-60.1	-46.4	174.5	-67.2	163.2	0	0	0	110.2	L257 T268 K269 R270 Q274 L275 S276 A283 V487 I493	L257-I272 HydrophobicContact CD2-CG1 4.47Å; T268-I272 HydrophobicContact CG2-CD1 3.96Å; T268-I272 WeakPolarHBondContact O-CD1 3.44Å; T268-I272 VanDerWaalsContact O-CG1 3.26Å; T268-I272 WeakPolarHBondContact O-CG1 3.04Å; T268-I272 PolarHBondContact O-N 3.16Å; K269-I272 PolarHBondContact O-N 3.35Å; R270-I272 VanDerWaalsContact C-N 3.35Å; R270-I272 PolarHBondContact O-N 2.86Å; I272-Q274 VanDerWaalsContact C-N 3.32Å; I272-Q274 PolarHBondContact O-N 2.92Å; I272-L275 PolarHBondContact O-N 3.09Å; I272-S276 WeakPolarHBondContact O-CB 3.47Å; I272-S276 PolarHBondContact O-N 2.96Å; I272-S276 PolarHBondContact O-OG 3.1Å; I272-A283 HydrophobicContact CD1-CB 3.72Å; I272-A283 HydrophobicContact CG1-CB 4.39Å; I272-V487 HydrophobicContact CG2-CG1 4.31Å; I272-I493 HydrophobicContact CD1-CD1 3.65Å; I272-I493 HydrophobicContact CD1-CG1 4.36Å
273	R	88.6	Confident	91	Very high	75 Å²	75	24.9 Å²	24.9	28%	0.283	12%	0.119	S	C	.	.	H	α-helix	trans	-58.7	-42.9	-179.5	-172.5	177.3	-175.4	-161.1	0.8	111.9	K269 R270 W271 L468 E473	K269-R273 PolarHBondContact O-N 3.29Å; R270-R273 WeakPolarHBondContact O-CB 3.04Å; R270-R273 PolarHBondContact O-N 2.94Å; R270-R273 VanDerWaalsContact O-N 3.16Å; W271-R273 VanDerWaalsContact C-N 3.34Å; W271-R273 PolarHBondContact O-N 3.26Å; R273-L468 HydrophobicContact CG-CD1 4.23Å; R273-E473 IonicContact CZ-OE1 3.81Å; R273-E473 IonicContact NH1-OE1 3.84Å; R273-E473 PolarHBondContact NH1-OE1 3.35Å
274	Q	89.6	Confident	91.2	Very high	42 Å²	42	24.9 Å²	24.9	20%	0.196	12%	0.119	C	C	.	.	H	α-helix	trans	-70.7	-51.6	179.2	-174.4	163.8	7.6	0	0	112	R270 W271 I272 S276 S277	R270-Q274 PolarHBondContact O-N 3.16Å; W271-Q274 PolarHBondContact O-N 3.01Å; I272-Q274 VanDerWaalsContact C-N 3.32Å; I272-Q274 PolarHBondContact O-N 2.92Å; Q274-S276 VanDerWaalsContact C-N 3.31Å; Q274-S276 PolarHBondContact O-N 2.68Å; Q274-S277 WeakPolarHBondContact O-CB 3.45Å; Q274-S277 PolarHBondContact O-N 2.92Å; Q274-S277 PolarHBondContact O-OG 2.96Å
275	L	91.8	Very high	91.4	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-68.1	-31.4	-176.8	-65.3	173.3	0	0	0	112.6	L227 P232 M233 L255 L257 W271 I272 S277 E278 Y279 T281	L227-L275 HydrophobicContact CD1-CD1 4.11Å; P232-L275 HydrophobicContact CB-CD1 4.24Å; M233-L275 HydrophobicContact SD-CD2 4.49Å; L255-L275 HydrophobicContact CD1-CB 4.09Å; L255-L275 HydrophobicContact CD1-CD2 4.14Å; L257-L275 HydrophobicContact CD1-CD1 4.24Å; W271-L275 WeakPolarHBondContact O-CB 3.34Å; W271-L275 VanDerWaalsContact O-CG 3.28Å; W271-L275 WeakPolarHBondContact O-CG 3.49Å; W271-L275 PolarHBondContact O-N 3.42Å; I272-L275 PolarHBondContact O-N 3.09Å; L275-S277 PolarHBondContact O-N 3.37Å; L275-E278 PolarHBondContact O-N 2.91Å; L275-Y279 PolarHBondContact O-N 3.14Å; L275-T281 HydrophobicContact CB-CG2 4.01Å; L275-T281 VanDerWaalsContact CB-OG1 3.28Å; L275-T281 WeakPolarHBondContact CB-OG1 3.18Å; L275-T281 HydrophobicContact CD1-CG2 4.14Å
276	S	89.2	Confident	91.5	Very high	6 Å²	6	25.3 Å²	25.3	4%	0.042	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-19.8	175.9	-66.8	0	0	0	0	113.8	Y112 I272 Q274 E278 Y279	Y112-S276 WeakPolarHBondContact OH-CB 3.11Å; I272-S276 WeakPolarHBondContact O-CB 3.47Å; I272-S276 PolarHBondContact O-N 2.96Å; I272-S276 PolarHBondContact O-OG 3.1Å; Q274-S276 VanDerWaalsContact C-N 3.31Å; Q274-S276 PolarHBondContact O-N 2.68Å; S276-E278 PolarHBondContact O-N 2.83Å; S276-Y279 WeakPolarHBondContact CA-O 3.43Å
277	S	86.9	Confident	91.7	Very high	80 Å²	80	28 Å²	28	56%	0.559	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68	-26.1	172.7	72.5	0	0	0	0	112.7	Q274 L275	Q274-S277 WeakPolarHBondContact O-CB 3.45Å; Q274-S277 PolarHBondContact O-N 2.92Å; Q274-S277 PolarHBondContact O-OG 2.96Å; L275-S277 PolarHBondContact O-N 3.37Å
278	E	89	Confident	91.7	Very high	75 Å²	75	31.9 Å²	31.9	35%	0.35	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-44.9	-178	-63.5	-176.1	-122.8	0	0	112.7	P111 R236 L275 S276	P111-E278 VanDerWaalsContact CB-O 3.29Å; P111-E278 WeakPolarHBondContact CB-O 3.38Å; R236-E278 IonicContact CZ-OE1 3.82Å; R236-E278 IonicContact CZ-OE2 3.25Å; R236-E278 VanDerWaalsContact NH1-CD 3.32Å; R236-E278 IonicContact NH1-OE1 2.87Å; R236-E278 PolarHBondContact NH1-OE1 3.1Å; R236-E278 IonicContact NH1-OE2 3.41Å; R236-E278 PolarHBondContact NH1-OE2 2.83Å; R236-E278 VanDerWaalsContact NH1-OE2 3.14Å; R236-E278 IonicContact NH2-OE1 2.71Å; R236-E278 IonicContact NH2-OE2 2.99Å; R236-E278 PolarHBondContact NH2-OE2 3.06Å; L275-E278 PolarHBondContact O-N 2.91Å; S276-E278 PolarHBondContact O-N 2.83Å
279	Y	90.9	Very high	91.7	Very high	20 Å²	20	40.4 Å²	40.4	8%	0.078	20%	0.197	C	C	.	.	S	Bend	trans	-148.1	151.3	180	-58.2	-80.7	0	0	0	111.4	R236 E241 K245 L253 L255 L275 S276 T281	R236-Y279 VanDerWaalsContact NH2-CE2 3.34Å; E241-Y279 WeakPolarHBondContact OE2-CE2 3.43Å; E241-Y279 PolarHBondContact OE2-OH 2.94Å; E241-Y279 VanDerWaalsContact OE2-OH 3.05Å; K245-Y279 WeakPolarHBondContact CE-OH 3.42Å; K245-Y279 PolarHBondContact NZ-OH 2.98Å; L253-Y279 HydrophobicContact CB-CD1 4.31Å; L253-Y279 HydrophobicContact CB-CE1 4.29Å; L253-Y279 HydrophobicContact CD2-CD1 4.08Å; L253-Y279 HydrophobicContact CD2-CE1 3.59Å; L253-Y279 HydrophobicContact CD2-CE2 4.21Å; L253-Y279 HydrophobicContact CG-CD1 4.2Å; L253-Y279 HydrophobicContact CG-CE1 4.18Å; L255-Y279 HydrophobicContact CD1-CD2 4.12Å; L255-Y279 HydrophobicContact CG-CD2 4.36Å; L275-Y279 PolarHBondContact O-N 3.14Å; S276-Y279 WeakPolarHBondContact CA-O 3.43Å; Y279-T281 PolarHBondContact O-N 3.24Å; Y279-T281 PolarHBondContact O-OG1 3.01Å
280	P	91.3	Very high	91.8	Very high	9 Å²	9	42.3 Å²	42.3	6%	0.058	21%	0.21	C	C	.	.			trans	-54.9	117.2	173.5	-25.2	35.3	0	0	0	111.1	P111 Y112 F114 L254 L255	P111-P280 WeakPolarHBondContact O-CD 3.29Å; P111-P280 WeakPolarHBondContact O-CG 3.19Å; Y112-P280 HydrophobicContact CD1-CB 4.26Å; Y112-P280 HydrophobicContact CD1-CG 3.86Å; Y112-P280 HydrophobicContact CE1-CB 4.01Å; Y112-P280 HydrophobicContact CE1-CG 4.02Å; F114-P280 HydrophobicContact CZ-CG 4.22Å; L254-P280 HydrophobicContact CD2-CB 4.22Å; L254-P280 HydrophobicContact CG-CB 4.43Å; L255-P280 PolarHBondContact N-O 3.27Å
281	T	92.9	Very high	91.9	Very high	4 Å²	4	41.3 Å²	41.3	3%	0.025	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	134	-174.2	-59.7	0	0	0	0	110.6	L255 L257 L275 Y279	L255-T281 HydrophobicContact CB-CG2 4.13Å; L255-T281 WeakPolarHBondContact O-CA 3.44Å; L257-T281 HydrophobicContact CB-CG2 4.4Å; L275-T281 HydrophobicContact CB-CG2 4.01Å; L275-T281 VanDerWaalsContact CB-OG1 3.28Å; L275-T281 WeakPolarHBondContact CB-OG1 3.18Å; L275-T281 HydrophobicContact CD1-CG2 4.14Å; Y279-T281 PolarHBondContact O-N 3.24Å; Y279-T281 PolarHBondContact O-OG1 3.01Å
282	I	93.4	Very high	91.9	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	124.9	-179	-58.5	179.7	0	0	0	108.9	L255 V256 L257 A296 L297 V300 V489 Q491	L255-I282 PolarHBondContact O-N 2.8Å; V256-I282 CarbonylContact C-O 3.53Å; V256-I282 WeakPolarHBondContact CA-O 3.39Å; L257-I282 PolarHBondContact N-O 3.39Å; I282-A296 HydrophobicContact CG2-CB 4.45Å; I282-L297 HydrophobicContact CD1-CD1 3.9Å; I282-V300 HydrophobicContact CD1-CB 4.26Å; I282-V300 HydrophobicContact CD1-CG2 3.94Å; I282-V489 HydrophobicContact CG1-CG1 4.38Å; I282-Q491 VanDerWaalsContact CG2-NE2 3.29Å
283	A	95.5	Very high	91.9	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	139.2	169	0	0	0	0	0	111.2	L257 V260 T268 I272 F292 Q491	L257-A283 CarbonylContact O-C 3.53Å; L257-A283 WeakPolarHBondContact O-CA 3.49Å; V260-A283 HydrophobicContact CG1-CB 3.82Å; T268-A283 HydrophobicContact CG2-CB 4.06Å; I272-A283 HydrophobicContact CD1-CB 3.72Å; I272-A283 HydrophobicContact CG1-CB 4.39Å; A283-F292 HydrophobicContact CB-CE1 4.16Å; A283-Q491 PolarHBondContact O-NE2 3.42Å
284	F	96	Very high	92.1	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	140.8	-174	-156.2	-89.5	0	0	0	112.1	V256 L257 N258 K259 V260 A286 F292 K294 L297 I329 A332	V256-F284 HydrophobicContact CG1-CB 3.7Å; V256-F284 HydrophobicContact CG1-CG 4.29Å; L257-F284 PolarHBondContact O-N 3.26Å; N258-F284 WeakPolarHBondContact CA-O 3.47Å; N258-F284 PolarHBondContact OD1-O 3.01Å; K259-F284 PolarHBondContact N-O 3.37Å; V260-F284 WeakPolarHBondContact CG2-O 3.39Å; F284-A286 HydrophobicContact CD1-CB 4.1Å; F284-A286 HydrophobicContact CE1-CB 3.96Å; F284-F292 WeakPolarHBondContact CD2-O 3.45Å; F284-K294 HydrophobicContact CE2-CB 4.41Å; F284-L297 HydrophobicContact CD2-CD2 4.19Å; F284-L297 HydrophobicContact CE2-CB 4.35Å; F284-L297 HydrophobicContact CE2-CD2 3.92Å; F284-I329 HydrophobicContact CD1-CB 4.49Å; F284-I329 HydrophobicContact CD1-CG1 3.78Å; F284-I329 HydrophobicContact CD1-CG2 4.28Å; F284-I329 HydrophobicContact CE1-CB 4.15Å; F284-I329 HydrophobicContact CE1-CG1 3.89Å; F284-I329 HydrophobicContact CE1-CG2 3.86Å; F284-I329 HydrophobicContact CE2-CG2 4.43Å; F284-I329 HydrophobicContact CZ-CG2 3.95Å; F284-A332 HydrophobicContact CE1-CB 4.03Å; F284-A332 HydrophobicContact CZ-CB 4.15Å
285	R	95.4	Very high	92.2	Very high	40 Å²	40	41.2 Å²	41.2	15%	0.151	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-120.1	113.6	165.8	-173.2	-172.3	-175.2	-163.4	7.7	108.8	V260 D261 D287 P291 F292	V260-R285 HydrophobicContact CG2-CB 4.2Å; D261-R285 HydrophobicContact CB-CG 4.16Å; D261-R285 VanDerWaalsContact CG-NE 3.3Å; D261-R285 IonicContact OD2-CZ 2.69Å; D261-R285 IonicContact OD2-NE 2.7Å; D261-R285 PolarHBondContact OD2-NE 3.5Å; D261-R285 IonicContact OD2-NH2 3.35Å; D261-R285 PolarHBondContact OD2-NH2 3.01Å; R285-D287 PolarHBondContact O-N 3.46Å; R285-D287 VanDerWaalsContact O-N 3.13Å; R285-P291 WeakPolarHBondContact O-CA 3.47Å; R285-F292 HydrophobicContact CB-CB 3.65Å; R285-F292 PolarHBondContact N-O 2.87Å; R285-F292 PolarHBondContact O-N 3.49Å
286	A	93.4	Very high	92.2	Very high	31 Å²	31	42.3 Å²	42.3	26%	0.256	24%	0.24	S	C	.	.			trans	-84.5	83.8	-178	0	0	0	0	0	112.1	N258 F284 I329	N258-A286 PolarHBondContact OD1-N 3.34Å; F284-A286 HydrophobicContact CD1-CB 4.1Å; F284-A286 HydrophobicContact CE1-CB 3.96Å; A286-I329 HydrophobicContact CB-CG1 3.94Å
287	D	93.3	Very high	92.3	Very high	58 Å²	58	42 Å²	42	31%	0.31	24%	0.238	S	C	.	.			trans	-120.2	152.2	168.4	-175.8	26.6	0	0	0	110.9	R285 N290 P291 A332	R285-D287 PolarHBondContact O-N 3.46Å; R285-D287 VanDerWaalsContact O-N 3.13Å; D287-N290 PolarHBondContact OD2-N 3.47Å; D287-P291 WeakPolarHBondContact O-CB 3.49Å; D287-A332 WeakPolarHBondContact O-CB 3.36Å
288	L	92	Very high	92.6	Very high	82 Å²	82	39.7 Å²	39.7	43%	0.429	22%	0.219	S	C	.	.	S	Bend	trans	-77.8	-36.2	179	-173	63.5	0	0	0	111.8	K336	L288-K336 VanDerWaalsContact CD1-N 3.35Å
289	K	91.3	Very high	92.7	Very high	180 Å²	180	39.8 Å²	39.8	78%	0.783	22%	0.222	S	C	*	.	S	Bend	trans	-89.6	-53.4	-177.1	-66.8	-177.4	178.6	-179.2	0	111.2	P291	K289-P291 VanDerWaalsContact O-CD 3.27Å; K289-P291 WeakPolarHBondContact O-CD 3.29Å
290	N	91.6	Very high	92.7	Very high	112 Å²	112	39.7 Å²	39.7	60%	0.599	22%	0.224	S	C	*	.	S	Bend	trans	-122.4	65.7	-173.3	-63.1	-27.7	0	0	0	112.2	D287	D287-N290 PolarHBondContact OD2-N 3.47Å
291	P	93.1	Very high	92.7	Very high	38 Å²	38	39.5 Å²	39.5	25%	0.247	22%	0.222	C	C	.	.			trans	-72.1	137.7	177.7	28.6	-32.9	0	0	0	112.1	R285 D287 K289 K294 A332	R285-P291 WeakPolarHBondContact O-CA 3.47Å; D287-P291 WeakPolarHBondContact O-CB 3.49Å; K289-P291 VanDerWaalsContact O-CD 3.27Å; K289-P291 WeakPolarHBondContact O-CD 3.29Å; P291-K294 HydrophobicContact CB-CB 4.14Å; P291-K294 HydrophobicContact CB-CD 4.46Å; P291-K294 HydrophobicContact CG-CB 4.18Å; P291-K294 HydrophobicContact CG-CD 3.82Å; P291-A332 HydrophobicContact CB-CB 4.29Å
292	F	93.3	Very high	92.6	Very high	22 Å²	22	44.9 Å²	44.9	10%	0.096	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-99.8	143.6	168.5	-179.1	-97.1	0	0	0	110.2	V260 A283 F284 R285 K294 Q491 N492 Q495 V496	V260-F292 HydrophobicContact CG2-CD1 4.19Å; A283-F292 HydrophobicContact CB-CE1 4.16Å; F284-F292 WeakPolarHBondContact CD2-O 3.45Å; R285-F292 HydrophobicContact CB-CB 3.65Å; R285-F292 PolarHBondContact N-O 2.87Å; R285-F292 PolarHBondContact O-N 3.49Å; F292-K294 VanDerWaalsContact C-N 3.26Å; F292-K294 PolarHBondContact O-N 3.08Å; F292-Q491 HydrophobicContact CZ-CB 4.31Å; F292-N492 WeakPolarHBondContact CE2-O 3.46Å; F292-Q495 HydrophobicContact CE2-CB 4.25Å; F292-V496 HydrophobicContact CD1-CG2 3.68Å; F292-V496 HydrophobicContact CD2-CG2 3.83Å; F292-V496 HydrophobicContact CE1-CG2 3.5Å; F292-V496 VanDerWaalsContact CE1-CG2 3.5Å; F292-V496 HydrophobicContact CE2-CG2 3.66Å; F292-V496 HydrophobicContact CG-CG2 3.85Å; F292-V496 HydrophobicContact CZ-CG2 3.49Å; F292-V496 VanDerWaalsContact CZ-CG2 3.49Å
293	G	91	Very high	92.4	Very high	11 Å²	11	48.3 Å²	48.3	11%	0.113	26%	0.258	C	S	.	.	S	Bend	trans	79.4	-4.6	178.3	0	0	0	0	0	115.7	G295 A296 L297	G293-G295 PolarHBondContact O-N 3.47Å; G293-A296 PolarHBondContact O-N 3.09Å; G293-L297 PolarHBondContact O-N 2.87Å
294	K	92.6	Very high	92	Very high	41 Å²	41	48.6 Å²	48.6	18%	0.178	26%	0.259	C	S	.	.	H	α-helix	trans	-54.9	-48.4	178.6	176.7	173.5	179.3	164.6	0	113.5	F284 P291 F292 I298 A332 L333 S335	F284-K294 HydrophobicContact CE2-CB 4.41Å; P291-K294 HydrophobicContact CB-CB 4.14Å; P291-K294 HydrophobicContact CB-CD 4.46Å; P291-K294 HydrophobicContact CG-CB 4.18Å; P291-K294 HydrophobicContact CG-CD 3.82Å; F292-K294 VanDerWaalsContact C-N 3.26Å; F292-K294 PolarHBondContact O-N 3.08Å; K294-I298 HydrophobicContact CG-CD1 3.81Å; K294-I298 WeakPolarHBondContact O-CB 3.41Å; K294-I298 VanDerWaalsContact O-CG1 3.28Å; K294-I298 WeakPolarHBondContact O-CG1 2.89Å; K294-I298 PolarHBondContact O-N 3.12Å; K294-A332 WeakPolarHBondContact CE-O 3.48Å; K294-A332 PolarHBondContact NZ-O 2.92Å; K294-L333 WeakPolarHBondContact CE-O 3.42Å; K294-L333 HydrophobicContact CG-CD2 4.35Å; K294-L333 PolarHBondContact NZ-O 2.9Å; K294-S335 PolarHBondContact NZ-OG 3.2Å
295	G	91.5	Very high	91.6	Very high	55 Å²	55	49.1 Å²	49.1	57%	0.567	26%	0.264	S	S	*	.	H	α-helix	trans	-63.1	-43.7	-179.8	0	0	0	0	0	112.4	G293 I298 N299	G293-G295 PolarHBondContact O-N 3.47Å; G295-I298 PolarHBondContact O-N 3.31Å; G295-N299 WeakPolarHBondContact O-CB 3.1Å; G295-N299 PolarHBondContact O-N 3.33Å
296	A	91.7	Very high	91.3	Very high	24 Å²	24	54.4 Å²	54.4	20%	0.198	29%	0.288	C	S	.	.	H	α-helix	trans	-60.7	-50.1	177.6	0	0	0	0	0	111.5	I282 G293 I298 N299 V300 V489 Q491	I282-A296 HydrophobicContact CG2-CB 4.45Å; G293-A296 PolarHBondContact O-N 3.09Å; A296-I298 PolarHBondContact O-N 3.48Å; A296-N299 WeakPolarHBondContact O-CB 3.48Å; A296-N299 PolarHBondContact O-N 2.75Å; A296-N299 VanDerWaalsContact O-N 3.14Å; A296-V300 WeakPolarHBondContact O-CG2 3.45Å; A296-V300 PolarHBondContact O-N 2.78Å; A296-V489 HydrophobicContact CB-CG1 3.99Å; A296-Q491 HydrophobicContact CB-CG 4.26Å
297	L	92.7	Very high	90.9	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-62	-43.2	179.1	-176.5	56.8	0	0	0	111.9	L224 I282 F284 G293 N299 V300 L301 I329 L333	L224-L297 HydrophobicContact CD1-CD1 3.99Å; L224-L297 HydrophobicContact CD1-CD2 4.48Å; L224-L297 HydrophobicContact CD2-CD1 4.48Å; I282-L297 HydrophobicContact CD1-CD1 3.9Å; F284-L297 HydrophobicContact CD2-CD2 4.19Å; F284-L297 HydrophobicContact CE2-CB 4.35Å; F284-L297 HydrophobicContact CE2-CD2 3.92Å; G293-L297 PolarHBondContact O-N 2.87Å; L297-N299 VanDerWaalsContact C-N 3.3Å; L297-N299 PolarHBondContact O-N 3.35Å; L297-V300 PolarHBondContact O-N 3.35Å; L297-L301 HydrophobicContact CD1-CD1 4.45Å; L297-L301 HydrophobicContact CD1-CG 4.29Å; L297-L301 HydrophobicContact CG-CD1 4.32Å; L297-L301 WeakPolarHBondContact O-CB 3.42Å; L297-L301 VanDerWaalsContact O-CG 3.28Å; L297-L301 WeakPolarHBondContact O-CG 3.45Å; L297-L301 PolarHBondContact O-N 3.34Å; L297-I329 HydrophobicContact CD2-CG2 4.24Å; L297-L333 HydrophobicContact CD2-CD1 3.98Å; L297-L333 HydrophobicContact CD2-CD2 4.08Å; L297-L333 HydrophobicContact CD2-CG 4.43Å; L297-L333 HydrophobicContact CG-CD2 4.4Å
298	I	92.8	Very high	90.5	Very high	30 Å²	30	52.4 Å²	52.4	15%	0.154	27%	0.272	C	S	.	.	H	α-helix	trans	-62.9	-38.1	176	-69.5	171.4	0	0	0	111.5	K294 G295 A296 R302 L333 M357	K294-I298 HydrophobicContact CG-CD1 3.81Å; K294-I298 WeakPolarHBondContact O-CB 3.41Å; K294-I298 VanDerWaalsContact O-CG1 3.28Å; K294-I298 WeakPolarHBondContact O-CG1 2.89Å; K294-I298 PolarHBondContact O-N 3.12Å; G295-I298 PolarHBondContact O-N 3.31Å; A296-I298 PolarHBondContact O-N 3.48Å; I298-R302 WeakPolarHBondContact O-CB 3.31Å; I298-R302 PolarHBondContact O-N 3.39Å; I298-L333 HydrophobicContact CD1-CD2 4.23Å; I298-L333 HydrophobicContact CG1-CD2 3.82Å; I298-M357 HydrophobicContact CG2-CE 3.84Å
299	N	91.8	Very high	90.1	Very high	78 Å²	78	52.8 Å²	52.8	42%	0.417	28%	0.281	S	S	.	.	H	α-helix	trans	-63.9	-48.5	178.3	-169.5	26.9	0	0	0	111	G295 A296 L297 L301 R302 Q303	G295-N299 WeakPolarHBondContact O-CB 3.1Å; G295-N299 PolarHBondContact O-N 3.33Å; A296-N299 WeakPolarHBondContact O-CB 3.48Å; A296-N299 PolarHBondContact O-N 2.75Å; A296-N299 VanDerWaalsContact O-N 3.14Å; L297-N299 VanDerWaalsContact C-N 3.3Å; L297-N299 PolarHBondContact O-N 3.35Å; N299-L301 PolarHBondContact O-N 2.88Å; N299-R302 WeakPolarHBondContact O-CB 3.29Å; N299-R302 PolarHBondContact O-N 2.83Å; N299-R302 VanDerWaalsContact O-N 3.16Å; N299-Q303 PolarHBondContact ND2-NE2 2.96Å; N299-Q303 WeakPolarHBondContact O-CG 3.39Å; N299-Q303 PolarHBondContact O-N 2.82Å
300	V	90.5	Very high	89.9	Confident	18 Å²	18	48.8 Å²	48.8	11%	0.109	27%	0.269	C	S	.	.	H	α-helix	trans	-59.8	-47.8	177	173.7	0	0	0	0	111	L254 I282 A296 L297 R302 Q303 L304 V489	L254-V300 HydrophobicContact CD2-CG1 3.52Å; I282-V300 HydrophobicContact CD1-CB 4.26Å; I282-V300 HydrophobicContact CD1-CG2 3.94Å; A296-V300 WeakPolarHBondContact O-CG2 3.45Å; A296-V300 PolarHBondContact O-N 2.78Å; L297-V300 PolarHBondContact O-N 3.35Å; V300-R302 VanDerWaalsContact C-N 3.26Å; V300-R302 PolarHBondContact O-N 2.86Å; V300-Q303 WeakPolarHBondContact O-CB 3.33Å; V300-Q303 PolarHBondContact O-N 3.12Å; V300-Q303 VanDerWaalsContact O-N 3.1Å; V300-L304 HydrophobicContact CG1-CD1 4.28Å; V300-L304 WeakPolarHBondContact O-CG 3.34Å; V300-L304 PolarHBondContact O-N 2.95Å; V300-V489 HydrophobicContact CG2-CG2 4.25Å
301	L	91.5	Very high	89.7	Confident	5 Å²	5	48.9 Å²	48.9	3%	0.026	26%	0.261	C	S	.	.	H	α-helix	trans	-61.2	-34.6	177.3	-67.9	-178.8	0	0	0	112.6	L297 N299 A305 V316 I360 L362	L297-L301 HydrophobicContact CD1-CD1 4.45Å; L297-L301 HydrophobicContact CD1-CG 4.29Å; L297-L301 HydrophobicContact CG-CD1 4.32Å; L297-L301 WeakPolarHBondContact O-CB 3.42Å; L297-L301 VanDerWaalsContact O-CG 3.28Å; L297-L301 WeakPolarHBondContact O-CG 3.45Å; L297-L301 PolarHBondContact O-N 3.34Å; N299-L301 PolarHBondContact O-N 2.88Å; L301-A305 VanDerWaalsContact O-CB 3.3Å; L301-A305 WeakPolarHBondContact O-CB 3.3Å; L301-A305 PolarHBondContact O-N 3.29Å; L301-V316 HydrophobicContact CD2-CG1 3.98Å; L301-V316 HydrophobicContact CD2-CG2 3.78Å; L301-I360 HydrophobicContact CB-CD1 4.24Å; L301-L362 HydrophobicContact CD1-CD2 4.48Å
302	R	90.5	Very high	89.4	Confident	117 Å²	117	55.3 Å²	55.3	44%	0.442	29%	0.287	S	S	.	.	H	α-helix	trans	-69.3	-38.2	175	-174	-172.2	-63.4	162.6	-0.4	112	I298 N299 V300 A305 K306	I298-R302 WeakPolarHBondContact O-CB 3.31Å; I298-R302 PolarHBondContact O-N 3.39Å; N299-R302 WeakPolarHBondContact O-CB 3.29Å; N299-R302 PolarHBondContact O-N 2.83Å; N299-R302 VanDerWaalsContact O-N 3.16Å; V300-R302 VanDerWaalsContact C-N 3.26Å; V300-R302 PolarHBondContact O-N 2.86Å; R302-A305 WeakPolarHBondContact O-CB 3.08Å; R302-A305 PolarHBondContact O-N 2.8Å; R302-K306 WeakPolarHBondContact O-CG 3.43Å; R302-K306 PolarHBondContact O-N 2.75Å
303	Q	88.3	Confident	89.4	Confident	73 Å²	73	58.6 Å²	58.6	34%	0.341	30%	0.303	S	S	.	.	H	α-helix	trans	-63.3	-47.9	175.4	-68.9	172.5	25.2	0	0	110.6	N299 V300 A305 K306 L307 F604	N299-Q303 PolarHBondContact ND2-NE2 2.96Å; N299-Q303 WeakPolarHBondContact O-CG 3.39Å; N299-Q303 PolarHBondContact O-N 2.82Å; V300-Q303 WeakPolarHBondContact O-CB 3.33Å; V300-Q303 PolarHBondContact O-N 3.12Å; V300-Q303 VanDerWaalsContact O-N 3.1Å; Q303-A305 PolarHBondContact O-N 2.96Å; Q303-K306 PolarHBondContact O-N 3.38Å; Q303-K306 VanDerWaalsContact O-N 3.11Å; Q303-L307 PolarHBondContact O-N 3.32Å; Q303-F604 HydrophobicContact CB-CE1 4.38Å
304	L	88	Confident	89.5	Confident	5 Å²	5	58.4 Å²	58.4	3%	0.026	30%	0.299	C	S	.	.	H	α-helix	trans	-59.6	-33.6	172.5	-63.6	176.3	0	0	0	111.7	V222 L254 V300 L307 H308 I314	V222-L304 HydrophobicContact CG1-CD1 3.85Å; V222-L304 HydrophobicContact CG2-CB 4.41Å; V222-L304 HydrophobicContact CG2-CD1 3.8Å; L254-L304 HydrophobicContact CD1-CD1 4.06Å; V300-L304 HydrophobicContact CG1-CD1 4.28Å; V300-L304 WeakPolarHBondContact O-CG 3.34Å; V300-L304 PolarHBondContact O-N 2.95Å; L304-L307 HydrophobicContact CD2-CD2 4.39Å; L304-L307 WeakPolarHBondContact O-CB 3.2Å; L304-L307 PolarHBondContact O-N 2.93Å; L304-H308 PolarHBondContact O-CD2 3.48Å; L304-H308 PolarHBondContact O-N 2.96Å; L304-I314 WeakPolarHBondContact O-CD1 3.49Å
305	A	87.9	Confident	89.7	Confident	12 Å²	12	56.9 Å²	56.9	10%	0.099	29%	0.294	C	S	.	.	H	α-helix	trans	-68.2	-36.3	174.3	0	0	0	0	0	115.4	L301 R302 Q303 L307 I314 I360	L301-A305 VanDerWaalsContact O-CB 3.3Å; L301-A305 WeakPolarHBondContact O-CB 3.3Å; L301-A305 PolarHBondContact O-N 3.29Å; R302-A305 WeakPolarHBondContact O-CB 3.08Å; R302-A305 PolarHBondContact O-N 2.8Å; Q303-A305 PolarHBondContact O-N 2.96Å; A305-L307 VanDerWaalsContact C-N 3.33Å; A305-I314 HydrophobicContact CB-CD1 3.96Å; A305-I360 HydrophobicContact CB-CD1 4.14Å; A305-I360 HydrophobicContact CB-CG1 4.2Å
306	K	87.7	Confident	90	Very high	150 Å²	150	54.3 Å²	54.3	65%	0.652	27%	0.267	S	S	*	.	H	α-helix	trans	-69.2	-36.1	171.9	-70.7	176.1	177.1	-176.5	0	111.5	R302 Q303 S309	R302-K306 WeakPolarHBondContact O-CG 3.43Å; R302-K306 PolarHBondContact O-N 2.75Å; Q303-K306 PolarHBondContact O-N 3.38Å; Q303-K306 VanDerWaalsContact O-N 3.11Å; K306-S309 WeakPolarHBondContact O-CB 3.28Å; K306-S309 PolarHBondContact O-N 3.44Å
307	L	85.9	Confident	90.3	Very high	29 Å²	29	53.2 Å²	53.2	15%	0.152	26%	0.258	C	S	.	.	H	α-helix	trans	-60.8	-45.1	-179.4	-161.3	67.9	0	0	0	111.9	L116 Q303 L304 A305 S309 V602 F604	L116-L307 HydrophobicContact CD1-CD1 3.56Å; L116-L307 HydrophobicContact CD1-CD2 4.13Å; L116-L307 HydrophobicContact CD1-CG 3.52Å; L116-L307 HydrophobicContact CD2-CD2 3.66Å; L116-L307 HydrophobicContact CD2-CG 3.8Å; L116-L307 HydrophobicContact CG-CD1 4.42Å; L116-L307 HydrophobicContact CG-CD2 4.17Å; L116-L307 HydrophobicContact CG-CG 4.09Å; Q303-L307 PolarHBondContact O-N 3.32Å; L304-L307 HydrophobicContact CD2-CD2 4.39Å; L304-L307 WeakPolarHBondContact O-CB 3.2Å; L304-L307 PolarHBondContact O-N 2.93Å; A305-L307 VanDerWaalsContact C-N 3.33Å; L307-S309 VanDerWaalsContact C-N 3.31Å; L307-S309 PolarHBondContact O-N 2.73Å; L307-V602 HydrophobicContact CD1-CB 4.09Å; L307-V602 HydrophobicContact CD1-CG1 4.04Å; L307-V602 HydrophobicContact CD1-CG2 4Å; L307-F604 HydrophobicContact CD1-CZ 4.37Å; L307-F604 HydrophobicContact CD2-CE2 4.48Å; L307-F604 HydrophobicContact CD2-CZ 4.2Å
308	H	84.7	Confident	90.5	Very high	19 Å²	19	53.2 Å²	53.2	9%	0.088	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	48.4	176.4	-64.4	-83.2	0	0	0	112.7	H252 L304 D310 R311 I314	H252-H308 AromaticContact CD2-NE2 3.54Å; H252-H308 AromaticContact NE2-CE1 3.88Å; H252-H308 AromaticContact NE2-NE2 3.05Å; H252-H308 PolarHBondContact NE2-NE2 3.18Å; L304-H308 PolarHBondContact O-CD2 3.48Å; L304-H308 PolarHBondContact O-N 2.96Å; H308-D310 PolarHBondContact O-N 3.07Å; H308-D310 VanDerWaalsContact O-N 3.13Å; H308-R311 HydrophobicContact CB-CG 4.48Å; H308-R311 PolarHBondContact O-N 2.74Å; H308-I314 HydrophobicContact CB-CD1 3.65Å; H308-I314 HydrophobicContact CB-CG1 4.16Å
309	S	83.6	Confident	90.6	Very high	89 Å²	89	51.8 Å²	51.8	62%	0.622	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-16.5	178.7	59.4	0	0	0	0	114.6	K306 L307 R311	K306-S309 WeakPolarHBondContact O-CB 3.28Å; K306-S309 PolarHBondContact O-N 3.44Å; L307-S309 VanDerWaalsContact C-N 3.31Å; L307-S309 PolarHBondContact O-N 2.73Å; S309-R311 VanDerWaalsContact C-N 3.3Å
310	D	86.4	Confident	90.8	Very high	97 Å²	97	48 Å²	48	52%	0.519	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-22.3	173.9	62.3	-48.5	0	0	0	112.9	H308	H308-D310 PolarHBondContact O-N 3.07Å; H308-D310 VanDerWaalsContact O-N 3.13Å
311	R	87.2	Confident	90.9	Very high	114 Å²	114	47.6 Å²	47.6	43%	0.43	23%	0.227	S	C	.	.	S	Bend	trans	-92.6	140.1	175.1	-58	-170.9	180	-144	11	110	D221 H308 S309 Q313	D221-R311 IonicContact OD1-CZ 2.64Å; D221-R311 VanDerWaalsContact OD1-CZ 3.3Å; D221-R311 IonicContact OD1-NE 3.71Å; D221-R311 IonicContact OD1-NH1 3.7Å; D221-R311 PolarHBondContact OD1-NH1 3.35Å; D221-R311 IonicContact OD1-NH2 3.74Å; H308-R311 HydrophobicContact CB-CG 4.48Å; H308-R311 PolarHBondContact O-N 2.74Å; S309-R311 VanDerWaalsContact C-N 3.3Å; R311-Q313 VanDerWaalsContact C-N 3.26Å; R311-Q313 PolarHBondContact O-N 3.28Å
312	Q	88.3	Confident	91	Very high	172 Å²	172	48 Å²	48	80%	0.804	23%	0.23	S	C	*	.	S	Bend	trans	-69.3	-30.2	177.8	-67	-173.8	8.8	0	0	112.4
313	Q	92.9	Very high	91.2	Very high	91 Å²	91	44.5 Å²	44.5	43%	0.425	22%	0.22	S	C	.	.			trans	-150.4	156.2	-177.2	69.1	-169.8	29	0	0	109.5	R311 Q359 Y361	R311-Q313 VanDerWaalsContact C-N 3.26Å; R311-Q313 PolarHBondContact O-N 3.28Å; Q313-Q359 CarbonylContact C-O 2.92Å; Q313-Q359 VanDerWaalsContact CA-O 3.26Å; Q313-Q359 WeakPolarHBondContact CA-O 3.19Å; Q313-Y361 HydrophobicContact CB-CD2 3.9Å; Q313-Y361 HydrophobicContact CB-CE2 3.75Å; Q313-Y361 HydrophobicContact CG-CD2 4.12Å; Q313-Y361 HydrophobicContact CG-CE2 4.02Å
314	I	94	Very high	91.5	Very high	7 Å²	7	41 Å²	41	4%	0.036	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	141.2	178.5	-69.1	173.5	0	0	0	108.6	D221 V222 L304 A305 H308 Q359 Y361	D221-I314 HydrophobicContact CB-CG2 3.96Å; D221-I314 WeakPolarHBondContact OD2-CA 3.37Å; V222-I314 HydrophobicContact CG2-CG2 4.22Å; L304-I314 WeakPolarHBondContact O-CD1 3.49Å; A305-I314 HydrophobicContact CB-CD1 3.96Å; H308-I314 HydrophobicContact CB-CD1 3.65Å; H308-I314 HydrophobicContact CB-CG1 4.16Å; I314-Q359 PolarHBondContact N-O 2.86Å; I314-Y361 PolarHBondContact O-N 3.39Å
315	S	96.6	Very high	91.8	Very high	9 Å²	9	41.4 Å²	41.4	6%	0.063	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	130.9	176	-57.2	0	0	0	0	110.8	S219 D221 V222 Y361	S219-S315 VanDerWaalsContact O-CB 3.27Å; S219-S315 WeakPolarHBondContact O-CB 3.31Å; D221-S315 PolarHBondContact N-O 3.27Å; D221-S315 PolarHBondContact OD2-N 3.28Å; V222-S315 PolarHBondContact N-O 3.4Å; S315-Y361 CarbonylContact C-O 3.59Å; S315-Y361 WeakPolarHBondContact CA-O 3.39Å
316	V	97.1	Very high	92.2	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.012	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	113.4	179.8	-175.2	0	0	0	0	108.1	V222 L224 L301 F318 I360 Y361 L362 I363	V222-V316 HydrophobicContact CB-CG1 4.37Å; V222-V316 HydrophobicContact CB-CG2 4.3Å; V222-V316 HydrophobicContact CG1-CG1 4.37Å; V222-V316 CarbonylContact O-C 3.56Å; V222-V316 VanDerWaalsContact O-CA 3.31Å; V222-V316 WeakPolarHBondContact O-CA 3.49Å; L224-V316 HydrophobicContact CD1-CG1 3.56Å; L224-V316 HydrophobicContact CG-CG1 3.65Å; L301-V316 HydrophobicContact CD2-CG1 3.98Å; L301-V316 HydrophobicContact CD2-CG2 3.78Å; V316-F318 HydrophobicContact CG1-CE2 4.46Å; V316-I360 HydrophobicContact CG2-CG2 3.96Å; V316-Y361 PolarHBondContact N-O 3.37Å; V316-L362 HydrophobicContact CB-CD2 3.95Å; V316-L362 HydrophobicContact CG1-CD2 4.47Å; V316-L362 HydrophobicContact CG2-CD2 4.31Å; V316-L362 CarbonylContact O-C 3.58Å; V316-L362 WeakPolarHBondContact O-CA 3.46Å; V316-I363 PolarHBondContact O-N 2.84Å
317	G	97.4	Very high	92.6	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	132.7	178.5	0	0	0	0	0	111.9	V222 V223 L224	V222-G317 PolarHBondContact O-N 3.4Å; V223-G317 WeakPolarHBondContact CA-O 3.32Å; L224-G317 PolarHBondContact N-O 3.49Å
318	F	97.5	Very high	93	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	123.4	172.4	-70.9	-97	0	0	0	109.9	L224 V226 V316 K326 I329 I330 L333 L362 I363 C365	L224-F318 HydrophobicContact CB-CD1 4.24Å; L224-F318 HydrophobicContact CB-CE1 4.38Å; L224-F318 HydrophobicContact CD1-CD1 4.31Å; L224-F318 HydrophobicContact CD1-CE1 3.66Å; L224-F318 HydrophobicContact CD1-CE2 4.39Å; L224-F318 HydrophobicContact CD1-CZ 3.71Å; L224-F318 WeakPolarHBondContact O-CA 3.44Å; V226-F318 HydrophobicContact CG2-CD1 3.86Å; V316-F318 HydrophobicContact CG1-CE2 4.46Å; F318-K326 HydrophobicContact CB-CB 4.29Å; F318-K326 HydrophobicContact CB-CD 4.38Å; F318-K326 HydrophobicContact CB-CG 4.4Å; F318-I329 HydrophobicContact CE1-CB 4.29Å; F318-I329 HydrophobicContact CE1-CG2 3.66Å; F318-I329 HydrophobicContact CZ-CG2 4.23Å; F318-I330 HydrophobicContact CD2-CD1 3.83Å; F318-I330 HydrophobicContact CD2-CG1 3.88Å; F318-I330 HydrophobicContact CE2-CD1 4.16Å; F318-I330 HydrophobicContact CE2-CG1 3.73Å; F318-I330 HydrophobicContact CG-CD1 4.31Å; F318-I330 HydrophobicContact CG-CG1 4.36Å; F318-I330 HydrophobicContact CZ-CG1 4.07Å; F318-L333 HydrophobicContact CZ-CD1 3.93Å; F318-L362 HydrophobicContact CE2-CB 3.99Å; F318-L362 HydrophobicContact CE2-CD1 4.27Å; F318-L362 HydrophobicContact CE2-CD2 4.03Å; F318-L362 HydrophobicContact CE2-CG 4.29Å; F318-I363 PolarHBondContact N-O 2.72Å; F318-C365 WeakPolarHBondContact O-CB 3.28Å
319	V	95.9	Very high	93.6	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	155	179.9	179.2	0	0	0	0	109.5	L213 L217 V223 L224 E225 V226 V240 I368	L213-V319 HydrophobicContact CD1-CB 4.4Å; L213-V319 HydrophobicContact CD1-CG1 3.64Å; L213-V319 HydrophobicContact CD1-CG2 3.83Å; L217-V319 HydrophobicContact CD2-CG2 3.97Å; V223-V319 HydrophobicContact CG1-CB 4.3Å; V223-V319 HydrophobicContact CG1-CG2 3.94Å; L224-V319 PolarHBondContact O-N 3.3Å; E225-V319 WeakPolarHBondContact CA-O 3.4Å; V226-V319 PolarHBondContact N-O 3.19Å; V240-V319 HydrophobicContact CG1-CG1 4.48Å; V319-I368 HydrophobicContact CG1-CD1 3.68Å; V319-I368 HydrophobicContact CG1-CG1 4.33Å
320	G	94.7	Very high	94.3	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.15	C	C	.	.			trans	147.3	176.3	176.6	0	0	0	0	0	113.2	K326 I368	G320-K326 PolarHBondContact O-NZ 2.78Å; G320-I368 PolarHBondContact O-N 3.21Å
321	F	93.8	Very high	94.8	Very high	9 Å²	9	26 Å²	26	4%	0.039	13%	0.129	C	C	.	.			trans	-58.9	159.5	-178.8	-86.8	-112.7	0	0	0	113.1	T235 C237 V324 K326 V369 K382 V384	T235-F321 WeakPolarHBondContact O-CD2 3.46Å; T235-F321 WeakPolarHBondContact O-CE2 3.41Å; C237-F321 WeakPolarHBondContact SG-CE2 3.39Å; F321-V324 HydrophobicContact CB-CG1 3.63Å; F321-V324 WeakPolarHBondContact O-CG2 3.41Å; F321-K326 PolarHBondContact O-NZ 3.21Å; F321-V369 HydrophobicContact CD1-CG2 4.03Å; F321-V369 HydrophobicContact CE1-CG1 4.17Å; F321-V369 HydrophobicContact CE1-CG2 4.13Å; F321-K382 HydrophobicContact CE1-CD 4.18Å; F321-V384 HydrophobicContact CD1-CG2 4.04Å; F321-V384 HydrophobicContact CE1-CG2 4.46Å
322	P	93.8	Very high	95.2	Very high	12 Å²	12	20.6 Å²	20.6	8%	0.078	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	151.2	165.6	-23.8	34.5	0	0	0	111.7	V324 A345 V369 V384	P322-V324 PolarHBondContact O-N 2.86Å; P322-A345 HydrophobicContact CB-CB 4.26Å; P322-V369 HydrophobicContact CG-CG2 4.12Å; P322-V384 HydrophobicContact CG-CG1 4.37Å; P322-V384 HydrophobicContact CG-CG2 4.36Å
323	N	93.8	Very high	95.6	Very high	44 Å²	44	12.6 Å²	12.6	24%	0.235	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.2	4.4	174.5	-66.7	-11.4	0	0	0	118	K259 G325 G383	K259-N323 WeakPolarHBondContact CE-O 3.5Å; K259-N323 PolarHBondContact NZ-O 2.94Å; N323-G325 PolarHBondContact O-N 3.45Å; N323-G383 PolarHBondContact ND2-O 2.97Å
324	V	94.8	Very high	95.7	Very high	1 Å²	1	12.3 Å²	12.3	1%	0.006	7%	0.066	C	C	.	.	S	Bend	trans	-66.5	-20.3	171.9	-58.1	0	0	0	0	113.1	V226 D228 N258 F321 P322 K326	V226-V324 HydrophobicContact CB-CG2 3.87Å; V226-V324 HydrophobicContact CG1-CB 4.1Å; V226-V324 HydrophobicContact CG1-CG2 3.71Å; D228-V324 HydrophobicContact CB-CG1 4.43Å; N258-V324 PolarHBondContact ND2-O 2.99Å; F321-V324 HydrophobicContact CB-CG1 3.63Å; F321-V324 WeakPolarHBondContact O-CG2 3.41Å; P322-V324 PolarHBondContact O-N 2.86Å; V324-K326 HydrophobicContact CG2-CG 3.77Å
325	G	94.4	Very high	95.6	Very high	13 Å²	13	15.4 Å²	15.4	13%	0.134	9%	0.089	C	C	.	.			trans	104.7	23.2	174.9	0	0	0	0	0	116.4	N323 S327 S328 I329	N323-G325 PolarHBondContact O-N 3.45Å; G325-S327 PolarHBondContact O-N 3.07Å; G325-S328 WeakPolarHBondContact O-CB 3.31Å; G325-S328 PolarHBondContact O-N 3.27Å; G325-S328 VanDerWaalsContact O-N 3.1Å; G325-I329 WeakPolarHBondContact O-CG1 3.47Å; G325-I329 PolarHBondContact O-N 2.9Å
326	K	95.4	Very high	95.5	Very high	13 Å²	13	21.7 Å²	21.7	6%	0.057	12%	0.115	C	C	.	.	H	α-helix	trans	-47.3	-57.5	177	-63.2	-174.9	-68.6	-74	0	113.5	V226 F318 G320 F321 V324 S328 I329 I330 C365	V226-K326 HydrophobicContact CB-CG 4.1Å; V226-K326 HydrophobicContact CG2-CG 4.02Å; F318-K326 HydrophobicContact CB-CB 4.29Å; F318-K326 HydrophobicContact CB-CD 4.38Å; F318-K326 HydrophobicContact CB-CG 4.4Å; G320-K326 PolarHBondContact O-NZ 2.78Å; F321-K326 PolarHBondContact O-NZ 3.21Å; V324-K326 HydrophobicContact CG2-CG 3.77Å; K326-S328 VanDerWaalsContact C-N 3.29Å; K326-S328 PolarHBondContact O-N 2.87Å; K326-I329 PolarHBondContact O-N 3.26Å; K326-I330 PolarHBondContact O-N 3.22Å; K326-C365 WeakPolarHBondContact CE-O 3.39Å
327	S	95.8	Very high	95.4	Very high	12 Å²	12	28.3 Å²	28.3	8%	0.084	14%	0.144	C	C	.	.	H	α-helix	trans	-64.8	-31.7	179.9	-48.1	0	0	0	0	112.8	G325 I330 N331 T348 D364	G325-S327 PolarHBondContact O-N 3.07Å; S327-I330 PolarHBondContact O-N 3.43Å; S327-N331 PolarHBondContact O-N 3.14Å; S327-N331 VanDerWaalsContact O-N 3.09Å; S327-N331 PolarHBondContact O-ND2 3.25Å; S327-T348 PolarHBondContact OG-OG1 3.28Å; S327-T348 VanDerWaalsContact OG-OG1 3.08Å; S327-D364 WeakPolarHBondContact CB-OD2 3.44Å; S327-D364 PolarHBondContact OG-OD1 3.08Å; S327-D364 PolarHBondContact OG-OD2 2.99Å
328	S	95.9	Very high	95.4	Very high	32 Å²	32	31 Å²	31	22%	0.224	16%	0.16	C	C	.	.	H	α-helix	trans	-67.7	-40.5	175	-53.7	0	0	0	0	112	G325 K326 I330 N331 A332 V341	G325-S328 WeakPolarHBondContact O-CB 3.31Å; G325-S328 PolarHBondContact O-N 3.27Å; G325-S328 VanDerWaalsContact O-N 3.1Å; K326-S328 VanDerWaalsContact C-N 3.29Å; K326-S328 PolarHBondContact O-N 2.87Å; S328-I330 VanDerWaalsContact C-N 3.33Å; S328-I330 PolarHBondContact O-N 3.1Å; S328-N331 PolarHBondContact O-N 3.31Å; S328-A332 WeakPolarHBondContact O-CB 3.11Å; S328-A332 PolarHBondContact O-N 3.39Å; S328-V341 WeakPolarHBondContact OG-CG1 3.21Å
329	I	97.1	Very high	95.3	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-61.8	-43	175.7	-65.4	163.7	0	0	0	110.3	V226 V256 N258 F284 A286 L297 F318 G325 K326 N331 A332 L333	V226-I329 HydrophobicContact CB-CD1 4.27Å; V226-I329 HydrophobicContact CG1-CD1 3.45Å; V226-I329 VanDerWaalsContact CG1-CD1 3.45Å; V226-I329 HydrophobicContact CG2-CD1 3.73Å; V256-I329 HydrophobicContact CG1-CD1 4.11Å; N258-I329 HydrophobicContact CB-CD1 4.08Å; F284-I329 HydrophobicContact CD1-CB 4.49Å; F284-I329 HydrophobicContact CD1-CG1 3.78Å; F284-I329 HydrophobicContact CD1-CG2 4.28Å; F284-I329 HydrophobicContact CE1-CB 4.15Å; F284-I329 HydrophobicContact CE1-CG1 3.89Å; F284-I329 HydrophobicContact CE1-CG2 3.86Å; F284-I329 HydrophobicContact CE2-CG2 4.43Å; F284-I329 HydrophobicContact CZ-CG2 3.95Å; A286-I329 HydrophobicContact CB-CG1 3.94Å; L297-I329 HydrophobicContact CD2-CG2 4.24Å; F318-I329 HydrophobicContact CE1-CB 4.29Å; F318-I329 HydrophobicContact CE1-CG2 3.66Å; F318-I329 HydrophobicContact CZ-CG2 4.23Å; G325-I329 WeakPolarHBondContact O-CG1 3.47Å; G325-I329 PolarHBondContact O-N 2.9Å; K326-I329 PolarHBondContact O-N 3.26Å; I329-N331 VanDerWaalsContact C-N 3.34Å; I329-N331 PolarHBondContact O-N 2.94Å; I329-A332 PolarHBondContact O-N 2.79Å; I329-L333 HydrophobicContact CG2-CD1 4.05Å; I329-L333 HydrophobicContact CG2-CG 4.38Å; I329-L333 WeakPolarHBondContact O-CB 3.45Å; I329-L333 WeakPolarHBondContact O-CG 3.39Å; I329-L333 PolarHBondContact O-N 3.47Å
330	I	96.8	Very high	95.3	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-60.3	-45.2	176.6	-65.3	171.3	0	0	0	110.8	F318 K326 S327 S328 A332 L333 R334 V354 L362 D364	F318-I330 HydrophobicContact CD2-CD1 3.83Å; F318-I330 HydrophobicContact CD2-CG1 3.88Å; F318-I330 HydrophobicContact CE2-CD1 4.16Å; F318-I330 HydrophobicContact CE2-CG1 3.73Å; F318-I330 HydrophobicContact CG-CD1 4.31Å; F318-I330 HydrophobicContact CG-CG1 4.36Å; F318-I330 HydrophobicContact CZ-CG1 4.07Å; K326-I330 PolarHBondContact O-N 3.22Å; S327-I330 PolarHBondContact O-N 3.43Å; S328-I330 VanDerWaalsContact C-N 3.33Å; S328-I330 PolarHBondContact O-N 3.1Å; I330-A332 PolarHBondContact O-N 2.95Å; I330-L333 PolarHBondContact O-N 3.2Å; I330-R334 WeakPolarHBondContact O-CB 3.49Å; I330-R334 WeakPolarHBondContact O-CG 3.21Å; I330-R334 PolarHBondContact O-N 3.44Å; I330-V354 HydrophobicContact CG2-CB 4.1Å; I330-V354 HydrophobicContact CG2-CG1 3.93Å; I330-V354 HydrophobicContact CG2-CG2 4.11Å; I330-L362 HydrophobicContact CG1-CD1 4.44Å; I330-L362 HydrophobicContact CG2-CD1 4.21Å; I330-D364 HydrophobicContact CD1-CB 3.51Å
331	N	97	Very high	95.3	Very high	14 Å²	14	38.8 Å²	38.8	8%	0.075	20%	0.204	C	C	.	.	H	α-helix	trans	-62.9	-41	176.8	-72.9	-19.7	0	0	0	112.4	S327 S328 I329 R334 S335 K336 V338 C339 V341	S327-N331 PolarHBondContact O-N 3.14Å; S327-N331 VanDerWaalsContact O-N 3.09Å; S327-N331 PolarHBondContact O-ND2 3.25Å; S328-N331 PolarHBondContact O-N 3.31Å; I329-N331 VanDerWaalsContact C-N 3.34Å; I329-N331 PolarHBondContact O-N 2.94Å; N331-R334 CarbonylContact O-C 3.53Å; N331-R334 PolarHBondContact O-N 3.38Å; N331-S335 PolarHBondContact O-N 2.88Å; N331-K336 WeakPolarHBondContact CA-O 3.19Å; N331-K336 PolarHBondContact O-N 2.87Å; N331-K336 PolarHBondContact OD1-O 3.25Å; N331-V338 PolarHBondContact OD1-N 2.83Å; N331-C339 PolarHBondContact ND2-O 3.32Å; N331-C339 PolarHBondContact OD1-N 2.9Å; N331-V341 WeakPolarHBondContact ND2-CG2 3.03Å
332	A	96.3	Very high	95.3	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.008	21%	0.214	C	C	.	.	H	α-helix	trans	-64.4	-42.4	176.1	0	0	0	0	0	112.1	F284 D287 P291 K294 S328 I329 I330 R334 S335	F284-A332 HydrophobicContact CE1-CB 4.03Å; F284-A332 HydrophobicContact CZ-CB 4.15Å; D287-A332 WeakPolarHBondContact O-CB 3.36Å; P291-A332 HydrophobicContact CB-CB 4.29Å; K294-A332 WeakPolarHBondContact CE-O 3.48Å; K294-A332 PolarHBondContact NZ-O 2.92Å; S328-A332 WeakPolarHBondContact O-CB 3.11Å; S328-A332 PolarHBondContact O-N 3.39Å; I329-A332 PolarHBondContact O-N 2.79Å; I330-A332 PolarHBondContact O-N 2.95Å; A332-R334 VanDerWaalsContact C-N 3.34Å; A332-R334 PolarHBondContact O-N 3.15Å; A332-S335 PolarHBondContact O-N 3.08Å
333	L	95.9	Very high	95.2	Very high	5 Å²	5	42.9 Å²	42.9	3%	0.026	23%	0.234	C	C	.	.	H	α-helix	trans	-61.7	-42.4	174.1	-74	171.2	0	0	0	111.5	K294 L297 I298 F318 I329 I330 S335 L356 L362	K294-L333 WeakPolarHBondContact CE-O 3.42Å; K294-L333 HydrophobicContact CG-CD2 4.35Å; K294-L333 PolarHBondContact NZ-O 2.9Å; L297-L333 HydrophobicContact CD2-CD1 3.98Å; L297-L333 HydrophobicContact CD2-CD2 4.08Å; L297-L333 HydrophobicContact CD2-CG 4.43Å; L297-L333 HydrophobicContact CG-CD2 4.4Å; I298-L333 HydrophobicContact CD1-CD2 4.23Å; I298-L333 HydrophobicContact CG1-CD2 3.82Å; F318-L333 HydrophobicContact CZ-CD1 3.93Å; I329-L333 HydrophobicContact CG2-CD1 4.05Å; I329-L333 HydrophobicContact CG2-CG 4.38Å; I329-L333 WeakPolarHBondContact O-CB 3.45Å; I329-L333 WeakPolarHBondContact O-CG 3.39Å; I329-L333 PolarHBondContact O-N 3.47Å; I330-L333 PolarHBondContact O-N 3.2Å; L333-S335 VanDerWaalsContact C-N 3.33Å; L333-S335 PolarHBondContact O-N 2.78Å; L333-L356 HydrophobicContact CB-CD1 4.09Å; L333-L362 HydrophobicContact CB-CD1 4.44Å; L333-L362 HydrophobicContact CD1-CD1 3.94Å
334	R	94.9	Very high	95.1	Very high	84 Å²	84	43.9 Å²	43.9	32%	0.317	24%	0.238	S	C	.	.	H	α-helix	trans	-76.2	-13.9	178.1	-72.9	-58.8	-52.4	-91.7	-3.1	114.7	I330 N331 A332 K336 V338 V354 T355	I330-R334 WeakPolarHBondContact O-CB 3.49Å; I330-R334 WeakPolarHBondContact O-CG 3.21Å; I330-R334 PolarHBondContact O-N 3.44Å; N331-R334 CarbonylContact O-C 3.53Å; N331-R334 PolarHBondContact O-N 3.38Å; A332-R334 VanDerWaalsContact C-N 3.34Å; A332-R334 PolarHBondContact O-N 3.15Å; R334-K336 PolarHBondContact O-N 3.45Å; R334-K336 VanDerWaalsContact O-N 3.15Å; R334-V338 HydrophobicContact CB-CG2 4.07Å; R334-V338 HydrophobicContact CG-CG2 4.11Å; R334-V354 HydrophobicContact CG-CG1 3.84Å; R334-T355 WeakPolarHBondContact CD-O 3.5Å; R334-T355 PolarHBondContact NE-O 3.36Å; R334-T355 PolarHBondContact NH1-O 2.9Å
335	S	93.1	Very high	94.8	Very high	73 Å²	73	44.1 Å²	44.1	51%	0.51	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	26.1	-169.1	-75	0	0	0	0	113.4	K294 N331 A332 L333	K294-S335 PolarHBondContact NZ-OG 3.2Å; N331-S335 PolarHBondContact O-N 2.88Å; A332-S335 PolarHBondContact O-N 3.08Å; L333-S335 VanDerWaalsContact C-N 3.33Å; L333-S335 PolarHBondContact O-N 2.78Å
336	K	95	Very high	94.5	Very high	141 Å²	141	45.5 Å²	45.5	61%	0.613	26%	0.255	S	S	*	.	S	Bend	trans	-152.6	148.7	177.4	-176.3	173.9	178	176.2	0	109.6	L288 N331 R334 V338	L288-K336 VanDerWaalsContact CD1-N 3.35Å; N331-K336 WeakPolarHBondContact CA-O 3.19Å; N331-K336 PolarHBondContact O-N 2.87Å; N331-K336 PolarHBondContact OD1-O 3.25Å; R334-K336 PolarHBondContact O-N 3.45Å; R334-K336 VanDerWaalsContact O-N 3.15Å; K336-V338 HydrophobicContact CB-CG2 4.49Å; K336-V338 PolarHBondContact O-N 3.29Å; K336-V338 VanDerWaalsContact O-N 3.1Å
337	K	95	Very high	94.4	Very high	140 Å²	140	48.6 Å²	48.6	61%	0.609	27%	0.27	S	S	*	.			trans	-68.1	102.8	168.5	-169.2	176.5	-177.3	178.4	0	109.7
338	V	95.4	Very high	94.3	Very high	56 Å²	56	49.3 Å²	49.3	34%	0.339	27%	0.274	S	S	.	.			trans	-109	-45.7	176.7	-179.9	0	0	0	0	110.3	N331 R334 K336 V354	N331-V338 PolarHBondContact OD1-N 2.83Å; R334-V338 HydrophobicContact CB-CG2 4.07Å; R334-V338 HydrophobicContact CG-CG2 4.11Å; K336-V338 HydrophobicContact CB-CG2 4.49Å; K336-V338 PolarHBondContact O-N 3.29Å; K336-V338 VanDerWaalsContact O-N 3.1Å; V338-V354 HydrophobicContact CB-CG1 4.49Å; V338-V354 HydrophobicContact CG1-CB 4.48Å; V338-V354 HydrophobicContact CG1-CG1 3.88Å; V338-V354 HydrophobicContact CG1-CG2 3.79Å
339	C	96	Very high	94.1	Very high	1 Å²	1	53.9 Å²	53.9	1%	0.007	29%	0.289	C	S	.	.	S	Bend	trans	-93.4	145.3	174.8	-59.8	0	0	0	0	110.2	N331	N331-C339 PolarHBondContact ND2-O 3.32Å; N331-C339 PolarHBondContact OD1-N 2.9Å
340	N	95.8	Very high	94	Very high	103 Å²	103	57.2 Å²	57.2	55%	0.551	31%	0.31	S	S	*	.			trans	-69.5	139.1	170	-70.4	-11.5	0	0	0	109.6	E347	N340-E347 HydrophobicContact CB-CG 4.29Å; N340-E347 WeakPolarHBondContact CB-OE1 3.49Å
341	V	94.9	Very high	93.8	Very high	61 Å²	61	59.4 Å²	59.4	37%	0.37	32%	0.318	S	S	.	.			trans	-136.7	132.8	-179.5	179.6	0	0	0	0	107.3	S328 N331	S328-V341 WeakPolarHBondContact OG-CG1 3.21Å; N331-V341 WeakPolarHBondContact ND2-CG2 3.03Å
342	A	93.8	Very high	93.7	Very high	30 Å²	30	63.3 Å²	63.3	25%	0.248	34%	0.336	C	S	.	.			trans	-142.4	154.2	172.2	0	0	0	0	0	108.3	I344 E347	A342-I344 PolarHBondContact O-N 2.91Å; A342-E347 HydrophobicContact CB-CB 4.31Å; A342-E347 HydrophobicContact CB-CG 4.06Å
343	P	91.4	Very high	93.7	Very high	77 Å²	77	68.5 Å²	68.5	50%	0.5	36%	0.356	S	S	.	.	S	Bend	trans	-73.1	10.5	174.5	32.2	-35.9	0	0	0	113.1	R456	P343-R456 HydrophobicContact CB-CG 4.25Å
344	I	92	Very high	93.7	Very high	64 Å²	64	68.6 Å²	68.6	33%	0.328	36%	0.356	S	S	.	.	S	Bend	trans	-107.5	136.9	-173.9	-54	172.9	0	0	0	108.7	A342 R386	A342-I344 PolarHBondContact O-N 2.91Å; I344-R386 HydrophobicContact CG2-CG 3.67Å; I344-R386 VanDerWaalsContact CG2-NE 3.33Å
345	A	88.9	Confident	93.7	Very high	7 Å²	7	67.9 Å²	67.9	6%	0.058	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	142.3	175.8	0	0	0	0	0	112.4	P322 V384 R386	P322-A345 HydrophobicContact CB-CB 4.26Å; A345-V384 WeakPolarHBondContact CB-O 3.39Å; A345-R386 PolarHBondContact O-NE 3Å; A345-R386 PolarHBondContact O-NH2 2.77Å; A345-R386 VanDerWaalsContact O-NH2 3.16Å
346	G	87.6	Confident	93.6	Very high	42 Å²	42	66 Å²	66	43%	0.433	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.2	21.4	174.9	0	0	0	0	0	115.7
347	E	94	Very high	93.4	Very high	78 Å²	78	63 Å²	63	36%	0.364	34%	0.335	S	S	.	.			trans	-62	-53.4	172.1	-177.6	57.1	-157.3	0	0	111.2	N340 A342 K349	N340-E347 HydrophobicContact CB-CG 4.29Å; N340-E347 WeakPolarHBondContact CB-OE1 3.49Å; A342-E347 HydrophobicContact CB-CB 4.31Å; A342-E347 HydrophobicContact CB-CG 4.06Å; E347-K349 PolarHBondContact O-N 2.9Å
348	T	93.3	Very high	93.1	Very high	27 Å²	27	66.8 Å²	66.8	17%	0.166	35%	0.345	C	S	.	.			trans	-78.7	108.8	173.2	-52.9	0	0	0	0	109.8	S327 P366	S327-T348 PolarHBondContact OG-OG1 3.28Å; S327-T348 VanDerWaalsContact OG-OG1 3.08Å; T348-P366 WeakPolarHBondContact O-CB 3.44Å
349	K	92.1	Very high	92.9	Very high	128 Å²	128	69.1 Å²	69.1	56%	0.557	35%	0.352	S	S	*	.			trans	-99.8	-27.1	-177.5	-65	179.8	-175.9	175.3	0	114.3	R208 E347	R208-K349 PolarHBondContact NH1-O 3.24Å; R208-K349 PolarHBondContact NH2-O 2.95Å; E347-K349 PolarHBondContact O-N 2.9Å
350	V	94.2	Very high	92.9	Very high	70 Å²	70	69.4 Å²	69.4	42%	0.424	35%	0.354	S	S	.	.	S	Bend	trans	-137.5	142.5	-172.7	179.2	0	0	0	0	107.4
351	W	93.7	Very high	92.9	Very high	46 Å²	46	67.3 Å²	67.3	17%	0.174	34%	0.338	C	S	.	.			trans	-60.9	149.9	176.6	76.5	-39.4	0	0	0	112.8	E212 K215 V216 Y353 I363 D364	E212-W351 PolarHBondContact OE2-N 3.34Å; K215-W351 HydrophobicContact CD-CD2 4.05Å; K215-W351 HydrophobicContact CD-CE3 4.41Å; K215-W351 HydrophobicContact CD-CH2 4.05Å; K215-W351 HydrophobicContact CD-CZ2 3.7Å; K215-W351 HydrophobicContact CD-CZ3 4.4Å; K215-W351 VanDerWaalsContact CE-CE2 3.45Å; K215-W351 HydrophobicContact CG-CE3 4.4Å; K215-W351 HydrophobicContact CG-CH2 4.07Å; K215-W351 HydrophobicContact CG-CZ2 4.24Å; K215-W351 HydrophobicContact CG-CZ3 4.17Å; K215-W351 VanDerWaalsContact NZ-CE2 3.28Å; K215-W351 VanDerWaalsContact NZ-NE1 3.13Å; V216-W351 HydrophobicContact CG2-CB 3.78Å; V216-W351 HydrophobicContact CG2-CD2 4.43Å; V216-W351 HydrophobicContact CG2-CE3 3.89Å; V216-W351 HydrophobicContact CG2-CG 4.41Å; W351-Y353 HydrophobicContact CE3-CE2 4.31Å; W351-Y353 HydrophobicContact CH2-CD2 4.35Å; W351-Y353 AromaticContact CH2-CE2 3.45Å; W351-Y353 HydrophobicContact CH2-CE2 3.45Å; W351-Y353 VanDerWaalsContact CH2-CE2 3.45Å; W351-Y353 HydrophobicContact CZ2-CE2 4.16Å; W351-Y353 HydrophobicContact CZ3-CD2 4.39Å; W351-Y353 AromaticContact CZ3-CE2 3.52Å; W351-Y353 HydrophobicContact CZ3-CE2 3.52Å; W351-Y353 AromaticContact CZ3-CZ 3.93Å; W351-I363 HydrophobicContact CB-CG2 4.42Å; W351-I363 HydrophobicContact CE3-CG2 3.62Å; W351-I363 HydrophobicContact CZ3-CD1 4.41Å; W351-I363 HydrophobicContact CZ3-CG2 4.3Å; W351-D364 WeakPolarHBondContact CA-O 3.4Å; W351-D364 WeakPolarHBondContact CB-O 3.49Å
352	Q	94.9	Very high	93	Very high	96 Å²	96	64.4 Å²	64.4	45%	0.449	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	138.8	-179.1	-60.9	-177.2	3.6	0	0	111.6	I363 D364	Q352-I363 WeakPolarHBondContact O-CA 3.37Å; Q352-D364 PolarHBondContact N-O 2.83Å; Q352-D364 PolarHBondContact O-N 3.28Å
353	Y	95.9	Very high	93.2	Very high	110 Å²	110	63 Å²	63	43%	0.431	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	126.9	173.2	-86.9	-79.9	0	0	0	111.6	S219 W351 Y361 L362 I363	S219-Y353 WeakPolarHBondContact CB-OH 3.39Å; W351-Y353 HydrophobicContact CE3-CE2 4.31Å; W351-Y353 HydrophobicContact CH2-CD2 4.35Å; W351-Y353 AromaticContact CH2-CE2 3.45Å; W351-Y353 HydrophobicContact CH2-CE2 3.45Å; W351-Y353 VanDerWaalsContact CH2-CE2 3.45Å; W351-Y353 HydrophobicContact CZ2-CE2 4.16Å; W351-Y353 HydrophobicContact CZ3-CD2 4.39Å; W351-Y353 AromaticContact CZ3-CE2 3.52Å; W351-Y353 HydrophobicContact CZ3-CE2 3.52Å; W351-Y353 AromaticContact CZ3-CZ 3.93Å; Y353-Y361 HydrophobicContact CD1-CD1 4.3Å; Y353-L362 WeakPolarHBondContact CA-O 3.34Å; Y353-I363 HydrophobicContact CD1-CD1 4.3Å; Y353-I363 HydrophobicContact CD1-CG1 3.72Å; Y353-I363 HydrophobicContact CE1-CD1 3.48Å; Y353-I363 VanDerWaalsContact CE1-CD1 3.48Å; Y353-I363 HydrophobicContact CE1-CG1 3.41Å; Y353-I363 VanDerWaalsContact CE1-CG1 3.41Å; Y353-I363 HydrophobicContact CG-CG1 4.48Å
354	V	95.8	Very high	93.4	Very high	6 Å²	6	59.3 Å²	59.3	4%	0.036	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	124.1	175.8	177.5	0	0	0	0	109.5	I330 R334 V338 L362	I330-V354 HydrophobicContact CG2-CB 4.1Å; I330-V354 HydrophobicContact CG2-CG1 3.93Å; I330-V354 HydrophobicContact CG2-CG2 4.11Å; R334-V354 HydrophobicContact CG-CG1 3.84Å; V338-V354 HydrophobicContact CB-CG1 4.49Å; V338-V354 HydrophobicContact CG1-CB 4.48Å; V338-V354 HydrophobicContact CG1-CG1 3.88Å; V338-V354 HydrophobicContact CG1-CG2 3.79Å; V354-L362 HydrophobicContact CB-CB 4.32Å; V354-L362 PolarHBondContact N-O 3.27Å; V354-L362 PolarHBondContact O-N 2.79Å
355	T	94.4	Very high	93.6	Very high	70 Å²	70	56.3 Å²	56.3	43%	0.429	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	124.5	178	57.8	0	0	0	0	110.6	R334 Y361	R334-T355 WeakPolarHBondContact CD-O 3.5Å; R334-T355 PolarHBondContact NE-O 3.36Å; R334-T355 PolarHBondContact NH1-O 2.9Å; T355-Y361 HydrophobicContact CG2-CD1 3.67Å; T355-Y361 HydrophobicContact CG2-CE1 3.28Å
356	L	92.1	Very high	93.8	Very high	32 Å²	32	56.1 Å²	56.1	17%	0.168	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	-53.9	172.3	-179.2	63.9	0	0	0	110.4	L333 I360 L362	L333-L356 HydrophobicContact CB-CD1 4.09Å; L356-I360 HydrophobicContact CB-CG2 4.48Å; L356-I360 PolarHBondContact N-O 3.18Å; L356-L362 HydrophobicContact CB-CD1 4.08Å; L356-L362 HydrophobicContact CB-CD2 4.37Å; L356-L362 HydrophobicContact CB-CG 4.03Å; L356-L362 HydrophobicContact CD2-CD1 4.42Å; L356-L362 HydrophobicContact CD2-CD2 4.38Å
357	M	90.6	Very high	94	Very high	78 Å²	78	54.9 Å²	54.9	38%	0.384	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	169.3	174.8	-63.2	-176.7	-177.8	0	0	108.5	I298 Q359 I360	I298-M357 HydrophobicContact CG2-CE 3.84Å; M357-Q359 PolarHBondContact O-N 2.75Å; M357-I360 HydrophobicContact CB-CB 4.47Å; M357-I360 PolarHBondContact N-O 3.4Å; M357-I360 PolarHBondContact O-N 3.25Å; M357-I360 VanDerWaalsContact O-N 3.1Å; M357-I360 VanDerWaalsContact O-O 3.06Å; M357-I360 HydrophobicContact SD-CD1 4.39Å
358	R	88.5	Confident	93.9	Very high	220 Å²	220	51.2 Å²	51.2	83%	0.83	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-28.5	178.6	-165.1	179.7	75.5	169	1.4	113.5
359	Q	91.8	Very high	93.8	Very high	105 Å²	105	50 Å²	50	49%	0.491	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-10.8	-179	-68.7	-179.9	-41	0	0	114	Q313 I314 M357	Q313-Q359 CarbonylContact C-O 2.92Å; Q313-Q359 VanDerWaalsContact CA-O 3.26Å; Q313-Q359 WeakPolarHBondContact CA-O 3.19Å; I314-Q359 PolarHBondContact N-O 2.86Å; M357-Q359 PolarHBondContact O-N 2.75Å
360	I	94.6	Very high	93.6	Very high	7 Å²	7	48 Å²	48	4%	0.036	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	117.7	-171.8	-56.5	174.4	0	0	0	109.5	L301 A305 V316 L356 M357 L362	L301-I360 HydrophobicContact CB-CD1 4.24Å; A305-I360 HydrophobicContact CB-CD1 4.14Å; A305-I360 HydrophobicContact CB-CG1 4.2Å; V316-I360 HydrophobicContact CG2-CG2 3.96Å; L356-I360 HydrophobicContact CB-CG2 4.48Å; L356-I360 PolarHBondContact N-O 3.18Å; M357-I360 HydrophobicContact CB-CB 4.47Å; M357-I360 PolarHBondContact N-O 3.4Å; M357-I360 PolarHBondContact O-N 3.25Å; M357-I360 VanDerWaalsContact O-N 3.1Å; M357-I360 VanDerWaalsContact O-O 3.06Å; M357-I360 HydrophobicContact SD-CD1 4.39Å; I360-L362 HydrophobicContact CG2-CD2 4.12Å
361	Y	96.6	Very high	93.1	Very high	59 Å²	59	48 Å²	48	23%	0.231	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	135.1	172.5	-70.9	-92.3	0	0	0	109.5	Q313 I314 S315 V316 Y353 T355	Q313-Y361 HydrophobicContact CB-CD2 3.9Å; Q313-Y361 HydrophobicContact CB-CE2 3.75Å; Q313-Y361 HydrophobicContact CG-CD2 4.12Å; Q313-Y361 HydrophobicContact CG-CE2 4.02Å; I314-Y361 PolarHBondContact O-N 3.39Å; S315-Y361 CarbonylContact C-O 3.59Å; S315-Y361 WeakPolarHBondContact CA-O 3.39Å; V316-Y361 PolarHBondContact N-O 3.37Å; Y353-Y361 HydrophobicContact CD1-CD1 4.3Å; T355-Y361 HydrophobicContact CG2-CD1 3.67Å; T355-Y361 HydrophobicContact CG2-CE1 3.28Å
362	L	97.4	Very high	92.4	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	142.2	172.7	-52.3	-176.7	0	0	0	108.3	L301 V316 F318 I330 L333 Y353 V354 L356 I360	L301-L362 HydrophobicContact CD1-CD2 4.48Å; V316-L362 HydrophobicContact CB-CD2 3.95Å; V316-L362 HydrophobicContact CG1-CD2 4.47Å; V316-L362 HydrophobicContact CG2-CD2 4.31Å; V316-L362 CarbonylContact O-C 3.58Å; V316-L362 WeakPolarHBondContact O-CA 3.46Å; F318-L362 HydrophobicContact CE2-CB 3.99Å; F318-L362 HydrophobicContact CE2-CD1 4.27Å; F318-L362 HydrophobicContact CE2-CD2 4.03Å; F318-L362 HydrophobicContact CE2-CG 4.29Å; I330-L362 HydrophobicContact CG1-CD1 4.44Å; I330-L362 HydrophobicContact CG2-CD1 4.21Å; L333-L362 HydrophobicContact CB-CD1 4.44Å; L333-L362 HydrophobicContact CD1-CD1 3.94Å; Y353-L362 WeakPolarHBondContact CA-O 3.34Å; V354-L362 HydrophobicContact CB-CB 4.32Å; V354-L362 PolarHBondContact N-O 3.27Å; V354-L362 PolarHBondContact O-N 2.79Å; L356-L362 HydrophobicContact CB-CD1 4.08Å; L356-L362 HydrophobicContact CB-CD2 4.37Å; L356-L362 HydrophobicContact CB-CG 4.03Å; L356-L362 HydrophobicContact CD2-CD1 4.42Å; L356-L362 HydrophobicContact CD2-CD2 4.38Å; I360-L362 HydrophobicContact CG2-CD2 4.12Å
363	I	97.3	Very high	91.6	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	116.6	176.7	-53.1	175.2	0	0	0	108	V216 V316 F318 W351 Q352 Y353	V216-I363 HydrophobicContact CB-CG2 4.34Å; V216-I363 HydrophobicContact CG1-CB 4.3Å; V216-I363 HydrophobicContact CG1-CG2 3.88Å; V216-I363 HydrophobicContact CG2-CG2 3.8Å; V316-I363 PolarHBondContact O-N 2.84Å; F318-I363 PolarHBondContact N-O 2.72Å; W351-I363 HydrophobicContact CB-CG2 4.42Å; W351-I363 HydrophobicContact CE3-CG2 3.62Å; W351-I363 HydrophobicContact CZ3-CD1 4.41Å; W351-I363 HydrophobicContact CZ3-CG2 4.3Å; Q352-I363 WeakPolarHBondContact O-CA 3.37Å; Y353-I363 HydrophobicContact CD1-CD1 4.3Å; Y353-I363 HydrophobicContact CD1-CG1 3.72Å; Y353-I363 HydrophobicContact CE1-CD1 3.48Å; Y353-I363 VanDerWaalsContact CE1-CD1 3.48Å; Y353-I363 HydrophobicContact CE1-CG1 3.41Å; Y353-I363 VanDerWaalsContact CE1-CG1 3.41Å; Y353-I363 HydrophobicContact CG-CG1 4.48Å
364	D	96.7	Very high	90.8	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	138.8	171.5	-161	7.4	0	0	0	109.8	S327 I330 W351 Q352	S327-D364 WeakPolarHBondContact CB-OD2 3.44Å; S327-D364 PolarHBondContact OG-OD1 3.08Å; S327-D364 PolarHBondContact OG-OD2 2.99Å; I330-D364 HydrophobicContact CD1-CB 3.51Å; W351-D364 WeakPolarHBondContact CA-O 3.4Å; W351-D364 WeakPolarHBondContact CB-O 3.49Å; Q352-D364 PolarHBondContact N-O 2.83Å; Q352-D364 PolarHBondContact O-N 3.28Å
365	C	94.3	Very high	90.4	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	26%	0.256	C	S	.	.			trans	-120.9	144	180	-175.3	0	0	0	0	109.7	V216 F318 K326	V216-C365 HydrophobicContact CG1-CB 4.36Å; V216-C365 HydrophobicContact CG2-CB 4.01Å; F318-C365 WeakPolarHBondContact O-CB 3.28Å; K326-C365 WeakPolarHBondContact CE-O 3.39Å
366	P	94.5	Very high	90.1	Very high	4 Å²	4	46.4 Å²	46.4	3%	0.026	25%	0.247	C	C	.	.			trans	-54.7	152	165.5	25.2	-35.7	0	0	0	111.4	I209 E212 T348	I209-P366 HydrophobicContact CG2-CB 4.22Å; I209-P366 HydrophobicContact CG2-CG 4.1Å; E212-P366 HydrophobicContact CB-CG 3.89Å; T348-P366 WeakPolarHBondContact O-CB 3.44Å
367	G	91.7	Very high	90	Very high	16 Å²	16	47.8 Å²	47.8	17%	0.165	25%	0.253	C	S	.	.			trans	-65.9	135.1	174.9	0	0	0	0	0	111.9
368	I	91.6	Very high	90	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	25%	0.25	C	C	.	.			trans	-109.6	148	-178.7	57.9	161.5	0	0	0	110.2	I209 L213 C237 V240 V319 G320	I209-I368 HydrophobicContact CG2-CG2 3.93Å; L213-I368 HydrophobicContact CB-CG2 4.05Å; L213-I368 HydrophobicContact CD1-CD1 4.06Å; L213-I368 HydrophobicContact CD1-CG2 4.12Å; L213-I368 HydrophobicContact CD2-CD1 3.81Å; L213-I368 HydrophobicContact CD2-CG2 4.03Å; L213-I368 HydrophobicContact CG-CG2 4.26Å; C237-I368 HydrophobicContact CB-CD1 4.44Å; V240-I368 HydrophobicContact CG2-CD1 3.73Å; V319-I368 HydrophobicContact CG1-CD1 3.68Å; V319-I368 HydrophobicContact CG1-CG1 4.33Å; G320-I368 PolarHBondContact O-N 3.21Å
369	V	91.3	Very high	90.1	Very high	1 Å²	1	37 Å²	37	1%	0.006	21%	0.212	C	C	.	.			trans	-136.7	123.7	171.3	179.9	0	0	0	0	107.6	Q205 F321 P322 L379 V384	Q205-V369 WeakPolarHBondContact CG-O 3.15Å; F321-V369 HydrophobicContact CD1-CG2 4.03Å; F321-V369 HydrophobicContact CE1-CG1 4.17Å; F321-V369 HydrophobicContact CE1-CG2 4.13Å; P322-V369 HydrophobicContact CG-CG2 4.12Å; V369-L379 HydrophobicContact CG1-CD2 3.78Å; V369-V384 HydrophobicContact CG2-CB 4.25Å; V369-V384 HydrophobicContact CG2-CG1 3.59Å; V369-V384 HydrophobicContact CG2-CG2 3.61Å
370	Y	87.3	Confident	90.2	Very high	85 Å²	85	32.1 Å²	32.1	33%	0.333	19%	0.189	S	C	.	.			trans	-81.8	136.3	176.3	-154.6	-78.3	0	0	0	109.9	W210 N239 T372	W210-Y370 AromaticContact CH2-CD2 3.35Å; W210-Y370 HydrophobicContact CH2-CD2 3.35Å; W210-Y370 AromaticContact CH2-CE2 3.79Å; W210-Y370 HydrophobicContact CH2-CE2 3.79Å; W210-Y370 HydrophobicContact CH2-CG 4.27Å; W210-Y370 AromaticContact CZ2-CD2 3.86Å; W210-Y370 HydrophobicContact CZ2-CD2 3.86Å; W210-Y370 HydrophobicContact CZ2-CE2 4.3Å; W210-Y370 HydrophobicContact CZ2-CG 4.44Å; W210-Y370 HydrophobicContact CZ3-CD2 4.28Å; W210-Y370 HydrophobicContact CZ3-CE2 4.39Å; N239-Y370 HydrophobicContact CB-CD1 4.48Å; N239-Y370 HydrophobicContact CB-CD2 3.4Å; N239-Y370 VanDerWaalsContact CB-CD2 3.4Å; N239-Y370 HydrophobicContact CB-CE1 4.44Å; N239-Y370 HydrophobicContact CB-CE2 3.39Å; N239-Y370 HydrophobicContact CB-CG 4.03Å; N239-Y370 WeakPolarHBondContact ND2-CD1 3.39Å; N239-Y370 WeakPolarHBondContact ND2-CE1 3.42Å; N239-Y370 WeakPolarHBondContact ND2-CE2 3.4Å; N239-Y370 PolarHBondContact ND2-OH 3.02Å; Y370-T372 HydrophobicContact CD1-CG2 3.72Å; Y370-T372 HydrophobicContact CG-CG2 4.28Å; Y370-T372 PolarHBondContact O-N 2.79Å
371	P	83.4	Confident	90.1	Very high	70 Å²	70	31.9 Å²	31.9	46%	0.455	19%	0.187	S	C	.	.			trans	-74	76.5	173.7	31.4	-35.6	0	0	0	110.5	G373	P371-G373 VanDerWaalsContact C-N 3.35Å
372	T	80.6	Confident	89.8	Confident	80 Å²	80	30.3 Å²	30.3	49%	0.491	18%	0.182	S	C	.	.	S	Bend	trans	-90.5	6.9	178.7	47.9	0	0	0	0	113.7	Y370 N374	Y370-T372 HydrophobicContact CD1-CG2 3.72Å; Y370-T372 HydrophobicContact CG-CG2 4.28Å; Y370-T372 PolarHBondContact O-N 2.79Å; T372-N374 PolarHBondContact OG1-ND2 2.89Å; T372-N374 PolarHBondContact OG1-OD1 3.41Å
373	G	78	Confident	89.4	Confident	78 Å²	78	30.4 Å²	30.4	80%	0.804	18%	0.183	S	C	*	.			trans	78.9	24	-172.2	0	0	0	0	0	114	P371	P371-G373 VanDerWaalsContact C-N 3.35Å
374	N	78.4	Confident	89.1	Confident	40 Å²	40	30.9 Å²	30.9	21%	0.214	19%	0.185	C	C	.	.			trans	-59.6	140.6	175.1	-57.3	-42.5	0	0	0	110.9	T372 L379	T372-N374 PolarHBondContact OG1-ND2 2.89Å; T372-N374 PolarHBondContact OG1-OD1 3.41Å; N374-L379 HydrophobicContact CB-CD2 4.27Å; N374-L379 HydrophobicContact CB-CG 4.29Å
375	S	87.2	Confident	88.8	Confident	43 Å²	43	31 Å²	31	30%	0.301	19%	0.186	S	C	.	.			trans	-63	155.6	172.2	72.8	0	0	0	0	111.5	E377 Q378 L379	S375-E377 VanDerWaalsContact C-N 3.26Å; S375-E377 PolarHBondContact O-N 3.03Å; S375-E377 PolarHBondContact OG-OE2 3.22Å; S375-Q378 PolarHBondContact O-N 3.02Å; S375-Q378 WeakPolarHBondContact OG-CG 3.49Å; S375-Q378 PolarHBondContact OG-N 3.01Å; S375-L379 PolarHBondContact O-N 2.8Å
376	E	88.6	Confident	88.7	Confident	54 Å²	54	35.7 Å²	35.7	25%	0.252	20%	0.204	S	C	.	.	H	α-helix	trans	-59.5	-39.9	179.5	-64.2	-171	172	0	0	111.7	Q197 F201 Q378 L379 I380 Y396	Q197-E376 WeakPolarHBondContact CG-OE1 3.37Å; Q197-E376 PolarHBondContact NE2-OE1 2.93Å; F201-E376 HydrophobicContact CD1-CB 4.19Å; F201-E376 HydrophobicContact CD1-CG 4.24Å; F201-E376 HydrophobicContact CD2-CG 4.12Å; F201-E376 HydrophobicContact CE1-CB 3.76Å; F201-E376 HydrophobicContact CE1-CG 4.18Å; F201-E376 HydrophobicContact CE2-CB 4.31Å; F201-E376 VanDerWaalsContact CE2-CD 3.47Å; F201-E376 HydrophobicContact CE2-CG 4.06Å; F201-E376 VanDerWaalsContact CE2-OE2 3.28Å; F201-E376 WeakPolarHBondContact CE2-OE2 3.43Å; F201-E376 HydrophobicContact CG-CG 4.21Å; F201-E376 HydrophobicContact CZ-CB 3.83Å; F201-E376 HydrophobicContact CZ-CG 4.1Å; E376-Q378 VanDerWaalsContact C-N 3.33Å; E376-Q378 PolarHBondContact O-N 3.35Å; E376-L379 PolarHBondContact O-N 3.1Å; E376-I380 WeakPolarHBondContact O-CG1 3.08Å; E376-I380 PolarHBondContact O-N 3.07Å; E376-Y396 HydrophobicContact CB-CE1 4.28Å; E376-Y396 PolarHBondContact OE2-OH 3.37Å
377	E	90.5	Very high	88.6	Confident	61 Å²	61	35.5 Å²	35.5	29%	0.285	20%	0.203	S	C	.	.	H	α-helix	trans	-56.2	-47.3	175.7	-54.7	137.9	-173.7	0	0	111	S375 L379 I380 L381 Y396 H399	S375-E377 VanDerWaalsContact C-N 3.26Å; S375-E377 PolarHBondContact O-N 3.03Å; S375-E377 PolarHBondContact OG-OE2 3.22Å; E377-L379 VanDerWaalsContact C-N 3.31Å; E377-L379 PolarHBondContact O-N 3.45Å; E377-I380 PolarHBondContact O-N 2.84Å; E377-L381 WeakPolarHBondContact O-CB 3.37Å; E377-L381 VanDerWaalsContact O-CG 3.22Å; E377-L381 WeakPolarHBondContact O-CG 3.48Å; E377-L381 PolarHBondContact O-N 3.24Å; E377-Y396 HydrophobicContact CB-CD1 4.24Å; E377-Y396 HydrophobicContact CG-CD1 3.69Å; E377-Y396 HydrophobicContact CG-CE1 4.12Å; E377-H399 IonicContact OE1-CE1 3.83Å; E377-H399 PolarHBondContact OE1-CE1 3.4Å; E377-H399 IonicContact OE1-ND1 3.88Å; E377-H399 IonicContact OE1-NE2 2.9Å; E377-H399 PolarHBondContact OE1-NE2 3.23Å; E377-H399 IonicContact OE2-CD2 3.32Å; E377-H399 IonicContact OE2-CE1 3.99Å; E377-H399 IonicContact OE2-NE2 3.74Å; E377-H399 PolarHBondContact OE2-NE2 2.95Å
378	Q	90.2	Very high	88.6	Confident	67 Å²	67	39 Å²	39	31%	0.313	22%	0.215	S	C	.	.	H	α-helix	trans	-63.7	-38	-178.9	-70.7	179.7	16.3	0	0	111.6	S375 E376 K382	S375-Q378 PolarHBondContact O-N 3.02Å; S375-Q378 WeakPolarHBondContact OG-CG 3.49Å; S375-Q378 PolarHBondContact OG-N 3.01Å; E376-Q378 VanDerWaalsContact C-N 3.33Å; E376-Q378 PolarHBondContact O-N 3.35Å; Q378-K382 VanDerWaalsContact O-CB 3.27Å; Q378-K382 WeakPolarHBondContact O-CB 3.42Å; Q378-K382 WeakPolarHBondContact O-CD 3.22Å; Q378-K382 WeakPolarHBondContact O-CG 3.45Å; Q378-K382 PolarHBondContact O-N 3.23Å
379	L	91	Very high	88.6	Confident	6 Å²	6	42.9 Å²	42.9	3%	0.031	24%	0.236	C	C	.	.	H	α-helix	trans	-66.3	-39	177	-67.4	175	0	0	0	111.8	F201 V369 N374 S375 E376 E377 G383 V384	F201-L379 HydrophobicContact CB-CD1 4.23Å; F201-L379 HydrophobicContact CD1-CB 4.42Å; F201-L379 HydrophobicContact CD1-CD1 4.25Å; V369-L379 HydrophobicContact CG1-CD2 3.78Å; N374-L379 HydrophobicContact CB-CD2 4.27Å; N374-L379 HydrophobicContact CB-CG 4.29Å; S375-L379 PolarHBondContact O-N 2.8Å; E376-L379 PolarHBondContact O-N 3.1Å; E377-L379 VanDerWaalsContact C-N 3.31Å; E377-L379 PolarHBondContact O-N 3.45Å; L379-G383 PolarHBondContact O-N 3.48Å; L379-V384 HydrophobicContact CD2-CG2 4.28Å; L379-V384 WeakPolarHBondContact O-CB 3.43Å; L379-V384 PolarHBondContact O-N 3.14Å; L379-V384 VanDerWaalsContact O-N 3.12Å
380	I	92.6	Very high	88.6	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-66.9	-50.3	175.7	-65.9	168.5	0	0	0	110	F201 E376 E377 K382 G383 V390 Y396 L451 Q455	F201-I380 HydrophobicContact CE1-CD1 3.8Å; F201-I380 HydrophobicContact CE1-CG1 3.79Å; F201-I380 HydrophobicContact CZ-CD1 4.05Å; E376-I380 WeakPolarHBondContact O-CG1 3.08Å; E376-I380 PolarHBondContact O-N 3.07Å; E377-I380 PolarHBondContact O-N 2.84Å; I380-K382 VanDerWaalsContact C-N 3.31Å; I380-K382 PolarHBondContact O-N 2.71Å; I380-G383 PolarHBondContact O-N 2.55Å; I380-V390 HydrophobicContact CD1-CG1 4.38Å; I380-V390 HydrophobicContact CD1-CG2 4.37Å; I380-Y396 HydrophobicContact CD1-CD1 3.74Å; I380-Y396 HydrophobicContact CD1-CD2 3.51Å; I380-Y396 HydrophobicContact CD1-CE1 3.63Å; I380-Y396 HydrophobicContact CD1-CE2 3.39Å; I380-Y396 HydrophobicContact CD1-CG 3.67Å; I380-Y396 VanDerWaalsContact CD1-CZ 3.44Å; I380-L451 HydrophobicContact CG2-CD1 4.31Å; I380-L451 HydrophobicContact CG2-CD2 4.08Å; I380-Q455 PolarHBondContact O-NE2 3.48Å
381	L	92.3	Very high	88.7	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.01	25%	0.247	C	C	.	.	H	α-helix	trans	-64.7	-34.3	-177	-65.9	174.5	0	0	0	112.5	E377 G383 H399 V400 R403 L451 F454	E377-L381 WeakPolarHBondContact O-CB 3.37Å; E377-L381 VanDerWaalsContact O-CG 3.22Å; E377-L381 WeakPolarHBondContact O-CG 3.48Å; E377-L381 PolarHBondContact O-N 3.24Å; L381-G383 PolarHBondContact O-N 3.25Å; L381-H399 HydrophobicContact CD1-CB 4.05Å; L381-V400 HydrophobicContact CD2-CG2 3.58Å; L381-R403 VanDerWaalsContact CD1-CZ 3.42Å; L381-L451 HydrophobicContact CD2-CD2 4.49Å; L381-F454 HydrophobicContact CB-CE1 3.95Å; L381-F454 HydrophobicContact CD2-CD1 3.9Å; L381-F454 HydrophobicContact CD2-CE1 3.6Å; L381-F454 HydrophobicContact CD2-CZ 4.11Å; L381-F454 HydrophobicContact CG-CE1 4.34Å
382	K	90	Very high	89.1	Confident	27 Å²	27	46.4 Å²	46.4	12%	0.117	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-7.9	173.4	-70	172.6	-172.6	-178.6	0	113.5	G234 F321 Q378 I380 V384	G234-K382 WeakPolarHBondContact O-CE 3.27Å; G234-K382 PolarHBondContact O-NZ 2.87Å; F321-K382 HydrophobicContact CE1-CD 4.18Å; Q378-K382 VanDerWaalsContact O-CB 3.27Å; Q378-K382 WeakPolarHBondContact O-CB 3.42Å; Q378-K382 WeakPolarHBondContact O-CD 3.22Å; Q378-K382 WeakPolarHBondContact O-CG 3.45Å; Q378-K382 PolarHBondContact O-N 3.23Å; I380-K382 VanDerWaalsContact C-N 3.31Å; I380-K382 PolarHBondContact O-N 2.71Å; K382-V384 HydrophobicContact CB-CG2 4.35Å
383	G	89.5	Confident	89.7	Confident	2 Å²	2	42.6 Å²	42.6	2%	0.021	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.7	30.5	177.7	0	0	0	0	0	114.2	N323 L379 I380 L381	N323-G383 PolarHBondContact ND2-O 2.97Å; L379-G383 PolarHBondContact O-N 3.48Å; I380-G383 PolarHBondContact O-N 2.55Å; L381-G383 PolarHBondContact O-N 3.25Å
384	V	90.7	Very high	90.4	Very high	9 Å²	9	40.2 Å²	40.2	6%	0.055	20%	0.195	C	C	.	.			trans	-75.7	-37.3	174.9	174.5	0	0	0	0	111.1	F321 P322 A345 V369 L379 K382	F321-V384 HydrophobicContact CD1-CG2 4.04Å; F321-V384 HydrophobicContact CE1-CG2 4.46Å; P322-V384 HydrophobicContact CG-CG1 4.37Å; P322-V384 HydrophobicContact CG-CG2 4.36Å; A345-V384 WeakPolarHBondContact CB-O 3.39Å; V369-V384 HydrophobicContact CG2-CB 4.25Å; V369-V384 HydrophobicContact CG2-CG1 3.59Å; V369-V384 HydrophobicContact CG2-CG2 3.61Å; L379-V384 HydrophobicContact CD2-CG2 4.28Å; L379-V384 WeakPolarHBondContact O-CB 3.43Å; L379-V384 PolarHBondContact O-N 3.14Å; L379-V384 VanDerWaalsContact O-N 3.12Å; K382-V384 HydrophobicContact CB-CG2 4.35Å
385	V	91.2	Very high	91.1	Very high	4 Å²	4	43.8 Å²	43.8	2%	0.024	21%	0.211	C	C	.	.	S	Bend	trans	-100.8	146.6	-172.7	174.2	0	0	0	0	110.3	L200 F201 V387 V390	L200-V385 HydrophobicContact CD1-CG1 3.98Å; L200-V385 HydrophobicContact CD2-CG1 3.37Å; L200-V385 HydrophobicContact CG-CG1 3.48Å; L200-V385 VanDerWaalsContact CG-CG1 3.48Å; F201-V385 HydrophobicContact CD1-CG2 3.95Å; F201-V385 HydrophobicContact CE1-CG2 4.33Å; V385-V387 PolarHBondContact O-N 3.49Å; V385-V390 HydrophobicContact CG1-CG2 3.97Å
386	R	92.1	Very high	91.4	Very high	98 Å²	98	42.7 Å²	42.7	37%	0.37	20%	0.2	S	C	.	.			trans	-77.8	115	170.2	-64.8	-171.9	-177.7	-172.3	-8.9	109	I344 A345 E388 N389	I344-R386 HydrophobicContact CG2-CG 3.67Å; I344-R386 VanDerWaalsContact CG2-NE 3.33Å; A345-R386 PolarHBondContact O-NE 3Å; A345-R386 PolarHBondContact O-NH2 2.77Å; A345-R386 VanDerWaalsContact O-NH2 3.16Å; R386-E388 WeakPolarHBondContact CB-OE2 3.45Å; R386-E388 PolarHBondContact O-N 3.24Å; R386-E388 VanDerWaalsContact O-N 3.14Å; R386-N389 PolarHBondContact O-N 3.13Å; R386-N389 VanDerWaalsContact O-N 3.1Å
387	V	92.4	Very high	91.7	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.006	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-58.3	-27.3	-175.5	-178.8	0	0	0	0	111.9	V385 N389 V390 R448 L451	V385-V387 PolarHBondContact O-N 3.49Å; V387-N389 PolarHBondContact O-N 3.04Å; V387-V390 PolarHBondContact O-N 2.97Å; V387-R448 HydrophobicContact CG1-CB 3.97Å; V387-R448 HydrophobicContact CG1-CG 4.01Å; V387-L451 HydrophobicContact CG1-CB 3.71Å; V387-L451 HydrophobicContact CG1-CD1 3.82Å; V387-L451 HydrophobicContact CG1-CG 4.44Å; V387-L451 HydrophobicContact CG2-CB 4.13Å
388	E	91.9	Very high	91.9	Very high	89 Å²	89	42.3 Å²	42.3	42%	0.416	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-64.9	-26.6	179.4	-58.5	77.9	-164.4	0	0	113.5	R386	R386-E388 WeakPolarHBondContact CB-OE2 3.45Å; R386-E388 PolarHBondContact O-N 3.24Å; R386-E388 VanDerWaalsContact O-N 3.14Å
389	N	91.8	Very high	92	Very high	82 Å²	82	42 Å²	42	44%	0.439	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-95.9	-2.1	-176.9	-60.4	-39.2	0	0	0	113.2	L200 R386 V387	L200-N389 HydrophobicContact CD1-CB 3.85Å; L200-N389 HydrophobicContact CD2-CB 3.78Å; L200-N389 WeakPolarHBondContact CD2-O 3.31Å; L200-N389 HydrophobicContact CG-CB 4.49Å; R386-N389 PolarHBondContact O-N 3.13Å; R386-N389 VanDerWaalsContact O-N 3.1Å; V387-N389 PolarHBondContact O-N 3.04Å
390	V	91.6	Very high	92.1	Very high	6 Å²	6	41.7 Å²	41.7	4%	0.036	20%	0.195	C	C	.	.			trans	-73.8	127.6	177.6	179.9	0	0	0	0	108.1	L200 I380 V385 V387 Y396	L200-V390 HydrophobicContact CD2-CG2 4.11Å; I380-V390 HydrophobicContact CD1-CG1 4.38Å; I380-V390 HydrophobicContact CD1-CG2 4.37Å; V385-V390 HydrophobicContact CG1-CG2 3.97Å; V387-V390 PolarHBondContact O-N 2.97Å; V390-Y396 HydrophobicContact CG1-CD2 4.13Å; V390-Y396 HydrophobicContact CG1-CE2 3.55Å
391	K	89.6	Confident	92.1	Very high	123 Å²	123	43.1 Å²	43.1	54%	0.535	20%	0.202	S	C	.	.	S	Bend	trans	-62.3	-55.6	-177.8	-64.4	-175.7	-172.7	177.2	0	111.2	E195 P393	E195-K391 IonicContact OE1-NZ 2.73Å; E195-K391 PolarHBondContact OE1-NZ 2.99Å; K391-P393 VanDerWaalsContact O-CD 3.26Å; K391-P393 WeakPolarHBondContact O-CD 3.49Å
392	E	91.1	Very high	92.2	Very high	102 Å²	102	49.9 Å²	49.9	48%	0.477	23%	0.234	S	C	.	.			trans	-121.9	80.1	-173.1	-64.1	-175.7	-169.9	0	0	110.4	S394 E395 Y396	E392-S394 PolarHBondContact O-N 3.32Å; E392-E395 HydrophobicContact CB-CG 4.33Å; E392-Y396 WeakPolarHBondContact O-CD2 3.48Å; E392-Y396 VanDerWaalsContact O-CE2 3.26Å; E392-Y396 WeakPolarHBondContact O-CE2 3.38Å
393	P	93.5	Very high	92.2	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-16.9	-177.9	27.5	-35.9	0	0	0	114.1	K391 N444 A447 R448 L451	K391-P393 VanDerWaalsContact O-CD 3.26Å; K391-P393 WeakPolarHBondContact O-CD 3.49Å; P393-N444 WeakPolarHBondContact CD-OD1 3.09Å; P393-N444 HydrophobicContact CG-CB 4.2Å; P393-A447 HydrophobicContact CB-CB 3.87Å; P393-A447 HydrophobicContact CG-CB 4.03Å; P393-R448 HydrophobicContact CB-CG 4.01Å; P393-R448 HydrophobicContact CG-CG 3.82Å; P393-L451 HydrophobicContact CB-CD1 3.92Å
394	S	93.2	Very high	92.4	Very high	28 Å²	28	52.9 Å²	52.9	20%	0.196	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-40.4	-178.7	43.2	0	0	0	0	112.9	E392 Y396 I397	E392-S394 PolarHBondContact O-N 3.32Å; S394-Y396 PolarHBondContact O-N 3.47Å; S394-Y396 VanDerWaalsContact O-N 3.16Å; S394-I397 WeakPolarHBondContact O-CB 3.38Å; S394-I397 PolarHBondContact O-N 2.87Å; S394-I397 VanDerWaalsContact O-N 3.1Å
395	E	92	Very high	92.4	Very high	114 Å²	114	55.4 Å²	55.4	53%	0.533	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-30.5	-176.9	-57.5	-171	144.5	0	0	112.8	E392	E392-E395 HydrophobicContact CB-CG 4.33Å
396	Y	93.9	Very high	92.4	Very high	21 Å²	21	60.8 Å²	60.8	8%	0.082	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-6.7	-176.6	-50.2	-70	0	0	0	113.6	E376 E377 I380 V390 E392 S394 H399	E376-Y396 HydrophobicContact CB-CE1 4.28Å; E376-Y396 PolarHBondContact OE2-OH 3.37Å; E377-Y396 HydrophobicContact CB-CD1 4.24Å; E377-Y396 HydrophobicContact CG-CD1 3.69Å; E377-Y396 HydrophobicContact CG-CE1 4.12Å; I380-Y396 HydrophobicContact CD1-CD1 3.74Å; I380-Y396 HydrophobicContact CD1-CD2 3.51Å; I380-Y396 HydrophobicContact CD1-CE1 3.63Å; I380-Y396 HydrophobicContact CD1-CE2 3.39Å; I380-Y396 HydrophobicContact CD1-CG 3.67Å; I380-Y396 VanDerWaalsContact CD1-CZ 3.44Å; V390-Y396 HydrophobicContact CG1-CD2 4.13Å; V390-Y396 HydrophobicContact CG1-CE2 3.55Å; E392-Y396 WeakPolarHBondContact O-CD2 3.48Å; E392-Y396 VanDerWaalsContact O-CE2 3.26Å; E392-Y396 WeakPolarHBondContact O-CE2 3.38Å; S394-Y396 PolarHBondContact O-N 3.47Å; S394-Y396 VanDerWaalsContact O-N 3.16Å; Y396-H399 PolarHBondContact O-N 3.45Å
397	I	94.8	Very high	92.4	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-72.2	-33.9	-176.5	-63	-58.6	0	0	0	111.6	S394 H399 V400 L401 A421 F424 L425 A447 V450 L451	S394-I397 WeakPolarHBondContact O-CB 3.38Å; S394-I397 PolarHBondContact O-N 2.87Å; S394-I397 VanDerWaalsContact O-N 3.1Å; I397-H399 PolarHBondContact O-N 3.34Å; I397-V400 WeakPolarHBondContact O-CA 3.46Å; I397-V400 WeakPolarHBondContact O-CB 3.39Å; I397-V400 PolarHBondContact O-N 3.5Å; I397-L401 HydrophobicContact CG2-CD1 4.34Å; I397-L401 HydrophobicContact CG2-CG 4.27Å; I397-L401 WeakPolarHBondContact O-CG 3.27Å; I397-L401 PolarHBondContact O-N 2.62Å; I397-A421 HydrophobicContact CB-CB 4.41Å; I397-A421 HydrophobicContact CG2-CB 4.25Å; I397-F424 HydrophobicContact CG2-CD1 4.34Å; I397-L425 HydrophobicContact CB-CD1 4.27Å; I397-L425 HydrophobicContact CG1-CD1 3.97Å; I397-L425 HydrophobicContact CG1-CD2 4.21Å; I397-L425 HydrophobicContact CG2-CD1 4.33Å; I397-L425 HydrophobicContact CG2-CD2 4.24Å; I397-L425 HydrophobicContact CG2-CG 4.26Å; I397-A447 HydrophobicContact CD1-CB 3.97Å; I397-A447 HydrophobicContact CG1-CB 3.77Å; I397-V450 HydrophobicContact CD1-CB 4Å; I397-V450 HydrophobicContact CD1-CG1 3.99Å; I397-L451 HydrophobicContact CD1-CD1 4.47Å; I397-L451 HydrophobicContact CD1-CD2 4.11Å; I397-L451 HydrophobicContact CD1-CG 3.82Å
398	E	94	Very high	92.3	Very high	107 Å²	107	60.7 Å²	60.7	50%	0.5	28%	0.276	S	S	.	.	H	α-helix	trans	-54.2	-42.8	174.3	-176.6	168.2	-167	0	0	111.4	V400 L401 H402 A421	E398-V400 VanDerWaalsContact C-N 3.29Å; E398-V400 PolarHBondContact O-N 3.25Å; E398-L401 PolarHBondContact O-N 3.17Å; E398-H402 VanDerWaalsContact CG-CE1 3.44Å; E398-H402 WeakPolarHBondContact CG-CE1 3.46Å; E398-H402 PolarHBondContact O-N 3.02Å; E398-H402 PolarHBondContact O-ND1 2.84Å; E398-H402 IonicContact OE1-CE1 3.9Å; E398-A421 HydrophobicContact CB-CB 4.15Å
399	H	92.6	Very high	92.4	Very high	60 Å²	60	56.5 Å²	56.5	28%	0.278	26%	0.256	S	S	.	.	H	α-helix	trans	-66.7	-27.2	177.1	-64.8	86.9	0	0	0	113.8	E377 L381 Y396 I397 R403	E377-H399 IonicContact OE1-CE1 3.83Å; E377-H399 PolarHBondContact OE1-CE1 3.4Å; E377-H399 IonicContact OE1-ND1 3.88Å; E377-H399 IonicContact OE1-NE2 2.9Å; E377-H399 PolarHBondContact OE1-NE2 3.23Å; E377-H399 IonicContact OE2-CD2 3.32Å; E377-H399 IonicContact OE2-CE1 3.99Å; E377-H399 IonicContact OE2-NE2 3.74Å; E377-H399 PolarHBondContact OE2-NE2 2.95Å; L381-H399 HydrophobicContact CD1-CB 4.05Å; Y396-H399 PolarHBondContact O-N 3.45Å; I397-H399 PolarHBondContact O-N 3.34Å; H399-R403 WeakPolarHBondContact O-CG 3.48Å
400	V	93.9	Very high	92.4	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-72.3	-45	172.4	178.5	0	0	0	0	110.1	L381 I397 E398 H402 R403 V404 V450 L451 F454 L459	L381-V400 HydrophobicContact CD2-CG2 3.58Å; I397-V400 WeakPolarHBondContact O-CA 3.46Å; I397-V400 WeakPolarHBondContact O-CB 3.39Å; I397-V400 PolarHBondContact O-N 3.5Å; E398-V400 VanDerWaalsContact C-N 3.29Å; E398-V400 PolarHBondContact O-N 3.25Å; V400-H402 VanDerWaalsContact C-N 3.28Å; V400-H402 PolarHBondContact O-N 3.25Å; V400-R403 PolarHBondContact O-N 3.42Å; V400-R403 VanDerWaalsContact O-N 3.11Å; V400-V404 HydrophobicContact CG1-CG2 4.01Å; V400-V404 WeakPolarHBondContact O-CG2 3.37Å; V400-V404 PolarHBondContact O-N 2.71Å; V400-V450 HydrophobicContact CG1-CG1 4.28Å; V400-L451 HydrophobicContact CG2-CD2 3.86Å; V400-F454 HydrophobicContact CG1-CB 4.4Å; V400-F454 HydrophobicContact CG1-CD2 3.73Å; V400-F454 HydrophobicContact CG1-CE2 4.31Å; V400-F454 HydrophobicContact CG1-CG 4.24Å; V400-F454 HydrophobicContact CG2-CG 4.49Å; V400-L459 HydrophobicContact CG1-CD1 4.42Å
401	L	93.3	Very high	92.4	Very high	30 Å²	30	61.3 Å²	61.3	16%	0.157	27%	0.272	C	S	.	.	H	α-helix	trans	-62	-35.8	179.9	-64	178.3	0	0	0	112.1	I397 E398 R403 V404 L409 A421 F424	I397-L401 HydrophobicContact CG2-CD1 4.34Å; I397-L401 HydrophobicContact CG2-CG 4.27Å; I397-L401 WeakPolarHBondContact O-CG 3.27Å; I397-L401 PolarHBondContact O-N 2.62Å; E398-L401 PolarHBondContact O-N 3.17Å; L401-R403 VanDerWaalsContact C-N 3.34Å; L401-R403 PolarHBondContact O-N 3.18Å; L401-V404 VanDerWaalsContact O-O 3.12Å; L401-L409 HydrophobicContact CD2-CD1 3.48Å; L401-L409 VanDerWaalsContact CD2-CD1 3.48Å; L401-L409 HydrophobicContact CD2-CD2 4.43Å; L401-A421 HydrophobicContact CD1-CB 3.97Å; L401-F424 HydrophobicContact CD1-CB 4.38Å; L401-F424 HydrophobicContact CD2-CD1 4.05Å; L401-F424 HydrophobicContact CD2-CD2 4.49Å; L401-F424 HydrophobicContact CD2-CE1 4.16Å; L401-F424 HydrophobicContact CD2-CG 4.22Å; L401-F424 HydrophobicContact CD2-CZ 4.42Å
402	H	92.5	Very high	92.5	Very high	145 Å²	145	58.1 Å²	58.1	67%	0.671	26%	0.263	S	S	*	.	H	α-helix	trans	-69	-27.8	175.3	-75.8	96.8	0	0	0	113.9	E398 V400	E398-H402 VanDerWaalsContact CG-CE1 3.44Å; E398-H402 WeakPolarHBondContact CG-CE1 3.46Å; E398-H402 PolarHBondContact O-N 3.02Å; E398-H402 PolarHBondContact O-ND1 2.84Å; E398-H402 IonicContact OE1-CE1 3.9Å; V400-H402 VanDerWaalsContact C-N 3.28Å; V400-H402 PolarHBondContact O-N 3.25Å
403	R	91.4	Very high	92.6	Very high	86 Å²	86	54 Å²	54	33%	0.325	24%	0.243	S	C	.	.	H	α-helix	trans	-92.7	-30.3	-176.7	-70.8	178.7	-177.6	-146.8	1.1	113.7	L381 H399 V400 L401	L381-R403 VanDerWaalsContact CD1-CZ 3.42Å; H399-R403 WeakPolarHBondContact O-CG 3.48Å; V400-R403 PolarHBondContact O-N 3.42Å; V400-R403 VanDerWaalsContact O-N 3.11Å; L401-R403 VanDerWaalsContact C-N 3.34Å; L401-R403 PolarHBondContact O-N 3.18Å
404	V	92.4	Very high	92.5	Very high	5 Å²	5	59.5 Å²	59.5	3%	0.03	27%	0.269	C	S	.	.	S	Bend	trans	-95.9	128.5	-177.8	-175.4	0	0	0	0	108.6	V400 L401 R406 L409 F454 L459	V400-V404 HydrophobicContact CG1-CG2 4.01Å; V400-V404 WeakPolarHBondContact O-CG2 3.37Å; V400-V404 PolarHBondContact O-N 2.71Å; L401-V404 VanDerWaalsContact O-O 3.12Å; V404-R406 PolarHBondContact O-N 3.49Å; V404-L409 HydrophobicContact CB-CD1 4.28Å; V404-L409 HydrophobicContact CB-CD2 4.36Å; V404-L409 HydrophobicContact CB-CG 4.2Å; V404-L409 HydrophobicContact CG1-CD1 4.36Å; V404-L409 HydrophobicContact CG1-CD2 4.06Å; V404-L409 HydrophobicContact CG1-CG 3.79Å; V404-F454 HydrophobicContact CG2-CD2 3.85Å; V404-F454 HydrophobicContact CG2-CE2 3.82Å; V404-L459 HydrophobicContact CG1-CB 4.44Å; V404-L459 HydrophobicContact CG2-CB 4.38Å
405	R	91.4	Very high	92.4	Very high	63 Å²	63	58.7 Å²	58.7	24%	0.238	26%	0.263	C	S	.	.			trans	-59	140.5	174.7	-61.9	-178.1	52.9	151.8	6.8	111	E407 Y408 L409 E505 D506	R405-E407 VanDerWaalsContact CB-OE2 3.27Å; R405-E407 WeakPolarHBondContact CB-OE2 3.41Å; R405-E407 IonicContact CZ-OE1 3.6Å; R405-E407 IonicContact CZ-OE2 3.33Å; R405-E407 IonicContact NE-OE1 3.3Å; R405-E407 IonicContact NE-OE2 3.55Å; R405-E407 PolarHBondContact NE-OE2 3.17Å; R405-E407 IonicContact NH2-OE1 3.47Å; R405-E407 PolarHBondContact NH2-OE1 3.14Å; R405-E407 IonicContact NH2-OE2 2.93Å; R405-E407 PolarHBondContact O-N 2.83Å; R405-Y408 HydrophobicContact CB-CD2 3.67Å; R405-Y408 HydrophobicContact CB-CE2 3.97Å; R405-Y408 HydrophobicContact CG-CD2 4.24Å; R405-Y408 HydrophobicContact CG-CE2 4.09Å; R405-Y408 PolarHBondContact O-N 3.32Å; R405-Y408 VanDerWaalsContact O-N 3.09Å; R405-L409 PolarHBondContact O-N 3.26Å; R405-E505 IonicContact CZ-OE2 3.43Å; R405-E505 IonicContact NH1-OE2 3.32Å; R405-E505 PolarHBondContact NH1-OE2 3.39Å; R405-E505 IonicContact NH2-OE2 2.75Å; R405-E505 PolarHBondContact NH2-OE2 3.12Å; R405-D506 IonicContact CZ-OD1 3.5Å; R405-D506 IonicContact NH1-OD1 2.85Å; R405-D506 PolarHBondContact NH1-OD1 3.27Å; R405-D506 IonicContact NH1-OD2 3.15Å
406	R	91.1	Very high	92	Very high	116 Å²	116	58.8 Å²	58.8	44%	0.438	27%	0.267	S	S	.	.	H	α-helix	trans	-56.9	-37.9	-174.7	-170.1	178.7	168.1	126.3	-5.3	112.3	V404 Y408 L409 V410 D416 W418	V404-R406 PolarHBondContact O-N 3.49Å; R406-Y408 VanDerWaalsContact C-N 3.29Å; R406-Y408 PolarHBondContact O-N 3.24Å; R406-L409 WeakPolarHBondContact O-CB 3.15Å; R406-L409 PolarHBondContact O-N 2.91Å; R406-V410 HydrophobicContact CG-CG2 4.47Å; R406-V410 WeakPolarHBondContact O-CG2 3.22Å; R406-V410 PolarHBondContact O-N 3.15Å; R406-D416 PolarHBondContact NH2-O 3.39Å; R406-W418 HydrophobicContact CG-CH2 3.52Å; R406-W418 HydrophobicContact CG-CZ2 3.69Å; R406-W418 HydrophobicContact CG-CZ3 4.35Å; R406-W418 PolarHBondContact NH1-O 2.91Å
407	E	91.6	Very high	91.8	Very high	89 Å²	89	66.5 Å²	66.5	42%	0.416	30%	0.301	S	S	.	.	H	α-helix	trans	-62.1	-36.4	-178.9	-52.7	90.9	153.4	0	0	112	R405 R411 V503	R405-E407 VanDerWaalsContact CB-OE2 3.27Å; R405-E407 WeakPolarHBondContact CB-OE2 3.41Å; R405-E407 IonicContact CZ-OE1 3.6Å; R405-E407 IonicContact CZ-OE2 3.33Å; R405-E407 IonicContact NE-OE1 3.3Å; R405-E407 IonicContact NE-OE2 3.55Å; R405-E407 PolarHBondContact NE-OE2 3.17Å; R405-E407 IonicContact NH2-OE1 3.47Å; R405-E407 PolarHBondContact NH2-OE1 3.14Å; R405-E407 IonicContact NH2-OE2 2.93Å; R405-E407 PolarHBondContact O-N 2.83Å; E407-R411 WeakPolarHBondContact O-CB 3.43Å; E407-R411 PolarHBondContact O-N 3Å; E407-V503 HydrophobicContact CB-CG2 4.31Å
408	Y	91.9	Very high	91.6	Very high	8 Å²	8	67.7 Å²	67.7	3%	0.031	31%	0.305	C	S	.	.	H	α-helix	trans	-71.3	-34.5	177.9	-62.1	-46.2	0	0	0	112.7	R405 R406 R411 T412 P460 F502 V503 D506	R405-Y408 HydrophobicContact CB-CD2 3.67Å; R405-Y408 HydrophobicContact CB-CE2 3.97Å; R405-Y408 HydrophobicContact CG-CD2 4.24Å; R405-Y408 HydrophobicContact CG-CE2 4.09Å; R405-Y408 PolarHBondContact O-N 3.32Å; R405-Y408 VanDerWaalsContact O-N 3.09Å; R406-Y408 VanDerWaalsContact C-N 3.29Å; R406-Y408 PolarHBondContact O-N 3.24Å; Y408-R411 PolarHBondContact O-N 3.11Å; Y408-T412 WeakPolarHBondContact O-CB 3.36Å; Y408-T412 PolarHBondContact O-N 3.32Å; Y408-T412 VanDerWaalsContact O-N 3.08Å; Y408-T412 PolarHBondContact O-OG1 3.49Å; Y408-P460 HydrophobicContact CD1-CG 3.62Å; Y408-P460 HydrophobicContact CD2-CB 4.49Å; Y408-P460 HydrophobicContact CD2-CG 3.77Å; Y408-P460 HydrophobicContact CE1-CG 4.08Å; Y408-P460 HydrophobicContact CE2-CG 4.24Å; Y408-P460 HydrophobicContact CG-CG 3.47Å; Y408-P460 VanDerWaalsContact CG-CG 3.47Å; Y408-F502 WeakPolarHBondContact OH-CA 3.34Å; Y408-V503 HydrophobicContact CD1-CG2 4.39Å; Y408-V503 HydrophobicContact CE1-CG2 3.64Å; Y408-V503 PolarHBondContact OH-N 3.37Å; Y408-D506 WeakPolarHBondContact CE2-OD2 3.34Å; Y408-D506 PolarHBondContact OH-OD2 3.4Å
409	L	92.5	Very high	91.4	Very high	1 Å²	1	67 Å²	67	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-66.8	-46	174.2	-69.1	166.1	0	0	0	110.8	L401 V404 R405 R406 R411 T412 Y413 W418 F424 L459	L401-L409 HydrophobicContact CD2-CD1 3.48Å; L401-L409 VanDerWaalsContact CD2-CD1 3.48Å; L401-L409 HydrophobicContact CD2-CD2 4.43Å; V404-L409 HydrophobicContact CB-CD1 4.28Å; V404-L409 HydrophobicContact CB-CD2 4.36Å; V404-L409 HydrophobicContact CB-CG 4.2Å; V404-L409 HydrophobicContact CG1-CD1 4.36Å; V404-L409 HydrophobicContact CG1-CD2 4.06Å; V404-L409 HydrophobicContact CG1-CG 3.79Å; R405-L409 PolarHBondContact O-N 3.26Å; R406-L409 WeakPolarHBondContact O-CB 3.15Å; R406-L409 PolarHBondContact O-N 2.91Å; L409-R411 VanDerWaalsContact C-N 3.35Å; L409-R411 PolarHBondContact O-N 3.18Å; L409-T412 PolarHBondContact O-N 3.09Å; L409-Y413 HydrophobicContact CD2-CD2 4.29Å; L409-Y413 HydrophobicContact CD2-CE2 4.21Å; L409-Y413 PolarHBondContact O-N 3.44Å; L409-W418 HydrophobicContact CB-CH2 3.86Å; L409-W418 HydrophobicContact CB-CZ2 4.05Å; L409-W418 HydrophobicContact CD1-CH2 4.42Å; L409-W418 HydrophobicContact CD1-CZ2 3.78Å; L409-F424 HydrophobicContact CD2-CZ 4.36Å; L409-L459 HydrophobicContact CD2-CD1 4.07Å; L409-L459 HydrophobicContact CD2-CD2 4.08Å
410	V	93.1	Very high	91.4	Very high	37 Å²	37	67.5 Å²	67.5	22%	0.224	32%	0.32	C	S	.	.	H	α-helix	trans	-61.6	-43.2	174.9	-177.5	0	0	0	0	110.5	R406 T412 Q414 V415 W418	R406-V410 HydrophobicContact CG-CG2 4.47Å; R406-V410 WeakPolarHBondContact O-CG2 3.22Å; R406-V410 PolarHBondContact O-N 3.15Å; V410-T412 VanDerWaalsContact C-N 3.29Å; V410-T412 PolarHBondContact O-N 3.23Å; V410-Q414 WeakPolarHBondContact O-CA 3.46Å; V410-Q414 PolarHBondContact O-N 3.36Å; V410-V415 WeakPolarHBondContact CG2-O 3.27Å; V410-W418 HydrophobicContact CG2-CH2 3.78Å; V410-W418 HydrophobicContact CG2-CZ3 3.76Å
411	R	91.4	Very high	91.4	Very high	152 Å²	152	68.1 Å²	68.1	57%	0.574	32%	0.324	S	S	*	.	H	α-helix	trans	-62.3	-36.8	179.1	-166.7	175.8	-173.1	176.2	2.7	112.9	E407 Y408 L409 E501	E407-R411 WeakPolarHBondContact O-CB 3.43Å; E407-R411 PolarHBondContact O-N 3Å; Y408-R411 PolarHBondContact O-N 3.11Å; L409-R411 VanDerWaalsContact C-N 3.35Å; L409-R411 PolarHBondContact O-N 3.18Å; R411-E501 IonicContact CZ-OE2 3.96Å; R411-E501 PolarHBondContact NH1-O 2.9Å; R411-E501 IonicContact NH1-OE2 2.86Å; R411-E501 PolarHBondContact NH1-OE2 3.49Å; R411-E501 IonicContact NH2-OE2 3.71Å; R411-E501 PolarHBondContact NH2-OE2 2.9Å
412	T	91.8	Very high	91.4	Very high	57 Å²	57	71 Å²	71	35%	0.35	34%	0.34	S	S	.	.	H	α-helix	trans	-83.4	-47	-175.4	-53.2	0	0	0	0	112.4	Y408 L409 V410 L459	Y408-T412 WeakPolarHBondContact O-CB 3.36Å; Y408-T412 PolarHBondContact O-N 3.32Å; Y408-T412 VanDerWaalsContact O-N 3.08Å; Y408-T412 PolarHBondContact O-OG1 3.49Å; L409-T412 PolarHBondContact O-N 3.09Å; V410-T412 VanDerWaalsContact C-N 3.29Å; V410-T412 PolarHBondContact O-N 3.23Å; T412-L459 HydrophobicContact CG2-CD2 3.85Å
413	Y	93.1	Very high	91.4	Very high	14 Å²	14	68.8 Å²	68.8	6%	0.055	33%	0.33	C	S	.	.	H	α-helix	trans	-102.8	-13.4	-173.9	-64.6	-60.7	0	0	0	113.6	L409 V415 F424 L428 R431 M449 V450 D453 L459	L409-Y413 HydrophobicContact CD2-CD2 4.29Å; L409-Y413 HydrophobicContact CD2-CE2 4.21Å; L409-Y413 PolarHBondContact O-N 3.44Å; Y413-V415 PolarHBondContact O-N 2.98Å; Y413-F424 HydrophobicContact CD2-CE2 4.36Å; Y413-F424 AromaticContact CD2-CZ 3.67Å; Y413-F424 HydrophobicContact CD2-CZ 3.67Å; Y413-F424 HydrophobicContact CE2-CZ 4.11Å; Y413-F424 HydrophobicContact CG-CZ 4.35Å; Y413-L428 HydrophobicContact CD1-CD1 3.51Å; Y413-L428 HydrophobicContact CD1-CD2 4.25Å; Y413-L428 HydrophobicContact CE1-CD1 4.27Å; Y413-L428 HydrophobicContact CE1-CD2 4.32Å; Y413-L428 HydrophobicContact CG-CD1 3.92Å; Y413-R431 WeakPolarHBondContact O-CD 3.19Å; Y413-R431 PolarHBondContact O-NE 3.05Å; Y413-R431 PolarHBondContact O-NH1 3.05Å; Y413-M449 HydrophobicContact CE1-CE 4.13Å; Y413-V450 HydrophobicContact CE2-CG2 4.3Å; Y413-D453 WeakPolarHBondContact OH-CB 3.37Å; Y413-D453 PolarHBondContact OH-OD2 3.37Å; Y413-L459 HydrophobicContact CD2-CD2 4.45Å; Y413-L459 HydrophobicContact CE2-CD1 4.07Å; Y413-L459 HydrophobicContact CE2-CD2 3.78Å; Y413-L459 HydrophobicContact CE2-CG 4.42Å
414	Q	91	Very high	91.6	Very high	117 Å²	117	64.7 Å²	64.7	55%	0.547	32%	0.315	S	S	.	.			trans	44.8	47.6	-176.8	6.6	160.7	-42.1	0	0	112.5	V410 R431	V410-Q414 WeakPolarHBondContact O-CA 3.46Å; V410-Q414 PolarHBondContact O-N 3.36Å; Q414-R431 VanDerWaalsContact C-NH1 3.31Å; Q414-R431 VanDerWaalsContact CG-NH1 3.29Å; Q414-R431 VanDerWaalsContact CG-NH2 3.31Å; Q414-R431 PolarHBondContact O-NH1 3.18Å; Q414-R431 VanDerWaalsContact OE1-CZ 3.25Å
415	V	90.4	Very high	91.7	Very high	11 Å²	11	64.5 Å²	64.5	7%	0.067	31%	0.313	C	S	.	.			trans	-103.3	125.2	163.9	177.7	0	0	0	0	105.2	V410 Y413 W418 F424 A427	V410-V415 WeakPolarHBondContact CG2-O 3.27Å; Y413-V415 PolarHBondContact O-N 2.98Å; V415-W418 HydrophobicContact CG1-CE3 4.01Å; V415-W418 WeakPolarHBondContact O-CZ3 3.35Å; V415-F424 HydrophobicContact CB-CE2 4.48Å; V415-F424 HydrophobicContact CG1-CD2 4.4Å; V415-A427 HydrophobicContact CG1-CB 3.72Å; V415-A427 HydrophobicContact CG2-CB 4.43Å
416	D	85.1	Confident	91.8	Very high	115 Å²	115	63.8 Å²	63.8	62%	0.615	32%	0.316	S	S	*	.			trans	-92	-38.4	-169.9	-63.2	-29.4	0	0	0	113.1	R406	R406-D416 PolarHBondContact NH2-O 3.39Å
417	K	87.8	Confident	91.9	Very high	183 Å²	183	59.8 Å²	59.8	80%	0.796	31%	0.308	S	S	*	.			trans	-134.9	123.2	-172	-62.7	-175.8	-175.7	179.6	0	112.2
418	W	90.7	Very high	92.1	Very high	26 Å²	26	55.5 Å²	55.5	10%	0.098	29%	0.288	C	S	.	.			trans	-147.8	151.1	168.6	64.1	98.5	0	0	0	108.5	R406 L409 V410 V415 E423 F424	R406-W418 HydrophobicContact CG-CH2 3.52Å; R406-W418 HydrophobicContact CG-CZ2 3.69Å; R406-W418 HydrophobicContact CG-CZ3 4.35Å; R406-W418 PolarHBondContact NH1-O 2.91Å; L409-W418 HydrophobicContact CB-CH2 3.86Å; L409-W418 HydrophobicContact CB-CZ2 4.05Å; L409-W418 HydrophobicContact CD1-CH2 4.42Å; L409-W418 HydrophobicContact CD1-CZ2 3.78Å; V410-W418 HydrophobicContact CG2-CH2 3.78Å; V410-W418 HydrophobicContact CG2-CZ3 3.76Å; V415-W418 HydrophobicContact CG1-CE3 4.01Å; V415-W418 WeakPolarHBondContact O-CZ3 3.35Å; W418-E423 HydrophobicContact CB-CB 4.42Å; W418-F424 HydrophobicContact CB-CB 3.87Å; W418-F424 HydrophobicContact CD2-CB 4.37Å; W418-F424 AromaticContact CD2-CD2 3.68Å; W418-F424 HydrophobicContact CD2-CD2 3.68Å; W418-F424 HydrophobicContact CD2-CG 4.43Å; W418-F424 AromaticContact CE2-CD2 3.86Å; W418-F424 HydrophobicContact CE3-CD2 4.03Å; W418-F424 HydrophobicContact CG-CB 3.73Å; W418-F424 AromaticContact CG-CD2 3.97Å; W418-F424 HydrophobicContact CG-CD2 3.97Å; W418-F424 HydrophobicContact CG-CG 4.28Å; W418-F424 HydrophobicContact CZ2-CD2 4.31Å; W418-F424 HydrophobicContact CZ2-CE2 4.46Å
419	S	90.6	Very high	92.2	Very high	92 Å²	92	55.1 Å²	55.1	64%	0.643	29%	0.286	S	S	*	.	S	Bend	trans	-108	-44.3	170.7	69.7	0	0	0	0	111.3	E423	S419-E423 WeakPolarHBondContact CB-OE2 3.39Å; S419-E423 PolarHBondContact N-OE2 2.85Å; S419-E423 PolarHBondContact OG-OE1 3.21Å; S419-E423 PolarHBondContact OG-OE2 3.12Å
420	T	92.9	Very high	92.2	Very high	71 Å²	71	59.7 Å²	59.7	44%	0.436	31%	0.311	S	S	.	.	S	Bend	trans	-110.7	155.9	-175.4	-52.2	0	0	0	0	110.8	D422 E423 F424	T420-D422 HydrophobicContact CG2-CB 4.49Å; T420-D422 PolarHBondContact O-N 3.49Å; T420-E423 PolarHBondContact N-OE2 3.46Å; T420-E423 PolarHBondContact O-N 2.78Å; T420-F424 PolarHBondContact O-N 3.49Å; T420-F424 VanDerWaalsContact O-N 3.11Å
421	A	92.8	Very high	92.1	Very high	12 Å²	12	63.3 Å²	63.3	10%	0.099	32%	0.32	C	S	.	.	H	α-helix	trans	-57.3	-38.6	175.6	0	0	0	0	0	112.4	I397 E398 L401 F424 L425	I397-A421 HydrophobicContact CB-CB 4.41Å; I397-A421 HydrophobicContact CG2-CB 4.25Å; E398-A421 HydrophobicContact CB-CB 4.15Å; L401-A421 HydrophobicContact CD1-CB 3.97Å; A421-F424 WeakPolarHBondContact O-CB 3.39Å; A421-F424 PolarHBondContact O-N 2.89Å; A421-L425 WeakPolarHBondContact O-CG 3.19Å; A421-L425 PolarHBondContact O-N 3.47Å
422	D	93.2	Very high	92.1	Very high	91 Å²	91	59.4 Å²	59.4	49%	0.487	31%	0.311	S	S	.	.	H	α-helix	trans	-65.6	-44.2	177.6	-66.4	-28	0	0	0	112.2	T420 F424 L425 T426	T420-D422 HydrophobicContact CG2-CB 4.49Å; T420-D422 PolarHBondContact O-N 3.49Å; D422-F424 VanDerWaalsContact C-N 3.28Å; D422-F424 PolarHBondContact O-N 3.47Å; D422-L425 PolarHBondContact O-N 3.43Å; D422-L425 VanDerWaalsContact O-N 3.14Å; D422-T426 WeakPolarHBondContact O-CB 3.39Å; D422-T426 PolarHBondContact O-N 3.11Å; D422-T426 PolarHBondContact O-OG1 3.3Å; D422-T426 VanDerWaalsContact O-OG1 3.05Å
423	E	93.4	Very high	92	Very high	99 Å²	99	59.4 Å²	59.4	46%	0.463	32%	0.323	S	S	.	.	H	α-helix	trans	-59.5	-40.9	175.3	-68.1	-177.1	165.1	0	0	111.8	W418 S419 T420 T426 A427	W418-E423 HydrophobicContact CB-CB 4.42Å; S419-E423 WeakPolarHBondContact CB-OE2 3.39Å; S419-E423 PolarHBondContact N-OE2 2.85Å; S419-E423 PolarHBondContact OG-OE1 3.21Å; S419-E423 PolarHBondContact OG-OE2 3.12Å; T420-E423 PolarHBondContact N-OE2 3.46Å; T420-E423 PolarHBondContact O-N 2.78Å; E423-T426 PolarHBondContact O-N 2.96Å; E423-A427 VanDerWaalsContact O-CB 3.28Å; E423-A427 WeakPolarHBondContact O-CB 3.45Å; E423-A427 PolarHBondContact O-N 3.35Å
424	F	95	Very high	91.9	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-61.2	-46.3	175.2	173.3	-102.2	0	0	0	111.5	I397 L401 L409 Y413 V415 W418 T420 A421 D422 A427 L428 V450	I397-F424 HydrophobicContact CG2-CD1 4.34Å; L401-F424 HydrophobicContact CD1-CB 4.38Å; L401-F424 HydrophobicContact CD2-CD1 4.05Å; L401-F424 HydrophobicContact CD2-CD2 4.49Å; L401-F424 HydrophobicContact CD2-CE1 4.16Å; L401-F424 HydrophobicContact CD2-CG 4.22Å; L401-F424 HydrophobicContact CD2-CZ 4.42Å; L409-F424 HydrophobicContact CD2-CZ 4.36Å; Y413-F424 HydrophobicContact CD2-CE2 4.36Å; Y413-F424 AromaticContact CD2-CZ 3.67Å; Y413-F424 HydrophobicContact CD2-CZ 3.67Å; Y413-F424 HydrophobicContact CE2-CZ 4.11Å; Y413-F424 HydrophobicContact CG-CZ 4.35Å; V415-F424 HydrophobicContact CB-CE2 4.48Å; V415-F424 HydrophobicContact CG1-CD2 4.4Å; W418-F424 HydrophobicContact CB-CB 3.87Å; W418-F424 HydrophobicContact CD2-CB 4.37Å; W418-F424 AromaticContact CD2-CD2 3.68Å; W418-F424 HydrophobicContact CD2-CD2 3.68Å; W418-F424 HydrophobicContact CD2-CG 4.43Å; W418-F424 AromaticContact CE2-CD2 3.86Å; W418-F424 HydrophobicContact CE3-CD2 4.03Å; W418-F424 HydrophobicContact CG-CB 3.73Å; W418-F424 AromaticContact CG-CD2 3.97Å; W418-F424 HydrophobicContact CG-CD2 3.97Å; W418-F424 HydrophobicContact CG-CG 4.28Å; W418-F424 HydrophobicContact CZ2-CD2 4.31Å; W418-F424 HydrophobicContact CZ2-CE2 4.46Å; T420-F424 PolarHBondContact O-N 3.49Å; T420-F424 VanDerWaalsContact O-N 3.11Å; A421-F424 WeakPolarHBondContact O-CB 3.39Å; A421-F424 PolarHBondContact O-N 2.89Å; D422-F424 VanDerWaalsContact C-N 3.28Å; D422-F424 PolarHBondContact O-N 3.47Å; F424-A427 PolarHBondContact O-N 3Å; F424-L428 HydrophobicContact CE1-CD2 4.43Å; F424-L428 VanDerWaalsContact O-CB 3.29Å; F424-L428 WeakPolarHBondContact O-CB 3.28Å; F424-L428 PolarHBondContact O-N 3.16Å; F424-V450 HydrophobicContact CE1-CG2 4.23Å
425	L	95	Very high	92.1	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-66.2	-42.4	178.7	-69	171.2	0	0	0	111.8	I397 A421 D422 L428 C429 V443 A447 V450	I397-L425 HydrophobicContact CB-CD1 4.27Å; I397-L425 HydrophobicContact CG1-CD1 3.97Å; I397-L425 HydrophobicContact CG1-CD2 4.21Å; I397-L425 HydrophobicContact CG2-CD1 4.33Å; I397-L425 HydrophobicContact CG2-CD2 4.24Å; I397-L425 HydrophobicContact CG2-CG 4.26Å; A421-L425 WeakPolarHBondContact O-CG 3.19Å; A421-L425 PolarHBondContact O-N 3.47Å; D422-L425 PolarHBondContact O-N 3.43Å; D422-L425 VanDerWaalsContact O-N 3.14Å; L425-L428 WeakPolarHBondContact O-CB 3.34Å; L425-L428 PolarHBondContact O-N 2.75Å; L425-C429 WeakPolarHBondContact O-CB 3.44Å; L425-C429 PolarHBondContact O-N 2.8Å; L425-C429 PolarHBondContact O-SG 2.74Å; L425-V443 HydrophobicContact CB-CG1 3.95Å; L425-V443 HydrophobicContact CD1-CG1 3.49Å; L425-V443 VanDerWaalsContact CD1-CG1 3.49Å; L425-V443 HydrophobicContact CG-CG1 4.34Å; L425-A447 HydrophobicContact CD1-CB 4.2Å; L425-A447 HydrophobicContact CD2-CB 4.19Å; L425-V450 HydrophobicContact CD2-CG2 4.45Å
426	T	94.3	Very high	92.2	Very high	48 Å²	48	65.4 Å²	65.4	29%	0.294	35%	0.35	S	S	.	.	H	α-helix	trans	-61.9	-46.4	175.9	-60.9	0	0	0	0	111.4	D422 E423 L428 C429 N430 P441	D422-T426 WeakPolarHBondContact O-CB 3.39Å; D422-T426 PolarHBondContact O-N 3.11Å; D422-T426 PolarHBondContact O-OG1 3.3Å; D422-T426 VanDerWaalsContact O-OG1 3.05Å; E423-T426 PolarHBondContact O-N 2.96Å; T426-L428 VanDerWaalsContact C-N 3.29Å; T426-L428 PolarHBondContact O-N 2.58Å; T426-C429 WeakPolarHBondContact O-CB 3.44Å; T426-C429 PolarHBondContact O-N 3.41Å; T426-N430 VanDerWaalsContact O-CG 3.29Å; T426-N430 PolarHBondContact O-N 3.09Å; T426-N430 PolarHBondContact O-ND2 3.29Å; T426-P441 HydrophobicContact CG2-CB 4.42Å; T426-P441 HydrophobicContact CG2-CG 4.1Å
427	A	93.4	Very high	92.6	Very high	32 Å²	32	69.9 Å²	69.9	26%	0.264	36%	0.364	S	S	.	.	H	α-helix	trans	-60.7	-40.7	175.8	0	0	0	0	0	111.6	V415 E423 F424 N430 R431	V415-A427 HydrophobicContact CG1-CB 3.72Å; V415-A427 HydrophobicContact CG2-CB 4.43Å; E423-A427 VanDerWaalsContact O-CB 3.28Å; E423-A427 WeakPolarHBondContact O-CB 3.45Å; E423-A427 PolarHBondContact O-N 3.35Å; F424-A427 PolarHBondContact O-N 3Å; A427-N430 PolarHBondContact O-N 2.9Å; A427-R431 VanDerWaalsContact O-CB 3.29Å; A427-R431 WeakPolarHBondContact O-CB 3.45Å; A427-R431 PolarHBondContact O-N 3.41Å
428	L	94.6	Very high	92.8	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-65.5	-40.6	176.1	-176.1	62	0	0	0	112.6	Y413 F424 L425 T426 N432 M449 V450	Y413-L428 HydrophobicContact CD1-CD1 3.51Å; Y413-L428 HydrophobicContact CD1-CD2 4.25Å; Y413-L428 HydrophobicContact CE1-CD1 4.27Å; Y413-L428 HydrophobicContact CE1-CD2 4.32Å; Y413-L428 HydrophobicContact CG-CD1 3.92Å; F424-L428 HydrophobicContact CE1-CD2 4.43Å; F424-L428 VanDerWaalsContact O-CB 3.29Å; F424-L428 WeakPolarHBondContact O-CB 3.28Å; F424-L428 PolarHBondContact O-N 3.16Å; L425-L428 WeakPolarHBondContact O-CB 3.34Å; L425-L428 PolarHBondContact O-N 2.75Å; T426-L428 VanDerWaalsContact C-N 3.29Å; T426-L428 PolarHBondContact O-N 2.58Å; L428-N432 VanDerWaalsContact CD1-ND2 3.32Å; L428-N432 WeakPolarHBondContact CD1-ND2 3.33Å; L428-N432 WeakPolarHBondContact O-CB 3.25Å; L428-N432 PolarHBondContact O-N 3.08Å; L428-N432 PolarHBondContact O-ND2 3.32Å; L428-M449 HydrophobicContact CD1-CE 4.39Å; L428-M449 HydrophobicContact CD2-CE 3.77Å; L428-M449 HydrophobicContact CG-CE 4.21Å; L428-V450 HydrophobicContact CD2-CG2 3.58Å
429	C	94.7	Very high	92.7	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-61.5	-49.2	175.4	-71.5	0	0	0	0	111.4	L425 T426 R431 N432 G433 R434 L435 P441 D442 S446	L425-C429 WeakPolarHBondContact O-CB 3.44Å; L425-C429 PolarHBondContact O-N 2.8Å; L425-C429 PolarHBondContact O-SG 2.74Å; T426-C429 WeakPolarHBondContact O-CB 3.44Å; T426-C429 PolarHBondContact O-N 3.41Å; C429-R431 VanDerWaalsContact C-N 3.31Å; C429-R431 PolarHBondContact O-N 2.81Å; C429-N432 PolarHBondContact O-N 3.43Å; C429-G433 PolarHBondContact O-N 2.87Å; C429-R434 PolarHBondContact O-N 3.49Å; C429-L435 HydrophobicContact CB-CD2 4.49Å; C429-P441 HydrophobicContact CB-CB 3.55Å; C429-D442 VanDerWaalsContact SG-C 3.5Å; C429-D442 PolarHBondContact SG-O 3.28Å; C429-S446 VanDerWaalsContact SG-CB 3.56Å; C429-S446 PolarHBondContact SG-OG 2.9Å
430	N	92.3	Very high	92.9	Very high	96 Å²	96	67.8 Å²	67.8	51%	0.513	38%	0.383	S	S	.	.	H	α-helix	trans	-60	-43.6	179.8	-71	-19.6	0	0	0	111.3	T426 A427 G433	T426-N430 VanDerWaalsContact O-CG 3.29Å; T426-N430 PolarHBondContact O-N 3.09Å; T426-N430 PolarHBondContact O-ND2 3.29Å; A427-N430 PolarHBondContact O-N 2.9Å; N430-G433 PolarHBondContact O-N 2.93Å
431	R	91.7	Very high	92.9	Very high	113 Å²	113	66.4 Å²	66.4	43%	0.426	38%	0.375	S	S	.	.	H	α-helix	trans	-66.8	-41.8	179	-176.3	-168.8	151.3	105.6	10.7	113	Y413 Q414 A427 C429 G433	Y413-R431 WeakPolarHBondContact O-CD 3.19Å; Y413-R431 PolarHBondContact O-NE 3.05Å; Y413-R431 PolarHBondContact O-NH1 3.05Å; Q414-R431 VanDerWaalsContact C-NH1 3.31Å; Q414-R431 VanDerWaalsContact CG-NH1 3.29Å; Q414-R431 VanDerWaalsContact CG-NH2 3.31Å; Q414-R431 PolarHBondContact O-NH1 3.18Å; Q414-R431 VanDerWaalsContact OE1-CZ 3.25Å; A427-R431 VanDerWaalsContact O-CB 3.29Å; A427-R431 WeakPolarHBondContact O-CB 3.45Å; A427-R431 PolarHBondContact O-N 3.41Å; C429-R431 VanDerWaalsContact C-N 3.31Å; C429-R431 PolarHBondContact O-N 2.81Å; R431-G433 VanDerWaalsContact C-N 3.31Å
432	N	90.6	Very high	93.1	Very high	70 Å²	70	67.9 Å²	67.9	37%	0.374	38%	0.382	S	S	.	.	H	α-helix	trans	-83.7	-5.1	-178.8	-70.3	-25.5	0	0	0	113.6	L428 C429 R434	L428-N432 VanDerWaalsContact CD1-ND2 3.32Å; L428-N432 WeakPolarHBondContact CD1-ND2 3.33Å; L428-N432 WeakPolarHBondContact O-CB 3.25Å; L428-N432 PolarHBondContact O-N 3.08Å; L428-N432 PolarHBondContact O-ND2 3.32Å; C429-N432 PolarHBondContact O-N 3.43Å; N432-R434 VanDerWaalsContact C-N 3.27Å; N432-R434 HydrophobicContact CB-CG 4.14Å; N432-R434 PolarHBondContact O-N 2.73Å
433	G	90.1	Very high	93.1	Very high	58 Å²	58	65.2 Å²	65.2	60%	0.598	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.5	25.5	-173.6	0	0	0	0	0	113.7	C429 N430 R431 L435	C429-G433 PolarHBondContact O-N 2.87Å; N430-G433 PolarHBondContact O-N 2.93Å; R431-G433 VanDerWaalsContact C-N 3.31Å; G433-L435 PolarHBondContact O-N 2.86Å
434	R	90.8	Very high	93.1	Very high	104 Å²	104	63.5 Å²	63.5	39%	0.392	36%	0.362	S	S	.	.			trans	-90.9	78.6	179	-70.8	-170.6	179.6	-169.5	2.8	110.6	C429 N432 D442 M449	C429-R434 PolarHBondContact O-N 3.49Å; N432-R434 VanDerWaalsContact C-N 3.27Å; N432-R434 HydrophobicContact CB-CG 4.14Å; N432-R434 PolarHBondContact O-N 2.73Å; R434-D442 PolarHBondContact O-N 3.27Å; R434-M449 VanDerWaalsContact CZ-SD 3.57Å; R434-M449 PolarHBondContact NH1-SD 3.38Å; R434-M449 PolarHBondContact NH2-SD 3.19Å
435	L	93.8	Very high	93	Very high	78 Å²	78	64.5 Å²	64.5	41%	0.408	37%	0.371	S	S	.	.	B	Isolated β-bridge	trans	-115.6	144.4	-180	-52.7	177	0	0	0	110	C429 G433 E440 P441	C429-L435 HydrophobicContact CB-CD2 4.49Å; G433-L435 PolarHBondContact O-N 2.86Å; L435-E440 CarbonylContact C-O 3.56Å; L435-E440 WeakPolarHBondContact CA-O 3.41Å; L435-P441 HydrophobicContact CD2-CB 4.17Å
436	L	94	Very high	93	Very high	86 Å²	86	64.5 Å²	64.5	45%	0.45	37%	0.371	S	S	.	.			trans	-76.3	173.7	169.8	-61.6	176.6	0	0	0	110.4	G438 G439 E440 D442	L436-G438 PolarHBondContact O-N 3.33Å; L436-G439 PolarHBondContact O-N 2.93Å; L436-G439 VanDerWaalsContact O-N 3.09Å; L436-E440 HydrophobicContact CB-CB 4.45Å; L436-E440 PolarHBondContact N-O 2.9Å; L436-D442 HydrophobicContact CD2-CB 4.04Å; L436-D442 HydrophobicContact CG-CB 4.01Å
437	K	93.4	Very high	93.1	Very high	208 Å²	208	62.2 Å²	62.2	90%	0.904	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	130.2	171.4	-67.1	-177.8	178.7	-179.4	0	108.9
438	G	91.2	Very high	93.1	Very high	83 Å²	83	64.5 Å²	64.5	86%	0.856	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.9	-1.3	-175.3	0	0	0	0	0	114.6	L436 E440	L436-G438 PolarHBondContact O-N 3.33Å; G438-E440 VanDerWaalsContact C-N 3.31Å
439	G	89.8	Confident	93.1	Very high	47 Å²	47	66 Å²	66	49%	0.485	37%	0.366	S	S	.	.	S	Bend	trans	82.7	7.6	177.8	0	0	0	0	0	114.1	L436	L436-G439 PolarHBondContact O-N 2.93Å; L436-G439 VanDerWaalsContact O-N 3.09Å
440	E	93.7	Very high	93.2	Very high	127 Å²	127	66 Å²	66	59%	0.593	37%	0.366	S	S	*	.			trans	-69.9	134.2	174.1	-66.1	-175.4	166.4	0	0	110.8	L435 L436 G438 D442	L435-E440 CarbonylContact C-O 3.56Å; L435-E440 WeakPolarHBondContact CA-O 3.41Å; L436-E440 HydrophobicContact CB-CB 4.45Å; L436-E440 PolarHBondContact N-O 2.9Å; G438-E440 VanDerWaalsContact C-N 3.31Å; E440-D442 PolarHBondContact O-N 2.92Å
441	P	94.1	Very high	93.3	Very high	42 Å²	42	61.5 Å²	61.5	27%	0.273	34%	0.342	S	S	.	.	B	Isolated β-bridge	trans	-68.1	132.5	179.9	27.8	-34.3	0	0	0	111.9	T426 C429 L435 V443	T426-P441 HydrophobicContact CG2-CB 4.42Å; T426-P441 HydrophobicContact CG2-CG 4.1Å; C429-P441 HydrophobicContact CB-CB 3.55Å; L435-P441 HydrophobicContact CD2-CB 4.17Å; P441-V443 VanDerWaalsContact C-N 3.29Å; P441-V443 HydrophobicContact CG-CG2 4.45Å; P441-V443 PolarHBondContact O-N 3.42Å
442	D	95	Very high	93.4	Very high	43 Å²	43	57.1 Å²	57.1	23%	0.23	33%	0.327	C	S	.	.			trans	-80.1	77.2	175.5	-170.7	-11.1	0	0	0	111.1	C429 R434 L436 E440 N444 A445 S446	C429-D442 VanDerWaalsContact SG-C 3.5Å; C429-D442 PolarHBondContact SG-O 3.28Å; R434-D442 PolarHBondContact O-N 3.27Å; L436-D442 HydrophobicContact CD2-CB 4.04Å; L436-D442 HydrophobicContact CG-CB 4.01Å; E440-D442 PolarHBondContact O-N 2.92Å; D442-N444 VanDerWaalsContact C-N 3.28Å; D442-N444 PolarHBondContact O-N 3.18Å; D442-A445 HydrophobicContact CB-CB 4.28Å; D442-A445 PolarHBondContact O-N 3.1Å; D442-A445 WeakPolarHBondContact OD1-CB 3.46Å; D442-A445 PolarHBondContact OD1-N 3.3Å; D442-A445 WeakPolarHBondContact OD2-CB 3.37Å; D442-S446 PolarHBondContact O-N 2.93Å; D442-S446 VanDerWaalsContact O-N 3.14Å; D442-S446 PolarHBondContact O-OG 3.31Å
443	V	94.4	Very high	93.6	Very high	35 Å²	35	54.3 Å²	54.3	21%	0.212	31%	0.312	C	S	.	.	H	α-helix	trans	-57	-42.3	-178.4	-179	0	0	0	0	111	L425 P441 S446 A447	L425-V443 HydrophobicContact CB-CG1 3.95Å; L425-V443 HydrophobicContact CD1-CG1 3.49Å; L425-V443 VanDerWaalsContact CD1-CG1 3.49Å; L425-V443 HydrophobicContact CG-CG1 4.34Å; P441-V443 VanDerWaalsContact C-N 3.29Å; P441-V443 HydrophobicContact CG-CG2 4.45Å; P441-V443 PolarHBondContact O-N 3.42Å; V443-S446 PolarHBondContact O-N 2.93Å; V443-A447 VanDerWaalsContact O-CB 3.28Å; V443-A447 WeakPolarHBondContact O-CB 3.42Å; V443-A447 PolarHBondContact O-N 3.08Å
444	N	93.8	Very high	93.8	Very high	63 Å²	63	51.6 Å²	51.6	34%	0.337	28%	0.284	S	S	.	.	H	α-helix	trans	-67.3	-45	-176.9	-77.8	-38.1	0	0	0	112.6	P393 D442 S446 A447 R448	P393-N444 WeakPolarHBondContact CD-OD1 3.09Å; P393-N444 HydrophobicContact CG-CB 4.2Å; D442-N444 VanDerWaalsContact C-N 3.28Å; D442-N444 PolarHBondContact O-N 3.18Å; N444-S446 VanDerWaalsContact C-N 3.33Å; N444-A447 PolarHBondContact O-N 3.32Å; N444-R448 WeakPolarHBondContact O-CG 3.48Å; N444-R448 PolarHBondContact O-N 3.03Å
445	A	93	Very high	93.9	Very high	22 Å²	22	47.7 Å²	47.7	18%	0.182	27%	0.27	C	S	.	.	H	α-helix	trans	-67.1	-36.1	177.3	0	0	0	0	0	112.3	D442 M449	D442-A445 HydrophobicContact CB-CB 4.28Å; D442-A445 PolarHBondContact O-N 3.1Å; D442-A445 WeakPolarHBondContact OD1-CB 3.46Å; D442-A445 PolarHBondContact OD1-N 3.3Å; D442-A445 WeakPolarHBondContact OD2-CB 3.37Å; A445-M449 PolarHBondContact O-N 3.04Å; A445-M449 VanDerWaalsContact O-N 3.1Å
446	S	94.3	Very high	93.8	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-67.5	-41.8	174.1	-70.5	0	0	0	0	111.7	C429 D442 V443 N444 R448 M449 V450	C429-S446 VanDerWaalsContact SG-CB 3.56Å; C429-S446 PolarHBondContact SG-OG 2.9Å; D442-S446 PolarHBondContact O-N 2.93Å; D442-S446 VanDerWaalsContact O-N 3.14Å; D442-S446 PolarHBondContact O-OG 3.31Å; V443-S446 PolarHBondContact O-N 2.93Å; N444-S446 VanDerWaalsContact C-N 3.33Å; S446-R448 PolarHBondContact O-N 3.17Å; S446-M449 WeakPolarHBondContact O-CB 3.47Å; S446-M449 PolarHBondContact O-N 3.38Å; S446-M449 VanDerWaalsContact O-N 3.12Å; S446-V450 WeakPolarHBondContact O-CG2 3.34Å; S446-V450 PolarHBondContact O-N 3.35Å
447	A	95.7	Very high	93.7	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60.4	-45.5	174.5	0	0	0	0	0	111.9	P393 I397 L425 V443 N444 M449 V450 L451	P393-A447 HydrophobicContact CB-CB 3.87Å; P393-A447 HydrophobicContact CG-CB 4.03Å; I397-A447 HydrophobicContact CD1-CB 3.97Å; I397-A447 HydrophobicContact CG1-CB 3.77Å; L425-A447 HydrophobicContact CD1-CB 4.2Å; L425-A447 HydrophobicContact CD2-CB 4.19Å; V443-A447 VanDerWaalsContact O-CB 3.28Å; V443-A447 WeakPolarHBondContact O-CB 3.42Å; V443-A447 PolarHBondContact O-N 3.08Å; N444-A447 PolarHBondContact O-N 3.32Å; A447-M449 VanDerWaalsContact C-N 3.25Å; A447-M449 PolarHBondContact O-N 3.26Å; A447-V450 PolarHBondContact O-N 3.4Å; A447-L451 WeakPolarHBondContact O-CG 3.47Å; A447-L451 PolarHBondContact O-N 3Å
448	R	95	Very high	93.6	Very high	79 Å²	79	42.6 Å²	42.6	30%	0.298	24%	0.241	S	C	.	.	H	α-helix	trans	-60.4	-35.3	174.5	-67.5	-175.4	-166.4	109	3.7	112.7	V387 P393 N444 S446 N452	V387-R448 HydrophobicContact CG1-CB 3.97Å; V387-R448 HydrophobicContact CG1-CG 4.01Å; P393-R448 HydrophobicContact CB-CG 4.01Å; P393-R448 HydrophobicContact CG-CG 3.82Å; N444-R448 WeakPolarHBondContact O-CG 3.48Å; N444-R448 PolarHBondContact O-N 3.03Å; S446-R448 PolarHBondContact O-N 3.17Å; R448-N452 WeakPolarHBondContact O-CB 3.44Å; R448-N452 PolarHBondContact O-N 2.78Å; R448-N452 VanDerWaalsContact O-N 3.09Å; R448-N452 PolarHBondContact O-ND2 3.05Å
449	M	94.3	Very high	93.6	Very high	33 Å²	33	38.7 Å²	38.7	16%	0.163	20%	0.201	C	C	.	.	H	α-helix	trans	-66.6	-48.2	176.7	-176.3	-175.8	69.2	0	0	110.9	Y413 L428 R434 A445 S446 A447 L451 N452 D453	Y413-M449 HydrophobicContact CE1-CE 4.13Å; L428-M449 HydrophobicContact CD1-CE 4.39Å; L428-M449 HydrophobicContact CD2-CE 3.77Å; L428-M449 HydrophobicContact CG-CE 4.21Å; R434-M449 VanDerWaalsContact CZ-SD 3.57Å; R434-M449 PolarHBondContact NH1-SD 3.38Å; R434-M449 PolarHBondContact NH2-SD 3.19Å; A445-M449 PolarHBondContact O-N 3.04Å; A445-M449 VanDerWaalsContact O-N 3.1Å; S446-M449 WeakPolarHBondContact O-CB 3.47Å; S446-M449 PolarHBondContact O-N 3.38Å; S446-M449 VanDerWaalsContact O-N 3.12Å; A447-M449 VanDerWaalsContact C-N 3.25Å; A447-M449 PolarHBondContact O-N 3.26Å; M449-L451 PolarHBondContact O-N 3.34Å; M449-N452 PolarHBondContact O-N 2.95Å; M449-D453 WeakPolarHBondContact O-CB 3.32Å; M449-D453 VanDerWaalsContact O-CG 3.27Å; M449-D453 PolarHBondContact O-N 3.44Å
450	V	95.3	Very high	93.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61.1	-45.8	178.7	175.4	0	0	0	0	111.2	I397 V400 Y413 F424 L425 L428 S446 A447 N452 D453 F454 L459	I397-V450 HydrophobicContact CD1-CB 4Å; I397-V450 HydrophobicContact CD1-CG1 3.99Å; V400-V450 HydrophobicContact CG1-CG1 4.28Å; Y413-V450 HydrophobicContact CE2-CG2 4.3Å; F424-V450 HydrophobicContact CE1-CG2 4.23Å; L425-V450 HydrophobicContact CD2-CG2 4.45Å; L428-V450 HydrophobicContact CD2-CG2 3.58Å; S446-V450 WeakPolarHBondContact O-CG2 3.34Å; S446-V450 PolarHBondContact O-N 3.35Å; A447-V450 PolarHBondContact O-N 3.4Å; V450-N452 PolarHBondContact O-N 2.75Å; V450-D453 PolarHBondContact O-N 3.05Å; V450-F454 WeakPolarHBondContact O-CB 3.16Å; V450-F454 PolarHBondContact O-N 3Å; V450-L459 HydrophobicContact CG1-CD1 4.37Å
451	L	95.2	Very high	93.7	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-61.1	-41.7	176.6	-72.1	173	0	0	0	112.4	I380 L381 V387 P393 I397 V400 A447 M449 F454 Q455	I380-L451 HydrophobicContact CG2-CD1 4.31Å; I380-L451 HydrophobicContact CG2-CD2 4.08Å; L381-L451 HydrophobicContact CD2-CD2 4.49Å; V387-L451 HydrophobicContact CG1-CB 3.71Å; V387-L451 HydrophobicContact CG1-CD1 3.82Å; V387-L451 HydrophobicContact CG1-CG 4.44Å; V387-L451 HydrophobicContact CG2-CB 4.13Å; P393-L451 HydrophobicContact CB-CD1 3.92Å; I397-L451 HydrophobicContact CD1-CD1 4.47Å; I397-L451 HydrophobicContact CD1-CD2 4.11Å; I397-L451 HydrophobicContact CD1-CG 3.82Å; V400-L451 HydrophobicContact CG2-CD2 3.86Å; A447-L451 WeakPolarHBondContact O-CG 3.47Å; A447-L451 PolarHBondContact O-N 3Å; M449-L451 PolarHBondContact O-N 3.34Å; L451-F454 PolarHBondContact O-N 3.28Å; L451-Q455 WeakPolarHBondContact O-CG 3.26Å; L451-Q455 PolarHBondContact O-N 3.43Å
452	N	94.6	Very high	93.7	Very high	21 Å²	21	31.2 Å²	31.2	11%	0.112	15%	0.149	C	C	.	.	H	α-helix	trans	-65	-41.7	175.1	-90	-61.7	0	0	0	112.2	R448 M449 V450 F454 Q455 R456	R448-N452 WeakPolarHBondContact O-CB 3.44Å; R448-N452 PolarHBondContact O-N 2.78Å; R448-N452 VanDerWaalsContact O-N 3.09Å; R448-N452 PolarHBondContact O-ND2 3.05Å; M449-N452 PolarHBondContact O-N 2.95Å; V450-N452 PolarHBondContact O-N 2.75Å; N452-F454 VanDerWaalsContact C-N 3.35Å; N452-Q455 PolarHBondContact O-N 3.18Å; N452-R456 VanDerWaalsContact O-CB 3.27Å; N452-R456 WeakPolarHBondContact O-CB 3.43Å; N452-R456 WeakPolarHBondContact O-CD 3.37Å; N452-R456 WeakPolarHBondContact O-CG 3.41Å; N452-R456 PolarHBondContact O-N 2.88Å
453	D	94.5	Very high	93.6	Very high	11 Å²	11	31.8 Å²	31.8	6%	0.059	16%	0.155	C	C	.	.	H	α-helix	trans	-65.7	-38.7	178.6	-73.8	-18.6	0	0	0	111.5	Y413 M449 V450 G457 K458	Y413-D453 WeakPolarHBondContact OH-CB 3.37Å; Y413-D453 PolarHBondContact OH-OD2 3.37Å; M449-D453 WeakPolarHBondContact O-CB 3.32Å; M449-D453 VanDerWaalsContact O-CG 3.27Å; M449-D453 PolarHBondContact O-N 3.44Å; V450-D453 PolarHBondContact O-N 3.05Å; D453-G457 PolarHBondContact O-N 3.16Å; D453-K458 HydrophobicContact CB-CB 4.14Å; D453-K458 HydrophobicContact CB-CD 4.2Å; D453-K458 PolarHBondContact O-N 2.96Å; D453-K458 VanDerWaalsContact OD1-CD 3.31Å; D453-K458 WeakPolarHBondContact OD1-CD 3.48Å; D453-K458 VanDerWaalsContact OD1-CE 3.25Å; D453-K458 WeakPolarHBondContact OD1-CE 3.47Å; D453-K458 IonicContact OD1-NZ 2.68Å; D453-K458 PolarHBondContact OD1-NZ 3.39Å; D453-K458 IonicContact OD2-NZ 3.37Å
454	F	94.4	Very high	93.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-61.2	-51.8	171.9	-179.8	-94.8	0	0	0	112	R230 L381 V400 V404 V450 L451 N452 R456 G457 L459 Y461	R230-F454 PolarHBondContact NH1-O 3.33Å; R230-F454 VanDerWaalsContact NH1-O 3.16Å; L381-F454 HydrophobicContact CB-CE1 3.95Å; L381-F454 HydrophobicContact CD2-CD1 3.9Å; L381-F454 HydrophobicContact CD2-CE1 3.6Å; L381-F454 HydrophobicContact CD2-CZ 4.11Å; L381-F454 HydrophobicContact CG-CE1 4.34Å; V400-F454 HydrophobicContact CG1-CB 4.4Å; V400-F454 HydrophobicContact CG1-CD2 3.73Å; V400-F454 HydrophobicContact CG1-CE2 4.31Å; V400-F454 HydrophobicContact CG1-CG 4.24Å; V400-F454 HydrophobicContact CG2-CG 4.49Å; V404-F454 HydrophobicContact CG2-CD2 3.85Å; V404-F454 HydrophobicContact CG2-CE2 3.82Å; V450-F454 WeakPolarHBondContact O-CB 3.16Å; V450-F454 PolarHBondContact O-N 3Å; L451-F454 PolarHBondContact O-N 3.28Å; N452-F454 VanDerWaalsContact C-N 3.35Å; F454-R456 VanDerWaalsContact C-N 3.33Å; F454-R456 PolarHBondContact O-N 3.25Å; F454-G457 PolarHBondContact O-N 3Å; F454-L459 HydrophobicContact CB-CD1 4.31Å; F454-Y461 HydrophobicContact CD1-CE1 4.16Å; F454-Y461 AromaticContact CD2-CD1 3.8Å; F454-Y461 HydrophobicContact CD2-CD1 3.8Å; F454-Y461 AromaticContact CD2-CE1 3.95Å; F454-Y461 HydrophobicContact CD2-CE1 3.95Å; F454-Y461 HydrophobicContact CE1-CD1 4.32Å; F454-Y461 AromaticContact CE1-CE1 3.57Å; F454-Y461 HydrophobicContact CE1-CE1 3.57Å; F454-Y461 AromaticContact CE1-CZ 3.76Å; F454-Y461 AromaticContact CE2-CD1 3.21Å; F454-Y461 HydrophobicContact CE2-CD1 3.21Å; F454-Y461 HydrophobicContact CE2-CD2 4.22Å; F454-Y461 AromaticContact CE2-CE1 3.35Å; F454-Y461 HydrophobicContact CE2-CE1 3.35Å; F454-Y461 HydrophobicContact CE2-CE2 4.38Å; F454-Y461 AromaticContact CE2-CG 3.67Å; F454-Y461 HydrophobicContact CE2-CG 3.67Å; F454-Y461 AromaticContact CE2-CZ 3.97Å; F454-Y461 HydrophobicContact CG-CE1 4.33Å; F454-Y461 AromaticContact CZ-CD1 3.52Å; F454-Y461 HydrophobicContact CZ-CD1 3.52Å; F454-Y461 HydrophobicContact CZ-CD2 4.1Å; F454-Y461 AromaticContact CZ-CE1 3.13Å; F454-Y461 HydrophobicContact CZ-CE1 3.13Å; F454-Y461 AromaticContact CZ-CE2 3.83Å; F454-Y461 HydrophobicContact CZ-CE2 3.83Å; F454-Y461 AromaticContact CZ-CG 3.97Å; F454-Y461 HydrophobicContact CZ-CG 3.97Å; F454-Y461 AromaticContact CZ-CZ 3.32Å
455	Q	92.4	Very high	93.1	Very high	22 Å²	22	32.9 Å²	32.9	10%	0.103	16%	0.159	C	C	.	.	H	α-helix	trans	-62.9	-39.3	-179.2	-73.3	177.5	1.2	0	0	112.4	R230 I380 L451 N452 G457	R230-Q455 PolarHBondContact NH1-O 3.36Å; I380-Q455 PolarHBondContact O-NE2 3.48Å; L451-Q455 WeakPolarHBondContact O-CG 3.26Å; L451-Q455 PolarHBondContact O-N 3.43Å; N452-Q455 PolarHBondContact O-N 3.18Å; Q455-G457 PolarHBondContact O-N 3.38Å
456	R	92	Very high	92.7	Very high	127 Å²	127	35 Å²	35	48%	0.479	17%	0.171	S	C	.	.	H	α-helix	trans	-74.1	-11.5	179.4	-69.3	170.2	-170	-176.9	5.1	113.7	P343 N452 F454	P343-R456 HydrophobicContact CB-CG 4.25Å; N452-R456 VanDerWaalsContact O-CB 3.27Å; N452-R456 WeakPolarHBondContact O-CB 3.43Å; N452-R456 WeakPolarHBondContact O-CD 3.37Å; N452-R456 WeakPolarHBondContact O-CG 3.41Å; N452-R456 PolarHBondContact O-N 2.88Å; F454-R456 VanDerWaalsContact C-N 3.33Å; F454-R456 PolarHBondContact O-N 3.25Å
457	G	90.8	Very high	91.6	Very high	14 Å²	14	41.4 Å²	41.4	14%	0.144	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.7	24.7	179.7	0	0	0	0	0	113.8	D453 F454 Q455	D453-G457 PolarHBondContact O-N 3.16Å; F454-G457 PolarHBondContact O-N 3Å; Q455-G457 PolarHBondContact O-N 3.38Å
458	K	91.5	Very high	89.8	Confident	124 Å²	124	43.7 Å²	43.7	54%	0.539	22%	0.217	S	C	.	.	S	Bend	trans	-70.9	-37.1	167.6	-68	-165.2	-167.2	159.3	0	111.2	D453 P460	D453-K458 HydrophobicContact CB-CB 4.14Å; D453-K458 HydrophobicContact CB-CD 4.2Å; D453-K458 PolarHBondContact O-N 2.96Å; D453-K458 VanDerWaalsContact OD1-CD 3.31Å; D453-K458 WeakPolarHBondContact OD1-CD 3.48Å; D453-K458 VanDerWaalsContact OD1-CE 3.25Å; D453-K458 WeakPolarHBondContact OD1-CE 3.47Å; D453-K458 IonicContact OD1-NZ 2.68Å; D453-K458 PolarHBondContact OD1-NZ 3.39Å; D453-K458 IonicContact OD2-NZ 3.37Å; K458-P460 WeakPolarHBondContact O-CD 3.43Å
459	L	92.7	Very high	87.8	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.005	23%	0.233	C	C	.	.	S	Bend	trans	-87.2	113.8	171.7	-62.3	175.8	0	0	0	108.4	V400 V404 L409 T412 Y413 V450 F454 Y461	V400-L459 HydrophobicContact CG1-CD1 4.42Å; V404-L459 HydrophobicContact CG1-CB 4.44Å; V404-L459 HydrophobicContact CG2-CB 4.38Å; L409-L459 HydrophobicContact CD2-CD1 4.07Å; L409-L459 HydrophobicContact CD2-CD2 4.08Å; T412-L459 HydrophobicContact CG2-CD2 3.85Å; Y413-L459 HydrophobicContact CD2-CD2 4.45Å; Y413-L459 HydrophobicContact CE2-CD1 4.07Å; Y413-L459 HydrophobicContact CE2-CD2 3.78Å; Y413-L459 HydrophobicContact CE2-CG 4.42Å; V450-L459 HydrophobicContact CG1-CD1 4.37Å; F454-L459 HydrophobicContact CB-CD1 4.31Å; L459-Y461 PolarHBondContact O-N 3.07Å
460	P	92.3	Very high	85.7	Confident	14 Å²	14	54.7 Å²	54.7	9%	0.091	27%	0.266	C	S	.	.			trans	-69.7	126.9	177	28.7	-33.4	0	0	0	109.6	Y408 K458 A500 F502	Y408-P460 HydrophobicContact CD1-CG 3.62Å; Y408-P460 HydrophobicContact CD2-CB 4.49Å; Y408-P460 HydrophobicContact CD2-CG 3.77Å; Y408-P460 HydrophobicContact CE1-CG 4.08Å; Y408-P460 HydrophobicContact CE2-CG 4.24Å; Y408-P460 HydrophobicContact CG-CG 3.47Å; Y408-P460 VanDerWaalsContact CG-CG 3.47Å; K458-P460 WeakPolarHBondContact O-CD 3.43Å; P460-A500 HydrophobicContact CB-CB 4.06Å; P460-A500 HydrophobicContact CG-CB 4.44Å; P460-F502 HydrophobicContact CB-CE1 4.02Å
461	Y	92.9	Very high	83.5	Confident	15 Å²	15	60.9 Å²	60.9	6%	0.059	30%	0.295	C	S	.	.			trans	-152.2	153.6	171.4	84.8	-90.4	0	0	0	109.1	R230 F454 L459	R230-Y461 HydrophobicContact CB-CE2 3.85Å; R230-Y461 VanDerWaalsContact NH1-CE1 3.34Å; F454-Y461 HydrophobicContact CD1-CE1 4.16Å; F454-Y461 AromaticContact CD2-CD1 3.8Å; F454-Y461 HydrophobicContact CD2-CD1 3.8Å; F454-Y461 AromaticContact CD2-CE1 3.95Å; F454-Y461 HydrophobicContact CD2-CE1 3.95Å; F454-Y461 HydrophobicContact CE1-CD1 4.32Å; F454-Y461 AromaticContact CE1-CE1 3.57Å; F454-Y461 HydrophobicContact CE1-CE1 3.57Å; F454-Y461 AromaticContact CE1-CZ 3.76Å; F454-Y461 AromaticContact CE2-CD1 3.21Å; F454-Y461 HydrophobicContact CE2-CD1 3.21Å; F454-Y461 HydrophobicContact CE2-CD2 4.22Å; F454-Y461 AromaticContact CE2-CE1 3.35Å; F454-Y461 HydrophobicContact CE2-CE1 3.35Å; F454-Y461 HydrophobicContact CE2-CE2 4.38Å; F454-Y461 AromaticContact CE2-CG 3.67Å; F454-Y461 HydrophobicContact CE2-CG 3.67Å; F454-Y461 AromaticContact CE2-CZ 3.97Å; F454-Y461 HydrophobicContact CG-CE1 4.33Å; F454-Y461 AromaticContact CZ-CD1 3.52Å; F454-Y461 HydrophobicContact CZ-CD1 3.52Å; F454-Y461 HydrophobicContact CZ-CD2 4.1Å; F454-Y461 AromaticContact CZ-CE1 3.13Å; F454-Y461 HydrophobicContact CZ-CE1 3.13Å; F454-Y461 AromaticContact CZ-CE2 3.83Å; F454-Y461 HydrophobicContact CZ-CE2 3.83Å; F454-Y461 AromaticContact CZ-CG 3.97Å; F454-Y461 HydrophobicContact CZ-CG 3.97Å; F454-Y461 AromaticContact CZ-CZ 3.32Å; L459-Y461 PolarHBondContact O-N 3.07Å
462	Y	93	Very high	81.4	Confident	30 Å²	30	63.4 Å²	63.4	12%	0.118	31%	0.31	C	S	.	.			trans	-154.7	147.8	172.4	62.3	-80.4	0	0	0	109.3	I263 P264 W266 A267 L464 F502 D506	I263-Y462 HydrophobicContact CG2-CD2 4.31Å; I263-Y462 HydrophobicContact CG2-CG 4.04Å; P264-Y462 HydrophobicContact CG-CD1 4.33Å; P264-Y462 HydrophobicContact CG-CE1 3.89Å; W266-Y462 HydrophobicContact CH2-CE2 4.12Å; W266-Y462 AromaticContact CZ2-CE2 3.83Å; W266-Y462 HydrophobicContact CZ2-CE2 3.83Å; A267-Y462 HydrophobicContact CB-CD2 4.33Å; A267-Y462 HydrophobicContact CB-CE2 4.43Å; Y462-L464 HydrophobicContact CE2-CD1 4.12Å; Y462-L464 HydrophobicContact CE2-CG 4.45Å; Y462-F502 HydrophobicContact CD1-CE1 4.49Å; Y462-D506 VanDerWaalsContact OH-CG 3.25Å; Y462-D506 PolarHBondContact OH-OD1 3.2Å
463	V	92.5	Very high	79.3	Confident	56 Å²	56	65.3 Å²	65.3	34%	0.339	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-81.9	133.9	170	178.3	0	0	0	0	107.8	R230 D231	R230-V463 WeakPolarHBondContact O-CB 3.49Å; R230-V463 PolarHBondContact O-N 3.02Å; D231-V463 HydrophobicContact CB-CG2 3.92Å
464	L	90.2	Very high	77.1	Confident	115 Å²	115	67.5 Å²	67.5	60%	0.602	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-65	132.6	176.1	-85.1	73	0	0	0	109.2	Y462	Y462-L464 HydrophobicContact CE2-CD1 4.12Å; Y462-L464 HydrophobicContact CE2-CG 4.45Å
465	P	88.5	Confident	75.1	Confident	5 Å²	5	74.5 Å²	74.5	3%	0.032	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-61.4	139.3	169.2	26.6	-31.5	0	0	0	108.7	W266 R270 W271 D467	W266-P465 HydrophobicContact CZ3-CG 4.27Å; R270-P465 HydrophobicContact CB-CB 4.04Å; R270-P465 HydrophobicContact CB-CG 3.66Å; R270-P465 HydrophobicContact CG-CG 4.38Å; W271-P465 HydrophobicContact CD2-CB 3.92Å; W271-P465 HydrophobicContact CE3-CB 4.23Å; W271-P465 HydrophobicContact CG-CB 4.41Å; W271-P465 HydrophobicContact CH2-CB 4.36Å; W271-P465 HydrophobicContact CZ2-CB 4.06Å; W271-P465 HydrophobicContact CZ3-CB 4.43Å; P465-D467 PolarHBondContact O-N 3.19Å
466	P	85.4	Confident	73	Confident	67 Å²	67	77 Å²	77	44%	0.435	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-48.2	134.3	170.7	-27.2	32.8	0	0	0	110.6	L468	P466-L468 PolarHBondContact O-N 3.34Å; P466-L468 VanDerWaalsContact O-N 3.14Å
467	D	70.9	Confident	71.1	Confident	135 Å²	135	81.2 Å²	81.2	72%	0.722	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-58.3	122.6	170.8	-74.1	-32.7	0	0	0	107.5	R270 P465 D469	R270-D467 IonicContact NH1-OD1 3.67Å; P465-D467 PolarHBondContact O-N 3.19Å; D467-D469 PolarHBondContact O-N 3.45Å
468	L	56.9	Low	69.1	Low	47 Å²	47	85.3 Å²	85.3	25%	0.246	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-62.1	122.7	168.8	-69.9	166.1	0	0	0	105.7	R273 P466 R470 E473	R273-L468 HydrophobicContact CG-CD1 4.23Å; P466-L468 PolarHBondContact O-N 3.34Å; P466-L468 VanDerWaalsContact O-N 3.14Å; L468-R470 PolarHBondContact O-N 3.09Å; L468-R470 VanDerWaalsContact O-N 3.13Å; L468-E473 HydrophobicContact CB-CG 4.37Å
469	D	54.5	Low	66.6	Low	120 Å²	120	82.8 Å²	82.8	64%	0.642	43%	0.428	S	S	*	.			trans	-42.6	126.9	-176.3	-62.3	-50.1	0	0	0	108.9	D467 E471 T472 E473	D467-D469 PolarHBondContact O-N 3.45Å; D469-E471 HydrophobicContact CB-CB 4.49Å; D469-E471 CarbonylContact O-C 3.31Å; D469-E471 PolarHBondContact O-N 2.93Å; D469-T472 WeakPolarHBondContact CB-OG1 3.38Å; D469-T472 PolarHBondContact N-OG1 3.08Å; D469-T472 WeakPolarHBondContact O-CA 3.39Å; D469-T472 WeakPolarHBondContact O-CB 3.43Å; D469-T472 PolarHBondContact O-N 2.91Å; D469-T472 PolarHBondContact O-OG1 3.49Å; D469-E473 PolarHBondContact O-N 2.81Å
470	R	49.4	Very low	64.2	Low	224 Å²	224	86.9 Å²	86.9	85%	0.845	45%	0.447	S	S	*	.	H	α-helix	trans	-51.2	-25.8	179.3	-73.7	-178.9	178.4	167.8	0.2	111.2	L468 E473 A474	L468-R470 PolarHBondContact O-N 3.09Å; L468-R470 VanDerWaalsContact O-N 3.13Å; R470-E473 PolarHBondContact O-N 2.69Å; R470-A474 WeakPolarHBondContact O-CB 3.39Å; R470-A474 PolarHBondContact O-N 3.36Å
471	E	48.1	Very low	61.7	Low	130 Å²	130	95.1 Å²	95.1	61%	0.607	48%	0.481	S	S	*	.	H	α-helix	trans	-62.9	-43.6	170.8	-66.3	-165.3	-179.7	0	0	114.1	D469 E473 A474 K475	D469-E471 HydrophobicContact CB-CB 4.49Å; D469-E471 CarbonylContact O-C 3.31Å; D469-E471 PolarHBondContact O-N 2.93Å; E471-E473 VanDerWaalsContact C-N 3.28Å; E471-E473 PolarHBondContact O-N 3.2Å; E471-A474 PolarHBondContact O-N 2.7Å; E471-K475 VanDerWaalsContact O-CB 3.22Å; E471-K475 WeakPolarHBondContact O-CB 3.13Å; E471-K475 VanDerWaalsContact O-CG 3.27Å; E471-K475 WeakPolarHBondContact O-CG 3.27Å; E471-K475 PolarHBondContact O-N 3.34Å; E471-K475 IonicContact OE2-NZ 3.74Å
472	T	51.1	Low	59.2	Low	53 Å²	53	99.7 Å²	99.7	33%	0.325	51%	0.507	S	S	.	.	H	α-helix	trans	-64.1	-35.7	173.3	2.6	0	0	0	0	111.5	D469 R476	D469-T472 WeakPolarHBondContact CB-OG1 3.38Å; D469-T472 PolarHBondContact N-OG1 3.08Å; D469-T472 WeakPolarHBondContact O-CA 3.39Å; D469-T472 WeakPolarHBondContact O-CB 3.43Å; D469-T472 PolarHBondContact O-N 2.91Å; D469-T472 PolarHBondContact O-OG1 3.49Å; T472-R476 VanDerWaalsContact O-CB 3.27Å; T472-R476 WeakPolarHBondContact O-CB 3.44Å; T472-R476 VanDerWaalsContact O-CD 3.29Å; T472-R476 WeakPolarHBondContact O-CD 3.36Å; T472-R476 WeakPolarHBondContact O-CG 3.18Å; T472-R476 PolarHBondContact O-N 3.1Å
473	E	50.8	Low	56.6	Low	62 Å²	62	100.8 Å²	100.8	29%	0.29	51%	0.514	S	S	.	.	H	α-helix	trans	-74.7	-38	175.5	-63.2	-152.8	136	0	0	112.6	R273 L468 D469 R470 E471 R476 R477	R273-E473 IonicContact CZ-OE1 3.81Å; R273-E473 IonicContact NH1-OE1 3.84Å; R273-E473 PolarHBondContact NH1-OE1 3.35Å; L468-E473 HydrophobicContact CB-CG 4.37Å; D469-E473 PolarHBondContact O-N 2.81Å; R470-E473 PolarHBondContact O-N 2.69Å; E471-E473 VanDerWaalsContact C-N 3.28Å; E471-E473 PolarHBondContact O-N 3.2Å; E473-R476 PolarHBondContact O-N 3.14Å; E473-R477 WeakPolarHBondContact O-CB 3.25Å; E473-R477 VanDerWaalsContact O-CG 3.27Å; E473-R477 WeakPolarHBondContact O-CG 3.31Å; E473-R477 PolarHBondContact O-N 2.61Å
474	A	49.2	Very low	54.1	Low	56 Å²	56	101.7 Å²	101.7	46%	0.463	52%	0.52	S	S	.	.	H	α-helix	trans	-71.2	-40.2	177.2	0	0	0	0	0	112.8	R470 E471 R476 R477 S478	R470-A474 WeakPolarHBondContact O-CB 3.39Å; R470-A474 PolarHBondContact O-N 3.36Å; E471-A474 PolarHBondContact O-N 2.7Å; A474-R476 VanDerWaalsContact C-N 3.26Å; A474-R476 PolarHBondContact O-N 2.81Å; A474-R477 PolarHBondContact O-N 3.32Å; A474-S478 PolarHBondContact O-N 3.1Å; A474-S478 PolarHBondContact O-OG 3.16Å
475	K	51.2	Low	51.5	Low	147 Å²	147	101.9 Å²	101.9	64%	0.639	52%	0.522	S	S	*	.	H	α-helix	trans	-64.2	-31.3	171.4	-74.6	171.4	179.6	161.5	0	111.7	E471 S478	E471-K475 VanDerWaalsContact O-CB 3.22Å; E471-K475 WeakPolarHBondContact O-CB 3.13Å; E471-K475 VanDerWaalsContact O-CG 3.27Å; E471-K475 WeakPolarHBondContact O-CG 3.27Å; E471-K475 PolarHBondContact O-N 3.34Å; E471-K475 IonicContact OE2-NZ 3.74Å; K475-S478 PolarHBondContact O-OG 3.29Å
476	R	48.7	Very low	49.2	Very low	74 Å²	74	107.2 Å²	107.2	28%	0.279	54%	0.541	S	S	.	.	H	α-helix	trans	-78.6	-32.8	175	-77	173.6	168.1	163.1	-2.8	113.6	T472 E473 A474 S478	T472-R476 VanDerWaalsContact O-CB 3.27Å; T472-R476 WeakPolarHBondContact O-CB 3.44Å; T472-R476 VanDerWaalsContact O-CD 3.29Å; T472-R476 WeakPolarHBondContact O-CD 3.36Å; T472-R476 WeakPolarHBondContact O-CG 3.18Å; T472-R476 PolarHBondContact O-N 3.1Å; E473-R476 PolarHBondContact O-N 3.14Å; A474-R476 VanDerWaalsContact C-N 3.26Å; A474-R476 PolarHBondContact O-N 2.81Å; R476-S478 PolarHBondContact O-N 3.29Å
477	R	51.9	Low	47.3	Very low	216 Å²	216	106.1 Å²	106.1	82%	0.815	53%	0.533	S	S	*	.	H	α-helix	trans	-67.3	-20.3	176.8	-79.7	175.2	177.7	-173.3	0.7	113.8	E473 A474	E473-R477 WeakPolarHBondContact O-CB 3.25Å; E473-R477 VanDerWaalsContact O-CG 3.27Å; E473-R477 WeakPolarHBondContact O-CG 3.31Å; E473-R477 PolarHBondContact O-N 2.61Å; A474-R477 PolarHBondContact O-N 3.32Å
478	S	48.8	Very low	46.5	Very low	101 Å²	101	104.1 Å²	104.1	71%	0.706	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	-6.9	-172.2	43.1	0	0	0	0	116	A474 K475 R476	A474-S478 PolarHBondContact O-N 3.1Å; A474-S478 PolarHBondContact O-OG 3.16Å; K475-S478 PolarHBondContact O-OG 3.29Å; R476-S478 PolarHBondContact O-N 3.29Å
479	G	39.9	Very low	46.7	Very low	70 Å²	70	103.2 Å²	103.2	72%	0.722	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-173.7	10.5	-177.7	0	0	0	0	0	120.1
480	E	41.9	Very low	47	Very low	88 Å²	88	104.4 Å²	104.4	41%	0.411	51%	0.513	S	S	.	.			trans	-150.1	67.6	-175.1	-145.9	174.9	-162.4	0	0	112.7	D482 L483	E480-D482 PolarHBondContact O-N 2.84Å; E480-L483 HydrophobicContact CG-CB 4.25Å; E480-L483 HydrophobicContact CG-CD1 4.33Å; E480-L483 PolarHBondContact O-N 3.11Å; E480-L483 WeakPolarHBondContact OE1-CD1 2.98Å
481	K	39.7	Very low	48.2	Very low	186 Å²	186	95 Å²	95	81%	0.809	48%	0.479	S	S	*	.	G	3₁₀ helix	trans	-59.4	-19.6	167.9	-75.8	-177.7	175	-179.9	0	112.2	L483	K481-L483 PolarHBondContact O-N 3.27Å
482	D	40	Very low	49.7	Very low	112 Å²	112	93.9 Å²	93.9	60%	0.599	48%	0.477	S	S	*	.	G	3₁₀ helix	trans	-77.5	-8.7	-176.7	-67.1	-8.4	0	0	0	115.6	E480 R486	E480-D482 PolarHBondContact O-N 2.84Å; D482-R486 VanDerWaalsContact O-CG 3.28Å; D482-R486 WeakPolarHBondContact O-CG 3.42Å; D482-R486 PolarHBondContact O-NE 2.93Å
483	L	39.9	Very low	51.1	Low	52 Å²	52	92.4 Å²	92.4	27%	0.272	47%	0.467	S	S	.	.	G	3₁₀ helix	trans	-93.5	-25.8	-176.6	-136.2	91	0	0	0	113.6	E480 K481 R486	E480-L483 HydrophobicContact CG-CB 4.25Å; E480-L483 HydrophobicContact CG-CD1 4.33Å; E480-L483 PolarHBondContact O-N 3.11Å; E480-L483 WeakPolarHBondContact OE1-CD1 2.98Å; K481-L483 PolarHBondContact O-N 3.27Å; L483-R486 WeakPolarHBondContact O-CB 3.26Å; L483-R486 PolarHBondContact O-N 3.35Å
484	V	38.6	Very low	52.4	Low	75 Å²	75	93 Å²	93	46%	0.455	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-81.7	-28	-178.9	-173.6	0	0	0	0	111.1	R486	V484-R486 PolarHBondContact O-N 3.44Å
485	D	35.6	Very low	53.8	Low	120 Å²	120	96.8 Å²	96.8	64%	0.642	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-71.3	-4.3	168.2	-78.7	-18.6	0	0	0	113.9	V487	D485-V487 VanDerWaalsContact C-N 3.25Å; D485-V487 PolarHBondContact O-N 3.5Å
486	R	41.4	Very low	55.2	Low	117 Å²	117	90 Å²	90	44%	0.442	46%	0.462	S	S	.	.	G	3₁₀ helix	trans	-82.2	3.7	176.4	-61.2	-178.8	-165.6	-170.7	5.9	114	D482 L483 V484 R488	D482-R486 VanDerWaalsContact O-CG 3.28Å; D482-R486 WeakPolarHBondContact O-CG 3.42Å; D482-R486 PolarHBondContact O-NE 2.93Å; L483-R486 WeakPolarHBondContact O-CB 3.26Å; L483-R486 PolarHBondContact O-N 3.35Å; V484-R486 PolarHBondContact O-N 3.44Å; R486-R488 PolarHBondContact O-N 3.29Å
487	V	44.6	Very low	56.7	Low	44 Å²	44	90.6 Å²	90.6	27%	0.267	47%	0.474	S	S	.	.			trans	-72.8	75.3	162.5	-172	0	0	0	0	108.5	I272 D485 V489	I272-V487 HydrophobicContact CG2-CG1 4.31Å; D485-V487 VanDerWaalsContact C-N 3.25Å; D485-V487 PolarHBondContact O-N 3.5Å; V487-V489 CarbonylContact O-C 3.51Å; V487-V489 PolarHBondContact O-N 3.21Å
488	R	54.4	Low	58.3	Low	93 Å²	93	83 Å²	83	35%	0.351	45%	0.449	S	S	.	.			trans	-63	-14.9	-172.1	-71.3	-172	175.3	142.5	13.3	114.9	R486 H490 F604 T605	R486-R488 PolarHBondContact O-N 3.29Å; R488-H490 VanDerWaalsContact C-N 3.31Å; R488-H490 PolarHBondContact O-N 3.23Å; R488-F604 VanDerWaalsContact NH1-C 3.25Å; R488-F604 PolarHBondContact NH1-O 3.02Å; R488-F604 VanDerWaalsContact NH1-O 3.15Å; R488-T605 VanDerWaalsContact CZ-CA 3.42Å; R488-T605 VanDerWaalsContact NH1-CA 3.34Å
489	V	60.3	Low	59.8	Low	28 Å²	28	81.3 Å²	81.3	17%	0.17	44%	0.437	C	S	.	.	S	Bend	trans	-89.5	77.3	169.2	-167.9	0	0	0	0	107.7	I282 A296 V300 V487 Q491	I282-V489 HydrophobicContact CG1-CG1 4.38Å; A296-V489 HydrophobicContact CB-CG1 3.99Å; V300-V489 HydrophobicContact CG2-CG2 4.25Å; V487-V489 CarbonylContact O-C 3.51Å; V487-V489 PolarHBondContact O-N 3.21Å; V489-Q491 HydrophobicContact CG1-CG 4.06Å; V489-Q491 PolarHBondContact O-N 2.89Å
490	H	62.5	Low	61.6	Low	144 Å²	144	79.4 Å²	79.4	67%	0.667	41%	0.414	S	S	*	.			trans	-60.5	114.2	172.4	-69.5	-79.3	0	0	0	109.4	R488	R488-H490 VanDerWaalsContact C-N 3.31Å; R488-H490 PolarHBondContact O-N 3.23Å
491	Q	73.4	Confident	63.4	Low	27 Å²	27	81.4 Å²	81.4	13%	0.126	42%	0.424	C	S	.	.			trans	-119.1	125.8	171.1	-61.8	-170.7	-55.9	0	0	108.3	I282 A283 F292 A296 V489 I493	I282-Q491 VanDerWaalsContact CG2-NE2 3.29Å; A283-Q491 PolarHBondContact O-NE2 3.42Å; F292-Q491 HydrophobicContact CZ-CB 4.31Å; A296-Q491 HydrophobicContact CB-CG 4.26Å; V489-Q491 HydrophobicContact CG1-CG 4.06Å; V489-Q491 PolarHBondContact O-N 2.89Å; Q491-I493 VanDerWaalsContact C-N 3.25Å; Q491-I493 HydrophobicContact CB-CG1 4.45Å; Q491-I493 PolarHBondContact O-N 3.27Å
492	N	79.8	Confident	65.5	Low	107 Å²	107	73 Å²	73	57%	0.572	39%	0.387	S	S	*	.			trans	-75.2	81.1	174.1	-69.3	-10.5	0	0	0	109.5	F292 A494 Q495	F292-N492 WeakPolarHBondContact CE2-O 3.46Å; N492-A494 PolarHBondContact O-N 3.29Å; N492-A494 VanDerWaalsContact O-N 3.1Å; N492-Q495 HydrophobicContact CB-CG 4.11Å; N492-Q495 WeakPolarHBondContact O-CB 3.28Å; N492-Q495 PolarHBondContact O-N 3.31Å
493	I	80.8	Confident	67.5	Low	21 Å²	21	69.8 Å²	69.8	11%	0.108	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-59.4	-23.1	-177.7	-64.3	158.6	0	0	0	111.6	K265 T268 K269 I272 Q491 Q495 V496	K265-I493 HydrophobicContact CB-CG2 4.19Å; T268-I493 HydrophobicContact CG2-CG2 4.47Å; K269-I493 HydrophobicContact CB-CD1 4.36Å; K269-I493 HydrophobicContact CG-CB 4.42Å; K269-I493 HydrophobicContact CG-CD1 3.53Å; K269-I493 HydrophobicContact CG-CG2 4.21Å; I272-I493 HydrophobicContact CD1-CD1 3.65Å; I272-I493 HydrophobicContact CD1-CG1 4.36Å; Q491-I493 VanDerWaalsContact C-N 3.25Å; Q491-I493 HydrophobicContact CB-CG1 4.45Å; Q491-I493 PolarHBondContact O-N 3.27Å; I493-Q495 PolarHBondContact O-N 2.88Å; I493-Q495 VanDerWaalsContact O-N 3.14Å; I493-V496 HydrophobicContact CG2-CG2 4.33Å; I493-V496 WeakPolarHBondContact O-CB 3.34Å; I493-V496 VanDerWaalsContact O-CG2 3.28Å; I493-V496 WeakPolarHBondContact O-CG2 3.46Å; I493-V496 PolarHBondContact O-N 2.88Å
494	A	77.8	Confident	69.1	Low	76 Å²	76	72 Å²	72	63%	0.628	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-55	-29.4	171.3	0	0	0	0	0	113.5	K265 N492 V496	K265-A494 PolarHBondContact NZ-O 3.48Å; N492-A494 PolarHBondContact O-N 3.29Å; N492-A494 VanDerWaalsContact O-N 3.1Å; A494-V496 VanDerWaalsContact C-N 3.29Å; A494-V496 PolarHBondContact O-N 2.73Å
495	Q	79.3	Confident	70.8	Confident	135 Å²	135	73.9 Å²	73.9	63%	0.631	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	-80.6	-4.1	-179.5	-61	178.8	-5.5	0	0	113.9	F292 N492 I493 T497	F292-Q495 HydrophobicContact CE2-CB 4.25Å; N492-Q495 HydrophobicContact CB-CG 4.11Å; N492-Q495 WeakPolarHBondContact O-CB 3.28Å; N492-Q495 PolarHBondContact O-N 3.31Å; I493-Q495 PolarHBondContact O-N 2.88Å; I493-Q495 VanDerWaalsContact O-N 3.14Å; Q495-T497 PolarHBondContact O-N 2.74Å
496	V	79.1	Confident	72.8	Confident	4 Å²	4	68.7 Å²	68.7	2%	0.024	36%	0.36	C	S	.	.			trans	-66	117.7	176.6	178.8	0	0	0	0	109.2	V260 K265 F292 I493 A494 L498	V260-V496 HydrophobicContact CG2-CG1 3.91Å; V260-V496 HydrophobicContact CG2-CG2 4.26Å; K265-V496 WeakPolarHBondContact CE-O 3.47Å; F292-V496 HydrophobicContact CD1-CG2 3.68Å; F292-V496 HydrophobicContact CD2-CG2 3.83Å; F292-V496 HydrophobicContact CE1-CG2 3.5Å; F292-V496 VanDerWaalsContact CE1-CG2 3.5Å; F292-V496 HydrophobicContact CE2-CG2 3.66Å; F292-V496 HydrophobicContact CG-CG2 3.85Å; F292-V496 HydrophobicContact CZ-CG2 3.49Å; F292-V496 VanDerWaalsContact CZ-CG2 3.49Å; I493-V496 HydrophobicContact CG2-CG2 4.33Å; I493-V496 WeakPolarHBondContact O-CB 3.34Å; I493-V496 VanDerWaalsContact O-CG2 3.28Å; I493-V496 WeakPolarHBondContact O-CG2 3.46Å; I493-V496 PolarHBondContact O-N 2.88Å; A494-V496 VanDerWaalsContact C-N 3.29Å; A494-V496 PolarHBondContact O-N 2.73Å; V496-L498 HydrophobicContact CG1-CD2 4.19Å; V496-L498 PolarHBondContact O-N 3.35Å
497	T	82.1	Confident	74.2	Confident	87 Å²	87	67.8 Å²	67.8	53%	0.534	36%	0.359	S	S	.	.			trans	-77.8	114.5	169.6	-42	0	0	0	0	109	D261 Q495	D261-T497 WeakPolarHBondContact CB-O 3.45Å; Q495-T497 PolarHBondContact O-N 2.74Å
498	L	84.9	Confident	74.8	Confident	57 Å²	57	71.8 Å²	71.8	30%	0.298	37%	0.373	S	S	.	.			trans	-76.4	148.2	177	-59.2	177.4	0	0	0	110.5	I263 K265 V496 F502	I263-L498 WeakPolarHBondContact O-CD2 3.36Å; K265-L498 HydrophobicContact CG-CD1 4.38Å; K265-L498 HydrophobicContact CG-CD2 4.34Å; V496-L498 HydrophobicContact CG1-CD2 4.19Å; V496-L498 PolarHBondContact O-N 3.35Å; L498-F502 HydrophobicContact CD1-CD2 4.09Å; L498-F502 HydrophobicContact CD1-CE2 4.05Å; L498-F502 HydrophobicContact CD2-CE2 4.48Å
499	S	79.5	Confident	75	Confident	65 Å²	65	70.2 Å²	70.2	46%	0.455	37%	0.372	S	S	.	.	S	Bend	trans	-86.9	-28.7	178.8	60.8	0	0	0	0	113.2	D261 L262	D261-S499 WeakPolarHBondContact O-CB 3.42Å; D261-S499 PolarHBondContact O-N 3.12Å; D261-S499 PolarHBondContact O-OG 3.33Å; L262-S499 WeakPolarHBondContact CD2-OG 3.28Å
500	A	78.5	Confident	74.5	Confident	29 Å²	29	71 Å²	71	24%	0.24	37%	0.374	C	S	.	.	S	Bend	trans	-122.7	150.1	-176.9	0	0	0	0	0	110.8	P460	P460-A500 HydrophobicContact CB-CB 4.06Å; P460-A500 HydrophobicContact CG-CB 4.44Å
501	E	80.3	Confident	73.5	Confident	131 Å²	131	69.1 Å²	69.1	61%	0.612	37%	0.369	S	S	*	.			trans	-86.3	110.3	168.6	-72	177	-170.4	0	0	109.3	R411	R411-E501 IonicContact CZ-OE2 3.96Å; R411-E501 PolarHBondContact NH1-O 2.9Å; R411-E501 IonicContact NH1-OE2 2.86Å; R411-E501 PolarHBondContact NH1-OE2 3.49Å; R411-E501 IonicContact NH2-OE2 3.71Å; R411-E501 PolarHBondContact NH2-OE2 2.9Å
502	F	83	Confident	72.1	Confident	8 Å²	8	72.7 Å²	72.7	4%	0.035	39%	0.393	C	S	.	.			trans	-76.1	150.6	175.8	-63.4	-81.6	0	0	0	111.4	L262 P264 Y408 P460 Y462 L498 D506 K507	L262-F502 WeakPolarHBondContact O-CZ 3.38Å; P264-F502 HydrophobicContact CG-CD1 3.78Å; P264-F502 HydrophobicContact CG-CD2 4.11Å; P264-F502 HydrophobicContact CG-CE1 3.93Å; P264-F502 HydrophobicContact CG-CE2 4.24Å; P264-F502 HydrophobicContact CG-CG 3.89Å; P264-F502 HydrophobicContact CG-CZ 4.16Å; Y408-F502 WeakPolarHBondContact OH-CA 3.34Å; P460-F502 HydrophobicContact CB-CE1 4.02Å; Y462-F502 HydrophobicContact CD1-CE1 4.49Å; L498-F502 HydrophobicContact CD1-CD2 4.09Å; L498-F502 HydrophobicContact CD1-CE2 4.05Å; L498-F502 HydrophobicContact CD2-CE2 4.48Å; F502-D506 HydrophobicContact CB-CB 4.04Å; F502-K507 WeakPolarHBondContact O-CE 3.32Å; F502-K507 PolarHBondContact O-NZ 3.48Å
503	V	81.3	Confident	70.5	Confident	45 Å²	45	70 Å²	70	27%	0.273	38%	0.377	S	S	.	.			trans	-64.8	150.8	171.5	178.5	0	0	0	0	109.2	E407 Y408 E505 D506 K507	E407-V503 HydrophobicContact CB-CG2 4.31Å; Y408-V503 HydrophobicContact CD1-CG2 4.39Å; Y408-V503 HydrophobicContact CE1-CG2 3.64Å; Y408-V503 PolarHBondContact OH-N 3.37Å; V503-E505 PolarHBondContact O-N 2.81Å; V503-D506 WeakPolarHBondContact O-CB 3.35Å; V503-D506 PolarHBondContact O-N 2.97Å; V503-K507 PolarHBondContact O-N 3.09Å
504	D	75	Confident	68.7	Low	100 Å²	100	70.7 Å²	70.7	54%	0.535	38%	0.384	S	S	.	.	H	α-helix	trans	-61.3	-27.9	-173.7	-64.1	-31.1	0	0	0	113.6	D506 K507 K508	D504-D506 VanDerWaalsContact C-N 3.34Å; D504-D506 PolarHBondContact O-N 3.47Å; D504-K507 CarbonylContact O-C 3.5Å; D504-K507 WeakPolarHBondContact O-CA 3.29Å; D504-K507 WeakPolarHBondContact O-CB 3.35Å; D504-K507 PolarHBondContact O-N 3.14Å; D504-K507 IonicContact OD1-NZ 2.74Å; D504-K507 PolarHBondContact OD1-NZ 2.99Å; D504-K508 VanDerWaalsContact O-CG 3.3Å; D504-K508 WeakPolarHBondContact O-CG 3.5Å; D504-K508 PolarHBondContact O-N 2.92Å
505	E	74.2	Confident	66.7	Low	113 Å²	113	74 Å²	74	53%	0.528	39%	0.386	S	S	.	.	H	α-helix	trans	-60.6	-42.5	171.2	-67.7	178.7	176	0	0	112.6	R405 V503 K507 K508	R405-E505 IonicContact CZ-OE2 3.43Å; R405-E505 IonicContact NH1-OE2 3.32Å; R405-E505 PolarHBondContact NH1-OE2 3.39Å; R405-E505 IonicContact NH2-OE2 2.75Å; R405-E505 PolarHBondContact NH2-OE2 3.12Å; V503-E505 PolarHBondContact O-N 2.81Å; E505-K507 PolarHBondContact O-N 3.05Å; E505-K508 PolarHBondContact O-N 2.81Å
506	D	76	Confident	64.7	Low	12 Å²	12	70.8 Å²	70.8	6%	0.064	38%	0.383	C	S	.	.	H	α-helix	trans	-71	-13.6	174.6	-70.8	-11.7	0	0	0	111.8	P264 W266 R405 Y408 Y462 F502 V503 D504	P264-D506 HydrophobicContact CG-CB 4.41Å; W266-D506 PolarHBondContact NE1-O 3.43Å; R405-D506 IonicContact CZ-OD1 3.5Å; R405-D506 IonicContact NH1-OD1 2.85Å; R405-D506 PolarHBondContact NH1-OD1 3.27Å; R405-D506 IonicContact NH1-OD2 3.15Å; Y408-D506 WeakPolarHBondContact CE2-OD2 3.34Å; Y408-D506 PolarHBondContact OH-OD2 3.4Å; Y462-D506 VanDerWaalsContact OH-CG 3.25Å; Y462-D506 PolarHBondContact OH-OD1 3.2Å; F502-D506 HydrophobicContact CB-CB 4.04Å; V503-D506 WeakPolarHBondContact O-CB 3.35Å; V503-D506 PolarHBondContact O-N 2.97Å; D504-D506 VanDerWaalsContact C-N 3.34Å; D504-D506 PolarHBondContact O-N 3.47Å
507	K	70.7	Confident	62.9	Low	98 Å²	98	75.3 Å²	75.3	43%	0.426	41%	0.407	S	S	.	.	H	α-helix	trans	-93.3	-28.8	171.3	-59.4	179.9	-166.5	143.1	0	113.2	F502 V503 D504 E505 N509 D510	F502-K507 WeakPolarHBondContact O-CE 3.32Å; F502-K507 PolarHBondContact O-NZ 3.48Å; V503-K507 PolarHBondContact O-N 3.09Å; D504-K507 CarbonylContact O-C 3.5Å; D504-K507 WeakPolarHBondContact O-CA 3.29Å; D504-K507 WeakPolarHBondContact O-CB 3.35Å; D504-K507 PolarHBondContact O-N 3.14Å; D504-K507 IonicContact OD1-NZ 2.74Å; D504-K507 PolarHBondContact OD1-NZ 2.99Å; E505-K507 PolarHBondContact O-N 3.05Å; K507-N509 PolarHBondContact O-N 2.98Å; K507-D510 WeakPolarHBondContact O-CA 3.48Å; K507-D510 WeakPolarHBondContact O-CB 3.16Å; K507-D510 PolarHBondContact O-N 3.1Å
508	K	58.5	Low	60.6	Low	127 Å²	127	76.5 Å²	76.5	55%	0.552	41%	0.41	S	S	*	.	H	α-helix	trans	-62.3	-28.6	-173	-84.3	172.9	-174.5	179.1	0	113	D504 E505 D510 L511	D504-K508 VanDerWaalsContact O-CG 3.3Å; D504-K508 WeakPolarHBondContact O-CG 3.5Å; D504-K508 PolarHBondContact O-N 2.92Å; E505-K508 PolarHBondContact O-N 2.81Å; K508-D510 PolarHBondContact O-N 2.95Å; K508-L511 PolarHBondContact O-N 3.46Å; K508-L511 VanDerWaalsContact O-N 3.16Å
509	N	57.9	Low	58.2	Low	61 Å²	61	79.6 Å²	79.6	33%	0.326	43%	0.427	S	S	.	.	H	α-helix	trans	-63.3	-23.6	171.5	-76.5	-5.6	0	0	0	113.2	W266 K507 T512	W266-N509 HydrophobicContact CD2-CB 3.71Å; W266-N509 HydrophobicContact CE3-CB 4.06Å; W266-N509 HydrophobicContact CG-CB 4.11Å; W266-N509 HydrophobicContact CH2-CB 4.37Å; W266-N509 WeakPolarHBondContact CH2-ND2 3.45Å; W266-N509 HydrophobicContact CZ2-CB 4.03Å; W266-N509 HydrophobicContact CZ3-CB 4.37Å; K507-N509 PolarHBondContact O-N 2.98Å; N509-T512 PolarHBondContact O-OG1 3.5Å
510	D	50	Low	56.2	Low	43 Å²	43	80 Å²	80	23%	0.23	43%	0.43	C	S	.	.	H	α-helix	trans	-72.5	-31.2	176	-131.4	-13.1	0	0	0	111.4	W266 K507 K508 S514	W266-D510 HydrophobicContact CB-CB 4.15Å; W266-D510 WeakPolarHBondContact CB-OD1 3.38Å; W266-D510 HydrophobicContact CG-CB 4.43Å; K507-D510 WeakPolarHBondContact O-CA 3.48Å; K507-D510 WeakPolarHBondContact O-CB 3.16Å; K507-D510 PolarHBondContact O-N 3.1Å; K508-D510 PolarHBondContact O-N 2.95Å; D510-S514 WeakPolarHBondContact O-CB 3.38Å; D510-S514 PolarHBondContact O-N 3.22Å; D510-S514 VanDerWaalsContact O-N 3.17Å; D510-S514 PolarHBondContact O-OG 3.49Å
511	L	40.7	Very low	54.2	Low	105 Å²	105	85.5 Å²	85.5	55%	0.55	45%	0.451	S	S	.	.	H	α-helix	trans	-74.4	-40.9	-175	-71.3	169.3	0	0	0	112.8	K508 E513 S514 E515	K508-L511 PolarHBondContact O-N 3.46Å; K508-L511 VanDerWaalsContact O-N 3.16Å; L511-E513 PolarHBondContact O-N 3.22Å; L511-S514 WeakPolarHBondContact CA-OG 3.11Å; L511-S514 PolarHBondContact O-N 3.36Å; L511-S514 PolarHBondContact O-OG 3.27Å; L511-E515 PolarHBondContact O-N 3.17Å
512	T	45.2	Very low	52	Low	103 Å²	103	82.5 Å²	82.5	63%	0.632	45%	0.448	S	S	*	.	H	α-helix	trans	-64.1	-24.6	178.8	59.4	0	0	0	0	113.6	N509	N509-T512 PolarHBondContact O-OG1 3.5Å
513	E	45.8	Very low	49.8	Very low	49 Å²	49	86.5 Å²	86.5	23%	0.229	47%	0.473	C	S	.	.	H	α-helix	trans	-88.7	-32.8	174.9	-69.1	179.9	-171.6	0	0	112	R270 L511 A516	R270-E513 IonicContact CZ-OE1 3.35Å; R270-E513 VanDerWaalsContact CZ-OE1 3.25Å; R270-E513 IonicContact NE-OE1 3.82Å; R270-E513 PolarHBondContact NE-OE1 2.84Å; R270-E513 IonicContact NH2-OE1 3.14Å; R270-E513 PolarHBondContact NH2-OE1 3.19Å; L511-E513 PolarHBondContact O-N 3.22Å; E513-A516 PolarHBondContact O-N 2.72Å
514	S	43.3	Very low	47.6	Very low	37 Å²	37	88.8 Å²	88.8	26%	0.259	49%	0.491	S	S	.	.	H	α-helix	trans	-73.1	-25.5	-178	66.7	0	0	0	0	115.3	D510 L511 A516 N518	D510-S514 WeakPolarHBondContact O-CB 3.38Å; D510-S514 PolarHBondContact O-N 3.22Å; D510-S514 VanDerWaalsContact O-N 3.17Å; D510-S514 PolarHBondContact O-OG 3.49Å; L511-S514 WeakPolarHBondContact CA-OG 3.11Å; L511-S514 PolarHBondContact O-N 3.36Å; L511-S514 PolarHBondContact O-OG 3.27Å; S514-A516 VanDerWaalsContact C-N 3.28Å; S514-A516 PolarHBondContact O-N 3.14Å; S514-N518 PolarHBondContact O-N 3.38Å; S514-N518 PolarHBondContact O-ND2 2.84Å
515	E	35.3	Very low	45.7	Very low	144 Å²	144	92.1 Å²	92.1	67%	0.673	50%	0.503	S	S	*	.	H	α-helix	trans	-74.5	-18.8	174.5	-69.1	-168.4	168.4	0	0	112.9	L511	L511-E515 PolarHBondContact O-N 3.17Å
516	A	38.4	Very low	43.8	Very low	69 Å²	69	97.7 Å²	97.7	57%	0.57	52%	0.52	S	S	*	.	H	α-helix	trans	-78.1	-34.3	176.1	0	0	0	0	0	112.6	E513 S514	E513-A516 PolarHBondContact O-N 2.72Å; S514-A516 VanDerWaalsContact C-N 3.28Å; S514-A516 PolarHBondContact O-N 3.14Å
517	D	40.8	Very low	41.7	Very low	98 Å²	98	105.2 Å²	105.2	52%	0.524	55%	0.554	S	S	.	*	H	α-helix	trans	-79.5	-40.6	-178.5	-72.2	-18.7	0	0	0	111.8	N519 S520	D517-N519 PolarHBondContact O-N 2.93Å; D517-S520 PolarHBondContact O-N 3.26Å; D517-S520 PolarHBondContact O-OG 3.44Å
518	N	33	Very low	39.7	Very low	112 Å²	112	106 Å²	106	60%	0.599	57%	0.572	S	S	*	*	H	α-helix	trans	-73.8	-21.6	-176.4	-71.2	-26.8	0	0	0	114.4	S514 S520	S514-N518 PolarHBondContact O-N 3.38Å; S514-N518 PolarHBondContact O-ND2 2.84Å; N518-S520 VanDerWaalsContact C-N 3.28Å
519	N	34.9	Very low	38.5	Very low	123 Å²	123	108.7 Å²	108.7	66%	0.658	59%	0.586	S	S	*	*	H	α-helix	trans	-81	-6.5	174.9	-92.8	-20.8	0	0	0	113.5	D517 V523	D517-N519 PolarHBondContact O-N 2.93Å; N519-V523 WeakPolarHBondContact O-CG2 3.5Å
520	S	38	Very low	37.2	Very low	73 Å²	73	114.8 Å²	114.8	51%	0.51	61%	0.61	S	S	.	*	H	α-helix	trans	-91.8	-27.9	179.4	75.4	0	0	0	0	113.4	D517 N518	D517-S520 PolarHBondContact O-N 3.26Å; D517-S520 PolarHBondContact O-OG 3.44Å; N518-S520 VanDerWaalsContact C-N 3.28Å
521	E	35.8	Very low	36.4	Very low	145 Å²	145	119.1 Å²	119.1	68%	0.678	63%	0.633	S	S	*	*	H	α-helix	trans	-81.1	-20.5	177.7	-71	-175.2	158.5	0	0	113.2	S524	E521-S524 PolarHBondContact O-OG 2.99Å
522	A	33.4	Very low	36	Very low	68 Å²	68	121.8 Å²	121.8	56%	0.562	65%	0.647	S	S	*	*	S	Bend	trans	-88.2	-7.4	-179.9	0	0	0	0	0	114.6
523	V	37.3	Very low	35.4	Very low	92 Å²	92	125.2 Å²	125.2	56%	0.558	66%	0.657	S	S	*	*	S	Bend	trans	-101.7	-14.5	-177.1	-179.3	0	0	0	0	112.2	N519	N519-V523 WeakPolarHBondContact O-CG2 3.5Å
524	S	35.2	Very low	34.6	Very low	92 Å²	92	130.3 Å²	130.3	64%	0.643	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-8.7	-179.7	60.2	0	0	0	0	114.7	E521	E521-S524 PolarHBondContact O-OG 2.99Å
525	E	36.3	Very low	33.9	Very low	171 Å²	171	132.8 Å²	132.8	80%	0.799	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.4	8.2	-178.4	-67.3	-170.1	156.8	0	0	114.5
526	R	33.3	Very low	33.6	Very low	230 Å²	230	134.7 Å²	134.7	87%	0.868	72%	0.717	S	S	*	*	S	Bend	trans	-128.3	12.5	-177.4	-73.2	-171.5	-179	-175.7	1.3	116.4
527	Q	32.3	Very low	33.1	Very low	170 Å²	170	136.9 Å²	136.9	79%	0.794	73%	0.728	S	S	*	*			trans	-134.5	69.2	-180	-70.9	-178.9	-11.6	0	0	111.2
528	S	28.6	Very low	32.6	Very low	114 Å²	114	138 Å²	138	80%	0.797	74%	0.742	S	S	*	*			trans	-142.3	57.7	166.1	68.4	0	0	0	0	110.2
529	E	32.8	Very low	32.4	Very low	183 Å²	183	137.1 Å²	137.1	86%	0.855	75%	0.745	S	S	*	*			trans	-165.3	94.6	165.6	-108.2	173.2	-172	0	0	106.1
530	F	31.9	Very low	32	Very low	189 Å²	189	138.1 Å²	138.1	83%	0.829	76%	0.755	S	S	*	*			trans	167.3	116.9	142.1	-108	-109.4	0	0	0	111.4
531	D	31.6	Very low	31.8	Very low	134 Å²	134	139.3 Å²	139.3	72%	0.717	77%	0.769	S	S	*	*			trans	75.2	99.4	140.9	-61.3	-4.9	0	0	0	123
532	L	32.8	Very low	31.4	Very low	161 Å²	161	137.4 Å²	137.4	84%	0.843	77%	0.772	S	S	*	*			trans	-54.4	126.6	138.7	-74.4	145.6	0	0	0	111
533	Q	33	Very low	31.4	Very low	176 Å²	176	142 Å²	142	82%	0.822	79%	0.787	S	S	*	*				169.4	139.9	127.2	-92.6	163.2	30.8	0	0	112.2
534	N	29.7	Very low	31.3	Very low	156 Å²	156	144.2 Å²	144.2	83%	0.834	80%	0.8	S	S	*	*			trans	109	104	156	-61.4	-19	0	0	0	118.1
535	A	28.7	Very low	31.2	Very low	89 Å²	89	148 Å²	148	74%	0.736	81%	0.813	S	S	*	*			trans	-82.3	167.8	160.9	0	0	0	0	0	111.2
536	E	28.4	Very low	31.1	Very low	183 Å²	183	144.8 Å²	144.8	86%	0.855	81%	0.81	S	S	*	*			trans	82.1	108.4	160.1	-58.2	-176.7	170.5	0	0	118.6
537	S	28.2	Very low	30.9	Very low	115 Å²	115	139.3 Å²	139.3	80%	0.804	81%	0.805	S	S	*	*				159.6	156.5	103.8	54.5	0	0	0	0	113.9
538	C	29.1	Very low	30.8	Very low	122 Å²	122	137.2 Å²	137.2	82%	0.824	81%	0.81	S	S	*	*			trans	70.7	135.4	164.5	-77.8	0	0	0	0	118.7
539	S	29.2	Very low	31.1	Very low	93 Å²	93	135 Å²	135	65%	0.65	80%	0.804	S	S	*	*			cis	140.1	115.7	-6.2	57.2	0	0	0	0	107
540	V	27.3	Very low	31.3	Very low	145 Å²	145	134 Å²	134	88%	0.879	80%	0.804	S	S	*	*			trans	27.6	117.2	145.8	-158.9	0	0	0	0	119.1
541	A	33	Very low	31.2	Very low	97 Å²	97	130.1 Å²	130.1	80%	0.802	80%	0.801	S	S	*	*			trans	-146	125.8	145.5	0	0	0	0	0	109.6
542	S	27.2	Very low	31.2	Very low	105 Å²	105	127 Å²	127	73%	0.734	80%	0.8	S	S	*	*			trans	-86.9	133.9	171.3	49.3	0	0	0	0	109.6
543	D	34.3	Very low	31.3	Very low	166 Å²	166	127.8 Å²	127.8	89%	0.888	80%	0.803	S	S	*	*			trans	-135.5	123.8	158.8	-78.3	-42.3	0	0	0	109.8
544	V	35.7	Very low	31.1	Very low	137 Å²	137	125.1 Å²	125.1	83%	0.83	80%	0.804	S	S	*	*			trans	-94.3	129.9	170.3	-88.5	0	0	0	0	106.6
545	D	32.8	Very low	31.2	Very low	171 Å²	171	120.9 Å²	120.9	91%	0.914	80%	0.797	S	S	*	*			trans	-151.6	148.9	155	-119.6	-23.3	0	0	0	115.1
546	S	33.4	Very low	31.4	Very low	104 Å²	104	125.1 Å²	125.1	73%	0.727	80%	0.804	S	S	*	*			trans	-69.4	146	-162	-82.5	0	0	0	0	117.6
547	C	28.7	Very low	31.7	Very low	115 Å²	115	120.8 Å²	120.8	78%	0.777	79%	0.794	S	S	*	*			trans	26.4	135.7	131.8	-65.9	0	0	0	0	123
548	S	30.4	Very low	32	Very low	127 Å²	127	121.4 Å²	121.4	89%	0.888	79%	0.788	S	S	*	*			trans	104.7	119.5	131.6	75.8	0	0	0	0	118.3
549	G	35.4	Very low	32.1	Very low	66 Å²	66	123.9 Å²	123.9	68%	0.68	79%	0.792	S	S	*	*			trans	-173.1	84.3	170.6	0	0	0	0	0	111
550	L	36.7	Very low	32.2	Very low	163 Å²	163	127.7 Å²	127.7	85%	0.853	81%	0.805	S	S	*	*				44	105.4	129.9	-58.8	168	0	0	0	117.3
551	S	29.6	Very low	32.4	Very low	108 Å²	108	125.4 Å²	125.4	76%	0.755	80%	0.802	S	S	*	*				71.4	120.6	77.2	73.3	0	0	0	0	115.3
552	G	31.9	Very low	32.2	Very low	68 Å²	68	126.2 Å²	126.2	70%	0.701	80%	0.802	S	S	*	*			trans	107.5	102.3	156.9	0	0	0	0	0	114.5
553	I	34.6	Very low	32.5	Very low	177 Å²	177	129.2 Å²	129.2	91%	0.908	81%	0.808	S	S	*	*				-177.9	136.4	96.8	49.9	166.7	0	0	0	111
554	S	28.8	Very low	32.4	Very low	121 Å²	121	126 Å²	126	85%	0.846	80%	0.799	S	S	*	*			trans	-85.6	155	-179.7	45.5	0	0	0	0	113.3
555	G	30.9	Very low	32.3	Very low	67 Å²	67	127 Å²	127	69%	0.691	80%	0.799	S	S	*	*			trans	157.8	130.9	153.8	0	0	0	0	0	116.8
556	M	34.2	Very low	32.4	Very low	177 Å²	177	127.9 Å²	127.9	87%	0.872	80%	0.798	S	S	*	*			trans	77.7	95.2	169.1	-82.5	73.2	127.4	0	0	118.4
557	S	34.6	Very low	32.4	Very low	93 Å²	93	130.5 Å²	130.5	65%	0.65	80%	0.804	S	S	*	*				69.5	91.4	79.2	71.5	0	0	0	0	113.1
558	D	34	Very low	32.8	Very low	127 Å²	127	133 Å²	133	68%	0.679	81%	0.809	S	S	*	*				63.3	102.2	85.4	-70.8	-29	0	0	0	114.7	R134	R134-D558 IonicContact NH1-OD2 2.66Å; R134-D558 PolarHBondContact NH1-OD2 2.76Å
559	L	31.8	Very low	33	Very low	174 Å²	174	136 Å²	136	91%	0.911	81%	0.809	S	S	*	*			trans	-172.8	83.8	154.4	-106.3	146.4	0	0	0	109.5
560	D	30.5	Very low	33.2	Very low	173 Å²	173	140.9 Å²	140.9	93%	0.925	82%	0.819	S	S	*	*			trans	-126.5	113.8	158.6	-97.2	-27.3	0	0	0	108
561	A	32.6	Very low	33.1	Very low	97 Å²	97	138.6 Å²	138.6	80%	0.802	81%	0.813	S	S	*	*			trans	-80.1	127.5	178.6	0	0	0	0	0	110.5
562	S	29.2	Very low	33.3	Very low	115 Å²	115	143.5 Å²	143.5	80%	0.804	82%	0.821	S	S	*	*			trans	-65.4	131.3	170.5	49.5	0	0	0	0	112.6
563	I	32.3	Very low	33.5	Very low	167 Å²	167	146.9 Å²	146.9	86%	0.856	83%	0.828	S	S	*	*			trans	-120.8	119.3	149.4	-81.4	173.3	0	0	0	106.7
564	S	33.3	Very low	33.7	Very low	100 Å²	100	143.9 Å²	143.9	70%	0.699	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-68.4	134.8	179.9	42.1	0	0	0	0	112.2
565	D	31.8	Very low	34	Very low	158 Å²	158	147.7 Å²	147.7	85%	0.845	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-73.3	127.6	161.3	-69.3	-49.4	0	0	0	108.9
566	E	35.9	Very low	35.1	Very low	189 Å²	189	150 Å²	150	88%	0.883	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-95.4	122.7	162.9	-74.6	-160.2	158.3	0	0	109.1
567	D	33.9	Very low	35.5	Very low	159 Å²	159	147.6 Å²	147.6	85%	0.85	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-73.2	128.7	172	-71.7	-55	0	0	0	110.7
568	D	36	Very low	35.6	Very low	166 Å²	166	150.9 Å²	150.9	89%	0.888	83%	0.833	S	S	*	*			trans	-113.4	108.7	165.7	-107.3	-29.3	0	0	0	110.1
569	E	35.9	Very low	36	Very low	192 Å²	192	151.5 Å²	151.5	90%	0.897	84%	0.841	S	S	*	*			trans	-67	130.8	175.1	-116.3	-177.2	159.6	0	0	111.5
570	L	38	Very low	36.1	Very low	168 Å²	168	154.6 Å²	154.6	88%	0.88	84%	0.841	S	S	*	*			trans	-112	137	167.3	-80.1	170	0	0	0	111.4
571	P	36.1	Very low	36.5	Very low	114 Å²	114	158.3 Å²	158.3	74%	0.74	84%	0.842	S	S	*	*			trans	-82.3	152.4	-168	31.9	-34.5	0	0	0	114.4
572	K	32.3	Very low	36.9	Very low	212 Å²	212	164 Å²	164	92%	0.922	85%	0.849	S	S	*	*			trans	-68.6	128.8	179.1	-65.8	170.6	-179.4	168.6	0	112
573	V	37.3	Very low	37.2	Very low	138 Å²	138	162.6 Å²	162.6	84%	0.836	85%	0.853	S	S	*	*			trans	-115	126.8	168.2	179.5	0	0	0	0	110.6
574	S	38.5	Very low	37.4	Very low	114 Å²	114	158.5 Å²	158.5	80%	0.797	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-69.5	142.1	178.6	50.1	0	0	0	0	113.8
575	K	36.1	Very low	37.4	Very low	201 Å²	201	166.2 Å²	166.2	87%	0.874	87%	0.865	S	S	*	*	P	Polyproline II helix	trans	-94.7	141.2	177.1	-70.4	175.6	179	169.7	0	112.4
576	P	53.1	Low	37.8	Very low	116 Å²	116	162.8 Å²	162.8	75%	0.753	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-90.8	165.1	163.5	33.9	-28.4	0	0	0	112.5
577	P	42.8	Very low	37.9	Very low	127 Å²	127	159.7 Å²	159.7	83%	0.825	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-82.4	155.2	-162.1	32.4	-34.2	0	0	0	114.9
578	I	36.8	Very low	37.9	Very low	162 Å²	162	162.2 Å²	162.2	83%	0.831	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-84.9	124.8	-173.8	-65.5	164.3	0	0	0	110.9
579	T	41.9	Very low	37.9	Very low	139 Å²	139	162.8 Å²	162.8	85%	0.853	86%	0.86	S	S	*	*	P	Polyproline II helix	trans	-103.1	120	162.8	53.7	0	0	0	0	111.2
580	R	34.2	Very low	37.9	Very low	240 Å²	240	158.2 Å²	158.2	91%	0.906	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-67.2	130.7	176	-84.4	172	151.1	172.2	-5.6	111.9
581	R	39.9	Very low	37.5	Very low	251 Å²	251	153.8 Å²	153.8	95%	0.947	85%	0.851	S	S	*	*			trans	-128.1	127.7	153.7	-98.1	-176.7	156.5	173.9	-5.3	110.4
582	K	39.1	Very low	37.4	Very low	216 Å²	216	157.9 Å²	157.9	94%	0.939	86%	0.857	S	S	*	*			trans	-74.6	148.7	177.1	-74.2	177.7	173.5	176.4	0	110.8
583	G	36	Very low	37.2	Very low	86 Å²	86	157.7 Å²	157.7	89%	0.887	86%	0.856	S	S	*	*			trans	117.8	117.2	146	0	0	0	0	0	116.1
584	G	36.8	Very low	36.9	Very low	80 Å²	80	160.7 Å²	160.7	83%	0.825	86%	0.858	S	S	*	*			trans	151.8	80.7	165	0	0	0	0	0	114.5	A586	G584-A586 PolarHBondContact O-N 2.94Å
585	R	33.3	Very low	36.4	Very low	262 Å²	262	163.7 Å²	163.7	99%	0.989	86%	0.861	S	S	*	*			trans	-64.4	121.9	176.7	-137.8	175.2	-178.1	178.3	-0.6	109.9
586	A	40.8	Very low	36.1	Very low	87 Å²	87	157.5 Å²	157.5	72%	0.719	86%	0.855	S	S	*	*			trans	-108.2	138.2	168.5	0	0	0	0	0	110.3	G584	G584-A586 PolarHBondContact O-N 2.94Å
587	P	37.9	Very low	35.2	Very low	123 Å²	123	158.7 Å²	158.7	80%	0.799	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-78	144.4	-172.8	30.6	-32.3	0	0	0	112.4	L589	P587-L589 PolarHBondContact O-N 3.5Å
588	K	32.7	Very low	34.8	Very low	213 Å²	213	159.8 Å²	159.8	93%	0.926	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-63.6	116.6	177.2	-67.4	177.2	177.3	176.7	0	110.3
589	L	36.7	Very low	34.8	Very low	177 Å²	177	154.9 Å²	154.9	93%	0.927	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-84.7	127.6	165.2	-92	152.5	0	0	0	109.7	P587 G591	P587-L589 PolarHBondContact O-N 3.5Å; L589-G591 PolarHBondContact O-N 2.98Å
590	A	34.8	Very low	34.7	Very low	96 Å²	96	150 Å²	150	79%	0.793	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-52.6	125.8	-175.3	0	0	0	0	0	113.2	K592	A590-K592 PolarHBondContact O-N 2.99Å
591	G	31.3	Very low	35.1	Very low	76 Å²	76	143 Å²	143	78%	0.784	78%	0.783	S	S	*	*			trans	-66.9	111.9	169.2	0	0	0	0	0	110.3	L589 K593	L589-G591 PolarHBondContact O-N 2.98Å; G591-K593 PolarHBondContact O-N 3.24Å
592	K	32.8	Very low	35.3	Very low	200 Å²	200	133.7 Å²	133.7	87%	0.87	75%	0.754	S	S	*	*			trans	-64.5	116.1	159.9	-83.7	-179.4	173	178.2	0	107.9	A590 K594	A590-K592 PolarHBondContact O-N 2.99Å; K592-K594 PolarHBondContact O-N 3.36Å
593	K	29.1	Very low	35.3	Very low	208 Å²	208	126.9 Å²	126.9	90%	0.904	73%	0.727	S	S	*	*			trans	-47.2	105.7	166.7	-77.1	179.5	173.2	179.8	0	108.9	G591 M595	G591-K593 PolarHBondContact O-N 3.24Å; K593-M595 PolarHBondContact O-N 3.04Å
594	K	30.1	Very low	35.5	Very low	201 Å²	201	125.9 Å²	125.9	87%	0.874	70%	0.699	S	S	*	*			trans	-76.5	106.8	160.6	-86.3	-174.5	175.4	178.5	0	106	K592 G596	K592-K594 PolarHBondContact O-N 3.36Å; K594-G596 PolarHBondContact O-N 3.41Å
595	M	28.2	Very low	35.6	Very low	176 Å²	176	124.4 Å²	124.4	87%	0.867	67%	0.674	S	S	*	*			trans	-51.1	110.9	163.3	-70.8	-96.2	-73.2	0	0	107.8	K593 K597	K593-M595 PolarHBondContact O-N 3.04Å; M595-K597 PolarHBondContact O-N 3.5Å; M595-K597 VanDerWaalsContact O-N 3.08Å
596	G	28.9	Very low	35.6	Very low	71 Å²	71	119.6 Å²	119.6	73%	0.732	66%	0.663	S	S	*	*			trans	-66	104.9	172.3	0	0	0	0	0	108.2	K594 Q598	K594-G596 PolarHBondContact O-N 3.41Å; G596-Q598 PolarHBondContact O-N 3.38Å; G596-Q598 VanDerWaalsContact O-N 3.16Å
597	K	35.7	Very low	35.2	Very low	142 Å²	142	123.5 Å²	123.5	62%	0.617	67%	0.666	S	S	*	*			trans	-69.9	106.2	162.9	-74.9	-172.7	174	-172.5	0	106.5	R117 M595	R117-K597 PolarHBondContact NH1-O 3.06Å; M595-K597 PolarHBondContact O-N 3.5Å; M595-K597 VanDerWaalsContact O-N 3.08Å
598	Q	34.6	Very low	35	Very low	150 Å²	150	120.7 Å²	120.7	70%	0.701	65%	0.648	S	S	*	*			trans	-52.7	147	172.5	-79	170.4	-21.2	0	0	110.1	R117 G596 G600	R117-Q598 PolarHBondContact NH1-O 2.74Å; R117-Q598 VanDerWaalsContact NH1-O 3.12Å; G596-Q598 PolarHBondContact O-N 3.38Å; G596-Q598 VanDerWaalsContact O-N 3.16Å; Q598-G600 PolarHBondContact O-N 3.32Å
599	A	35.2	Very low	34.9	Very low	59 Å²	59	119.1 Å²	119.1	49%	0.488	65%	0.648	S	S	.	*			trans	-85.5	96.6	170.4	0	0	0	0	0	106.2	L121	L121-A599 HydrophobicContact CD2-CB 4.42Å
600	G	39.9	Very low	34.8	Very low	37 Å²	37	115.8 Å²	115.8	38%	0.381	64%	0.639	S	S	.	*			trans	-88.9	134.6	176.4	0	0	0	0	0	110.7	Q598 V602	Q598-G600 PolarHBondContact O-N 3.32Å; G600-V602 PolarHBondContact O-N 3.42Å
601	I	43.2	Very low	34.7	Very low	93 Å²	93	115.8 Å²	115.8	48%	0.477	64%	0.639	S	S	.	*			trans	-70	116.8	154.4	-65.1	167.1	0	0	0	104.6	A107	A107-I601 HydrophobicContact CB-CG2 4.31Å
602	V	43.8	Very low	34.7	Very low	55 Å²	55	117.2 Å²	117.2	33%	0.333	64%	0.644	S	S	.	*	B	Isolated β-bridge	trans	-94.9	105.2	177.8	-179.2	0	0	0	0	106.7	L116 L307 G600	L116-V602 HydrophobicContact CD1-CG2 4.19Å; L307-V602 HydrophobicContact CD1-CB 4.09Å; L307-V602 HydrophobicContact CD1-CG1 4.04Å; L307-V602 HydrophobicContact CD1-CG2 4Å; G600-V602 PolarHBondContact O-N 3.42Å
603	D	39.1	Very low	34.7	Very low	72 Å²	72	111.3 Å²	111.3	39%	0.385	64%	0.64	S	S	.	*			trans	-85.9	122	175.2	-151.2	11.3	0	0	0	108.6	T605	D603-T605 HydrophobicContact CB-CG2 4.41Å; D603-T605 PolarHBondContact O-N 2.98Å; D603-T605 WeakPolarHBondContact OD1-CG2 3.36Å; D603-T605 WeakPolarHBondContact OD2-CG2 3.29Å; D603-T605 PolarHBondContact OD2-OG1 2.98Å
604	F	40.3	Very low	34.6	Very low	65 Å²	65	111.5 Å²	111.5	29%	0.285	64%	0.641	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.6	16.9	-178.1	-79.3	-91.3	0	0	0	112.6	Y112 F114 Q303 L307 R488	Y112-F604 WeakPolarHBondContact O-CD2 3.34Å; F114-F604 HydrophobicContact CD2-CD2 4.31Å; F114-F604 AromaticContact CD2-CE2 3.77Å; F114-F604 HydrophobicContact CD2-CE2 3.77Å; F114-F604 HydrophobicContact CE2-CE2 4.45Å; Q303-F604 HydrophobicContact CB-CE1 4.38Å; L307-F604 HydrophobicContact CD1-CZ 4.37Å; L307-F604 HydrophobicContact CD2-CE2 4.48Å; L307-F604 HydrophobicContact CD2-CZ 4.2Å; R488-F604 VanDerWaalsContact NH1-C 3.25Å; R488-F604 PolarHBondContact NH1-O 3.02Å; R488-F604 VanDerWaalsContact NH1-O 3.15Å
605	T	38.9	Very low	34.8	Very low	50 Å²	50	113.6 Å²	113.6	31%	0.307	64%	0.643	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109.5	-22.8	-160.1	66.2	0	0	0	0	114.2	R488 D603	R488-T605 VanDerWaalsContact CZ-CA 3.42Å; R488-T605 VanDerWaalsContact NH1-CA 3.34Å; D603-T605 HydrophobicContact CB-CG2 4.41Å; D603-T605 PolarHBondContact O-N 2.98Å; D603-T605 WeakPolarHBondContact OD1-CG2 3.36Å; D603-T605 WeakPolarHBondContact OD2-CG2 3.29Å; D603-T605 PolarHBondContact OD2-OG1 2.98Å
606	Q	32.5	Very low	34.7	Very low	160 Å²	160	114.7 Å²	114.7	75%	0.748	65%	0.646	S	S	*	*			trans	-99.2	113.2	-169	-65.2	-172.8	1.7	0	0	112.7
607	E	32.9	Very low	34.9	Very low	170 Å²	170	121.5 Å²	121.5	79%	0.794	65%	0.65	S	S	*	*			trans	-71.3	135.9	159.3	-66.2	-165.1	151.1	0	0	109.8	I609	E607-I609 PolarHBondContact O-N 3.25Å
608	P	34.7	Very low	34.7	Very low	63 Å²	63	120.8 Å²	120.8	41%	0.409	66%	0.662	S	S	.	*			trans	-73.2	121.4	172.1	28.3	-30.9	0	0	0	109.9	S610 L620	P608-S610 PolarHBondContact O-N 3.43Å; P608-L620 VanDerWaalsContact CD-CD2 3.48Å; P608-L620 HydrophobicContact CG-CD2 4.04Å
609	I	31	Very low	34.5	Very low	180 Å²	180	123.1 Å²	123.1	92%	0.923	67%	0.666	S	S	*	*			trans	-57.4	105.1	164.8	-59.3	165.6	0	0	0	107.2	E607	E607-I609 PolarHBondContact O-N 3.25Å
610	S	33.2	Very low	34.3	Very low	107 Å²	107	126.6 Å²	126.6	75%	0.748	68%	0.676	S	S	*	*			trans	-110.9	120.7	176.2	79.1	0	0	0	0	110.7	P608	P608-S610 PolarHBondContact O-N 3.43Å
611	A	33.7	Very low	33.6	Very low	96 Å²	96	128.8 Å²	128.8	79%	0.793	69%	0.685	S	S	*	*			trans	-61.5	132.4	171.2	0	0	0	0	0	110.9
612	A	31	Very low	32.9	Very low	107 Å²	107	131 Å²	131	88%	0.884	70%	0.703	S	S	*	*	S	Bend	trans	25.1	106.8	153.8	0	0	0	0	0	118
613	G	31.6	Very low	32.1	Very low	76 Å²	76	135.3 Å²	135.3	78%	0.784	72%	0.723	S	S	*	*			trans	169.7	92.6	162.8	0	0	0	0	0	114.7	R615	G613-R615 PolarHBondContact O-N 3.46Å; G613-R615 VanDerWaalsContact O-N 3.15Å
614	K	28.8	Very low	31.6	Very low	212 Å²	212	141.3 Å²	141.3	92%	0.922	75%	0.754	S	S	*	*			trans	-41.1	112.4	172.8	-72.4	170.7	174.8	173.5	0	112.9
615	R	32.7	Very low	31.1	Very low	244 Å²	244	145.2 Å²	145.2	92%	0.921	78%	0.777	S	S	*	*			trans	177.7	117.7	136.8	-99	163.2	178.4	-170.3	0.2	111.6	G613 R617	G613-R615 PolarHBondContact O-N 3.46Å; G613-R615 VanDerWaalsContact O-N 3.15Å; R615-R617 PolarHBondContact O-N 3.09Å
616	Q	27.2	Very low	30.7	Very low	200 Å²	200	150.2 Å²	150.2	94%	0.935	80%	0.802	S	S	*	*			trans	-54.6	113.1	174.3	-72.2	167.8	-35.4	0	0	111.8
617	R	33.2	Very low	30.6	Very low	214 Å²	214	149.6 Å²	149.6	81%	0.808	81%	0.805	S	S	*	*			trans	-164	110.7	156.8	-105.3	172.6	-172.2	-170.4	2.5	108.3	R615 Y619	R615-R617 PolarHBondContact O-N 3.09Å; R617-Y619 HydrophobicContact CB-CD2 4.12Å; R617-Y619 HydrophobicContact CB-CE2 4.21Å; R617-Y619 HydrophobicContact CG-CE2 4.42Å; R617-Y619 PolarHBondContact O-N 3.31Å
618	S	30.7	Very low	30.5	Very low	126 Å²	126	148.4 Å²	148.4	88%	0.881	81%	0.805	S	S	*	*			trans	-64.2	97.3	179.7	57.3	0	0	0	0	111.6
619	Y	30.3	Very low	30.2	Very low	200 Å²	200	153.8 Å²	153.8	78%	0.784	83%	0.83	S	S	*	*			trans	-134.1	109.8	167.2	-74.3	-85.6	0	0	0	108.1	R617	R617-Y619 HydrophobicContact CB-CD2 4.12Å; R617-Y619 HydrophobicContact CB-CE2 4.21Å; R617-Y619 HydrophobicContact CG-CE2 4.42Å; R617-Y619 PolarHBondContact O-N 3.31Å
620	L	32.6	Very low	30.2	Very low	131 Å²	131	152 Å²	152	69%	0.686	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-93.3	116.6	170.6	-107.7	141.8	0	0	0	109.5	P608	P608-L620 VanDerWaalsContact CD-CD2 3.48Å; P608-L620 HydrophobicContact CG-CD2 4.04Å
621	S	25.3	Very low	30	Very low	84 Å²	84	155.2 Å²	155.2	59%	0.587	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-78.3	135.5	174.4	51.2	0	0	0	0	111.3
622	V	28.1	Very low	29.7	Very low	138 Å²	138	159.8 Å²	159.8	84%	0.836	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-82.5	120.8	169	175.4	0	0	0	0	108.3
623	I	25.6	Very low	29.6	Very low	147 Å²	147	164.2 Å²	164.2	75%	0.754	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-80.1	137.1	164.4	-62.2	176.5	0	0	0	107.6
624	L	28.9	Very low	29.4	Very low	198 Å²	198	172.2 Å²	172.2	100%	1.037	83%	0.832	S	S	*	*			trans	-61.3	0	-165	-92.9	160.2	0	0	0	116.3

Retrieved 624 of 624 residues in 343.3 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).