A0A087YAT8_POEFO Loading...

WT1 interacting protein

AlphaFold DB , UniProt , Accession A0A087YAT8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 710 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	52.1	Low	61.2	Low	190 Å²	190	132.3 Å²	132.3	94%	0.936	62%	0.616	S	S	*	*				0	-39.2	0	-161.8	159.3	-80.4	0	0	108.4	R3 Y4	M1-R3 PolarHBondContact O-N 3.23Å; M1-R3 VanDerWaalsContact O-N 3.15Å; M1-Y4 WeakPolarHBondContact O-CB 3.37Å; M1-Y4 PolarHBondContact O-N 3Å
2	E	48	Very low	61.6	Low	135 Å²	135	125.3 Å²	125.3	63%	0.631	60%	0.598	S	S	*	*	H	α-helix	trans	-40.7	-49.2	179.1	-55.6	99.3	147.6	0	0	115	Y4 E5 E6	E2-Y4 PolarHBondContact O-N 3.25Å; E2-E5 CarbonylContact O-C 3.55Å; E2-E5 WeakPolarHBondContact O-CA 3.37Å; E2-E5 WeakPolarHBondContact O-CB 3.4Å; E2-E5 PolarHBondContact O-N 3.09Å; E2-E6 PolarHBondContact O-N 3.07Å
3	R	51.5	Low	62.3	Low	218 Å²	218	118.9 Å²	118.9	82%	0.823	58%	0.579	S	S	*	*	H	α-helix	trans	-57.9	-20.5	-178.9	-63.7	-164.1	-162.3	178.2	5.9	115.1	M1 E6 D7	M1-R3 PolarHBondContact O-N 3.23Å; M1-R3 VanDerWaalsContact O-N 3.15Å; R3-E6 WeakPolarHBondContact CA-OE2 3.28Å; R3-D7 PolarHBondContact O-N 2.89Å
4	Y	54	Low	63	Low	174 Å²	174	115.7 Å²	115.7	68%	0.682	57%	0.57	S	S	*	*	H	α-helix	trans	-87.3	-27.9	175.6	-162.6	-98.5	0	0	0	111.9	M1 E2 L8	M1-Y4 WeakPolarHBondContact O-CB 3.37Å; M1-Y4 PolarHBondContact O-N 3Å; E2-Y4 PolarHBondContact O-N 3.25Å; Y4-L8 HydrophobicContact CE1-CD1 4.49Å; Y4-L8 PolarHBondContact O-N 2.94Å
5	E	58.4	Low	63.3	Low	131 Å²	131	115.5 Å²	115.5	61%	0.612	57%	0.571	S	S	*	*	H	α-helix	trans	-76.4	-34.3	170.3	-68.4	171.7	107	0	0	111.2	E2 L8 G9	E2-E5 CarbonylContact O-C 3.55Å; E2-E5 WeakPolarHBondContact O-CA 3.37Å; E2-E5 WeakPolarHBondContact O-CB 3.4Å; E2-E5 PolarHBondContact O-N 3.09Å; E5-L8 PolarHBondContact O-N 2.71Å; E5-G9 PolarHBondContact O-N 3.44Å
6	E	62.3	Low	63.7	Low	121 Å²	121	116.1 Å²	116.1	57%	0.565	57%	0.574	S	S	*	*	H	α-helix	trans	-60.9	-49.2	171.3	-70.8	-179.3	122	0	0	111.7	E2 R3 L8 G9 L10	E2-E6 PolarHBondContact O-N 3.07Å; R3-E6 WeakPolarHBondContact CA-OE2 3.28Å; E6-L8 VanDerWaalsContact C-N 3.29Å; E6-L8 PolarHBondContact O-N 2.85Å; E6-G9 PolarHBondContact O-N 3.36Å; E6-G9 VanDerWaalsContact O-N 3.13Å; E6-L10 WeakPolarHBondContact O-CD1 3.35Å; E6-L10 PolarHBondContact O-N 3.34Å
7	D	66.8	Low	64	Low	74 Å²	74	117 Å²	117	40%	0.396	58%	0.577	S	S	.	*	H	α-helix	trans	-66.2	-30.8	178.6	-166.3	63.8	0	0	0	112.4	R3 R11	R3-D7 PolarHBondContact O-N 2.89Å; D7-R11 WeakPolarHBondContact O-CB 3.47Å; D7-R11 WeakPolarHBondContact O-CD 3.42Å; D7-R11 WeakPolarHBondContact O-CG 3.5Å; D7-R11 PolarHBondContact O-N 3.39Å; D7-R11 IonicContact OD1-NE 3.5Å; D7-R11 IonicContact OD1-NH2 3.31Å; D7-R11 IonicContact OD2-CZ 3.91Å; D7-R11 IonicContact OD2-NE 2.79Å; D7-R11 PolarHBondContact OD2-NE 2.93Å; D7-R11 IonicContact OD2-NH2 3.15Å; D7-R11 PolarHBondContact OD2-NH2 2.66Å
8	L	67.1	Low	64	Low	103 Å²	103	115.9 Å²	115.9	54%	0.539	57%	0.574	S	S	.	*	H	α-helix	trans	-69.1	-41.9	170.2	-125.2	73.2	0	0	0	112	Y4 E5 E6 R11 A12	Y4-L8 HydrophobicContact CE1-CD1 4.49Å; Y4-L8 PolarHBondContact O-N 2.94Å; E5-L8 PolarHBondContact O-N 2.71Å; E6-L8 VanDerWaalsContact C-N 3.29Å; E6-L8 PolarHBondContact O-N 2.85Å; L8-R11 PolarHBondContact O-N 3.07Å; L8-A12 WeakPolarHBondContact O-CB 3.45Å; L8-A12 PolarHBondContact O-N 3.05Å
9	G	71.8	Confident	64	Low	40 Å²	40	115.6 Å²	115.6	41%	0.412	57%	0.574	S	S	.	*	H	α-helix	trans	-64.4	-44	179	0	0	0	0	0	112.7	E5 E6 A12 A13	E5-G9 PolarHBondContact O-N 3.44Å; E6-G9 PolarHBondContact O-N 3.36Å; E6-G9 VanDerWaalsContact O-N 3.13Å; G9-A12 PolarHBondContact O-N 2.78Å; G9-A13 PolarHBondContact O-N 3.2Å
10	L	71.5	Confident	63.8	Low	115 Å²	115	113.6 Å²	113.6	60%	0.602	57%	0.572	S	S	*	*	H	α-helix	trans	-62.3	-46.8	174.4	-90.6	76.7	0	0	0	111.2	E6 A12 A13 T14	E6-L10 WeakPolarHBondContact O-CD1 3.35Å; E6-L10 PolarHBondContact O-N 3.34Å; L10-A12 VanDerWaalsContact C-N 3.3Å; L10-A12 PolarHBondContact O-N 3.36Å; L10-A13 WeakPolarHBondContact O-CB 3.42Å; L10-A13 PolarHBondContact O-N 2.63Å; L10-A13 VanDerWaalsContact O-N 3.15Å; L10-T14 PolarHBondContact O-N 3.29Å; L10-T14 PolarHBondContact O-OG1 3.05Å; L10-T14 VanDerWaalsContact O-OG1 3.11Å
11	R	69.7	Low	63.4	Low	154 Å²	154	114 Å²	114	58%	0.581	58%	0.575	S	S	*	*	H	α-helix	trans	-61.8	-36.7	177.2	-70.3	169.4	-165.8	-115.6	5.1	112.7	D7 L8 L15	D7-R11 WeakPolarHBondContact O-CB 3.47Å; D7-R11 WeakPolarHBondContact O-CD 3.42Å; D7-R11 WeakPolarHBondContact O-CG 3.5Å; D7-R11 PolarHBondContact O-N 3.39Å; D7-R11 IonicContact OD1-NE 3.5Å; D7-R11 IonicContact OD1-NH2 3.31Å; D7-R11 IonicContact OD2-CZ 3.91Å; D7-R11 IonicContact OD2-NE 2.79Å; D7-R11 PolarHBondContact OD2-NE 2.93Å; D7-R11 IonicContact OD2-NH2 3.15Å; D7-R11 PolarHBondContact OD2-NH2 2.66Å; L8-R11 PolarHBondContact O-N 3.07Å; R11-L15 PolarHBondContact O-N 3.28Å
12	A	66.3	Low	63.4	Low	48 Å²	48	112.4 Å²	112.4	40%	0.397	56%	0.559	S	S	.	*	H	α-helix	trans	-67.3	-39.9	174.6	0	0	0	0	0	111.8	L8 G9 L10 M16	L8-A12 WeakPolarHBondContact O-CB 3.45Å; L8-A12 PolarHBondContact O-N 3.05Å; G9-A12 PolarHBondContact O-N 2.78Å; L10-A12 VanDerWaalsContact C-N 3.3Å; L10-A12 PolarHBondContact O-N 3.36Å; A12-M16 WeakPolarHBondContact O-CG 3.3Å; A12-M16 PolarHBondContact O-N 3.45Å
13	A	71.1	Confident	63.4	Low	43 Å²	43	112.4 Å²	112.4	36%	0.355	56%	0.559	S	S	.	*	H	α-helix	trans	-62.5	-50	175.7	0	0	0	0	0	112	G9 L10 L15 M16 E17	G9-A13 PolarHBondContact O-N 3.2Å; L10-A13 WeakPolarHBondContact O-CB 3.42Å; L10-A13 PolarHBondContact O-N 2.63Å; L10-A13 VanDerWaalsContact O-N 3.15Å; A13-L15 VanDerWaalsContact C-N 3.3Å; A13-L15 PolarHBondContact O-N 2.9Å; A13-M16 PolarHBondContact O-N 3.45Å; A13-E17 PolarHBondContact O-N 3.19Å
14	T	71.1	Confident	63.4	Low	74 Å²	74	105.3 Å²	105.3	45%	0.454	55%	0.548	S	S	.	.	H	α-helix	trans	-59.6	-39.7	179	-46.8	0	0	0	0	112.1	L10 M16 E17 D18	L10-T14 PolarHBondContact O-N 3.29Å; L10-T14 PolarHBondContact O-OG1 3.05Å; L10-T14 VanDerWaalsContact O-OG1 3.11Å; T14-M16 VanDerWaalsContact C-N 3.31Å; T14-M16 PolarHBondContact O-N 3.32Å; T14-E17 PolarHBondContact O-N 3.34Å; T14-D18 PolarHBondContact O-N 3.28Å
15	L	68	Low	63.2	Low	112 Å²	112	106 Å²	106	59%	0.586	55%	0.55	S	S	*	*	H	α-helix	trans	-65.5	-30.6	175.4	-82.3	168.1	0	0	0	113.5	R11 A13 L19	R11-L15 PolarHBondContact O-N 3.28Å; A13-L15 VanDerWaalsContact C-N 3.3Å; A13-L15 PolarHBondContact O-N 2.9Å; L15-L19 WeakPolarHBondContact O-CB 3.32Å; L15-L19 WeakPolarHBondContact O-CD1 3.41Å; L15-L19 VanDerWaalsContact O-CG 3.26Å; L15-L19 WeakPolarHBondContact O-CG 3.4Å; L15-L19 PolarHBondContact O-N 3.04Å
16	M	70	Confident	62.8	Low	125 Å²	125	106 Å²	106	62%	0.616	55%	0.548	S	S	*	.	H	α-helix	trans	-75.5	-34.3	174.4	-70.6	-174.8	-67.1	0	0	112.1	A12 A13 T14 S20	A12-M16 WeakPolarHBondContact O-CG 3.3Å; A12-M16 PolarHBondContact O-N 3.45Å; A13-M16 PolarHBondContact O-N 3.45Å; T14-M16 VanDerWaalsContact C-N 3.31Å; T14-M16 PolarHBondContact O-N 3.32Å; M16-S20 WeakPolarHBondContact O-CB 3.4Å; M16-S20 PolarHBondContact O-N 2.87Å
17	E	68.6	Low	62.1	Low	132 Å²	132	106 Å²	106	62%	0.617	55%	0.552	S	S	*	*	H	α-helix	trans	-67.2	-45.6	173.3	-68	-177.4	137.8	0	0	111.8	A13 T14 L19 S20 L21	A13-E17 PolarHBondContact O-N 3.19Å; T14-E17 PolarHBondContact O-N 3.34Å; E17-L19 VanDerWaalsContact C-N 3.34Å; E17-L19 PolarHBondContact O-N 2.74Å; E17-S20 PolarHBondContact O-N 3.4Å; E17-L21 PolarHBondContact O-N 3.47Å
18	D	64.1	Low	61.2	Low	97 Å²	97	105.9 Å²	105.9	52%	0.519	57%	0.569	S	S	.	*	H	α-helix	trans	-60.6	-39.4	175.4	-84.7	-22.7	0	0	0	112.5	T14 Y22	T14-D18 PolarHBondContact O-N 3.28Å; D18-Y22 PolarHBondContact O-N 2.65Å; D18-Y22 VanDerWaalsContact O-N 3.09Å
19	L	63.5	Low	60.3	Low	110 Å²	110	108.1 Å²	108.1	58%	0.576	58%	0.578	S	S	*	*	H	α-helix	trans	-66.2	-43	175	-78.7	168.6	0	0	0	112	L15 E17 L21 Y22 E23	L15-L19 WeakPolarHBondContact O-CB 3.32Å; L15-L19 WeakPolarHBondContact O-CD1 3.41Å; L15-L19 VanDerWaalsContact O-CG 3.26Å; L15-L19 WeakPolarHBondContact O-CG 3.4Å; L15-L19 PolarHBondContact O-N 3.04Å; E17-L19 VanDerWaalsContact C-N 3.34Å; E17-L19 PolarHBondContact O-N 2.74Å; L19-L21 VanDerWaalsContact C-N 3.33Å; L19-L21 PolarHBondContact O-N 3.46Å; L19-Y22 WeakPolarHBondContact O-CB 3.41Å; L19-Y22 PolarHBondContact O-N 3.46Å; L19-Y22 VanDerWaalsContact O-N 3.08Å; L19-E23 PolarHBondContact O-N 3.4Å
20	S	60.8	Low	58.9	Low	76 Å²	76	116.3 Å²	116.3	53%	0.531	60%	0.598	S	S	.	*	H	α-helix	trans	-63.2	-39.3	177.5	-167.3	0	0	0	0	111.9	M16 E17 Y22 E23 A24	M16-S20 WeakPolarHBondContact O-CB 3.4Å; M16-S20 PolarHBondContact O-N 2.87Å; E17-S20 PolarHBondContact O-N 3.4Å; S20-Y22 VanDerWaalsContact C-N 3.31Å; S20-Y22 PolarHBondContact O-N 3.29Å; S20-E23 PolarHBondContact O-N 3.17Å; S20-A24 WeakPolarHBondContact O-CB 3.21Å; S20-A24 PolarHBondContact O-N 3.05Å
21	L	54.9	Low	57.5	Low	122 Å²	122	118 Å²	118	64%	0.639	61%	0.608	S	S	*	*	H	α-helix	trans	-61.1	-37	170.7	-105.6	155.3	0	0	0	112.7	E17 L19 Y25	E17-L21 PolarHBondContact O-N 3.47Å; L19-L21 VanDerWaalsContact C-N 3.33Å; L19-L21 PolarHBondContact O-N 3.46Å; L21-Y25 PolarHBondContact O-N 3.01Å
22	Y	52.7	Low	56	Low	156 Å²	156	114.9 Å²	114.9	61%	0.612	62%	0.615	S	S	*	*	H	α-helix	trans	-75	-32.1	178.8	-162.4	-98.5	0	0	0	113.4	D18 L19 S20 K26	D18-Y22 PolarHBondContact O-N 2.65Å; D18-Y22 VanDerWaalsContact O-N 3.09Å; L19-Y22 WeakPolarHBondContact O-CB 3.41Å; L19-Y22 PolarHBondContact O-N 3.46Å; L19-Y22 VanDerWaalsContact O-N 3.08Å; S20-Y22 VanDerWaalsContact C-N 3.31Å; S20-Y22 PolarHBondContact O-N 3.29Å; Y22-K26 PolarHBondContact O-N 3.45Å
23	E	47.9	Very low	54.6	Low	135 Å²	135	124.4 Å²	124.4	63%	0.631	64%	0.641	S	S	*	*	H	α-helix	trans	-72.7	-43.1	172.2	-68.3	-168.2	135.4	0	0	111.5	L19 S20 Y25 K26 D27	L19-E23 PolarHBondContact O-N 3.4Å; S20-E23 PolarHBondContact O-N 3.17Å; E23-Y25 PolarHBondContact O-N 2.97Å; E23-K26 WeakPolarHBondContact O-CB 3.25Å; E23-K26 PolarHBondContact O-N 3.47Å; E23-D27 PolarHBondContact O-N 2.73Å
24	A	51	Low	53	Low	70 Å²	70	133.5 Å²	133.5	58%	0.579	67%	0.666	S	S	*	*	H	α-helix	trans	-57.5	-34.4	173.6	0	0	0	0	0	113	S20 K26	S20-A24 WeakPolarHBondContact O-CB 3.21Å; S20-A24 PolarHBondContact O-N 3.05Å; A24-K26 VanDerWaalsContact C-N 3.33Å
25	Y	49.2	Very low	51.2	Low	189 Å²	189	137 Å²	137	74%	0.741	68%	0.682	S	S	*	*	H	α-helix	trans	-73.4	-20.5	176.1	-153.9	-89.9	0	0	0	113.6	L21 E23	L21-Y25 PolarHBondContact O-N 3.01Å; E23-Y25 PolarHBondContact O-N 2.97Å
26	K	50.4	Low	49.7	Very low	130 Å²	130	139.8 Å²	139.8	57%	0.565	70%	0.697	S	S	*	*	H	α-helix	trans	-81.9	-46.3	176.9	-89.1	178.8	174.3	173.9	0	113	Y22 E23 A24 G28 M29	Y22-K26 PolarHBondContact O-N 3.45Å; E23-K26 WeakPolarHBondContact O-CB 3.25Å; E23-K26 PolarHBondContact O-N 3.47Å; A24-K26 VanDerWaalsContact C-N 3.33Å; K26-G28 PolarHBondContact O-N 3.32Å; K26-M29 PolarHBondContact O-N 2.9Å
27	D	48	Very low	47.9	Very low	120 Å²	120	139.6 Å²	139.6	64%	0.642	70%	0.702	S	S	*	*	H	α-helix	trans	-67	-22.6	-174.8	-78.7	-11.2	0	0	0	112.8	E23 M29	E23-D27 PolarHBondContact O-N 2.73Å; D27-M29 PolarHBondContact O-N 2.82Å
28	G	47.9	Very low	46.3	Very low	73 Å²	73	140.1 Å²	140.1	75%	0.753	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-11.3	173.8	0	0	0	0	0	116.1	K26	K26-G28 PolarHBondContact O-N 3.32Å
29	M	47.1	Very low	44.8	Very low	150 Å²	150	142.2 Å²	142.2	74%	0.739	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.6	-9.4	-174.2	-76.7	-153	72.3	0	0	116.6	K26 D27	K26-M29 PolarHBondContact O-N 2.9Å; D27-M29 PolarHBondContact O-N 2.82Å
30	Y	42.6	Very low	44.1	Very low	212 Å²	212	141.8 Å²	141.8	83%	0.831	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.1	-8.7	-171	-93.5	-82	0	0	0	117.2
31	N	43.1	Very low	42.5	Very low	150 Å²	150	145.1 Å²	145.1	80%	0.802	74%	0.735	S	S	*	*	S	Bend	trans	-103.3	56.7	-177.4	-78.5	-49.1	0	0	0	114
32	A	37.3	Very low	41.5	Very low	89 Å²	89	147.2 Å²	147.2	74%	0.736	75%	0.746	S	S	*	*			trans	-152.4	41.5	-177.7	0	0	0	0	0	117.5
33	R	37.7	Very low	40.4	Very low	247 Å²	247	146.5 Å²	146.5	93%	0.932	75%	0.752	S	S	*	*	S	Bend	trans	-155.4	68.9	160.3	-86	-141.2	173.1	172.3	0.4	115
34	R	37.2	Very low	39.5	Very low	235 Å²	235	149 Å²	149	89%	0.887	76%	0.761	S	S	*	*	S	Bend	trans	173.8	123.1	156.6	-96.2	161.5	-167.2	165.4	4	104.4
35	D	33.9	Very low	38.6	Very low	148 Å²	148	151.2 Å²	151.2	79%	0.791	77%	0.772	S	S	*	*			cis	-127.8	178.7	5.4	-61.4	-57.2	0	0	0	110.5
36	L	35	Very low	37.8	Very low	170 Å²	170	146.5 Å²	146.5	89%	0.89	77%	0.773	S	S	*	*			trans	-171.2	145.4	140.9	-108.1	174.2	0	0	0	111.8
37	V	32.8	Very low	37.6	Very low	121 Å²	121	146.7 Å²	146.7	73%	0.733	79%	0.787	S	S	*	*			trans	-126.2	125.7	171.4	172.1	0	0	0	0	107.9
38	I	35.3	Very low	36.9	Very low	142 Å²	142	145.5 Å²	145.5	73%	0.728	79%	0.794	S	S	*	*			trans	14.4	125.7	141.5	-56.9	173.8	0	0	0	115.1
39	N	32	Very low	36	Very low	142 Å²	142	149.1 Å²	149.1	76%	0.759	80%	0.801	S	S	*	*			cis	-159.9	-146.7	3	-101.7	0.6	0	0	0	106.8
40	P	49.5	Very low	35.3	Very low	101 Å²	101	146.6 Å²	146.6	66%	0.656	80%	0.804	S	S	*	*				-118.3	177.6	-86.8	38.5	-23.1	0	0	0	113.4
41	D	27.6	Very low	34.7	Very low	146 Å²	146	139.7 Å²	139.7	78%	0.781	80%	0.797	S	S	*	*				164	159.2	120	-94.4	-19.7	0	0	0	115.7
42	L	34.4	Very low	34.2	Very low	166 Å²	166	140.2 Å²	140.2	87%	0.869	80%	0.799	S	S	*	*			trans	78.6	138.2	158.1	-74.5	162.1	0	0	0	122.2
43	D	28.5	Very low	33.9	Very low	141 Å²	141	144.1 Å²	144.1	75%	0.754	80%	0.8	S	S	*	*			trans	-96.2	179.5	-166.4	-79.1	-69.7	0	0	0	115.9
44	F	30.3	Very low	33.7	Very low	187 Å²	187	137.9 Å²	137.9	82%	0.82	79%	0.789	S	S	*	*			trans	104.9	118.4	140.1	-88.2	-68.8	0	0	0	122.3
45	S	30.6	Very low	33.6	Very low	116 Å²	116	135.8 Å²	135.8	81%	0.811	79%	0.787	S	S	*	*			trans	80	143.4	140.3	68.6	0	0	0	0	121.3
46	A	31.9	Very low	34.3	Very low	90 Å²	90	133.6 Å²	133.6	74%	0.744	78%	0.781	S	S	*	*			trans	-116.2	178.7	172.4	0	0	0	0	0	109.9
47	P	47.9	Very low	34.3	Very low	135 Å²	135	133.1 Å²	133.1	88%	0.877	78%	0.776	S	S	*	*				-149.4	171.9	106.8	37.5	-20.1	0	0	0	117.7
48	A	31.8	Very low	34.2	Very low	95 Å²	95	134.4 Å²	134.4	79%	0.785	78%	0.779	S	S	*	*			trans	-66.3	177.3	-174.2	0	0	0	0	0	118.8
49	V	29.8	Very low	33.9	Very low	148 Å²	148	130.9 Å²	130.9	90%	0.897	78%	0.777	S	S	*	*				-167.6	152.3	122.6	141.7	0	0	0	0	113.8
50	A	32.5	Very low	33.9	Very low	97 Å²	97	130.3 Å²	130.3	80%	0.802	78%	0.779	S	S	*	*			trans	-54.8	173.8	-171.6	0	0	0	0	0	120.2
51	G	30.4	Very low	33	Very low	67 Å²	67	131 Å²	131	69%	0.691	79%	0.786	S	S	*	*			cis	150.2	-167.7	-7.5	0	0	0	0	0	115.6
52	L	32.5	Very low	33.1	Very low	161 Å²	161	130.1 Å²	130.1	84%	0.843	79%	0.786	S	S	*	*			trans	75.1	151.1	172.2	-52.6	170.2	0	0	0	116.7
53	K	31.4	Very low	32.8	Very low	171 Å²	171	129.1 Å²	129.1	74%	0.743	78%	0.78	S	S	*	*			cis	-161.4	148.5	3.9	-134.5	169.8	-177.8	177.6	0	114
54	T	31.7	Very low	32.8	Very low	117 Å²	117	129.6 Å²	129.6	72%	0.718	78%	0.778	S	S	*	*			trans	56.4	131.6	154.2	42.3	0	0	0	0	121.4
55	K	36.5	Very low	32.8	Very low	190 Å²	190	126.2 Å²	126.2	83%	0.826	77%	0.765	S	S	*	*			cis	91.3	154.5	42.5	-88.5	-162.9	172.3	-172.1	0	114.9
56	P	49.1	Very low	32.9	Very low	103 Å²	103	127.9 Å²	127.9	67%	0.669	76%	0.759	S	S	*	*			cis	-147.7	154	-21.6	38.7	-18.5	0	0	0	119.7
57	M	34.7	Very low	32.8	Very low	160 Å²	160	129.3 Å²	129.3	79%	0.788	76%	0.755	S	S	*	*			trans	54.7	154.4	131	-60.5	-175.4	70.1	0	0	127.5
58	N	30.8	Very low	31.9	Very low	148 Å²	148	130.1 Å²	130.1	79%	0.791	75%	0.747	S	S	*	*			trans	75.5	140.9	163.3	-59.5	-16.1	0	0	0	117.6
59	G	28.5	Very low	31.7	Very low	67 Å²	67	131.2 Å²	131.2	69%	0.691	74%	0.744	S	S	*	*			cis	-179.7	-170.3	-0	0	0	0	0	0	109.7
60	T	31.8	Very low	31.6	Very low	130 Å²	130	130.6 Å²	130.6	80%	0.798	73%	0.734	S	S	*	*			cis	-177.3	157.2	-12.4	12.1	0	0	0	0	110.5
61	S	30.9	Very low	31.3	Very low	116 Å²	116	133.1 Å²	133.1	81%	0.811	73%	0.73	S	S	*	*			trans	75.8	152.9	159.6	88	0	0	0	0	118.6
62	V	28.8	Very low	31.2	Very low	128 Å²	128	135.2 Å²	135.2	78%	0.776	73%	0.725	S	S	*	*			cis	-162.3	156.4	-5.1	107.1	0	0	0	0	114.7
63	L	27.9	Very low	30.9	Very low	144 Å²	144	136.3 Å²	136.3	75%	0.754	72%	0.723	S	S	*	*			trans	72.5	138.2	158.8	-117.7	73.5	0	0	0	126.6
64	H	29.3	Very low	30.9	Very low	152 Å²	152	133.9 Å²	133.9	70%	0.704	72%	0.723	S	S	*	*			trans	81.3	145.2	137.4	-115.9	56.1	0	0	0	122.4
65	Q	30.9	Very low	31.5	Very low	116 Å²	116	134.5 Å²	134.5	54%	0.542	73%	0.729	S	S	.	*			cis	-170.3	123.9	-47.5	171.4	166	-27.5	0	0	110.2
66	Q	32.6	Very low	31	Very low	150 Å²	150	128.5 Å²	128.5	70%	0.701	72%	0.721	S	S	*	*			trans	63.8	160.2	159.2	-69.5	169.2	-16.2	0	0	117.6
67	N	29	Very low	30	Very low	120 Å²	120	131.5 Å²	131.5	64%	0.642	73%	0.731	S	S	*	*			cis	-157	147.2	-13.8	-113.8	-6.1	0	0	0	113.5
68	H	28.2	Very low	29.8	Very low	153 Å²	153	133.4 Å²	133.4	71%	0.708	74%	0.735	S	S	*	*			trans	47.7	125.9	142.2	-84.8	-103.8	0	0	0	125
69	T	29.3	Very low	29.6	Very low	118 Å²	118	133.4 Å²	133.4	72%	0.724	74%	0.74	S	S	*	*			trans	68.2	160.3	137.5	59.2	0	0	0	0	119.5
70	L	27.2	Very low	29.8	Very low	134 Å²	134	140.8 Å²	140.8	70%	0.702	75%	0.749	S	S	*	*			cis	-147.1	170.8	2.3	-153.7	68.6	0	0	0	110.2
71	E	26.6	Very low	29.7	Very low	150 Å²	150	142.2 Å²	142.2	70%	0.701	75%	0.752	S	S	*	*			trans	5.7	154.8	147.3	-73	177.1	-135.6	0	0	122.3
72	N	27	Very low	29.6	Very low	111 Å²	111	141.5 Å²	141.5	59%	0.594	75%	0.752	S	S	*	*			cis	-165.7	174.3	6.3	-131.4	-38.9	0	0	0	114.6
73	F	27.3	Very low	29.6	Very low	184 Å²	184	139.7 Å²	139.7	81%	0.807	75%	0.751	S	S	*	*			trans	75.2	157.3	153.7	-79.3	-61.9	0	0	0	125.3
74	T	31.1	Very low	30.1	Very low	120 Å²	120	139.1 Å²	139.1	74%	0.736	76%	0.756	S	S	*	*			trans	-101.2	-171.9	-164.8	10.7	0	0	0	0	112.9
75	P	43.3	Very low	30.2	Very low	131 Å²	131	138.8 Å²	138.8	85%	0.851	76%	0.764	S	S	*	*			cis	-130.2	179.9	17.9	39.8	-19.3	0	0	0	115.9
76	G	25.7	Very low	30.1	Very low	63 Å²	63	144.2 Å²	144.2	65%	0.649	78%	0.78	S	S	*	*			cis	-179	-148.6	2.4	0	0	0	0	0	114.4
77	N	28.4	Very low	30.1	Very low	166 Å²	166	143.1 Å²	143.1	89%	0.888	79%	0.785	S	S	*	*			trans	62.6	105.2	175.8	-70.8	5.4	0	0	0	119.5
78	K	30.7	Very low	30.2	Very low	201 Å²	201	144.3 Å²	144.3	87%	0.874	80%	0.797	S	S	*	*			trans	-144.6	148.1	149.8	-74.6	-163.6	177.2	-179.3	0	111.5
79	V	27.8	Very low	30.1	Very low	147 Å²	147	144.1 Å²	144.1	89%	0.891	80%	0.801	S	S	*	*			trans	-83.4	145.2	173.1	178.5	0	0	0	0	109.7
80	Y	31.6	Very low	29.9	Very low	223 Å²	223	144.5 Å²	144.5	88%	0.875	81%	0.807	S	S	*	*			trans	-91.2	153.9	179.6	-92.5	-87.4	0	0	0	113.6
81	N	29.3	Very low	29.9	Very low	160 Å²	160	141.9 Å²	141.9	86%	0.856	80%	0.8	S	S	*	*			trans	-129.8	156.9	172.8	-147.8	-16.1	0	0	0	108.7
82	A	30.4	Very low	29.9	Very low	100 Å²	100	145.3 Å²	145.3	83%	0.826	81%	0.806	S	S	*	*			trans	-73	161.4	-165.5	0	0	0	0	0	115.1
83	A	28.9	Very low	30.2	Very low	91 Å²	91	145.9 Å²	145.9	75%	0.752	82%	0.816	S	S	*	*			trans	-129.9	150	-177.3	0	0	0	0	0	113.1
84	P	36.4	Very low	30.3	Very low	132 Å²	132	143.2 Å²	143.2	86%	0.857	82%	0.815	S	S	*	*			trans	-91.6	160.4	-178.8	36.5	-35.8	0	0	0	114.2
85	V	31.5	Very low	30.6	Very low	144 Å²	144	143.4 Å²	143.4	87%	0.873	82%	0.818	S	S	*	*			trans	-109.5	151.9	-174.1	-178.4	0	0	0	0	112.2
86	R	29.2	Very low	29.9	Very low	231 Å²	231	143.1 Å²	143.1	87%	0.872	81%	0.813	S	S	*	*			trans	-110.4	153.2	176.5	-70.4	-177.7	174.5	-175.6	-1.5	112.5
87	P	33.7	Very low	30	Very low	126 Å²	126	146.1 Å²	146.1	82%	0.818	82%	0.815	S	S	*	*			trans	-89.5	158.4	172	36.6	-34.8	0	0	0	113.3
88	V	29.5	Very low	29.9	Very low	145 Å²	145	147.1 Å²	147.1	88%	0.879	81%	0.812	S	S	*	*			trans	-142.2	147.4	170.4	-179.3	0	0	0	0	109.4
89	N	26.6	Very low	29.7	Very low	150 Å²	150	143.4 Å²	143.4	80%	0.802	81%	0.809	S	S	*	*			trans	-140.9	138.5	177	177.2	29.1	0	0	0	109.8
90	C	25.6	Very low	29.9	Very low	125 Å²	125	140.9 Å²	140.9	85%	0.845	80%	0.804	S	S	*	*			trans	-165	167.9	169.6	-123.5	0	0	0	0	111.3
91	S	27.5	Very low	31.1	Very low	79 Å²	79	135.9 Å²	135.9	55%	0.552	80%	0.799	S	S	*	*			trans	-153.1	135.4	-157	58.6	0	0	0	0	118.9
92	R	26.3	Very low	31	Very low	222 Å²	222	136.5 Å²	136.5	84%	0.838	80%	0.797	S	S	*	*			trans	66.4	169.3	157.6	-95.9	121.4	-84.7	175.7	-3.3	116.6
93	P	34.3	Very low	30.9	Very low	123 Å²	123	140.5 Å²	140.5	80%	0.799	79%	0.79	S	S	*	*			cis	-122.1	-154.7	-4.5	40.2	-23.3	0	0	0	113.9
94	V	28.7	Very low	30.6	Very low	129 Å²	129	142.2 Å²	142.2	78%	0.782	79%	0.787	S	S	*	*			trans	-131.1	154.7	-172.4	178.9	0	0	0	0	110.8
95	P	37.9	Very low	30	Very low	123 Å²	123	141.3 Å²	141.3	80%	0.799	78%	0.784	S	S	*	*			trans	-135.6	168.5	137.4	37.9	-25.7	0	0	0	115.5
96	V	28.1	Very low	31.3	Very low	125 Å²	125	139.9 Å²	139.9	76%	0.758	78%	0.777	S	S	*	*			trans	-81.8	-179.8	176.5	-71	0	0	0	0	111.6
97	D	27.5	Very low	31.1	Very low	127 Å²	127	138.7 Å²	138.7	68%	0.679	77%	0.774	S	S	*	*			cis	-171.2	179.4	27.8	-146.1	-25.7	0	0	0	114.4
98	F	25.6	Very low	30.8	Very low	187 Å²	187	137 Å²	137	82%	0.82	77%	0.766	S	S	*	*			trans	77.3	158.8	158.1	-88.8	-81.1	0	0	0	124.8
99	C	27.3	Very low	30.8	Very low	122 Å²	122	137.6 Å²	137.6	82%	0.824	76%	0.759	S	S	*	*			trans	-100.7	-172.7	-176.5	-52.3	0	0	0	0	112.4
100	A	33	Very low	31	Very low	94 Å²	94	139.5 Å²	139.5	78%	0.777	76%	0.763	S	S	*	*			cis	-160.9	178.3	17.8	0	0	0	0	0	112.3
101	P	55.8	Low	31.1	Very low	119 Å²	119	137.1 Å²	137.1	77%	0.773	76%	0.76	S	S	*	*			trans	-116.9	166	-169.9	42	-33.1	0	0	0	117
102	Q	27.8	Very low	31	Very low	172 Å²	172	139.4 Å²	139.4	80%	0.804	77%	0.774	S	S	*	*			trans	-167.1	160.9	159.2	-79.9	-142.5	-19.5	0	0	109.2
103	R	27.5	Very low	31	Very low	185 Å²	185	134.2 Å²	134.2	70%	0.698	77%	0.771	S	S	*	*			cis	-162	152.9	-0	-127.9	-169.8	134.6	170.1	-16.7	114
104	D	23.2	Very low	30.7	Very low	127 Å²	127	134.5 Å²	134.5	68%	0.679	77%	0.77	S	S	*	*			trans	52.2	171.6	142.9	-65.1	11.2	0	0	0	125.3
105	S	24.3	Very low	30.8	Very low	113 Å²	113	138 Å²	138	79%	0.79	78%	0.775	S	S	*	*			trans	-145.8	-156.6	-170.7	-148.4	0	0	0	0	108.4
106	P	57.4	Low	30.4	Very low	113 Å²	113	137.7 Å²	137.7	73%	0.734	78%	0.775	S	S	*	*			cis	-127.3	-177	-40.1	37.4	-20.8	0	0	0	113.4
107	Y	25.9	Very low	30.6	Very low	206 Å²	206	140.9 Å²	140.9	81%	0.808	78%	0.782	S	S	*	*			trans	-167.7	133.5	151.3	-129.4	-109.2	0	0	0	108.8
108	S	27.4	Very low	30.8	Very low	92 Å²	92	141.5 Å²	141.5	64%	0.643	79%	0.79	S	S	*	*				64.2	136.4	68.5	-89.1	0	0	0	0	114.4
109	E	28.2	Very low	31	Very low	156 Å²	156	136.9 Å²	136.9	73%	0.729	79%	0.787	S	S	*	*			cis	-143.9	148.3	7.6	-102.4	168.9	127.5	0	0	110.2
110	E	31.7	Very low	31.2	Very low	191 Å²	191	139.3 Å²	139.3	89%	0.893	79%	0.79	S	S	*	*				53.3	137.5	100.1	-61.3	-154.6	-160.3	0	0	119.8
111	G	27.2	Very low	31.7	Very low	75 Å²	75	140 Å²	140	77%	0.773	79%	0.787	S	S	*	*			trans	156.4	136.5	174.3	0	0	0	0	0	114.2
112	C	26.2	Very low	30.5	Very low	126 Å²	126	140.9 Å²	140.9	85%	0.851	79%	0.794	S	S	*	*			trans	-132.5	166.7	-171.5	-76.3	0	0	0	0	114.9
113	C	25.6	Very low	30.5	Very low	114 Å²	114	142.5 Å²	142.5	77%	0.77	80%	0.795	S	S	*	*			trans	113.2	129.1	147.4	-68.5	0	0	0	0	121.6
114	T	29	Very low	30.8	Very low	129 Å²	129	139.4 Å²	139.4	79%	0.791	80%	0.801	S	S	*	*			trans	75.1	111.1	145.9	48.3	0	0	0	0	123.4
115	K	29.4	Very low	31	Very low	202 Å²	202	137.1 Å²	137.1	88%	0.878	81%	0.808	S	S	*	*			trans	38.4	121.9	132.5	-64.1	-176.2	175.8	-175.8	0	120.7
116	S	29.3	Very low	31.3	Very low	116 Å²	116	138.6 Å²	138.6	81%	0.811	81%	0.812	S	S	*	*				-170.1	152.8	108.3	56.8	0	0	0	0	112.2
117	E	33.8	Very low	30.1	Very low	193 Å²	193	138.9 Å²	138.9	90%	0.902	82%	0.817	S	S	*	*			trans	-93.1	130.4	172.1	-63.6	167.6	108.4	0	0	110.5
118	V	31.8	Very low	30.3	Very low	140 Å²	140	135.7 Å²	135.7	85%	0.848	81%	0.809	S	S	*	*			trans	-144.8	129.9	156.2	-177.5	0	0	0	0	108.1
119	A	28.6	Very low	30.5	Very low	90 Å²	90	142.3 Å²	142.3	74%	0.744	82%	0.82	S	S	*	*			trans	-102.9	137.1	175.4	0	0	0	0	0	111.3
120	L	32.8	Very low	30.7	Very low	172 Å²	172	142.4 Å²	142.4	90%	0.901	82%	0.821	S	S	*	*			trans	-155.7	160.4	153.5	-90.7	-166.8	0	0	0	110
121	P	42.7	Very low	30.8	Very low	109 Å²	109	142.8 Å²	142.8	71%	0.708	81%	0.814	S	S	*	*			trans	-96.7	166.7	-162	37.7	-37.3	0	0	0	114.9
122	C	31.1	Very low	31.1	Very low	137 Å²	137	150.1 Å²	150.1	93%	0.926	82%	0.818	S	S	*	*			trans	-129.5	123.5	160.7	-70.8	0	0	0	0	110.4
123	Y	27.3	Very low	31.5	Very low	207 Å²	207	152.8 Å²	152.8	81%	0.812	81%	0.811	S	S	*	*			trans	-122.8	161	170.5	-152	-87.2	0	0	0	108.2
124	S	34	Very low	31.6	Very low	119 Å²	119	152.7 Å²	152.7	83%	0.832	81%	0.812	S	S	*	*			trans	87.6	129.7	178.2	-36.9	0	0	0	0	115.7
125	G	28	Very low	31.6	Very low	80 Å²	80	154.4 Å²	154.4	83%	0.825	82%	0.816	S	S	*	*			trans	162.4	42	-180	0	0	0	0	0	114.9
126	T	30.3	Very low	31.8	Very low	144 Å²	144	153.4 Å²	153.4	88%	0.883	81%	0.814	S	S	*	*			trans	-68.9	130.1	-176.5	49.2	0	0	0	0	113.5
127	S	31.2	Very low	32.1	Very low	118 Å²	118	153.7 Å²	153.7	83%	0.825	81%	0.811	S	S	*	*			trans	-156.9	120.4	141.8	-151.6	0	0	0	0	114
128	E	31.1	Very low	31.9	Very low	139 Å²	139	153 Å²	153	65%	0.65	81%	0.807	S	S	*	*			trans	-31.4	125.2	162	-178.7	71.3	-124.4	0	0	115.3	H130	E128-H130 IonicContact OE1-CE1 3.85Å; E128-H130 IonicContact OE1-CG 2.7Å; E128-H130 IonicContact OE1-ND1 2.96Å; E128-H130 PolarHBondContact OE1-ND1 3.49Å
129	R	30.9	Very low	31.7	Very low	231 Å²	231	149.1 Å²	149.1	87%	0.872	80%	0.796	S	S	*	*			trans	-156.9	94.3	146.7	-118.4	175.3	-164.1	-167.7	4.3	113.1	R131	R129-R131 PolarHBondContact O-N 3.18Å
130	H	32.3	Very low	31.7	Very low	159 Å²	159	154.4 Å²	154.4	74%	0.736	81%	0.805	S	S	*	*			trans	-38.9	125.9	158.2	-86.1	66.8	0	0	0	112	E128	E128-H130 IonicContact OE1-CE1 3.85Å; E128-H130 IonicContact OE1-CG 2.7Å; E128-H130 IonicContact OE1-ND1 2.96Å; E128-H130 PolarHBondContact OE1-ND1 3.49Å
131	R	34.5	Very low	31.6	Very low	198 Å²	198	156.4 Å²	156.4	75%	0.747	80%	0.801	S	S	*	*			trans	-127.4	96.7	164.9	-91.2	-170.6	169	147.7	-4.4	111.2	R129 Y133	R129-R131 PolarHBondContact O-N 3.18Å; R131-Y133 HydrophobicContact CB-CD2 4.44Å; R131-Y133 HydrophobicContact CB-CE2 4.4Å
132	R	34.1	Very low	30.9	Very low	229 Å²	229	160.1 Å²	160.1	86%	0.864	80%	0.802	S	S	*	*			trans	-60.1	139.2	150.5	-60	175	-176.3	153.1	1.1	107.9
133	Y	33	Very low	30.7	Very low	182 Å²	182	159.5 Å²	159.5	71%	0.714	80%	0.799	S	S	*	*			trans	-116.4	90.8	169.5	-102.3	-75.9	0	0	0	110.3	R131	R131-Y133 HydrophobicContact CB-CD2 4.44Å; R131-Y133 HydrophobicContact CB-CE2 4.4Å
134	S	28.4	Very low	30.9	Very low	113 Å²	113	156.5 Å²	156.5	79%	0.79	80%	0.803	S	S	*	*			trans	-68.9	136.9	153.8	-54.1	0	0	0	0	108.2
135	L	29.9	Very low	30.6	Very low	164 Å²	164	154.7 Å²	154.7	86%	0.859	80%	0.803	S	S	*	*			trans	-108.7	93.1	-171.7	-169.9	87.2	0	0	0	111.5
136	E	33.8	Very low	31.1	Very low	181 Å²	181	156.6 Å²	156.6	85%	0.846	80%	0.803	S	S	*	*			trans	-131.4	120.9	166.5	-75.5	-161.1	169.2	0	0	113.6
137	V	34.1	Very low	31.2	Very low	123 Å²	123	156.1 Å²	156.1	75%	0.745	80%	0.8	S	S	*	*			trans	45.4	100	140.2	-163.8	0	0	0	0	119.8
138	Q	31.1	Very low	31.2	Very low	177 Å²	177	159.3 Å²	159.3	83%	0.827	80%	0.8	S	S	*	*				-168.8	140.5	124.6	-143.8	64.8	-18.2	0	0	106
139	G	27	Very low	31.3	Very low	60 Å²	60	159.8 Å²	159.8	62%	0.619	81%	0.807	S	S	*	*			cis	118.3	91.3	20.1	0	0	0	0	0	108.5
140	H	27.3	Very low	31.2	Very low	200 Å²	200	152 Å²	152	93%	0.926	80%	0.798	S	S	*	*			trans	-131.2	151.7	-179.9	-93.7	19.2	0	0	0	112
141	R	30.5	Very low	31.2	Very low	214 Å²	214	151.2 Å²	151.2	81%	0.808	80%	0.804	S	S	*	*			trans	-135.5	138.7	-172.5	-101.7	-175.2	173.9	-170.1	0.4	110.4
142	Y	29.2	Very low	32.1	Very low	187 Å²	187	147.1 Å²	147.1	73%	0.733	80%	0.803	S	S	*	*			trans	44.2	129.5	155.4	-55.6	-61.7	0	0	0	120.5
143	S	27.1	Very low	32.1	Very low	125 Å²	125	143 Å²	143	87%	0.874	80%	0.798	S	S	*	*				-153.5	143.6	120.6	-82.7	0	0	0	0	111
144	T	31.9	Very low	32	Very low	144 Å²	144	141.2 Å²	141.2	88%	0.883	80%	0.801	S	S	*	*			trans	-130.6	143.2	173	46.8	0	0	0	0	108.6
145	G	27.6	Very low	32.1	Very low	81 Å²	81	145.1 Å²	145.1	84%	0.835	80%	0.804	S	S	*	*			trans	-148	147.8	177.6	0	0	0	0	0	110.7
146	S	38.1	Very low	32	Very low	119 Å²	119	141.9 Å²	141.9	83%	0.832	80%	0.8	S	S	*	*			trans	-157.6	141.5	-171.2	178.1	0	0	0	0	112.3
147	T	32.5	Very low	31.9	Very low	134 Å²	134	139.3 Å²	139.3	82%	0.822	80%	0.796	S	S	*	*			trans	-158.8	157.3	169	45.9	0	0	0	0	109.3
148	F	31.1	Very low	32.4	Very low	185 Å²	185	139.4 Å²	139.4	81%	0.811	80%	0.8	S	S	*	*			cis	-159.2	-171	-39.1	-159.9	-108	0	0	0	109
149	D	32.1	Very low	32.4	Very low	149 Å²	149	138.4 Å²	138.4	80%	0.797	80%	0.799	S	S	*	*			trans	72.8	141.1	175.8	-68.1	-42.9	0	0	0	117.9
150	G	28.7	Very low	33.3	Very low	67 Å²	67	141.7 Å²	141.7	69%	0.691	81%	0.81	S	S	*	*			cis	-158.9	170.2	-0.3	0	0	0	0	0	113.5
151	V	33.1	Very low	33.3	Very low	143 Å²	143	135.4 Å²	135.4	87%	0.867	80%	0.799	S	S	*	*			trans	-139.6	139.6	-165.1	175.1	0	0	0	0	107.9
152	P	54.2	Low	33.4	Very low	112 Å²	112	132.7 Å²	132.7	73%	0.727	80%	0.801	S	S	*	*				-149.8	-164	65.4	44	-22.2	0	0	0	114.3
153	L	33.6	Very low	33.4	Very low	144 Å²	144	135.6 Å²	135.6	75%	0.754	81%	0.81	S	S	*	*			cis	-152.5	143.9	4.7	-157.5	68.9	0	0	0	105.3
154	N	31.1	Very low	33.5	Very low	144 Å²	144	134.7 Å²	134.7	77%	0.77	80%	0.803	S	S	*	*				178.8	174.7	69.1	-138.5	-26.5	0	0	0	111.2
155	K	29.5	Very low	33.6	Very low	195 Å²	195	135 Å²	135	85%	0.848	80%	0.799	S	S	*	*			trans	-100.3	171.9	179.6	-91.8	175.8	-179.5	174.7	0	112.2
156	A	28.2	Very low	33.7	Very low	96 Å²	96	135.7 Å²	135.7	79%	0.793	79%	0.791	S	S	*	*			cis	-154.4	-166	38.2	0	0	0	0	0	116.8
157	V	31.6	Very low	33.3	Very low	126 Å²	126	136.5 Å²	136.5	76%	0.764	79%	0.791	S	S	*	*			trans	-139.5	142	-155.9	160	0	0	0	0	107.7
158	P	45.3	Very low	33	Very low	125 Å²	125	135 Å²	135	81%	0.812	79%	0.785	S	S	*	*				-150.6	162.1	94	38.9	-18.7	0	0	0	119.8
159	L	31.1	Very low	33	Very low	156 Å²	156	133.6 Å²	133.6	82%	0.817	78%	0.784	S	S	*	*			trans	-69.2	-177.2	162.4	-73.5	157.6	0	0	0	111.8
160	P	45.7	Very low	32.8	Very low	130 Å²	130	133 Å²	133	84%	0.844	79%	0.786	S	S	*	*			cis	-127.9	-169	5.1	40.7	-22.1	0	0	0	113.3
161	G	27.2	Very low	32.7	Very low	68 Å²	68	134.5 Å²	134.5	70%	0.701	79%	0.786	S	S	*	*			cis	157.2	157.8	-12.3	0	0	0	0	0	113.6
162	N	32.8	Very low	32.6	Very low	157 Å²	157	133.6 Å²	133.6	84%	0.84	79%	0.786	S	S	*	*			trans	31.6	106	159.6	-81.1	1.9	0	0	0	121.6
163	R	29.2	Very low	31.5	Very low	248 Å²	248	136.3 Å²	136.3	94%	0.936	79%	0.789	S	S	*	*				169.1	165.4	104.5	-97.2	174	178	-179.1	-0.3	113.6
164	C	30.1	Very low	31.4	Very low	106 Å²	106	136.1 Å²	136.1	72%	0.716	79%	0.788	S	S	*	*			trans	-123.3	145.8	175.3	46.4	0	0	0	0	111.1
165	N	32.6	Very low	31.3	Very low	149 Å²	149	132.1 Å²	132.1	80%	0.797	78%	0.781	S	S	*	*			trans	170.3	145.9	131.1	-90.4	-12.2	0	0	0	115.4
166	S	30.7	Very low	31.5	Very low	96 Å²	96	132.7 Å²	132.7	67%	0.671	78%	0.778	S	S	*	*			trans	58	107.4	137.2	68.9	0	0	0	0	123.6
167	V	29.6	Very low	31.8	Very low	137 Å²	137	137.7 Å²	137.7	83%	0.83	78%	0.778	S	S	*	*			trans	58.6	153.5	139.8	-135.8	0	0	0	0	116.2
168	C	26.6	Very low	31.7	Very low	103 Å²	103	135.2 Å²	135.2	70%	0.696	78%	0.777	S	S	*	*			cis	-145.1	154.9	17.9	-45.2	0	0	0	0	114.2
169	I	29.2	Very low	31	Very low	155 Å²	155	134.5 Å²	134.5	80%	0.795	78%	0.782	S	S	*	*			trans	25.4	120.6	138.6	-55.8	171	0	0	0	118.6
170	T	29.2	Very low	30.9	Very low	136 Å²	136	131.5 Å²	131.5	83%	0.834	78%	0.78	S	S	*	*				-155.5	156.1	127.3	-2.2	0	0	0	0	112.7
171	S	27	Very low	30.4	Very low	99 Å²	99	130.8 Å²	130.8	69%	0.692	78%	0.778	S	S	*	*			trans	-64.8	150.6	-175.6	47.8	0	0	0	0	115.5
172	S	29.9	Very low	31.7	Very low	124 Å²	124	133.6 Å²	133.6	87%	0.867	78%	0.784	S	S	*	*			trans	-146.1	142.6	153.6	-74.7	0	0	0	0	109.7
173	H	32.3	Very low	31.7	Very low	169 Å²	169	137.6 Å²	137.6	78%	0.782	79%	0.787	S	S	*	*			trans	-94.4	-179.1	-168.5	-102.6	-90.6	0	0	0	113.7
174	D	30.4	Very low	31.9	Very low	139 Å²	139	130.6 Å²	130.6	74%	0.743	78%	0.776	S	S	*	*			trans	-29	152.9	167.9	-52.3	-98	0	0	0	116.7
175	G	29.2	Very low	32.3	Very low	61 Å²	61	130.8 Å²	130.8	63%	0.629	78%	0.779	S	S	*	*			cis	133.5	143.6	2.2	0	0	0	0	0	112.6
176	R	33.7	Very low	32.3	Very low	207 Å²	207	131.7 Å²	131.7	78%	0.781	78%	0.783	S	S	*	*			trans	70.8	147.4	-179.1	-47.4	171.7	-168.8	-132.6	9.4	113.8
177	Y	33.9	Very low	32.2	Very low	201 Å²	201	131.9 Å²	131.9	79%	0.788	79%	0.79	S	S	*	*			cis	-143.1	172.6	-10.1	-83.6	-51.2	0	0	0	107.1
178	G	29.8	Very low	32.1	Very low	73 Å²	73	130.8 Å²	130.8	75%	0.753	79%	0.788	S	S	*	*			cis	137.3	122.7	0.2	0	0	0	0	0	111.7
179	A	30.2	Very low	32.3	Very low	110 Å²	110	131 Å²	131	91%	0.909	79%	0.791	S	S	*	*			trans	-144.8	160.5	-179.7	0	0	0	0	0	111.1
180	A	30	Very low	32.2	Very low	93 Å²	93	132 Å²	132	77%	0.769	80%	0.797	S	S	*	*			trans	-148.7	142.9	-160.8	0	0	0	0	0	118
181	S	34.6	Very low	32.1	Very low	116 Å²	116	130 Å²	130	81%	0.811	79%	0.789	S	S	*	*			trans	65	176.3	151.6	-58.9	0	0	0	0	117.9
182	P	55.6	Low	32.3	Very low	126 Å²	126	130.7 Å²	130.7	82%	0.818	79%	0.793	S	S	*	*			cis	-131.3	-163.3	-4.7	31.5	-7.2	0	0	0	116.2
183	R	31.1	Very low	32.2	Very low	241 Å²	241	132.8 Å²	132.8	91%	0.909	79%	0.79	S	S	*	*			trans	-39.3	173.2	171.2	-55.5	169	158.6	179.7	-7.8	117
184	S	35	Very low	31.9	Very low	102 Å²	102	133 Å²	133	71%	0.713	79%	0.791	S	S	*	*			cis	-170.7	159.1	33.8	52	0	0	0	0	116
185	S	38.4	Very low	31.9	Very low	110 Å²	110	133.5 Å²	133.5	77%	0.769	79%	0.789	S	S	*	*			trans	35.3	154.6	139.3	-44	0	0	0	0	122.5
186	L	31.8	Very low	31.9	Very low	168 Å²	168	134.8 Å²	134.8	88%	0.88	79%	0.788	S	S	*	*			cis	-158.3	173.7	37.6	-85.3	171.9	0	0	0	113.6
187	A	29.1	Very low	31.6	Very low	99 Å²	99	133.9 Å²	133.9	82%	0.818	79%	0.79	S	S	*	*			trans	93.4	147.2	149	0	0	0	0	0	121.6
188	S	28.1	Very low	31.4	Very low	114 Å²	114	133.4 Å²	133.4	80%	0.797	80%	0.795	S	S	*	*			trans	-102.1	177.3	-178.1	-49.2	0	0	0	0	110.6
189	S	29.9	Very low	31.4	Very low	107 Å²	107	134.3 Å²	134.3	75%	0.748	80%	0.795	S	S	*	*			cis	-159.7	152.1	22.3	-55.5	0	0	0	0	111.8
190	L	27.5	Very low	31.3	Very low	176 Å²	176	134.9 Å²	134.9	92%	0.921	79%	0.792	S	S	*	*				174.2	167.2	129.6	-95.2	166.2	0	0	0	110.5
191	S	27.1	Very low	32.1	Very low	96 Å²	96	136.6 Å²	136.6	67%	0.671	80%	0.796	S	S	*	*			trans	-141.1	153.6	-160.8	58.8	0	0	0	0	115.2
192	S	30.1	Very low	31.8	Very low	112 Å²	112	143 Å²	143	78%	0.783	80%	0.802	S	S	*	*			trans	76.3	151.6	162.6	-45.8	0	0	0	0	115.6
193	Q	28.2	Very low	30.6	Very low	169 Å²	169	142.6 Å²	142.6	79%	0.79	80%	0.802	S	S	*	*			cis	-148.6	142	6.9	-163.8	168.5	-26.6	0	0	112.7
194	E	27.1	Very low	30.5	Very low	172 Å²	172	136.3 Å²	136.3	80%	0.804	80%	0.795	S	S	*	*			trans	-96.1	146.8	166.5	-79.4	-173	75.9	0	0	113
195	Q	28.7	Very low	30.2	Very low	150 Å²	150	138.8 Å²	138.8	70%	0.701	80%	0.799	S	S	*	*			trans	-172.8	104.3	141.3	-106.9	169.9	66.7	0	0	107.6
196	S	29.5	Very low	29.8	Very low	89 Å²	89	139.1 Å²	139.1	62%	0.622	80%	0.801	S	S	*	*				65.7	104.9	60	87.1	0	0	0	0	113.9
197	K	27.4	Very low	29.7	Very low	187 Å²	187	136.7 Å²	136.7	81%	0.813	80%	0.799	S	S	*	*			trans	179.8	84	162.4	-102.9	152.3	-173	166	0	113.7
198	H	31.1	Very low	30.4	Very low	191 Å²	191	137.7 Å²	137.7	88%	0.884	80%	0.797	S	S	*	*			trans	-129.4	121.3	152.7	-67.9	-14	0	0	0	106.3
199	A	28.7	Very low	30.4	Very low	92 Å²	92	143 Å²	143	76%	0.76	80%	0.799	S	S	*	*			cis	89.4	101.2	41.2	0	0	0	0	0	113.2
200	S	28.6	Very low	30.3	Very low	122 Å²	122	144 Å²	144	85%	0.853	80%	0.801	S	S	*	*			trans	-160.3	135.4	157.5	-80.2	0	0	0	0	109
201	P	47.1	Very low	30.4	Very low	129 Å²	129	141.1 Å²	141.1	84%	0.838	80%	0.795	S	S	*	*			trans	-93	165.6	-170.2	36.5	-36.4	0	0	0	113.8
202	R	28.3	Very low	30.7	Very low	250 Å²	250	144.6 Å²	144.6	94%	0.943	81%	0.806	S	S	*	*			trans	-111.7	137.1	154.9	-90.2	-176.9	166.2	-122	-0.4	109.4
203	S	29.3	Very low	30.6	Very low	118 Å²	118	146.1 Å²	146.1	83%	0.825	81%	0.81	S	S	*	*			trans	-90.8	155.1	170.2	48.8	0	0	0	0	111.2
204	S	30.3	Very low	31.1	Very low	109 Å²	109	144.3 Å²	144.3	76%	0.762	81%	0.81	S	S	*	*			trans	-167.5	118.1	149.5	-118.9	0	0	0	0	112.7
205	I	28.8	Very low	31.7	Very low	154 Å²	154	142.1 Å²	142.1	79%	0.79	81%	0.811	S	S	*	*			trans	11.5	127.1	157.4	32	64.3	0	0	0	121.5
206	S	29.5	Very low	31.7	Very low	118 Å²	118	138 Å²	138	83%	0.825	81%	0.809	S	S	*	*				-172.2	150	106.4	42	0	0	0	0	113.2
207	S	29.5	Very low	31.7	Very low	117 Å²	117	141.4 Å²	141.4	82%	0.818	82%	0.815	S	S	*	*			trans	-165.5	139.5	167.1	-76.3	0	0	0	0	106.4
208	P	43.7	Very low	31.7	Very low	120 Å²	120	138.9 Å²	138.9	78%	0.779	81%	0.81	S	S	*	*				-152	-176.6	91.9	41.5	-24.2	0	0	0	115.4
209	R	27.7	Very low	31.7	Very low	225 Å²	225	139.9 Å²	139.9	85%	0.849	81%	0.806	S	S	*	*			trans	79	101.5	153.5	-85.4	-176.7	173.6	-175.7	-3	120.6
210	T	28.3	Very low	31.8	Very low	127 Å²	127	145.1 Å²	145.1	78%	0.779	81%	0.808	S	S	*	*				52.7	104.4	123.1	56.9	0	0	0	0	119.1
211	S	30	Very low	31.8	Very low	116 Å²	116	145.7 Å²	145.7	81%	0.811	81%	0.806	S	S	*	*			trans	-62.6	137.2	160.7	51.9	0	0	0	0	114.1
212	L	32.1	Very low	31.1	Very low	170 Å²	170	144.8 Å²	144.8	89%	0.89	80%	0.803	S	S	*	*			trans	-155	163	145.6	-94.5	-174.3	0	0	0	109.5
213	V	29.3	Very low	32.5	Very low	144 Å²	144	138.3 Å²	138.3	87%	0.873	79%	0.793	S	S	*	*			trans	90.8	138	-177.4	-174.9	0	0	0	0	115.6
214	V	39.3	Very low	32.6	Very low	131 Å²	131	143.7 Å²	143.7	79%	0.794	80%	0.796	S	S	*	*			trans	-125.1	138.7	-167.8	172.2	0	0	0	0	111.1
215	P	37.9	Very low	32.4	Very low	125 Å²	125	145.7 Å²	145.7	81%	0.812	80%	0.803	S	S	*	*			trans	-106	145.4	157.8	36.1	-27.5	0	0	0	111.6
216	G	30.4	Very low	32.6	Very low	65 Å²	65	143.6 Å²	143.6	67%	0.67	80%	0.802	S	S	*	*			cis	158.9	165	-8.1	0	0	0	0	0	112.2
217	Q	28.5	Very low	32.5	Very low	159 Å²	159	145.8 Å²	145.8	74%	0.743	80%	0.804	S	S	*	*			trans	65	108.6	165	-49.8	-71.1	-14.9	0	0	117
218	N	27.8	Very low	32.5	Very low	134 Å²	134	146.2 Å²	146.2	72%	0.717	80%	0.801	S	S	*	*				74.1	112.5	73.6	-73.4	-37.4	0	0	0	116.6
219	R	30.4	Very low	31.8	Very low	212 Å²	212	149 Å²	149	80%	0.8	80%	0.804	S	S	*	*				169.4	134.3	104	-86.9	-176.7	-152.5	-93.1	-2.2	114.6
220	Y	30.5	Very low	31.8	Very low	202 Å²	202	144 Å²	144	79%	0.792	80%	0.802	S	S	*	*			trans	48.7	117.5	144.9	-77.3	-104.1	0	0	0	122.3
221	T	28.7	Very low	31.8	Very low	134 Å²	134	147.3 Å²	147.3	82%	0.822	81%	0.808	S	S	*	*				-166.2	161.1	95.1	18.6	0	0	0	0	112.7
222	S	33.1	Very low	31.7	Very low	110 Å²	110	145 Å²	145	77%	0.769	80%	0.803	S	S	*	*			trans	-140.4	-176.5	176.2	-38.6	0	0	0	0	106.8
223	P	58.2	Low	31.5	Very low	114 Å²	114	144.6 Å²	144.6	74%	0.74	80%	0.801	S	S	*	*			cis	-150.6	-168.6	29.1	43.6	-20.9	0	0	0	117.9
224	R	30.7	Very low	31.4	Very low	231 Å²	231	142.8 Å²	142.8	87%	0.872	80%	0.795	S	S	*	*			trans	67.8	113.2	149.7	-94.8	-176.4	168.4	176.9	-3.4	121.1
225	T	26.6	Very low	31	Very low	151 Å²	151	143.5 Å²	143.5	93%	0.926	79%	0.793	S	S	*	*				-147.6	171.5	112.8	23.4	0	0	0	0	109
226	S	31.8	Very low	30.7	Very low	110 Å²	110	144.8 Å²	144.8	77%	0.769	79%	0.793	S	S	*	*			trans	-151.4	142.7	-163.1	54.1	0	0	0	0	113.4
227	L	27.8	Very low	30.7	Very low	164 Å²	164	146.7 Å²	146.7	86%	0.859	80%	0.795	S	S	*	*			trans	-152.6	107.3	162.6	-156.8	70.1	0	0	0	114.3
228	V	29.3	Very low	31.8	Very low	126 Å²	126	144.3 Å²	144.3	76%	0.764	79%	0.794	S	S	*	*			trans	63.3	138.9	146.8	-178	0	0	0	0	120.9
229	H	28.6	Very low	31.7	Very low	180 Å²	180	149 Å²	149	83%	0.833	80%	0.802	S	S	*	*			trans	-143	-176.5	164.8	-119.7	-66.8	0	0	0	108.2
230	C	28.8	Very low	32	Very low	118 Å²	118	143.3 Å²	143.3	80%	0.797	79%	0.794	S	S	*	*			trans	80.2	147	-174.8	-54.7	0	0	0	0	114.8
231	E	27.5	Very low	32.4	Very low	197 Å²	197	138.6 Å²	138.6	92%	0.921	79%	0.791	S	S	*	*			cis	-90.8	-142.5	-1	-57.2	-160.2	75.4	0	0	112.3
232	G	27.9	Very low	32.8	Very low	67 Å²	67	143.1 Å²	143.1	69%	0.691	79%	0.794	S	S	*	*			cis	-175.4	-167.1	2.8	0	0	0	0	0	114.4
233	N	28.4	Very low	32.7	Very low	162 Å²	162	142 Å²	142	87%	0.866	79%	0.791	S	S	*	*			trans	-127.9	167	-169.1	-106	-8.8	0	0	0	113.4
234	S	27.3	Very low	31.8	Very low	107 Å²	107	141.9 Å²	141.9	75%	0.748	79%	0.794	S	S	*	*			trans	90.8	151.8	163.1	-48	0	0	0	0	117.3
235	I	30.3	Very low	32	Very low	146 Å²	146	137.2 Å²	137.2	75%	0.749	79%	0.791	S	S	*	*			cis	-173.4	141.5	-33.8	-111.7	157.5	0	0	0	108.4
236	L	31.3	Very low	32.3	Very low	152 Å²	152	133.7 Å²	133.7	80%	0.796	78%	0.777	S	S	*	*			trans	61	125.7	163.8	-69.9	166.6	0	0	0	123.2
237	S	30.9	Very low	32.5	Very low	104 Å²	104	133.6 Å²	133.6	73%	0.727	78%	0.777	S	S	*	*				24.5	159.2	116.9	-57	0	0	0	0	122.3
238	P	51.1	Low	32.8	Very low	109 Å²	109	132.3 Å²	132.3	71%	0.708	77%	0.771	S	S	*	*			cis	-147.3	-170.5	24.4	45	-25.2	0	0	0	118.4
239	R	26.9	Very low	33	Very low	234 Å²	234	132.2 Å²	132.2	88%	0.883	77%	0.77	S	S	*	*			trans	73.3	154.4	157.5	-79.1	179	163.9	159.4	-5.9	119.8
240	S	35.4	Very low	33.2	Very low	91 Å²	91	128.7 Å²	128.7	64%	0.636	77%	0.766	S	S	*	*			cis	-176.6	131.4	-33.5	50.3	0	0	0	0	113.3
241	S	40.8	Very low	33.5	Very low	104 Å²	104	131.8 Å²	131.8	73%	0.727	77%	0.766	S	S	*	*			trans	63.4	160.4	156.1	-43.6	0	0	0	0	118.3
242	Y	36	Very low	33.7	Very low	228 Å²	228	130.9 Å²	130.9	89%	0.894	76%	0.761	S	S	*	*			cis	-114.1	-159.4	-2.2	-100.7	-91.1	0	0	0	109.3
243	A	30.4	Very low	34	Very low	86 Å²	86	133.5 Å²	133.5	71%	0.711	77%	0.769	S	S	*	*			cis	-152.4	-169.6	11.7	0	0	0	0	0	112.3
244	S	39.4	Very low	34.3	Very low	113 Å²	113	131.2 Å²	131.2	79%	0.79	77%	0.766	S	S	*	*			trans	-142.8	175.7	-179.5	-47.8	0	0	0	0	110.5
245	T	35.6	Very low	35.5	Very low	132 Å²	132	132.2 Å²	132.2	81%	0.81	77%	0.77	S	S	*	*			cis	-126	-159.2	8.3	56.5	0	0	0	0	110
246	A	31.9	Very low	35.6	Very low	78 Å²	78	136 Å²	136	65%	0.645	77%	0.774	S	S	*	*			cis	-155.8	163.9	3.2	0	0	0	0	0	108.1
247	S	37.7	Very low	35.6	Very low	108 Å²	108	135.5 Å²	135.5	76%	0.755	78%	0.778	S	S	*	*			cis	89.8	126.3	20.8	-53.2	0	0	0	0	116.1
248	D	32.6	Very low	35.7	Very low	137 Å²	137	135 Å²	135	73%	0.733	77%	0.774	S	S	*	*			cis	-168	155.7	-16.4	-151.4	-10.7	0	0	0	113.7
249	T	35.2	Very low	34.9	Very low	123 Å²	123	136.9 Å²	136.9	76%	0.755	78%	0.778	S	S	*	*			trans	54.3	-177.2	164.9	78.1	0	0	0	0	117.9
250	S	32.6	Very low	35.2	Very low	106 Å²	106	132.4 Å²	132.4	74%	0.741	77%	0.772	S	S	*	*			cis	-149.8	-174.9	-2.1	60.1	0	0	0	0	110.7
251	K	33.4	Very low	34.8	Very low	184 Å²	184	132.6 Å²	132.6	80%	0.8	77%	0.773	S	S	*	*			trans	-115.8	157.2	170.2	-74.2	-176.1	178.6	178.4	0	111.6
252	H	33.4	Very low	34.4	Very low	177 Å²	177	133.1 Å²	133.1	82%	0.819	78%	0.775	S	S	*	*			trans	116.8	152.6	157.1	-72	-87.8	0	0	0	117.9
253	S	32.6	Very low	34	Very low	122 Å²	122	128.6 Å²	128.6	85%	0.853	77%	0.767	S	S	*	*			trans	84.1	114	163.8	-56.3	0	0	0	0	119
254	S	36.4	Very low	33.8	Very low	115 Å²	115	130.2 Å²	130.2	80%	0.804	77%	0.771	S	S	*	*			trans	-92.5	172.6	163.3	-43.9	0	0	0	0	111
255	P	51.1	Low	33.3	Very low	128 Å²	128	130.6 Å²	130.6	83%	0.831	77%	0.772	S	S	*	*				-127.1	179.2	129.5	35.8	-28.1	0	0	0	113.7
256	R	33.9	Very low	33.2	Very low	224 Å²	224	130.2 Å²	130.2	85%	0.845	78%	0.775	S	S	*	*			trans	-86.6	171.4	-169.8	-57.9	171.4	157.7	-142.3	-3.8	112.3
257	T	29.5	Very low	33.5	Very low	143 Å²	143	135.6 Å²	135.6	88%	0.877	78%	0.784	S	S	*	*				-161.9	154.3	84.5	-61.5	0	0	0	0	112
258	S	33.4	Very low	33.4	Very low	92 Å²	92	136 Å²	136	64%	0.643	78%	0.784	S	S	*	*			trans	-84.5	167.5	-167.7	-35.6	0	0	0	0	115.8
259	L	34.1	Very low	33.4	Very low	150 Å²	150	134 Å²	134	79%	0.785	78%	0.781	S	S	*	*				-173.3	130	118.6	-98	168.3	0	0	0	112.3
260	N	33.2	Very low	33.4	Very low	140 Å²	140	133 Å²	133	75%	0.749	78%	0.779	S	S	*	*			trans	43.8	153.8	153.9	-56.9	0.2	0	0	0	122.7
261	S	28.3	Very low	33.5	Very low	95 Å²	95	135.2 Å²	135.2	66%	0.664	78%	0.783	S	S	*	*			cis	-178.6	137.4	-32.4	-93.4	0	0	0	0	109
262	C	31.6	Very low	33.4	Very low	114 Å²	114	137.6 Å²	137.6	77%	0.77	79%	0.787	S	S	*	*			trans	63.8	152.2	156.5	-64.5	0	0	0	0	118.2
263	D	28.1	Very low	33.4	Very low	134 Å²	134	135.1 Å²	135.1	72%	0.717	78%	0.784	S	S	*	*			cis	-160.7	171.9	-12.1	-126.2	-49.5	0	0	0	113.5
264	C	26.7	Very low	33.5	Very low	119 Å²	119	135.2 Å²	135.2	80%	0.804	79%	0.785	S	S	*	*			trans	68.5	157.3	154.4	-74.3	0	0	0	0	122.3
265	C	29	Very low	33.2	Very low	121 Å²	121	132.7 Å²	132.7	82%	0.818	78%	0.776	S	S	*	*			trans	-108.5	158.3	-176.5	-42.5	0	0	0	0	112.7
266	S	32	Very low	32.2	Very low	125 Å²	125	134.4 Å²	134.4	87%	0.874	78%	0.777	S	S	*	*			trans	178.8	171.9	132	-89.1	0	0	0	0	115.9
267	K	38.8	Very low	32.4	Very low	191 Å²	191	128.7 Å²	128.7	83%	0.83	77%	0.772	S	S	*	*			trans	-67.6	163.8	-179.7	-52.8	164.1	-175.2	170.2	0	113.3
268	P	36.4	Very low	32.6	Very low	117 Å²	117	130.9 Å²	130.9	76%	0.76	77%	0.774	S	S	*	*				-128.1	160.9	117.6	37.2	-31.6	0	0	0	112.2
269	S	31.2	Very low	32.6	Very low	95 Å²	95	129.6 Å²	129.6	66%	0.664	78%	0.775	S	S	*	*			cis	79.2	79.1	9.8	85.2	0	0	0	0	119.2
270	S	36.8	Very low	32.3	Very low	101 Å²	101	133 Å²	133	71%	0.706	78%	0.779	S	S	*	*			trans	61.7	123	132.2	64.2	0	0	0	0	123.1
271	N	32.8	Very low	32.4	Very low	153 Å²	153	132.3 Å²	132.3	82%	0.818	78%	0.776	S	S	*	*			trans	77.2	144.4	133.1	-73.7	0.1	0	0	0	122.7
272	R	31.9	Very low	32.6	Very low	234 Å²	234	134 Å²	134	88%	0.883	77%	0.773	S	S	*	*			trans	75.5	141.5	169.4	-59.5	177.9	102.4	171	3.9	115
273	T	33.5	Very low	32.7	Very low	125 Å²	125	140.1 Å²	140.1	77%	0.767	78%	0.78	S	S	*	*			cis	127.7	139.3	5.2	-75.9	0	0	0	0	107.5
274	S	34.1	Very low	33	Very low	124 Å²	124	140.9 Å²	140.9	87%	0.867	78%	0.779	S	S	*	*			trans	77.6	145.4	-169.2	88.2	0	0	0	0	114.4
275	G	30.8	Very low	33.1	Very low	61 Å²	61	143.1 Å²	143.1	63%	0.629	78%	0.781	S	S	*	*			cis	164.6	158.7	-12.6	0	0	0	0	0	112.9
276	I	30.9	Very low	33.2	Very low	164 Å²	164	142.6 Å²	142.6	84%	0.841	78%	0.779	S	S	*	*			trans	68.8	106.4	166	-46.9	149.2	0	0	0	113.2
277	S	36.8	Very low	34.3	Very low	105 Å²	105	142.2 Å²	142.2	73%	0.734	77%	0.773	S	S	*	*				75	142.1	71.7	-55.6	0	0	0	0	115.3
278	M	34	Very low	33.7	Very low	188 Å²	188	145.1 Å²	145.1	93%	0.926	78%	0.779	S	S	*	*			trans	66.3	133.3	-167.5	-86	55.5	175.6	0	0	115
279	G	32.9	Very low	33.5	Very low	65 Å²	65	144.9 Å²	144.9	67%	0.67	78%	0.78	S	S	*	*			cis	127.5	121.2	-7.3	0	0	0	0	0	112.9
280	Y	29.5	Very low	33.6	Very low	222 Å²	222	145.6 Å²	145.6	87%	0.871	79%	0.785	S	S	*	*			trans	-155.5	158.4	174.9	-121.1	-83.3	0	0	0	113.6
281	D	34.6	Very low	33.3	Very low	126 Å²	126	147 Å²	147	67%	0.674	79%	0.79	S	S	*	*			trans	-7	137.8	-177.8	-69	-35.3	0	0	0	121.8
282	Q	31.4	Very low	33.2	Very low	129 Å²	129	144.8 Å²	144.8	60%	0.603	79%	0.793	S	S	*	*			cis	83.2	107.8	35.6	-169.9	88.9	96.7	0	0	115	H284	Q282-H284 PolarHBondContact NE2-CD2 2.92Å; Q282-H284 VanDerWaalsContact NE2-CD2 3.3Å; Q282-H284 PolarHBondContact NE2-NE2 3.2Å
283	R	35.4	Very low	33.2	Very low	243 Å²	243	139.3 Å²	139.3	92%	0.917	79%	0.79	S	S	*	*			trans	-161.9	135	136	-112.3	-177	-67.4	-103.1	2.5	110.9
284	H	33.2	Very low	33.1	Very low	151 Å²	151	141.7 Å²	141.7	70%	0.699	79%	0.793	S	S	*	*			trans	-85.8	179.4	170.5	-61	-94	0	0	0	109.4	Q282	Q282-H284 PolarHBondContact NE2-CD2 2.92Å; Q282-H284 VanDerWaalsContact NE2-CD2 3.3Å; Q282-H284 PolarHBondContact NE2-NE2 3.2Å
285	I	29.8	Very low	32.8	Very low	165 Å²	165	145.2 Å²	145.2	85%	0.846	79%	0.788	S	S	*	*				-168.5	154	70.8	-80.8	164.9	0	0	0	108.9
286	S	29.8	Very low	32.8	Very low	110 Å²	110	146.7 Å²	146.7	77%	0.769	79%	0.789	S	S	*	*			trans	-97.6	-137.2	179.9	-60	0	0	0	0	113.5
287	P	56.1	Low	32.6	Very low	118 Å²	118	148.5 Å²	148.5	77%	0.766	79%	0.791	S	S	*	*				-112.8	174.6	-119	37.9	-22.3	0	0	0	114.8
288	R	26.1	Very low	32.5	Very low	251 Å²	251	148.9 Å²	148.9	95%	0.947	79%	0.789	S	S	*	*			trans	-141.6	145.7	162.6	-82.7	-164.2	165.2	-173	-5.8	113.2
289	S	32.6	Very low	32.3	Very low	113 Å²	113	146.6 Å²	146.6	79%	0.79	79%	0.786	S	S	*	*			trans	-116.3	150.6	176.2	-44	0	0	0	0	110.3
290	S	32.4	Very low	32.4	Very low	110 Å²	110	148.6 Å²	148.6	77%	0.769	79%	0.79	S	S	*	*			trans	-152.3	130.4	155.2	-70.4	0	0	0	0	106.7
291	T	30.9	Very low	33.1	Very low	131 Å²	131	144.5 Å²	144.5	80%	0.804	79%	0.79	S	S	*	*			cis	69.1	97.8	46.3	73.6	0	0	0	0	114.9
292	A	30.2	Very low	32.8	Very low	106 Å²	106	149.2 Å²	149.2	88%	0.876	80%	0.799	S	S	*	*			trans	-156.2	140.9	151.9	0	0	0	0	0	109.3
293	S	31.9	Very low	32.7	Very low	118 Å²	118	147.9 Å²	147.9	83%	0.825	80%	0.804	S	S	*	*			trans	-112.7	164.6	-178.6	-42.2	0	0	0	0	110.6
294	Q	30.8	Very low	32.6	Very low	176 Å²	176	140.6 Å²	140.6	82%	0.822	79%	0.79	S	S	*	*			trans	-169.7	161.4	136.2	-97.4	-47.7	-16.1	0	0	111.9
295	Y	27.9	Very low	32.3	Very low	197 Å²	197	143.7 Å²	143.7	77%	0.773	80%	0.797	S	S	*	*			trans	-64.6	137.4	-174.6	-84.5	-117.2	0	0	0	113.6
296	S	31.3	Very low	32.3	Very low	93 Å²	93	141.5 Å²	141.5	65%	0.65	80%	0.797	S	S	*	*				75.4	117.7	70	-52.6	0	0	0	0	115.4
297	F	27.9	Very low	32.2	Very low	202 Å²	202	142.8 Å²	142.8	89%	0.886	80%	0.795	S	S	*	*				-178	174.8	124.1	-102.6	-64.3	0	0	0	113.1
298	T	34	Very low	31	Very low	113 Å²	113	139.7 Å²	139.7	69%	0.693	78%	0.776	S	S	*	*			trans	-99	151.1	-168.2	51.9	0	0	0	0	114.3
299	T	29.9	Very low	31.4	Very low	139 Å²	139	137.9 Å²	137.9	85%	0.853	77%	0.769	S	S	*	*				169.5	157.9	117.9	33.9	0	0	0	0	112.8
300	S	35.1	Very low	31.2	Very low	108 Å²	108	143.4 Å²	143.4	76%	0.755	77%	0.774	S	S	*	*			trans	-85.8	167.8	159.4	-43.4	0	0	0	0	110.8
301	P	43.3	Very low	31.1	Very low	135 Å²	135	140.9 Å²	140.9	88%	0.877	77%	0.765	S	S	*	*			trans	-125.5	173.5	131.4	36.5	-30.8	0	0	0	113.2
302	R	28.8	Very low	32.1	Very low	226 Å²	226	140.3 Å²	140.3	85%	0.853	76%	0.764	S	S	*	*			trans	-147.7	135.5	-167.5	177.1	-167.3	-177.2	-159.3	3	109.5
303	S	30.3	Very low	32	Very low	101 Å²	101	141 Å²	141	71%	0.706	76%	0.757	S	S	*	*			trans	61.2	153.3	170	53.1	0	0	0	0	115.5
304	S	31.6	Very low	32	Very low	90 Å²	90	140.9 Å²	140.9	63%	0.629	75%	0.751	S	S	*	*				-177.7	142.6	59.2	-91.8	0	0	0	0	113.3
305	Y	28.5	Very low	32.1	Very low	215 Å²	215	138.8 Å²	138.8	84%	0.843	75%	0.746	S	S	*	*			trans	57.9	156.1	147.9	-72.3	-92.7	0	0	0	118.9
306	S	30.1	Very low	32.4	Very low	120 Å²	120	136.7 Å²	136.7	84%	0.839	74%	0.742	S	S	*	*			cis	-139.7	176	31.4	-61.9	0	0	0	0	114.9
307	D	27.7	Very low	32.4	Very low	137 Å²	137	137.9 Å²	137.9	73%	0.733	74%	0.741	S	S	*	*			trans	-131.9	167	-171.8	170.4	49.6	0	0	0	112.4
308	S	30.6	Very low	33.1	Very low	52 Å²	52	135.2 Å²	135.2	36%	0.364	74%	0.736	S	S	.	*			trans	86.3	115	150.1	-91.3	0	0	0	0	123.1
309	R	33.1	Very low	33	Very low	214 Å²	214	137.1 Å²	137.1	81%	0.808	74%	0.737	S	S	*	*				66.4	121.3	128.5	-61.7	176	-69.5	-132.6	-9.8	121.7
310	Y	29	Very low	33	Very low	228 Å²	228	133.7 Å²	133.7	89%	0.894	73%	0.729	S	S	*	*				-166.3	165.2	105.8	-127	-104.4	0	0	0	112.8
311	G	30	Very low	33.1	Very low	57 Å²	57	132.4 Å²	132.4	59%	0.588	72%	0.72	S	S	*	*			trans	-111.2	-152.6	167.2	0	0	0	0	0	111.4
312	P	51.3	Low	32.6	Very low	120 Å²	120	133.7 Å²	133.7	78%	0.779	72%	0.716	S	S	*	*			cis	-139.4	-171.1	1.2	43.2	-23.9	0	0	0	115.4
313	V	29.8	Very low	33	Very low	121 Å²	121	130.6 Å²	130.6	73%	0.733	71%	0.714	S	S	*	*			trans	6	136.8	139.4	-171.6	0	0	0	0	117.2
314	V	30.9	Very low	33.2	Very low	115 Å²	115	131.4 Å²	131.4	70%	0.697	71%	0.709	S	S	*	*				-163.2	158.4	56.4	-134.3	0	0	0	0	113.8
315	N	32.2	Very low	33.1	Very low	132 Å²	132	135.2 Å²	135.2	71%	0.706	72%	0.717	S	S	*	*			trans	34.2	152.6	134.3	-64.9	5.6	0	0	0	123
316	H	34.8	Very low	33.1	Very low	152 Å²	152	129.3 Å²	129.3	70%	0.704	71%	0.713	S	S	*	*			cis	-150.5	-159.5	-0.4	-127.4	-83.2	0	0	0	106.1
317	D	32.1	Very low	33.3	Very low	118 Å²	118	128 Å²	128	63%	0.631	71%	0.709	S	S	*	*			cis	-158.8	-175	7.9	-139.9	-19	0	0	0	115
318	L	41.5	Very low	34.4	Very low	146 Å²	146	127.1 Å²	127.1	76%	0.764	71%	0.711	S	S	*	*			trans	5.1	133.2	164.2	-95.7	64.3	0	0	0	120.7
319	E	32.5	Very low	34.6	Very low	153 Å²	153	132.7 Å²	132.7	72%	0.715	74%	0.736	S	S	*	*			cis	-142.6	174.6	7.1	-131.3	-140.6	111	0	0	109.8	S321	E319-S321 WeakPolarHBondContact OE1-CB 3.39Å; E319-S321 PolarHBondContact OE1-N 3.14Å; E319-S321 PolarHBondContact OE1-OG 3.34Å
320	G	29.4	Very low	34.4	Very low	67 Å²	67	127.6 Å²	127.6	69%	0.691	74%	0.739	S	S	*	*			cis	161.1	-148	9.1	0	0	0	0	0	118.4
321	S	37.2	Very low	34.6	Very low	81 Å²	81	122 Å²	122	57%	0.566	73%	0.733	S	S	*	*			trans	-3.2	125.1	165.4	-71.1	0	0	0	0	119.2	E319	E319-S321 WeakPolarHBondContact OE1-CB 3.39Å; E319-S321 PolarHBondContact OE1-N 3.14Å; E319-S321 PolarHBondContact OE1-OG 3.34Å
322	M	33.7	Very low	35.5	Very low	162 Å²	162	124.5 Å²	124.5	80%	0.798	74%	0.739	S	S	*	*			cis	-157.4	143.8	3	-45.2	-179.6	-170.6	0	0	112.2
323	M	36.7	Very low	34.4	Very low	162 Å²	162	129.5 Å²	129.5	80%	0.798	74%	0.742	S	S	*	*			trans	50.8	138.4	142.7	-54.1	-76.7	129.1	0	0	121.8
324	L	35.7	Very low	34.4	Very low	118 Å²	118	128.4 Å²	128.4	62%	0.618	74%	0.74	S	S	*	*			cis	-164.1	153.7	-12.4	-93.4	-175.5	0	0	0	111.6
325	H	28.3	Very low	34.6	Very low	169 Å²	169	127.3 Å²	127.3	78%	0.782	74%	0.738	S	S	*	*			trans	45.5	148.8	146.3	-61.8	-33.3	0	0	0	122.9
326	A	28.5	Very low	34.5	Very low	92 Å²	92	128.5 Å²	128.5	76%	0.76	74%	0.742	S	S	*	*			cis	-167.6	169.9	-15.3	0	0	0	0	0	110.8
327	A	33.6	Very low	34.3	Very low	91 Å²	91	127.3 Å²	127.3	75%	0.752	75%	0.75	S	S	*	*			trans	-103.5	-175.5	167.8	0	0	0	0	0	109.6
328	P	51.4	Low	34.3	Very low	119 Å²	119	126.7 Å²	126.7	77%	0.773	75%	0.754	S	S	*	*			cis	-147.9	-158.7	14.7	46.3	-24.2	0	0	0	116.9
329	L	35.6	Very low	33.9	Very low	170 Å²	170	128 Å²	128	89%	0.89	76%	0.757	S	S	*	*			trans	-32.8	145.9	167.3	-55.6	160.3	0	0	0	118.7
330	A	29.4	Very low	33.8	Very low	107 Å²	107	128 Å²	128	88%	0.884	76%	0.762	S	S	*	*			trans	-170.4	160.8	138.6	0	0	0	0	0	113.8
331	S	33.2	Very low	33.9	Very low	110 Å²	110	128.4 Å²	128.4	77%	0.769	77%	0.765	S	S	*	*			trans	-109.7	165.8	169.4	-164.4	0	0	0	0	109.7
332	P	47	Very low	33.7	Very low	109 Å²	109	131 Å²	131	71%	0.708	78%	0.783	S	S	*	*				-160.7	175.5	90.6	43	-23	0	0	0	118.2
333	R	29.4	Very low	33.8	Very low	225 Å²	225	127.9 Å²	127.9	85%	0.849	78%	0.784	S	S	*	*			trans	41.2	132.4	140.4	-72.6	176.2	172.5	166.4	-3.5	121.2
334	S	29.5	Very low	33.6	Very low	99 Å²	99	132 Å²	132	69%	0.692	79%	0.79	S	S	*	*				65.6	146.2	70	106.8	0	0	0	0	113.8
335	S	34.3	Very low	33.9	Very low	91 Å²	91	132.7 Å²	132.7	64%	0.636	80%	0.802	S	S	*	*			cis	-176.6	159.2	7.3	28.4	0	0	0	0	112.2
336	I	31.9	Very low	33.9	Very low	157 Å²	157	128 Å²	128	81%	0.805	80%	0.8	S	S	*	*			trans	62.6	117.2	154.5	-60.2	152.7	0	0	0	119.1
337	C	29.6	Very low	34.1	Very low	128 Å²	128	131.1 Å²	131.1	87%	0.865	81%	0.81	S	S	*	*			trans	-153.3	154	141.9	46.1	0	0	0	0	109.6
338	S	31.2	Very low	34	Very low	104 Å²	104	131.7 Å²	131.7	73%	0.727	81%	0.814	S	S	*	*			trans	-156.1	147.1	-163.4	-52.8	0	0	0	0	112.3
339	Q	34.8	Very low	33.1	Very low	173 Å²	173	130.6 Å²	130.6	81%	0.808	82%	0.816	S	S	*	*			trans	163.9	134.2	134.2	-90.6	175	1.1	0	0	114.4
340	D	30.2	Very low	32.8	Very low	155 Å²	155	129.9 Å²	129.9	83%	0.829	81%	0.813	S	S	*	*			trans	45.2	133.3	137.5	-50.5	-37.6	0	0	0	123.7
341	G	30.5	Very low	32.7	Very low	74 Å²	74	129.8 Å²	129.8	76%	0.763	80%	0.804	S	S	*	*			trans	174.1	58	176.3	0	0	0	0	0	115.5	A343	G341-A343 PolarHBondContact O-N 3.45Å
342	S	34.1	Very low	32.6	Very low	135 Å²	135	130.1 Å²	130.1	94%	0.944	80%	0.801	S	S	*	*			trans	-73.8	107	-174.9	-68.6	0	0	0	0	114.5
343	A	34.4	Very low	31.8	Very low	98 Å²	98	131.5 Å²	131.5	81%	0.81	81%	0.807	S	S	*	*			trans	-149.2	114.5	162.6	0	0	0	0	0	113.6	G341	G341-A343 PolarHBondContact O-N 3.45Å
344	R	32.9	Very low	31.9	Very low	247 Å²	247	125.4 Å²	125.4	93%	0.932	80%	0.799	S	S	*	*			trans	-125.4	149.4	156.2	-92.8	-173.1	171.8	-146.6	-1.1	105.9
345	P	41.9	Very low	32.9	Very low	133 Å²	133	126.1 Å²	126.1	86%	0.864	80%	0.801	S	S	*	*			cis	-135.7	172.4	41.9	40.6	-24.5	0	0	0	115.9
346	G	29	Very low	32.7	Very low	72 Å²	72	133.1 Å²	133.1	74%	0.742	81%	0.814	S	S	*	*			trans	157.6	115.2	170.8	0	0	0	0	0	112.7
347	T	33.1	Very low	32.7	Very low	156 Å²	156	130.8 Å²	130.8	96%	0.957	81%	0.812	S	S	*	*			trans	-93.5	100.2	-173.2	-54.5	0	0	0	0	112.5
348	A	31.8	Very low	32.9	Very low	103 Å²	103	130.7 Å²	130.7	85%	0.851	81%	0.813	S	S	*	*			trans	-163.9	144.3	155	0	0	0	0	0	109.6
349	A	32	Very low	32.9	Very low	97 Å²	97	133.8 Å²	133.8	80%	0.802	82%	0.819	S	S	*	*			trans	-114.2	142.5	-169.3	0	0	0	0	0	114.8
350	N	28.8	Very low	32.7	Very low	155 Å²	155	130.6 Å²	130.6	83%	0.829	82%	0.816	S	S	*	*			trans	-170.5	162.1	169.4	-106.6	-44.3	0	0	0	109.5
351	C	27.8	Very low	32.7	Very low	104 Å²	104	127.8 Å²	127.8	70%	0.703	81%	0.809	S	S	*	*			cis	-149.8	131.9	-7.1	51	0	0	0	0	112.7
352	V	31.3	Very low	32.8	Very low	117 Å²	117	132.9 Å²	132.9	71%	0.709	81%	0.812	S	S	*	*			trans	28.9	117.7	136.3	-165.8	0	0	0	0	120.8
353	V	30.3	Very low	32.6	Very low	138 Å²	138	131.4 Å²	131.4	84%	0.836	80%	0.801	S	S	*	*				-159.8	115	129.9	172.9	0	0	0	0	105.3
354	S	31.6	Very low	32.3	Very low	97 Å²	97	131.8 Å²	131.8	68%	0.678	80%	0.799	S	S	*	*				74.1	152.3	57.5	-74.3	0	0	0	0	115.9
355	P	50.3	Low	32.1	Very low	114 Å²	114	130.7 Å²	130.7	74%	0.74	79%	0.794	S	S	*	*			cis	-133.8	157.6	8	39.8	-24	0	0	0	117.3
356	R	29.2	Very low	31.5	Very low	239 Å²	239	129.6 Å²	129.6	90%	0.902	79%	0.79	S	S	*	*				-176.8	122.3	122.8	-105.1	-179.9	175.9	-159.7	-2.5	115
357	S	32.3	Very low	31.5	Very low	108 Å²	108	131.2 Å²	131.2	76%	0.755	79%	0.79	S	S	*	*			trans	46.1	107.5	148.9	55.8	0	0	0	0	122.2
358	S	34.6	Very low	31.3	Very low	126 Å²	126	135.3 Å²	135.3	88%	0.881	79%	0.788	S	S	*	*			trans	-160.7	157.2	142.5	-80.6	0	0	0	0	109.4
359	I	30.8	Very low	31.1	Very low	168 Å²	168	135.8 Å²	135.8	86%	0.862	79%	0.785	S	S	*	*			trans	-138.5	130.1	-164.7	-42.6	173.4	0	0	0	112.3
360	S	29.3	Very low	31.3	Very low	107 Å²	107	136.5 Å²	136.5	75%	0.748	78%	0.784	S	S	*	*			trans	-173.9	150.3	158.1	-84.6	0	0	0	0	113.5
361	S	31.2	Very low	31.5	Very low	96 Å²	96	141.4 Å²	141.4	67%	0.671	79%	0.791	S	S	*	*			trans	67.2	163.8	160.9	-47.2	0	0	0	0	117.3
362	H	33	Very low	31.5	Very low	181 Å²	181	139.7 Å²	139.7	84%	0.838	79%	0.791	S	S	*	*			cis	-129.2	-158.2	-4.4	-55.3	-105.1	0	0	0	108.1
363	S	28.4	Very low	31.7	Very low	103 Å²	103	139.4 Å²	139.4	72%	0.72	79%	0.794	S	S	*	*			cis	-166.2	154.8	-5.5	-162	0	0	0	0	109.4
364	S	29.4	Very low	31.7	Very low	107 Å²	107	140 Å²	140	75%	0.748	79%	0.789	S	S	*	*			trans	176.9	116.1	132.5	-85.9	0	0	0	0	117.2
365	R	28.6	Very low	31.7	Very low	223 Å²	223	140 Å²	140	84%	0.842	79%	0.79	S	S	*	*			trans	53.8	103.2	131.9	-54.3	179.8	75.4	173.6	3.5	122.1
366	S	27.9	Very low	30.6	Very low	111 Å²	111	141 Å²	141	78%	0.776	79%	0.794	S	S	*	*				59	126	120.4	-49.4	0	0	0	0	122.7
367	S	30.6	Very low	30.6	Very low	106 Å²	106	140 Å²	140	74%	0.741	79%	0.792	S	S	*	*				-175.5	125.3	121.5	-88.4	0	0	0	0	117.7
368	R	27.4	Very low	31.5	Very low	241 Å²	241	139.9 Å²	139.9	91%	0.909	79%	0.788	S	S	*	*			trans	62.2	154.4	130.5	-54.4	177.5	81.3	171.9	5.7	121.9
369	S	28.9	Very low	31.2	Very low	114 Å²	114	140.3 Å²	140.3	80%	0.797	78%	0.781	S	S	*	*			trans	-109.8	175.1	-172.5	-35.4	0	0	0	0	114
370	S	34.8	Very low	31.2	Very low	112 Å²	112	138.5 Å²	138.5	78%	0.783	77%	0.772	S	S	*	*			trans	110.2	148.9	144.2	-57.1	0	0	0	0	119.8
371	R	32.8	Very low	31.1	Very low	257 Å²	257	141.5 Å²	141.5	97%	0.97	78%	0.775	S	S	*	*			trans	88.9	126.2	177.1	-56.6	178.7	174.9	-161.4	-2.8	115.9
372	G	28.6	Very low	31.1	Very low	68 Å²	68	144.5 Å²	144.5	70%	0.701	78%	0.782	S	S	*	*			cis	143.1	138.3	-22.4	0	0	0	0	0	116.4
373	S	36.5	Very low	31.4	Very low	111 Å²	111	141.9 Å²	141.9	78%	0.776	78%	0.781	S	S	*	*			trans	72.7	148.3	159.2	-49.7	0	0	0	0	117.4
374	M	29.1	Very low	31.4	Very low	150 Å²	150	142.3 Å²	142.3	74%	0.739	78%	0.784	S	S	*	*			cis	-134.2	150.2	-0.7	-62.6	-83.5	40.6	0	0	109.9
375	S	31	Very low	32.4	Very low	99 Å²	99	142.6 Å²	142.6	69%	0.692	78%	0.784	S	S	*	*				40.6	133.8	98.3	-44.9	0	0	0	0	115.5
376	T	28.8	Very low	32.4	Very low	135 Å²	135	142.8 Å²	142.8	83%	0.828	78%	0.784	S	S	*	*				-155.3	158.3	52.2	46.6	0	0	0	0	115.7
377	Y	28.8	Very low	32.4	Very low	217 Å²	217	142.1 Å²	142.1	85%	0.851	78%	0.78	S	S	*	*			trans	-81.4	174.7	157.8	-100.1	-106.5	0	0	0	110.3
378	P	50.6	Low	32.5	Very low	105 Å²	105	142.1 Å²	142.1	68%	0.682	78%	0.78	S	S	*	*			cis	-132.9	-158.3	23.6	41.3	-18.5	0	0	0	113.7
379	D	28.8	Very low	32.7	Very low	135 Å²	135	138.4 Å²	138.4	72%	0.722	78%	0.775	S	S	*	*			cis	-157.2	-168.2	12.6	-141.5	-23.1	0	0	0	116
380	L	29.9	Very low	32.8	Very low	131 Å²	131	140.8 Å²	140.8	69%	0.686	78%	0.778	S	S	*	*			trans	-57.6	158.2	-174.7	-79.7	157.2	0	0	0	122.9
381	Q	27.5	Very low	32.3	Very low	170 Å²	170	139 Å²	139	79%	0.794	78%	0.777	S	S	*	*			trans	90.2	130.1	136.5	-90	167.5	-94.5	0	0	124.3
382	L	30.8	Very low	32.2	Very low	159 Å²	159	132.9 Å²	132.9	83%	0.832	77%	0.773	S	S	*	*			trans	-78.5	156.7	159.4	-61.6	166.5	0	0	0	110.2
383	P	39.6	Very low	32.2	Very low	126 Å²	126	133.3 Å²	133.3	82%	0.818	78%	0.778	S	S	*	*				-148	162.7	95	39.8	-24.4	0	0	0	116.5
384	S	29.8	Very low	32	Very low	111 Å²	111	135.6 Å²	135.6	78%	0.776	78%	0.781	S	S	*	*			trans	-93.7	169.8	156.7	-60.3	0	0	0	0	109.1
385	P	50.1	Low	32.8	Very low	114 Å²	114	134 Å²	134	74%	0.74	78%	0.782	S	S	*	*			cis	-147	-161.3	19.6	43.1	-21.2	0	0	0	116.5
386	R	28.3	Very low	32.7	Very low	226 Å²	226	137.5 Å²	137.5	85%	0.853	79%	0.787	S	S	*	*			trans	84.3	113.4	153.3	-82.9	-179.6	171.5	172	-2.6	121.8
387	S	28.1	Very low	32.7	Very low	98 Å²	98	138.3 Å²	138.3	69%	0.685	79%	0.786	S	S	*	*				73.7	103.5	118.4	-58	0	0	0	0	123
388	S	33.3	Very low	32.8	Very low	106 Å²	106	133.2 Å²	133.2	74%	0.741	78%	0.778	S	S	*	*				86.3	148.2	126.1	-53.9	0	0	0	0	122
389	M	30.2	Very low	31.8	Very low	162 Å²	162	135.1 Å²	135.1	80%	0.798	78%	0.781	S	S	*	*			trans	98.2	108.7	159.4	-55.2	-53.5	-171.5	0	0	120.7
390	L	30.8	Very low	31.8	Very low	164 Å²	164	135.9 Å²	135.9	86%	0.859	79%	0.785	S	S	*	*			trans	53.7	114.5	130.9	-56.6	174.4	0	0	0	122
391	G	25.8	Very low	31.8	Very low	74 Å²	74	137.4 Å²	137.4	76%	0.763	79%	0.788	S	S	*	*			trans	81.6	159.7	153.2	0	0	0	0	0	116.6
392	S	29.9	Very low	31.9	Very low	129 Å²	129	135.7 Å²	135.7	90%	0.902	78%	0.781	S	S	*	*			cis	-164.1	154.4	-9.6	-76.8	0	0	0	0	109.5
393	G	28.3	Very low	31.8	Very low	78 Å²	78	138.8 Å²	138.8	80%	0.804	78%	0.783	S	S	*	*			trans	102.3	123.5	156.1	0	0	0	0	0	119.1
394	L	33	Very low	31.3	Very low	159 Å²	159	136.3 Å²	136.3	83%	0.832	78%	0.78	S	S	*	*			trans	-94.3	166.2	147.2	-70.1	170.7	0	0	0	107.4
395	P	45.3	Very low	31.3	Very low	117 Å²	117	138.5 Å²	138.5	76%	0.76	78%	0.783	S	S	*	*			cis	-113.1	159.2	39.7	6.9	18.8	0	0	0	113.8
396	E	30	Very low	30.5	Very low	172 Å²	172	138.1 Å²	138.1	80%	0.804	78%	0.783	S	S	*	*				76.6	116.4	57.6	-66.9	-152.1	107.6	0	0	116.9
397	D	27.6	Very low	30.5	Very low	152 Å²	152	133.3 Å²	133.3	81%	0.813	78%	0.784	S	S	*	*			trans	175.8	143.1	151.2	-108.2	-29.7	0	0	0	108.8
398	T	31.1	Very low	30.5	Very low	109 Å²	109	132.4 Å²	132.4	67%	0.669	79%	0.79	S	S	*	*			cis	-160.2	175.7	-22.3	-10.3	0	0	0	0	109.8
399	L	29.6	Very low	30.3	Very low	145 Å²	145	132.2 Å²	132.2	76%	0.759	80%	0.795	S	S	*	*			trans	103.1	107.2	155.2	-53.6	-173.2	0	0	0	121.3
400	L	29.3	Very low	30.3	Very low	152 Å²	152	133.4 Å²	133.4	80%	0.796	80%	0.799	S	S	*	*			trans	61.4	126.1	131.7	-55.9	173.6	0	0	0	119.8
401	Q	29.8	Very low	30.1	Very low	162 Å²	162	133.5 Å²	133.5	76%	0.757	80%	0.798	S	S	*	*			cis	74.6	134.8	29.2	-148.3	132.9	-10.8	0	0	112.8
402	E	30.1	Very low	30.2	Very low	135 Å²	135	141.5 Å²	141.5	63%	0.631	81%	0.805	S	S	*	*			cis	-156.1	168	16.6	-159.3	157.2	-118.4	0	0	112.6
403	Y	28.7	Very low	30	Very low	223 Å²	223	140.9 Å²	140.9	88%	0.875	80%	0.796	S	S	*	*				167.1	127.2	125.6	-96.9	-63.2	0	0	0	116
404	G	28.9	Very low	30	Very low	74 Å²	74	145.8 Å²	145.8	76%	0.763	80%	0.798	S	S	*	*				94.9	102.7	126.7	0	0	0	0	0	121.2
405	D	29.5	Very low	29.8	Very low	158 Å²	158	145.5 Å²	145.5	85%	0.845	80%	0.797	S	S	*	*			trans	-73.2	158.5	169.3	-75.1	-76.3	0	0	0	115.8
406	S	32.7	Very low	29.1	Very low	105 Å²	105	148.7 Å²	148.7	73%	0.734	80%	0.802	S	S	*	*				169.3	121.9	110.3	-75	0	0	0	0	116.1
407	S	29.3	Very low	28.7	Very low	126 Å²	126	146.8 Å²	146.8	88%	0.881	80%	0.802	S	S	*	*			trans	58.7	145.6	150.8	65.4	0	0	0	0	121.2
408	G	26.9	Very low	28.7	Very low	79 Å²	79	145.6 Å²	145.6	81%	0.814	80%	0.799	S	S	*	*			cis	152.7	125.9	-11.1	0	0	0	0	0	114
409	A	29.2	Very low	28.5	Very low	102 Å²	102	144.7 Å²	144.7	84%	0.843	80%	0.798	S	S	*	*			trans	-168.9	145.7	162	0	0	0	0	0	111.7
410	Q	30.5	Very low	28.5	Very low	186 Å²	186	145.8 Å²	145.8	87%	0.869	80%	0.799	S	S	*	*			trans	-143.2	155.8	170.6	-75.2	-164.6	5.7	0	0	111.5
411	I	26.8	Very low	28.9	Very low	166 Å²	166	144.4 Å²	144.4	85%	0.851	80%	0.799	S	S	*	*			trans	-139.4	116.9	157.5	-56.9	179.5	0	0	0	109.4
412	R	27.7	Very low	28.6	Very low	242 Å²	242	143.8 Å²	143.8	91%	0.913	80%	0.796	S	S	*	*			trans	-154.1	130.5	152.9	-171.4	170.3	-177.6	158.8	1.4	110.4
413	T	24.9	Very low	28.8	Very low	116 Å²	116	142.8 Å²	142.8	71%	0.712	80%	0.802	S	S	*	*			trans	-93.6	145.4	-177.3	-33.5	0	0	0	0	111.8
414	H	30.1	Very low	28.8	Very low	181 Å²	181	139 Å²	139	84%	0.838	79%	0.792	S	S	*	*			trans	-147.7	151.9	159	-156.3	-86.3	0	0	0	110
415	L	27.7	Very low	28.6	Very low	154 Å²	154	142.8 Å²	142.8	81%	0.806	79%	0.793	S	S	*	*			trans	-92.6	172.3	174.7	-101.7	70.4	0	0	0	112.1
416	Q	29.8	Very low	28.5	Very low	184 Å²	184	139.8 Å²	139.8	86%	0.86	79%	0.791	S	S	*	*			trans	-139.4	151.5	-152.4	-179.2	-174.5	20.4	0	0	112.2
417	T	22.9	Very low	28.2	Very low	131 Å²	131	144.2 Å²	144.2	80%	0.804	80%	0.8	S	S	*	*			trans	-145.8	112.3	167.3	45.5	0	0	0	0	112.3
418	V	27.2	Very low	28.2	Very low	127 Å²	127	143.2 Å²	143.2	77%	0.77	80%	0.8	S	S	*	*			trans	24.5	108.2	139.8	-167.8	0	0	0	0	116.4
419	S	27.1	Very low	28.2	Very low	90 Å²	90	143.4 Å²	143.4	63%	0.629	80%	0.802	S	S	*	*				68.9	146.1	73.8	-67.9	0	0	0	0	114.3
420	E	29.8	Very low	28.1	Very low	168 Å²	168	142.4 Å²	142.4	79%	0.785	80%	0.801	S	S	*	*			cis	-169.5	-173.4	-3.2	-110.3	161.8	69.4	0	0	107.6
421	P	36.8	Very low	28	Very low	123 Å²	123	139.8 Å²	139.8	80%	0.799	80%	0.798	S	S	*	*			cis	-131.4	-164.5	2	39.7	-19	0	0	0	115.3
422	Q	24.9	Very low	28.2	Very low	150 Å²	150	137.7 Å²	137.7	70%	0.701	79%	0.793	S	S	*	*			trans	-111.9	167.1	-173.9	-149.7	-166.5	-28	0	0	113.3
423	P	33.3	Very low	28.3	Very low	114 Å²	114	132.5 Å²	132.5	74%	0.74	78%	0.783	S	S	*	*				-135.8	149.2	103.6	18.2	3.1	0	0	0	112.6
424	Q	28.1	Very low	28.5	Very low	144 Å²	144	133.6 Å²	133.6	67%	0.673	78%	0.783	S	S	*	*				69.7	133.5	57.3	-64.9	-166.7	2.3	0	0	112.6
425	L	25.3	Very low	28.5	Very low	152 Å²	152	130.4 Å²	130.4	80%	0.796	78%	0.781	S	S	*	*			cis	-158	-179	4.9	-152.8	74.3	0	0	0	111.6
426	A	28.6	Very low	28.6	Very low	96 Å²	96	128.3 Å²	128.3	79%	0.793	79%	0.786	S	S	*	*			trans	102.5	147.3	146.5	0	0	0	0	0	119.7
427	Q	26.5	Very low	28.6	Very low	197 Å²	197	123.4 Å²	123.4	92%	0.921	79%	0.785	S	S	*	*			trans	-119	148.8	178.6	-56.9	165.7	-7.1	0	0	108.8
428	A	28.4	Very low	29.1	Very low	106 Å²	106	123 Å²	123	88%	0.876	79%	0.787	S	S	*	*			trans	-167.3	151.1	147.6	0	0	0	0	0	109.8
429	G	25.9	Very low	29.8	Very low	83 Å²	83	122.7 Å²	122.7	86%	0.856	79%	0.788	S	S	*	*			trans	-103.8	169.9	170.1	0	0	0	0	0	112.2
430	G	28.6	Very low	30	Very low	80 Å²	80	123.1 Å²	123.1	83%	0.825	79%	0.791	S	S	*	*			trans	-176.6	152	176.1	0	0	0	0	0	111.3
431	T	28.6	Very low	30.1	Very low	132 Å²	132	119.9 Å²	119.9	81%	0.81	79%	0.787	S	S	*	*			trans	-115.7	178.6	-177.2	46.1	0	0	0	0	111.9
432	V	31.1	Very low	29.8	Very low	122 Å²	122	122.8 Å²	122.8	74%	0.739	79%	0.787	S	S	*	*			trans	84.6	127.4	162.3	-49	0	0	0	0	121.5
433	D	28.8	Very low	30.2	Very low	132 Å²	132	120.7 Å²	120.7	71%	0.706	79%	0.789	S	S	*	*			trans	70.1	117.7	132.1	-67.3	-27.2	0	0	0	126.1
434	I	29.8	Very low	30.2	Very low	140 Å²	140	126.1 Å²	126.1	72%	0.718	80%	0.796	S	S	*	*				74.5	102.4	120.6	-62.2	172.6	0	0	0	120.7
435	S	28.9	Very low	30.5	Very low	113 Å²	113	122.5 Å²	122.5	79%	0.79	80%	0.798	S	S	*	*			trans	80.8	150.9	131.3	-69.7	0	0	0	0	125.1
436	A	29.9	Very low	30.9	Very low	111 Å²	111	122.5 Å²	122.5	92%	0.917	80%	0.804	S	S	*	*			trans	77.9	121.1	155.7	0	0	0	0	0	119.6
437	G	29.2	Very low	31.1	Very low	81 Å²	81	123 Å²	123	84%	0.835	80%	0.801	S	S	*	*			trans	171.5	26.7	176.6	0	0	0	0	0	118.8
438	S	33.9	Very low	31.5	Very low	121 Å²	121	119 Å²	119	85%	0.846	80%	0.795	S	S	*	*			trans	-80.2	169.3	169.8	-57.9	0	0	0	0	111.3
439	P	42.6	Very low	31.7	Very low	122 Å²	122	123.5 Å²	123.5	79%	0.792	80%	0.795	S	S	*	*			cis	-116	-175.4	11.4	43.3	-29.3	0	0	0	112.7
440	S	31.6	Very low	32	Very low	99 Å²	99	125.6 Å²	125.6	69%	0.692	79%	0.791	S	S	*	*			cis	-156.2	130.5	38.7	28	0	0	0	0	111
441	S	32.1	Very low	32.2	Very low	99 Å²	99	126.1 Å²	126.1	69%	0.692	79%	0.788	S	S	*	*				58.8	127.3	82.2	78.2	0	0	0	0	115.5
442	F	30.8	Very low	32.4	Very low	185 Å²	185	125.3 Å²	125.3	81%	0.811	79%	0.788	S	S	*	*			cis	-162.1	156.5	-10.1	-129.7	-76.4	0	0	0	108.6
443	S	33	Very low	32.5	Very low	106 Å²	106	125.1 Å²	125.1	74%	0.741	79%	0.792	S	S	*	*			trans	-71.7	148.8	172.9	-64.2	0	0	0	0	112.9
444	Y	32.6	Very low	32.8	Very low	227 Å²	227	122.5 Å²	122.5	89%	0.89	80%	0.796	S	S	*	*			trans	-133.6	147.1	154.5	-70.8	-77.2	0	0	0	110.1
445	G	34	Very low	33.3	Very low	68 Å²	68	124.5 Å²	124.5	70%	0.701	80%	0.802	S	S	*	*			trans	-162.5	-176	177.3	0	0	0	0	0	111.6
446	V	34.2	Very low	34.2	Very low	153 Å²	153	130 Å²	130	93%	0.927	81%	0.805	S	S	*	*			trans	70.3	135.8	179.6	-173.7	0	0	0	0	114.8
447	S	32.7	Very low	34.6	Very low	106 Å²	106	135.5 Å²	135.5	74%	0.741	80%	0.804	S	S	*	*			trans	-116.5	142	-178.4	-63.3	0	0	0	0	113.2
448	S	34.7	Very low	35.8	Very low	113 Å²	113	141.2 Å²	141.2	79%	0.79	81%	0.806	S	S	*	*			trans	72.4	109.3	144.2	-56.6	0	0	0	0	121.2
449	K	33.9	Very low	36	Very low	200 Å²	200	143.4 Å²	143.4	87%	0.87	81%	0.807	S	S	*	*			trans	-176.4	139.2	145	-98	146	-172.6	176.2	0	110
450	T	31.8	Very low	36	Very low	127 Å²	127	143.4 Å²	143.4	78%	0.779	81%	0.808	S	S	*	*			cis	-162.7	154.7	-16.5	-3.5	0	0	0	0	111.4
451	A	31.1	Very low	36.4	Very low	92 Å²	92	148.4 Å²	148.4	76%	0.76	81%	0.813	S	S	*	*			trans	67.9	122.2	147.2	0	0	0	0	0	123.2
452	S	33.7	Very low	37.1	Very low	115 Å²	115	151.1 Å²	151.1	80%	0.804	81%	0.814	S	S	*	*				90	142.5	129.9	-152.3	0	0	0	0	122.5
453	S	33.9	Very low	37.6	Very low	118 Å²	118	148 Å²	148	83%	0.825	81%	0.81	S	S	*	*			trans	62.4	135.4	171	70.6	0	0	0	0	118.2
454	G	34.7	Very low	38.5	Very low	76 Å²	76	149.4 Å²	149.4	78%	0.784	81%	0.814	S	S	*	*			cis	142.3	103.1	-16.6	0	0	0	0	0	114.5
455	Q	40.8	Very low	39.3	Very low	183 Å²	183	143.9 Å²	143.9	86%	0.855	81%	0.807	S	S	*	*			trans	-142.2	163.2	165.6	-87.3	-119.4	-19.3	0	0	111.3
456	R	47.1	Very low	40.1	Very low	227 Å²	227	146.4 Å²	146.4	86%	0.857	81%	0.813	S	S	*	*			trans	-101.7	125.1	-168.2	-69	-85.6	-173.4	81.2	-1.6	111.6
457	Y	38.8	Very low	40.9	Very low	227 Å²	227	150.1 Å²	150.1	89%	0.89	81%	0.811	S	S	*	*			trans	-127.7	146	151	-73.3	-78	0	0	0	109.8
458	K	54.3	Low	42	Very low	201 Å²	201	153.8 Å²	153.8	87%	0.874	82%	0.816	S	S	*	*			trans	-142.9	127.9	-170.2	-179.6	-168.3	-176	-171.2	0	107.5
459	L	36.7	Very low	43.3	Very low	167 Å²	167	155.9 Å²	155.9	87%	0.874	82%	0.819	S	S	*	*			trans	158.4	154.3	163.6	-92.1	161.8	0	0	0	108.3
460	P	43.4	Very low	44.9	Very low	123 Å²	123	148.7 Å²	148.7	80%	0.799	80%	0.801	S	S	*	*			cis	-113.4	-161.1	-34.1	36.1	-21	0	0	0	111
461	Y	41	Very low	46.8	Very low	204 Å²	204	145.7 Å²	145.7	80%	0.8	78%	0.784	S	S	*	*			trans	-104.1	175.1	-176.6	173.6	-123.9	0	0	0	111.7
462	Q	45.8	Very low	49.3	Very low	155 Å²	155	143.9 Å²	143.9	72%	0.724	77%	0.765	S	S	*	*			trans	72.1	140.2	176.8	-80.7	162.4	-2.2	0	0	116.4
463	V	40.7	Very low	51.8	Low	120 Å²	120	145.2 Å²	145.2	73%	0.727	76%	0.759	S	S	*	*			cis	-133.4	144.6	-3.7	-174	0	0	0	0	109.3	P465	V463-P465 VanDerWaalsContact O-CD 3.24Å; V463-P465 WeakPolarHBondContact O-CD 3.4Å
464	T	51.8	Low	54.2	Low	135 Å²	135	142.4 Å²	142.4	83%	0.828	74%	0.743	S	S	*	*			trans	-85.2	113.7	163.5	28.2	0	0	0	0	111.8
465	P	49.6	Very low	56.7	Low	112 Å²	112	143.9 Å²	143.9	73%	0.727	73%	0.729	S	S	*	*			trans	-73.9	147.7	147.5	33.1	-31.9	0	0	0	109.1	V463 R467	V463-P465 VanDerWaalsContact O-CD 3.24Å; V463-P465 WeakPolarHBondContact O-CD 3.4Å; P465-R467 PolarHBondContact O-N 2.83Å
466	S	50.7	Low	59	Low	121 Å²	121	140.9 Å²	140.9	85%	0.846	71%	0.714	S	S	*	*			trans	-60.1	125.4	177.3	-59.7	0	0	0	0	110.6	E468	S466-E468 PolarHBondContact O-N 3.12Å; S466-E468 VanDerWaalsContact O-N 3.12Å
467	R	52.3	Low	60.9	Low	231 Å²	231	138 Å²	138	87%	0.872	70%	0.703	S	S	*	*			trans	-68.1	110.9	166.6	-129.2	-175.8	-178	-143.1	-0.7	107.7	P465 N469	P465-R467 PolarHBondContact O-N 2.83Å; R467-N469 PolarHBondContact O-N 3.48Å; R467-N469 VanDerWaalsContact O-N 3.14Å; R467-N469 PolarHBondContact O-OD1 3.46Å
468	E	56.2	Low	63.3	Low	182 Å²	182	132.3 Å²	132.3	85%	0.85	69%	0.687	S	S	*	*			trans	-62.1	110.9	166.6	55.8	-162.3	117.2	0	0	108.5	S466 G470	S466-E468 PolarHBondContact O-N 3.12Å; S466-E468 VanDerWaalsContact O-N 3.12Å; E468-G470 PolarHBondContact O-N 3.07Å
469	N	61.3	Low	65	Low	158 Å²	158	128 Å²	128	85%	0.845	67%	0.67	S	S	*	*			trans	-77	47.5	-178.2	-75.6	-9.1	0	0	0	111.7	R467	R467-N469 PolarHBondContact O-N 3.48Å; R467-N469 VanDerWaalsContact O-N 3.14Å; R467-N469 PolarHBondContact O-OD1 3.46Å
470	G	67.5	Low	67.5	Low	49 Å²	49	122.7 Å²	122.7	51%	0.505	65%	0.65	S	S	.	*	P	Polyproline II helix	trans	-82.9	146.5	166.5	0	0	0	0	0	110.5	E468 S472	E468-G470 PolarHBondContact O-N 3.07Å; G470-S472 PolarHBondContact O-N 3.24Å
471	P	71.1	Confident	69.8	Low	63 Å²	63	121.3 Å²	121.3	41%	0.409	64%	0.636	S	S	.	*	P	Polyproline II helix	trans	-59.7	137.2	176.2	20.8	-28.8	0	0	0	110.6	E475 K476	P471-E475 HydrophobicContact CB-CB 3.83Å; P471-K476 HydrophobicContact CB-CG 4.21Å; P471-K476 HydrophobicContact CG-CG 4.06Å; P471-K476 WeakPolarHBondContact O-CE 3.44Å
472	S	84.3	Confident	72.2	Confident	54 Å²	54	115 Å²	115	38%	0.378	62%	0.619	S	S	.	*	P	Polyproline II helix	trans	-61.8	165.8	-179.1	67.5	0	0	0	0	112.1	G470 A474 E475 K476	G470-S472 PolarHBondContact O-N 3.24Å; S472-A474 PolarHBondContact O-N 3.31Å; S472-A474 VanDerWaalsContact O-N 3.14Å; S472-A474 PolarHBondContact OG-N 2.94Å; S472-E475 WeakPolarHBondContact CA-OE2 3.34Å; S472-E475 WeakPolarHBondContact CB-OE2 3.39Å; S472-E475 PolarHBondContact N-OE2 2.99Å; S472-E475 PolarHBondContact O-N 2.8Å; S472-E475 VanDerWaalsContact O-N 3.13Å; S472-E475 PolarHBondContact OG-N 2.82Å; S472-E475 PolarHBondContact OG-OE2 2.85Å; S472-K476 PolarHBondContact O-N 3.05Å
473	Q	85.6	Confident	74.3	Confident	144 Å²	144	112.5 Å²	112.5	67%	0.673	61%	0.61	S	S	*	*	H	α-helix	trans	-61.1	-22.2	175.3	-162.9	-178.2	44	0	0	112.7	R477	Q473-R477 WeakPolarHBondContact O-CD 3.44Å; Q473-R477 VanDerWaalsContact O-CG 3.24Å; Q473-R477 WeakPolarHBondContact O-CG 3.45Å; Q473-R477 PolarHBondContact O-N 3.37Å
474	A	84.1	Confident	76.7	Confident	59 Å²	59	113 Å²	113	49%	0.488	60%	0.604	S	S	.	*	H	α-helix	trans	-75.6	-49.7	171.7	0	0	0	0	0	111.3	S472 K476 R477 L478	S472-A474 PolarHBondContact O-N 3.31Å; S472-A474 VanDerWaalsContact O-N 3.14Å; S472-A474 PolarHBondContact OG-N 2.94Å; A474-K476 PolarHBondContact O-N 3.33Å; A474-R477 PolarHBondContact O-N 3.43Å; A474-R477 VanDerWaalsContact O-N 3.07Å; A474-L478 WeakPolarHBondContact O-CG 3.39Å; A474-L478 PolarHBondContact O-N 3.27Å
475	E	86.8	Confident	78.4	Confident	106 Å²	106	110.9 Å²	110.9	50%	0.495	59%	0.587	S	S	.	*	H	α-helix	trans	-60.2	-44	179.2	-72.1	154	132.3	0	0	111.7	P471 S472 R477 L478 E479	P471-E475 HydrophobicContact CB-CB 3.83Å; S472-E475 WeakPolarHBondContact CA-OE2 3.34Å; S472-E475 WeakPolarHBondContact CB-OE2 3.39Å; S472-E475 PolarHBondContact N-OE2 2.99Å; S472-E475 PolarHBondContact O-N 2.8Å; S472-E475 VanDerWaalsContact O-N 3.13Å; S472-E475 PolarHBondContact OG-N 2.82Å; S472-E475 PolarHBondContact OG-OE2 2.85Å; E475-R477 VanDerWaalsContact C-N 3.26Å; E475-R477 PolarHBondContact O-N 3.31Å; E475-L478 PolarHBondContact O-N 2.91Å; E475-L478 VanDerWaalsContact O-N 3.16Å; E475-E479 WeakPolarHBondContact O-CB 3.34Å; E475-E479 PolarHBondContact O-N 3Å
476	K	88.9	Confident	80.1	Confident	120 Å²	120	111.4 Å²	111.4	52%	0.522	58%	0.58	S	S	.	*	H	α-helix	trans	-62	-29.3	174.7	-70.1	177.5	176.3	172.7	0	113.9	P471 S472 A474 A480	P471-K476 HydrophobicContact CB-CG 4.21Å; P471-K476 HydrophobicContact CG-CG 4.06Å; P471-K476 WeakPolarHBondContact O-CE 3.44Å; S472-K476 PolarHBondContact O-N 3.05Å; A474-K476 PolarHBondContact O-N 3.33Å; K476-A480 WeakPolarHBondContact O-CB 3.33Å; K476-A480 PolarHBondContact O-N 3.13Å
477	R	88.9	Confident	81.7	Confident	166 Å²	166	112.3 Å²	112.3	63%	0.626	57%	0.569	S	S	*	*	H	α-helix	trans	-79.1	-35.8	174.9	-77.5	174.2	177.6	172.2	1	112	Q473 A474 E475 L481	Q473-R477 WeakPolarHBondContact O-CD 3.44Å; Q473-R477 VanDerWaalsContact O-CG 3.24Å; Q473-R477 WeakPolarHBondContact O-CG 3.45Å; Q473-R477 PolarHBondContact O-N 3.37Å; A474-R477 PolarHBondContact O-N 3.43Å; A474-R477 VanDerWaalsContact O-N 3.07Å; E475-R477 VanDerWaalsContact C-N 3.26Å; E475-R477 PolarHBondContact O-N 3.31Å; R477-L481 WeakPolarHBondContact O-CB 3.28Å; R477-L481 PolarHBondContact O-N 3.37Å
478	L	88.8	Confident	83.2	Confident	109 Å²	109	107.2 Å²	107.2	57%	0.571	56%	0.555	S	S	*	*	H	α-helix	trans	-66.2	-45.5	173.8	-68.9	167.7	0	0	0	110.8	A474 E475 A480 L481 T482	A474-L478 WeakPolarHBondContact O-CG 3.39Å; A474-L478 PolarHBondContact O-N 3.27Å; E475-L478 PolarHBondContact O-N 2.91Å; E475-L478 VanDerWaalsContact O-N 3.16Å; L478-A480 PolarHBondContact O-N 3.28Å; L478-L481 PolarHBondContact O-N 2.77Å; L478-T482 PolarHBondContact O-N 2.93Å; L478-T482 PolarHBondContact O-OG1 2.91Å; L478-T482 VanDerWaalsContact O-OG1 3.08Å
479	E	90.4	Very high	84.1	Confident	109 Å²	109	104.3 Å²	104.3	51%	0.509	54%	0.544	S	S	.	.	H	α-helix	trans	-59.2	-44.1	175.7	-176.1	175.3	-149.1	0	0	112.2	E475 T482 L483	E475-E479 WeakPolarHBondContact O-CB 3.34Å; E475-E479 PolarHBondContact O-N 3Å; E479-T482 WeakPolarHBondContact CA-OG1 3.42Å; E479-T482 PolarHBondContact O-N 2.85Å; E479-T482 PolarHBondContact O-OG1 3.22Å; E479-L483 HydrophobicContact CG-CD1 4.49Å; E479-L483 WeakPolarHBondContact O-CB 3.24Å; E479-L483 WeakPolarHBondContact O-CG 3.49Å; E479-L483 PolarHBondContact O-N 2.92Å
480	A	89.3	Confident	84.8	Confident	56 Å²	56	101.3 Å²	101.3	46%	0.463	53%	0.525	S	S	.	.	H	α-helix	trans	-63.3	-42.3	173.8	0	0	0	0	0	112.6	K476 L478 L483 E484	K476-A480 WeakPolarHBondContact O-CB 3.33Å; K476-A480 PolarHBondContact O-N 3.13Å; L478-A480 PolarHBondContact O-N 3.28Å; A480-L483 PolarHBondContact O-N 3.21Å; A480-E484 WeakPolarHBondContact O-CB 3.43Å; A480-E484 PolarHBondContact O-N 3.11Å
481	L	90.4	Very high	84.6	Confident	94 Å²	94	103.8 Å²	103.8	49%	0.492	53%	0.525	S	S	.	.	H	α-helix	trans	-66.7	-39.3	177.9	-171.8	72.9	0	0	0	111.9	R477 L478 E484 L485	R477-L481 WeakPolarHBondContact O-CB 3.28Å; R477-L481 PolarHBondContact O-N 3.37Å; L478-L481 PolarHBondContact O-N 2.77Å; L481-E484 PolarHBondContact O-N 3.12Å; L481-L485 HydrophobicContact CG-CD1 4.28Å; L481-L485 WeakPolarHBondContact O-CG 3.22Å; L481-L485 PolarHBondContact O-N 3.39Å
482	T	91.5	Very high	84.3	Confident	73 Å²	73	105.9 Å²	105.9	45%	0.448	53%	0.529	S	S	.	.	H	α-helix	trans	-65.2	-42.4	174.6	44.3	0	0	0	0	111.6	L478 E479 E484 L485 E486	L478-T482 PolarHBondContact O-N 2.93Å; L478-T482 PolarHBondContact O-OG1 2.91Å; L478-T482 VanDerWaalsContact O-OG1 3.08Å; E479-T482 WeakPolarHBondContact CA-OG1 3.42Å; E479-T482 PolarHBondContact O-N 2.85Å; E479-T482 PolarHBondContact O-OG1 3.22Å; T482-E484 VanDerWaalsContact C-N 3.32Å; T482-E484 PolarHBondContact O-N 3.47Å; T482-L485 PolarHBondContact O-N 3.41Å; T482-E486 WeakPolarHBondContact O-CB 3.22Å; T482-E486 VanDerWaalsContact O-CG 3.28Å; T482-E486 WeakPolarHBondContact O-CG 3.46Å; T482-E486 PolarHBondContact O-N 3.2Å
483	L	90.3	Very high	83.2	Confident	101 Å²	101	109.6 Å²	109.6	53%	0.529	54%	0.542	S	S	.	.	H	α-helix	trans	-63.9	-35.5	175	-81	166.3	0	0	0	112.8	E479 A480 K487	E479-L483 HydrophobicContact CG-CD1 4.49Å; E479-L483 WeakPolarHBondContact O-CB 3.24Å; E479-L483 WeakPolarHBondContact O-CG 3.49Å; E479-L483 PolarHBondContact O-N 2.92Å; A480-L483 PolarHBondContact O-N 3.21Å; L483-K487 WeakPolarHBondContact O-CB 3.24Å; L483-K487 PolarHBondContact O-N 2.93Å
484	E	90.8	Very high	81.9	Confident	132 Å²	132	108.6 Å²	108.6	62%	0.617	54%	0.536	S	S	*	.	H	α-helix	trans	-68.5	-43.6	176	-172.3	155.2	-131	0	0	111.7	A480 L481 T482 K487 E488	A480-E484 WeakPolarHBondContact O-CB 3.43Å; A480-E484 PolarHBondContact O-N 3.11Å; L481-E484 PolarHBondContact O-N 3.12Å; T482-E484 VanDerWaalsContact C-N 3.32Å; T482-E484 PolarHBondContact O-N 3.47Å; E484-K487 PolarHBondContact O-N 2.92Å; E484-E488 WeakPolarHBondContact O-CB 3.28Å; E484-E488 PolarHBondContact O-N 3.46Å
485	L	87	Confident	80.9	Confident	89 Å²	89	113.4 Å²	113.4	47%	0.466	55%	0.545	S	S	.	.	H	α-helix	trans	-66.3	-41.8	174.8	-70.9	168.6	0	0	0	112.8	L481 T482 K487 E488 L489	L481-L485 HydrophobicContact CG-CD1 4.28Å; L481-L485 WeakPolarHBondContact O-CG 3.22Å; L481-L485 PolarHBondContact O-N 3.39Å; T482-L485 PolarHBondContact O-N 3.41Å; L485-K487 VanDerWaalsContact C-N 3.34Å; L485-E488 PolarHBondContact O-N 3.46Å; L485-L489 WeakPolarHBondContact O-CB 3.09Å; L485-L489 VanDerWaalsContact O-CG 3.26Å; L485-L489 WeakPolarHBondContact O-CG 3.32Å; L485-L489 PolarHBondContact O-N 3.14Å
486	E	87	Confident	80.2	Confident	123 Å²	123	113.1 Å²	113.1	58%	0.575	54%	0.544	S	S	*	.	H	α-helix	trans	-60.8	-44.5	174.5	-77.4	174.7	176.7	0	0	111.1	T482 L489 E490	T482-E486 WeakPolarHBondContact O-CB 3.22Å; T482-E486 VanDerWaalsContact O-CG 3.28Å; T482-E486 WeakPolarHBondContact O-CG 3.46Å; T482-E486 PolarHBondContact O-N 3.2Å; E486-L489 PolarHBondContact O-N 2.96Å; E486-E490 WeakPolarHBondContact O-CB 3.14Å; E486-E490 PolarHBondContact O-N 2.7Å
487	K	83.4	Confident	79.9	Confident	140 Å²	140	112.3 Å²	112.3	61%	0.609	54%	0.539	S	S	*	.	H	α-helix	trans	-64.9	-40.5	176	-179	-176.6	176.2	-170.6	0	112.3	L483 E484 L485 E490 M491	L483-K487 WeakPolarHBondContact O-CB 3.24Å; L483-K487 PolarHBondContact O-N 2.93Å; E484-K487 PolarHBondContact O-N 2.92Å; L485-K487 VanDerWaalsContact C-N 3.34Å; K487-E490 PolarHBondContact O-N 2.9Å; K487-M491 WeakPolarHBondContact O-CB 3.16Å; K487-M491 WeakPolarHBondContact O-CG 3.45Å; K487-M491 PolarHBondContact O-N 3.26Å
488	E	82.9	Confident	79.6	Confident	124 Å²	124	109 Å²	109	58%	0.579	53%	0.529	S	S	*	.	H	α-helix	trans	-66.3	-43.6	176.3	-175	167.1	-140.6	0	0	111.6	E484 L485 E490 M491 H492	E484-E488 WeakPolarHBondContact O-CB 3.28Å; E484-E488 PolarHBondContact O-N 3.46Å; L485-E488 PolarHBondContact O-N 3.46Å; E488-E490 PolarHBondContact O-N 3.5Å; E488-M491 WeakPolarHBondContact O-CB 3.38Å; E488-M491 PolarHBondContact O-N 2.63Å; E488-H492 PolarHBondContact O-N 3.14Å
489	L	75.6	Confident	79.6	Confident	121 Å²	121	104.7 Å²	104.7	63%	0.634	51%	0.51	S	S	*	.	H	α-helix	trans	-61.9	-41.8	173.5	-72.3	169.5	0	0	0	112	L485 E486 H492 M493	L485-L489 WeakPolarHBondContact O-CB 3.09Å; L485-L489 VanDerWaalsContact O-CG 3.26Å; L485-L489 WeakPolarHBondContact O-CG 3.32Å; L485-L489 PolarHBondContact O-N 3.14Å; E486-L489 PolarHBondContact O-N 2.96Å; L489-H492 PolarHBondContact O-N 2.99Å; L489-M493 PolarHBondContact O-N 2.84Å
490	E	76.4	Confident	79.5	Confident	95 Å²	95	104.1 Å²	104.1	44%	0.444	51%	0.51	S	S	.	.	H	α-helix	trans	-65.3	-40.7	175.8	-157	-154.3	-170.8	0	0	111.6	E486 K487 E488 H492 M493 K494	E486-E490 WeakPolarHBondContact O-CB 3.14Å; E486-E490 PolarHBondContact O-N 2.7Å; K487-E490 PolarHBondContact O-N 2.9Å; E488-E490 PolarHBondContact O-N 3.5Å; E490-H492 VanDerWaalsContact C-N 3.31Å; E490-H492 PolarHBondContact O-N 2.86Å; E490-M493 PolarHBondContact O-N 2.87Å; E490-K494 VanDerWaalsContact CD-CE 3.5Å; E490-K494 HydrophobicContact CG-CD 4.34Å; E490-K494 WeakPolarHBondContact O-CB 3.27Å; E490-K494 VanDerWaalsContact O-CG 3.31Å; E490-K494 WeakPolarHBondContact O-CG 3.12Å; E490-K494 PolarHBondContact O-N 3.19Å; E490-K494 WeakPolarHBondContact OE1-CE 3.22Å; E490-K494 IonicContact OE1-NZ 2.86Å; E490-K494 PolarHBondContact OE1-NZ 3.26Å; E490-K494 IonicContact OE2-NZ 3.51Å; E490-K494 PolarHBondContact OE2-NZ 2.97Å
491	M	63.7	Low	79.6	Confident	101 Å²	101	101.4 Å²	101.4	50%	0.498	49%	0.488	S	S	.	.	H	α-helix	trans	-62	-37.6	172.6	-68.1	-105.1	70.9	0	0	111.7	K487 E488 K495	K487-M491 WeakPolarHBondContact O-CB 3.16Å; K487-M491 WeakPolarHBondContact O-CG 3.45Å; K487-M491 PolarHBondContact O-N 3.26Å; E488-M491 WeakPolarHBondContact O-CB 3.38Å; E488-M491 PolarHBondContact O-N 2.63Å; M491-K495 WeakPolarHBondContact O-CG 3.47Å; M491-K495 PolarHBondContact O-N 3.44Å; M491-K495 VanDerWaalsContact O-N 3.12Å
492	H	64	Low	79.5	Confident	108 Å²	108	101.1 Å²	101.1	50%	0.5	49%	0.49	S	S	.	.	H	α-helix	trans	-70.2	-44.3	176.8	-129.9	-81.5	0	0	0	112	E488 L489 E490 K494 K495	E488-H492 PolarHBondContact O-N 3.14Å; L489-H492 PolarHBondContact O-N 2.99Å; E490-H492 VanDerWaalsContact C-N 3.31Å; E490-H492 PolarHBondContact O-N 2.86Å; H492-K494 VanDerWaalsContact C-N 3.32Å; H492-K494 PolarHBondContact O-N 3.41Å; H492-K495 PolarHBondContact O-N 3.43Å
493	M	61.1	Low	79.2	Confident	132 Å²	132	103.4 Å²	103.4	65%	0.65	49%	0.493	S	S	*	.	H	α-helix	trans	-61.5	-38.7	174.3	-107.1	172.7	50.2	0	0	112.3	L489 E490 K495 E496 Y497	L489-M493 PolarHBondContact O-N 2.84Å; E490-M493 PolarHBondContact O-N 2.87Å; M493-K495 VanDerWaalsContact C-N 3.35Å; M493-E496 PolarHBondContact O-N 2.81Å; M493-Y497 PolarHBondContact O-N 2.9Å
494	K	58.5	Low	79.2	Confident	123 Å²	123	101.2 Å²	101.2	54%	0.535	49%	0.486	S	S	.	.	H	α-helix	trans	-69.3	-26.7	175.6	-76.1	170.7	178.5	167.4	0	113.5	E490 H492 E496	E490-K494 VanDerWaalsContact CD-CE 3.5Å; E490-K494 HydrophobicContact CG-CD 4.34Å; E490-K494 WeakPolarHBondContact O-CB 3.27Å; E490-K494 VanDerWaalsContact O-CG 3.31Å; E490-K494 WeakPolarHBondContact O-CG 3.12Å; E490-K494 PolarHBondContact O-N 3.19Å; E490-K494 WeakPolarHBondContact OE1-CE 3.22Å; E490-K494 IonicContact OE1-NZ 2.86Å; E490-K494 PolarHBondContact OE1-NZ 3.26Å; E490-K494 IonicContact OE2-NZ 3.51Å; E490-K494 PolarHBondContact OE2-NZ 2.97Å; H492-K494 VanDerWaalsContact C-N 3.32Å; H492-K494 PolarHBondContact O-N 3.41Å; K494-E496 VanDerWaalsContact C-N 3.33Å; K494-E496 PolarHBondContact O-N 3.27Å
495	K	62.3	Low	79	Confident	159 Å²	159	97.7 Å²	97.7	69%	0.691	49%	0.485	S	S	*	.	H	α-helix	trans	-71.4	-22.2	176.7	-85.4	176.1	177.9	174.1	0	114.3	M491 H492 M493	M491-K495 WeakPolarHBondContact O-CG 3.47Å; M491-K495 PolarHBondContact O-N 3.44Å; M491-K495 VanDerWaalsContact O-N 3.12Å; H492-K495 PolarHBondContact O-N 3.43Å; M493-K495 VanDerWaalsContact C-N 3.35Å
496	E	73.1	Confident	79.1	Confident	101 Å²	101	100.5 Å²	100.5	47%	0.472	49%	0.493	S	S	.	.	H	α-helix	trans	-114.4	-6.6	-175.4	-63.6	-163.7	169.3	0	0	115.1	M493 K494 F498 Y509 G510	M493-E496 PolarHBondContact O-N 2.81Å; K494-E496 VanDerWaalsContact C-N 3.33Å; K494-E496 PolarHBondContact O-N 3.27Å; E496-F498 WeakPolarHBondContact O-CD2 3.07Å; E496-F498 VanDerWaalsContact O-CE2 3.29Å; E496-F498 WeakPolarHBondContact O-CE2 3.27Å; E496-Y509 CarbonylContact O-C 3.57Å; E496-Y509 VanDerWaalsContact O-CA 3.29Å; E496-Y509 WeakPolarHBondContact O-CA 3.17Å; E496-G510 PolarHBondContact O-N 3.33Å
497	Y	83.1	Confident	79.2	Confident	103 Å²	103	95.6 Å²	95.6	40%	0.404	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	113.9	-178.6	179.5	-109.3	0	0	0	112.6	M493 G499 I500 Y509	M493-Y497 PolarHBondContact O-N 2.9Å; Y497-G499 WeakPolarHBondContact CE2-O 3.27Å; Y497-I500 VanDerWaalsContact OH-CG1 3.25Å; Y497-I500 WeakPolarHBondContact OH-CG1 3.37Å; Y497-Y509 HydrophobicContact CD2-CD1 4.1Å; Y497-Y509 AromaticContact CD2-CE1 3.59Å; Y497-Y509 HydrophobicContact CD2-CE1 3.59Å; Y497-Y509 AromaticContact CD2-CZ 3.9Å; Y497-Y509 HydrophobicContact CE2-CE1 4.44Å; Y497-Y509 HydrophobicContact CG-CE1 4.34Å
498	F	82.8	Confident	79.5	Confident	97 Å²	97	88.9 Å²	88.9	43%	0.425	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-3.4	-178.5	-69.9	-91.3	0	0	0	114.1	E496 V508 G510 A511 A514 L521	E496-F498 WeakPolarHBondContact O-CD2 3.07Å; E496-F498 VanDerWaalsContact O-CE2 3.29Å; E496-F498 WeakPolarHBondContact O-CE2 3.27Å; F498-V508 HydrophobicContact CB-CB 4.48Å; F498-V508 HydrophobicContact CB-CG1 4.37Å; F498-V508 PolarHBondContact N-O 3.15Å; F498-G510 VanDerWaalsContact CE2-C 3.45Å; F498-A511 HydrophobicContact CE1-CB 4.38Å; F498-A511 HydrophobicContact CE2-CB 4.18Å; F498-A511 HydrophobicContact CZ-CB 3.75Å; F498-A514 HydrophobicContact CB-CB 4.32Å; F498-A514 HydrophobicContact CG-CB 4.21Å; F498-L521 HydrophobicContact CB-CD1 4.45Å; F498-L521 HydrophobicContact CB-CD2 4.37Å; F498-L521 VanDerWaalsContact O-CD2 3.24Å; F498-L521 WeakPolarHBondContact O-CD2 3.19Å
499	G	87	Confident	79.7	Confident	17 Å²	17	88.7 Å²	88.7	18%	0.175	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	117.2	-165.1	-178	0	0	0	0	0	113.9	Y497 G507 V508 L521	Y497-G499 WeakPolarHBondContact CE2-O 3.27Å; G499-G507 CarbonylContact O-C 3.55Å; G499-G507 WeakPolarHBondContact O-CA 3.29Å; G499-V508 PolarHBondContact O-N 2.9Å; G499-L521 VanDerWaalsContact C-CD2 3.41Å
500	I	89.4	Confident	80	Confident	97 Å²	97	83.5 Å²	83.5	50%	0.497	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	133.8	-174.8	-53.9	179.6	0	0	0	110.5	Y497 V502 G505	Y497-I500 VanDerWaalsContact OH-CG1 3.25Å; Y497-I500 WeakPolarHBondContact OH-CG1 3.37Å; I500-V502 PolarHBondContact O-N 3.17Å; I500-G505 WeakPolarHBondContact CG2-O 3.48Å
501	C	91.1	Very high	80.1	Confident	0 Å²	0	82.3 Å²	82.3	0%	0	42%	0.423	C	S	.	.			trans	-73.7	117.7	173.3	172.6	0	0	0	0	111.7	K503 C504 G505 K506 V508 L521 H523	C501-K503 PolarHBondContact O-N 3.5Å; C501-K503 VanDerWaalsContact O-N 3.13Å; C501-C504 PolarHBondContact O-N 2.97Å; C501-C504 VanDerWaalsContact O-N 3.13Å; C501-C504 VanDerWaalsContact SG-SG 3.65Å; C501-G505 PolarHBondContact O-N 3.34Å; C501-K506 PolarHBondContact N-O 3.33Å; C501-V508 HydrophobicContact CB-CG2 3.83Å; C501-L521 WeakPolarHBondContact CA-O 3.48Å; C501-H523 WeakPolarHBondContact CB-CE1 3.4Å; C501-H523 WeakPolarHBondContact CB-ND1 3.18Å; C501-H523 PolarHBondContact SG-ND1 3.07Å; C501-H523 VanDerWaalsContact SG-ND1 3.44Å
502	V	87.9	Confident	80.8	Confident	88 Å²	88	81.5 Å²	81.5	53%	0.533	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-28.8	-176.9	178.6	0	0	0	0	113.1	I500 N520 L521 Y522	I500-V502 PolarHBondContact O-N 3.17Å; V502-N520 HydrophobicContact CG2-CB 4.05Å; V502-L521 PolarHBondContact N-O 3.41Å; V502-Y522 HydrophobicContact CB-CE1 3.98Å
503	K	86.1	Confident	81.7	Confident	120 Å²	120	80.9 Å²	80.9	52%	0.522	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-24.8	179.7	-168.4	-176.6	177.8	-166.7	0	114.4	C501 Y522 C526 T528	C501-K503 PolarHBondContact O-N 3.5Å; C501-K503 VanDerWaalsContact O-N 3.13Å; K503-Y522 HydrophobicContact CB-CD1 4.06Å; K503-Y522 HydrophobicContact CB-CE1 4.3Å; K503-C526 HydrophobicContact CB-CB 4.2Å; K503-C526 HydrophobicContact CD-CB 4.01Å; K503-C526 WeakPolarHBondContact CD-O 3.39Å; K503-C526 PolarHBondContact NZ-O 2.83Å; K503-T528 PolarHBondContact NZ-OG1 3.35Å
504	C	89.5	Confident	82.8	Confident	55 Å²	55	75.5 Å²	75.5	37%	0.372	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.7	-0.5	-172.2	74.3	0	0	0	0	115.9	C501 K506 H523	C501-C504 PolarHBondContact O-N 2.97Å; C501-C504 VanDerWaalsContact O-N 3.13Å; C501-C504 VanDerWaalsContact SG-SG 3.65Å; C504-K506 PolarHBondContact O-N 3.11Å; C504-K506 VanDerWaalsContact O-N 3.11Å; C504-H523 PolarHBondContact SG-CE1 3.1Å; C504-H523 PolarHBondContact SG-ND1 3.12Å; C504-H523 VanDerWaalsContact SG-ND1 3.45Å
505	G	86.9	Confident	84.2	Confident	58 Å²	58	70.5 Å²	70.5	60%	0.598	38%	0.382	S	S	*	.			trans	69.4	2	177.1	0	0	0	0	0	115.6	I500 C501	I500-G505 WeakPolarHBondContact CG2-O 3.48Å; C501-G505 PolarHBondContact O-N 3.34Å
506	K	89.3	Confident	85.4	Confident	149 Å²	149	70.2 Å²	70.2	65%	0.648	38%	0.383	S	S	*	.			trans	-95.7	149.5	-178.8	-60.7	-175.6	-177.7	-174.3	0	111.9	C501 C504	C501-K506 PolarHBondContact N-O 3.33Å; C504-K506 PolarHBondContact O-N 3.11Å; C504-K506 VanDerWaalsContact O-N 3.11Å
507	G	88.5	Confident	85.9	Confident	19 Å²	19	65.8 Å²	65.8	20%	0.196	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	144.5	171.3	0	0	0	0	0	112.8	G499 H523	G499-G507 CarbonylContact O-C 3.55Å; G499-G507 WeakPolarHBondContact O-CA 3.29Å; G507-H523 PolarHBondContact O-NE2 3.32Å
508	V	89.3	Confident	85.9	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	116.1	173.3	-179.1	0	0	0	0	107.7	F498 G499 C501 A514 L521	F498-V508 HydrophobicContact CB-CB 4.48Å; F498-V508 HydrophobicContact CB-CG1 4.37Å; F498-V508 PolarHBondContact N-O 3.15Å; G499-V508 PolarHBondContact O-N 2.9Å; C501-V508 HydrophobicContact CB-CG2 3.83Å; V508-A514 HydrophobicContact CG1-CB 3.83Å; V508-L521 HydrophobicContact CB-CD2 3.82Å; V508-L521 HydrophobicContact CG1-CD2 4.48Å; V508-L521 HydrophobicContact CG2-CD2 3.59Å; V508-L521 HydrophobicContact CG2-CG 4.19Å
509	Y	87.3	Confident	85.9	Confident	119 Å²	119	64.3 Å²	64.3	47%	0.467	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	132.3	-179.4	-56.4	-89.1	0	0	0	109.9	E496 Y497	E496-Y509 CarbonylContact O-C 3.57Å; E496-Y509 VanDerWaalsContact O-CA 3.29Å; E496-Y509 WeakPolarHBondContact O-CA 3.17Å; Y497-Y509 HydrophobicContact CD2-CD1 4.1Å; Y497-Y509 AromaticContact CD2-CE1 3.59Å; Y497-Y509 HydrophobicContact CD2-CE1 3.59Å; Y497-Y509 AromaticContact CD2-CZ 3.9Å; Y497-Y509 HydrophobicContact CE2-CE1 4.44Å; Y497-Y509 HydrophobicContact CG-CE1 4.34Å
510	G	82.9	Confident	85.9	Confident	13 Å²	13	66.8 Å²	66.8	13%	0.134	39%	0.39	C	S	.	.	S	Bend	trans	79.2	134.5	-179.2	0	0	0	0	0	114.4	E496 F498 S512 Q513 A514	E496-G510 PolarHBondContact O-N 3.33Å; F498-G510 VanDerWaalsContact CE2-C 3.45Å; G510-S512 PolarHBondContact O-N 3.36Å; G510-S512 VanDerWaalsContact O-N 3.09Å; G510-Q513 PolarHBondContact O-N 3.46Å; G510-A514 PolarHBondContact O-N 3.01Å
511	A	77.5	Confident	85.9	Confident	69 Å²	69	63.4 Å²	63.4	57%	0.57	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-24.3	-179.7	0	0	0	0	0	113.3	F498 Q513	F498-A511 HydrophobicContact CE1-CB 4.38Å; F498-A511 HydrophobicContact CE2-CB 4.18Å; F498-A511 HydrophobicContact CZ-CB 3.75Å; A511-Q513 VanDerWaalsContact C-N 3.29Å; A511-Q513 PolarHBondContact O-N 3.28Å
512	S	78.8	Confident	85.9	Confident	84 Å²	84	65 Å²	65	59%	0.587	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-23.9	176.3	61.6	0	0	0	0	113.7	G510 T524 R537	G510-S512 PolarHBondContact O-N 3.36Å; G510-S512 VanDerWaalsContact O-N 3.09Å; S512-T524 WeakPolarHBondContact O-CG2 3.35Å; S512-R537 PolarHBondContact O-NH2 3.33Å
513	Q	82.2	Confident	86.1	Confident	95 Å²	95	62 Å²	62	44%	0.444	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-14.7	177.7	-58.1	-158.7	29.3	0	0	113.6	G510 A511 H523 T524	G510-Q513 PolarHBondContact O-N 3.46Å; A511-Q513 VanDerWaalsContact C-N 3.29Å; A511-Q513 PolarHBondContact O-N 3.28Å; Q513-H523 CarbonylContact O-C 3.54Å; Q513-H523 VanDerWaalsContact O-CA 3.23Å; Q513-H523 WeakPolarHBondContact O-CA 2.9Å; Q513-T524 PolarHBondContact O-N 2.95Å
514	A	85.8	Confident	86.2	Confident	20 Å²	20	56.7 Å²	56.7	17%	0.165	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	141.1	175.9	0	0	0	0	0	113	F498 V508 G510	F498-A514 HydrophobicContact CB-CB 4.32Å; F498-A514 HydrophobicContact CG-CB 4.21Å; V508-A514 HydrophobicContact CG1-CB 3.83Å; G510-A514 PolarHBondContact O-N 3.01Å
515	C	87.7	Confident	86.1	Confident	17 Å²	17	59 Å²	59	12%	0.115	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	104.1	165.7	-79.9	0	0	0	0	107.6	Y522 T524 F527	C515-Y522 PolarHBondContact N-O 2.89Å; C515-Y522 PolarHBondContact O-N 3.07Å; C515-T524 WeakPolarHBondContact SG-CG2 3.42Å; C515-F527 HydrophobicContact CB-CB 4.26Å
516	Q	87.4	Confident	86.3	Confident	154 Å²	154	57.2 Å²	57.2	72%	0.72	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.7	128.5	169.5	-164	176.6	23	0	0	108.8	N520 L521	Q516-N520 WeakPolarHBondContact CA-O 3.4Å; Q516-L521 HydrophobicContact CB-CD1 4.48Å
517	A	83.6	Confident	86.4	Confident	7 Å²	7	50.5 Å²	50.5	6%	0.058	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	128.9	177.5	0	0	0	0	0	108.8	G519 N520 Y522 F527 F541	A517-G519 VanDerWaalsContact C-N 3.34Å; A517-G519 PolarHBondContact O-N 3.38Å; A517-N520 PolarHBondContact N-O 3.13Å; A517-N520 WeakPolarHBondContact O-CB 3.35Å; A517-N520 PolarHBondContact O-N 3.32Å; A517-N520 VanDerWaalsContact O-O 3.09Å; A517-Y522 HydrophobicContact CB-CD2 4.37Å; A517-Y522 HydrophobicContact CB-CE2 4.3Å; A517-F527 HydrophobicContact CB-CD2 4.24Å; A517-F527 HydrophobicContact CB-CE1 4.35Å; A517-F527 HydrophobicContact CB-CE2 3.48Å; A517-F527 VanDerWaalsContact CB-CE2 3.48Å; A517-F527 HydrophobicContact CB-CZ 3.56Å; A517-F541 HydrophobicContact CB-CE2 4.35Å; A517-F541 HydrophobicContact CB-CZ 3.92Å
518	M	82.4	Confident	86.5	Confident	102 Å²	102	50.5 Å²	50.5	50%	0.502	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.9	44.3	176.9	-48.1	-163.5	69.2	0	0	113.8	N520 F541 N543	M518-N520 PolarHBondContact O-N 2.87Å; M518-N520 PolarHBondContact O-ND2 3.31Å; M518-F541 HydrophobicContact CG-CE2 4.06Å; M518-F541 HydrophobicContact SD-CE2 4.28Å; M518-N543 HydrophobicContact CE-CB 3.61Å; M518-N543 WeakPolarHBondContact CE-ND2 3.42Å; M518-N543 HydrophobicContact SD-CB 3.29Å; M518-N543 WeakPolarHBondContact SD-CB 3.22Å
519	G	82.3	Confident	86.5	Confident	67 Å²	67	50.6 Å²	50.6	69%	0.691	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.3	-19.2	-173.6	0	0	0	0	0	114.9	A517	A517-G519 VanDerWaalsContact C-N 3.34Å; A517-G519 PolarHBondContact O-N 3.38Å
520	N	88.1	Confident	86.5	Confident	70 Å²	70	48.4 Å²	48.4	37%	0.374	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	150	-176.9	-70.9	-83.7	0	0	0	111.8	V502 Q516 A517 M518 Y522	V502-N520 HydrophobicContact CG2-CB 4.05Å; Q516-N520 WeakPolarHBondContact CA-O 3.4Å; A517-N520 PolarHBondContact N-O 3.13Å; A517-N520 WeakPolarHBondContact O-CB 3.35Å; A517-N520 PolarHBondContact O-N 3.32Å; A517-N520 VanDerWaalsContact O-O 3.09Å; M518-N520 PolarHBondContact O-N 2.87Å; M518-N520 PolarHBondContact O-ND2 3.31Å; N520-Y522 HydrophobicContact CB-CE2 3.59Å; N520-Y522 WeakPolarHBondContact CB-OH 3.44Å
521	L	89.6	Confident	86.5	Confident	25 Å²	25	51 Å²	51	13%	0.131	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	137.3	179.5	-164.8	86.2	0	0	0	111.1	F498 G499 C501 V502 V508 Q516	F498-L521 HydrophobicContact CB-CD1 4.45Å; F498-L521 HydrophobicContact CB-CD2 4.37Å; F498-L521 VanDerWaalsContact O-CD2 3.24Å; F498-L521 WeakPolarHBondContact O-CD2 3.19Å; G499-L521 VanDerWaalsContact C-CD2 3.41Å; C501-L521 WeakPolarHBondContact CA-O 3.48Å; V502-L521 PolarHBondContact N-O 3.41Å; V508-L521 HydrophobicContact CB-CD2 3.82Å; V508-L521 HydrophobicContact CG1-CD2 4.48Å; V508-L521 HydrophobicContact CG2-CD2 3.59Å; V508-L521 HydrophobicContact CG2-CG 4.19Å; Q516-L521 HydrophobicContact CB-CD1 4.48Å
522	Y	90.8	Very high	86.8	Confident	35 Å²	35	50.3 Å²	50.3	14%	0.137	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	152.8	177.7	-55.4	-84.6	0	0	0	111.6	V502 K503 C515 A517 N520 F527	V502-Y522 HydrophobicContact CB-CE1 3.98Å; K503-Y522 HydrophobicContact CB-CD1 4.06Å; K503-Y522 HydrophobicContact CB-CE1 4.3Å; C515-Y522 PolarHBondContact N-O 2.89Å; C515-Y522 PolarHBondContact O-N 3.07Å; A517-Y522 HydrophobicContact CB-CD2 4.37Å; A517-Y522 HydrophobicContact CB-CE2 4.3Å; N520-Y522 HydrophobicContact CB-CE2 3.59Å; N520-Y522 WeakPolarHBondContact CB-OH 3.44Å; Y522-F527 AromaticContact CD2-CD2 3.76Å; Y522-F527 HydrophobicContact CD2-CD2 3.76Å; Y522-F527 HydrophobicContact CD2-CE2 4.32Å; Y522-F527 HydrophobicContact CE2-CD2 4.18Å; Y522-F527 HydrophobicContact CE2-CE2 4.39Å; Y522-F527 HydrophobicContact CG-CB 4.42Å; Y522-F527 HydrophobicContact CG-CD2 4.06Å
523	H	91.4	Very high	87.1	Confident	23 Å²	23	48.3 Å²	48.3	11%	0.106	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	151.2	160.2	-55.8	90.7	0	0	0	110.5	C501 C504 G507 Q513 N525 C526 F527	C501-H523 WeakPolarHBondContact CB-CE1 3.4Å; C501-H523 WeakPolarHBondContact CB-ND1 3.18Å; C501-H523 PolarHBondContact SG-ND1 3.07Å; C501-H523 VanDerWaalsContact SG-ND1 3.44Å; C504-H523 PolarHBondContact SG-CE1 3.1Å; C504-H523 PolarHBondContact SG-ND1 3.12Å; C504-H523 VanDerWaalsContact SG-ND1 3.45Å; G507-H523 PolarHBondContact O-NE2 3.32Å; Q513-H523 CarbonylContact O-C 3.54Å; Q513-H523 VanDerWaalsContact O-CA 3.23Å; Q513-H523 WeakPolarHBondContact O-CA 2.9Å; H523-N525 PolarHBondContact O-N 2.83Å; H523-C526 HydrophobicContact CB-CB 3.99Å; H523-C526 WeakPolarHBondContact O-CA 3.13Å; H523-C526 WeakPolarHBondContact O-CB 3.41Å; H523-C526 PolarHBondContact O-N 3.45Å; H523-F527 PolarHBondContact O-N 2.99Å
524	T	88	Confident	87.3	Confident	10 Å²	10	48.5 Å²	48.5	6%	0.061	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-20.4	172.1	56.2	0	0	0	0	114.4	S512 Q513 C515 R535	S512-T524 WeakPolarHBondContact O-CG2 3.35Å; Q513-T524 PolarHBondContact O-N 2.95Å; C515-T524 WeakPolarHBondContact SG-CG2 3.42Å; T524-R535 VanDerWaalsContact O-CZ 3.3Å; T524-R535 PolarHBondContact O-NE 3.3Å; T524-R535 PolarHBondContact O-NH2 3.03Å
525	N	89	Confident	87.5	Confident	102 Å²	102	53.5 Å²	53.5	55%	0.545	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-22.5	173.9	-66.5	-19.6	0	0	0	112.6	H523 R535	H523-N525 PolarHBondContact O-N 2.83Å; N525-R535 PolarHBondContact OD1-NH1 3.08Å; N525-R535 PolarHBondContact OD1-NH2 3.38Å
526	C	89.8	Confident	87.6	Confident	21 Å²	21	52.8 Å²	52.8	14%	0.142	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-33.8	179.5	-73.1	0	0	0	0	112.1	K503 H523 T528	K503-C526 HydrophobicContact CB-CB 4.2Å; K503-C526 HydrophobicContact CD-CB 4.01Å; K503-C526 WeakPolarHBondContact CD-O 3.39Å; K503-C526 PolarHBondContact NZ-O 2.83Å; H523-C526 HydrophobicContact CB-CB 3.99Å; H523-C526 WeakPolarHBondContact O-CA 3.13Å; H523-C526 WeakPolarHBondContact O-CB 3.41Å; H523-C526 PolarHBondContact O-N 3.45Å; C526-T528 PolarHBondContact O-N 3.45Å; C526-T528 PolarHBondContact O-OG1 3.45Å
527	F	91.1	Very high	87.5	Confident	8 Å²	8	52 Å²	52	4%	0.035	29%	0.289	C	S	.	.			trans	-71.1	91.6	-180	-167.3	-123.1	0	0	0	111.6	C515 A517 Y522 H523 R535 L536 F541 V548	C515-F527 HydrophobicContact CB-CB 4.26Å; A517-F527 HydrophobicContact CB-CD2 4.24Å; A517-F527 HydrophobicContact CB-CE1 4.35Å; A517-F527 HydrophobicContact CB-CE2 3.48Å; A517-F527 VanDerWaalsContact CB-CE2 3.48Å; A517-F527 HydrophobicContact CB-CZ 3.56Å; Y522-F527 AromaticContact CD2-CD2 3.76Å; Y522-F527 HydrophobicContact CD2-CD2 3.76Å; Y522-F527 HydrophobicContact CD2-CE2 4.32Å; Y522-F527 HydrophobicContact CE2-CD2 4.18Å; Y522-F527 HydrophobicContact CE2-CE2 4.39Å; Y522-F527 HydrophobicContact CG-CB 4.42Å; Y522-F527 HydrophobicContact CG-CD2 4.06Å; H523-F527 PolarHBondContact O-N 2.99Å; F527-R535 WeakPolarHBondContact O-CA 3.21Å; F527-L536 HydrophobicContact CD1-CB 3.56Å; F527-L536 HydrophobicContact CE1-CB 3.38Å; F527-L536 HydrophobicContact CE1-CD1 4.42Å; F527-L536 HydrophobicContact CE2-CD1 4.42Å; F527-L536 HydrophobicContact CG-CB 4.3Å; F527-L536 HydrophobicContact CZ-CB 4Å; F527-L536 HydrophobicContact CZ-CD1 4.21Å; F527-L536 PolarHBondContact O-N 2.84Å; F527-F541 AromaticContact CE1-CD1 3.96Å; F527-F541 HydrophobicContact CE1-CD1 3.96Å; F527-F541 HydrophobicContact CE1-CE1 4.03Å; F527-F541 HydrophobicContact CE1-CG 4.41Å; F527-F541 AromaticContact CZ-CD1 3.74Å; F527-F541 HydrophobicContact CZ-CD1 3.74Å; F527-F541 AromaticContact CZ-CD2 3.93Å; F527-F541 HydrophobicContact CZ-CD2 3.93Å; F527-F541 AromaticContact CZ-CE1 3.72Å; F527-F541 HydrophobicContact CZ-CE1 3.72Å; F527-F541 AromaticContact CZ-CE2 3.91Å; F527-F541 HydrophobicContact CZ-CE2 3.91Å; F527-F541 AromaticContact CZ-CG 3.86Å; F527-F541 HydrophobicContact CZ-CG 3.86Å; F527-F541 AromaticContact CZ-CZ 3.81Å; F527-F541 HydrophobicContact CZ-CZ 3.81Å; F527-V548 HydrophobicContact CE2-CG1 4.33Å; F527-V548 HydrophobicContact CE2-CG2 4.42Å
528	T	91.7	Very high	87.5	Confident	19 Å²	19	55.8 Å²	55.8	12%	0.117	33%	0.329	C	S	.	.	B	Isolated β-bridge	trans	-138.9	150.3	-171.7	61.4	0	0	0	0	111.3	K503 C526 G533 R534 R535 V548	K503-T528 PolarHBondContact NZ-OG1 3.35Å; C526-T528 PolarHBondContact O-N 3.45Å; C526-T528 PolarHBondContact O-OG1 3.45Å; T528-G533 WeakPolarHBondContact CB-O 3.22Å; T528-G533 WeakPolarHBondContact CG2-O 3.17Å; T528-R534 CarbonylContact C-O 3.58Å; T528-R534 WeakPolarHBondContact CA-O 3.44Å; T528-R535 HydrophobicContact CG2-CG 4.01Å; T528-V548 WeakPolarHBondContact O-CG2 3.46Å
529	C	89.9	Confident	87.5	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.014	33%	0.33	C	S	.	.			trans	-55	139.3	169.4	179.5	0	0	0	0	111.9	S531 C532 G533 R534 L536 V548 C550 D553	C529-S531 VanDerWaalsContact C-N 3.34Å; C529-S531 PolarHBondContact SG-N 3.06Å; C529-C532 VanDerWaalsContact CB-SG 3.54Å; C529-C532 VanDerWaalsContact SG-SG 3.7Å; C529-G533 VanDerWaalsContact O-CA 3.26Å; C529-G533 WeakPolarHBondContact O-CA 3.11Å; C529-G533 PolarHBondContact O-N 3.45Å; C529-G533 VanDerWaalsContact O-N 3.17Å; C529-R534 PolarHBondContact N-O 3.12Å; C529-L536 HydrophobicContact CB-CD2 4.21Å; C529-V548 CarbonylContact C-O 3.56Å; C529-V548 WeakPolarHBondContact CA-O 3.31Å; C529-C550 HydrophobicContact CB-CB 4.46Å; C529-D553 PolarHBondContact SG-OD2 2.7Å
530	C	85.6	Confident	87.6	Confident	74 Å²	74	55.8 Å²	55.8	50%	0.5	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-22.9	174.6	-69	0	0	0	0	114.4	K547 V548 Y549	C530-K547 HydrophobicContact CB-CB 4.36Å; C530-V548 PolarHBondContact N-O 2.86Å; C530-Y549 HydrophobicContact CB-CE1 4.29Å
531	S	83.1	Confident	87.6	Confident	68 Å²	68	55.8 Å²	55.8	48%	0.476	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-70.5	179	-71.1	0	0	0	0	111.7	C529 Y549 D553	C529-S531 VanDerWaalsContact C-N 3.34Å; C529-S531 PolarHBondContact SG-N 3.06Å; S531-Y549 WeakPolarHBondContact OG-CE1 3.39Å; S531-D553 WeakPolarHBondContact CB-OD2 3.42Å
532	C	84.9	Confident	87.4	Confident	53 Å²	53	58.9 Å²	58.9	36%	0.358	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-4.6	-177.7	65.6	0	0	0	0	116.2	C529 R534 C550 D553	C529-C532 VanDerWaalsContact CB-SG 3.54Å; C529-C532 VanDerWaalsContact SG-SG 3.7Å; C532-R534 HydrophobicContact CB-CG 4.28Å; C532-R534 PolarHBondContact O-N 3.42Å; C532-R534 VanDerWaalsContact SG-CB 3.57Å; C532-R534 VanDerWaalsContact SG-CG 3.56Å; C532-R534 PolarHBondContact SG-N 2.83Å; C532-R534 PolarHBondContact SG-NE 2.73Å; C532-C550 PolarHBondContact SG-SG 3.47Å; C532-D553 WeakPolarHBondContact CB-OD2 3.17Å; C532-D553 PolarHBondContact N-OD2 3.25Å; C532-D553 VanDerWaalsContact SG-CG 3.58Å; C532-D553 PolarHBondContact SG-OD2 2.53Å
533	G	84.4	Confident	87.2	Confident	43 Å²	43	60.4 Å²	60.4	44%	0.443	33%	0.333	S	S	.	.			trans	68.5	0.1	-176.6	0	0	0	0	0	116.1	T528 C529	T528-G533 WeakPolarHBondContact CB-O 3.22Å; T528-G533 WeakPolarHBondContact CG2-O 3.17Å; C529-G533 VanDerWaalsContact O-CA 3.26Å; C529-G533 WeakPolarHBondContact O-CA 3.11Å; C529-G533 PolarHBondContact O-N 3.45Å; C529-G533 VanDerWaalsContact O-N 3.17Å
534	R	87.1	Confident	86.7	Confident	98 Å²	98	61.7 Å²	61.7	37%	0.37	34%	0.342	S	S	.	.			trans	-63.5	139	179.9	-69.1	-178.5	-76.8	-175.1	-9.2	111.6	T528 C529 C532 E552 D553	T528-R534 CarbonylContact C-O 3.58Å; T528-R534 WeakPolarHBondContact CA-O 3.44Å; C529-R534 PolarHBondContact N-O 3.12Å; C532-R534 HydrophobicContact CB-CG 4.28Å; C532-R534 PolarHBondContact O-N 3.42Å; C532-R534 VanDerWaalsContact SG-CB 3.57Å; C532-R534 VanDerWaalsContact SG-CG 3.56Å; C532-R534 PolarHBondContact SG-N 2.83Å; C532-R534 PolarHBondContact SG-NE 2.73Å; R534-E552 IonicContact CZ-OE1 2.63Å; R534-E552 VanDerWaalsContact CZ-OE1 3.31Å; R534-E552 IonicContact CZ-OE2 3.68Å; R534-E552 IonicContact NH1-OE1 3.86Å; R534-E552 PolarHBondContact NH1-OE1 3.24Å; R534-E552 IonicContact NH1-OE2 2.73Å; R534-E552 PolarHBondContact NH1-OE2 3Å; R534-E552 VanDerWaalsContact NH2-CD 3.25Å; R534-E552 IonicContact NH2-OE1 3.61Å; R534-E552 PolarHBondContact NH2-OE1 3.14Å; R534-E552 IonicContact NH2-OE2 3.45Å; R534-E552 PolarHBondContact NH2-OE2 3.3Å; R534-D553 IonicContact CZ-OD1 3.94Å; R534-D553 IonicContact NH2-OD1 2.72Å; R534-D553 PolarHBondContact NH2-OD1 2.95Å
535	R	90.3	Very high	86.3	Confident	125 Å²	125	68.8 Å²	68.8	47%	0.472	38%	0.38	S	S	.	.	B	Isolated β-bridge	trans	-66.8	133.8	178.2	-65.8	172.2	68.1	-176.3	4.9	110.7	T524 N525 F527 T528	T524-R535 VanDerWaalsContact O-CZ 3.3Å; T524-R535 PolarHBondContact O-NE 3.3Å; T524-R535 PolarHBondContact O-NH2 3.03Å; N525-R535 PolarHBondContact OD1-NH1 3.08Å; N525-R535 PolarHBondContact OD1-NH2 3.38Å; F527-R535 WeakPolarHBondContact O-CA 3.21Å; T528-R535 HydrophobicContact CG2-CG 4.01Å
536	L	88.6	Confident	85.9	Confident	2 Å²	2	67 Å²	67	1%	0.01	39%	0.386	C	S	.	.			trans	-100.5	-1.1	-171.7	-62.1	176.3	0	0	0	114	F527 C529 G538 K539 F541 V548 C550	F527-L536 HydrophobicContact CD1-CB 3.56Å; F527-L536 HydrophobicContact CE1-CB 3.38Å; F527-L536 HydrophobicContact CE1-CD1 4.42Å; F527-L536 HydrophobicContact CE2-CD1 4.42Å; F527-L536 HydrophobicContact CG-CB 4.3Å; F527-L536 HydrophobicContact CZ-CB 4Å; F527-L536 HydrophobicContact CZ-CD1 4.21Å; F527-L536 PolarHBondContact O-N 2.84Å; C529-L536 HydrophobicContact CB-CD2 4.21Å; L536-G538 PolarHBondContact O-N 3.26Å; L536-G538 VanDerWaalsContact O-N 3.17Å; L536-K539 PolarHBondContact O-N 2.88Å; L536-K539 VanDerWaalsContact O-N 3.14Å; L536-F541 HydrophobicContact CB-CB 4.42Å; L536-F541 HydrophobicContact CD1-CB 3.96Å; L536-F541 HydrophobicContact CD2-CB 4.28Å; L536-F541 HydrophobicContact CG-CB 4.45Å; L536-V548 HydrophobicContact CD1-CB 3.97Å; L536-V548 HydrophobicContact CD1-CG2 3.91Å; L536-C550 HydrophobicContact CD2-CB 3.47Å; L536-C550 VanDerWaalsContact CD2-CB 3.47Å
537	R	86.1	Confident	85.6	Confident	138 Å²	138	71.4 Å²	71.4	52%	0.521	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	119.6	-179.7	-171.7	-168.2	-164.8	-175.1	10.1	110.5	S512 K539	S512-R537 PolarHBondContact O-NH2 3.33Å; R537-K539 VanDerWaalsContact C-N 3.3Å; R537-K539 PolarHBondContact O-N 3.16Å
538	G	82.5	Confident	85.4	Confident	87 Å²	87	71.8 Å²	71.8	90%	0.897	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.6	16.9	177.9	0	0	0	0	0	114.8	L536	L536-G538 PolarHBondContact O-N 3.26Å; L536-G538 VanDerWaalsContact O-N 3.17Å
539	K	83.9	Confident	85.1	Confident	123 Å²	123	72.9 Å²	72.9	54%	0.535	41%	0.408	S	S	.	.	S	Bend	trans	-118	159	173.1	-67.3	-164.8	169.6	-156.9	0	110.7	L536 R537	L536-K539 PolarHBondContact O-N 2.88Å; L536-K539 VanDerWaalsContact O-N 3.14Å; R537-K539 VanDerWaalsContact C-N 3.3Å; R537-K539 PolarHBondContact O-N 3.16Å
540	A	84.3	Confident	85.1	Confident	46 Å²	46	73.1 Å²	73.1	38%	0.38	41%	0.409	S	S	.	.			trans	-61.7	135.2	165.5	0	0	0	0	0	110.1	E551	A540-E551 HydrophobicContact CB-CB 4.25Å; A540-E551 PolarHBondContact O-N 3.22Å
541	F	87.9	Confident	85	Confident	69 Å²	69	74 Å²	74	30%	0.303	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	150.4	176.6	67.7	-90.8	0	0	0	109.7	A517 M518 F527 L536 V548 Y549	A517-F541 HydrophobicContact CB-CE2 4.35Å; A517-F541 HydrophobicContact CB-CZ 3.92Å; M518-F541 HydrophobicContact CG-CE2 4.06Å; M518-F541 HydrophobicContact SD-CE2 4.28Å; F527-F541 AromaticContact CE1-CD1 3.96Å; F527-F541 HydrophobicContact CE1-CD1 3.96Å; F527-F541 HydrophobicContact CE1-CE1 4.03Å; F527-F541 HydrophobicContact CE1-CG 4.41Å; F527-F541 AromaticContact CZ-CD1 3.74Å; F527-F541 HydrophobicContact CZ-CD1 3.74Å; F527-F541 AromaticContact CZ-CD2 3.93Å; F527-F541 HydrophobicContact CZ-CD2 3.93Å; F527-F541 AromaticContact CZ-CE1 3.72Å; F527-F541 HydrophobicContact CZ-CE1 3.72Å; F527-F541 AromaticContact CZ-CE2 3.91Å; F527-F541 HydrophobicContact CZ-CE2 3.91Å; F527-F541 AromaticContact CZ-CG 3.86Å; F527-F541 HydrophobicContact CZ-CG 3.86Å; F527-F541 AromaticContact CZ-CZ 3.81Å; F527-F541 HydrophobicContact CZ-CZ 3.81Å; L536-F541 HydrophobicContact CB-CB 4.42Å; L536-F541 HydrophobicContact CD1-CB 3.96Å; L536-F541 HydrophobicContact CD2-CB 4.28Å; L536-F541 HydrophobicContact CG-CB 4.45Å; F541-V548 HydrophobicContact CD2-CG1 4.44Å; F541-Y549 CarbonylContact C-O 3.46Å; F541-Y549 VanDerWaalsContact CA-O 3.23Å; F541-Y549 WeakPolarHBondContact CA-O 3.29Å; F541-Y549 WeakPolarHBondContact CB-O 3.41Å
542	Y	85.8	Confident	84.9	Confident	91 Å²	91	75 Å²	75	36%	0.357	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	150	-178.6	-64.9	-94.3	0	0	0	109.4	V548 Y549 E551 F554	Y542-V548 WeakPolarHBondContact O-CA 3.38Å; Y542-Y549 PolarHBondContact N-O 2.85Å; Y542-Y549 PolarHBondContact O-N 2.9Å; Y542-E551 HydrophobicContact CE2-CB 4.01Å; Y542-E551 HydrophobicContact CE2-CG 4.17Å; Y542-F554 VanDerWaalsContact CB-CD2 3.49Å; Y542-F554 VanDerWaalsContact CB-CG 3.41Å; Y542-F554 AromaticContact CD1-CD1 3.6Å; Y542-F554 HydrophobicContact CD1-CD1 3.6Å; Y542-F554 AromaticContact CD1-CE1 3.39Å; Y542-F554 HydrophobicContact CD1-CE1 3.39Å; Y542-F554 HydrophobicContact CD1-CE2 4.39Å; Y542-F554 HydrophobicContact CD1-CG 4.19Å; Y542-F554 AromaticContact CD1-CZ 3.82Å; Y542-F554 HydrophobicContact CD1-CZ 3.82Å; Y542-F554 HydrophobicContact CD2-CB 3.86Å; Y542-F554 AromaticContact CD2-CD1 3.43Å; Y542-F554 HydrophobicContact CD2-CD1 3.43Å; Y542-F554 VanDerWaalsContact CD2-CD1 3.43Å; Y542-F554 HydrophobicContact CD2-CE1 4.12Å; Y542-F554 AromaticContact CD2-CG 3.73Å; Y542-F554 HydrophobicContact CD2-CG 3.73Å; Y542-F554 HydrophobicContact CE1-CD1 4.01Å; Y542-F554 AromaticContact CE1-CE1 3.72Å; Y542-F554 HydrophobicContact CE1-CE1 3.72Å; Y542-F554 HydrophobicContact CE1-CZ 4.47Å; Y542-F554 AromaticContact CE2-CD1 3.87Å; Y542-F554 HydrophobicContact CE2-CD1 3.87Å; Y542-F554 HydrophobicContact CE2-CE1 4.42Å; Y542-F554 HydrophobicContact CG-CB 4.07Å; Y542-F554 AromaticContact CG-CD1 3.29Å; Y542-F554 HydrophobicContact CG-CD1 3.29Å; Y542-F554 HydrophobicContact CG-CD2 4.02Å; Y542-F554 AromaticContact CG-CE1 3.61Å; Y542-F554 HydrophobicContact CG-CE1 3.61Å; Y542-F554 HydrophobicContact CG-CE2 4.29Å; Y542-F554 AromaticContact CG-CG 3.51Å; Y542-F554 HydrophobicContact CG-CG 3.51Å; Y542-F554 HydrophobicContact CG-CZ 4.1Å
543	N	85.6	Confident	84.6	Confident	67 Å²	67	73.2 Å²	73.2	36%	0.358	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	125.7	177.6	172.4	58.1	0	0	0	110.5	M518 G546 K547	M518-N543 HydrophobicContact CE-CB 3.61Å; M518-N543 WeakPolarHBondContact CE-ND2 3.42Å; M518-N543 HydrophobicContact SD-CB 3.29Å; M518-N543 WeakPolarHBondContact SD-CB 3.22Å; N543-G546 WeakPolarHBondContact OD1-CA 3.34Å; N543-G546 PolarHBondContact OD1-N 3.04Å; N543-K547 WeakPolarHBondContact CA-O 3.33Å; N543-K547 PolarHBondContact OD1-N 3.29Å; N543-K547 PolarHBondContact OD1-O 3.24Å
544	V	81.9	Confident	84.3	Confident	49 Å²	49	73.5 Å²	73.5	30%	0.297	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	120.1	174.7	-170.5	0	0	0	0	107	G546 K547 Y549 F554	V544-G546 VanDerWaalsContact C-N 3.25Å; V544-G546 PolarHBondContact O-N 3.34Å; V544-K547 PolarHBondContact N-O 3.03Å; V544-K547 WeakPolarHBondContact O-CB 3.15Å; V544-K547 PolarHBondContact O-N 2.97Å; V544-Y549 HydrophobicContact CB-CD2 4.36Å; V544-Y549 HydrophobicContact CB-CE2 3.97Å; V544-Y549 HydrophobicContact CG2-CD2 4.27Å; V544-Y549 HydrophobicContact CG2-CE2 4.34Å; V544-F554 HydrophobicContact CG2-CD2 3.72Å; V544-F554 HydrophobicContact CG2-CE2 3.53Å
545	N	79.7	Confident	83.7	Confident	159 Å²	159	73.2 Å²	73.2	85%	0.85	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	39.9	177.1	-54.1	-21.9	0	0	0	113.8	K547	N545-K547 VanDerWaalsContact C-N 3.29Å; N545-K547 PolarHBondContact O-N 3.23Å
546	G	78.8	Confident	82.6	Confident	65 Å²	65	72 Å²	72	67%	0.67	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.6	4.4	179.6	0	0	0	0	0	115.2	N543 V544	N543-G546 WeakPolarHBondContact OD1-CA 3.34Å; N543-G546 PolarHBondContact OD1-N 3.04Å; V544-G546 VanDerWaalsContact C-N 3.25Å; V544-G546 PolarHBondContact O-N 3.34Å
547	K	83.8	Confident	81.5	Confident	113 Å²	113	75.2 Å²	75.2	49%	0.491	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	132.5	175.8	-66.1	176.4	-176.6	176.8	0	110.1	C530 N543 V544 N545 Y549	C530-K547 HydrophobicContact CB-CB 4.36Å; N543-K547 WeakPolarHBondContact CA-O 3.33Å; N543-K547 PolarHBondContact OD1-N 3.29Å; N543-K547 PolarHBondContact OD1-O 3.24Å; V544-K547 PolarHBondContact N-O 3.03Å; V544-K547 WeakPolarHBondContact O-CB 3.15Å; V544-K547 PolarHBondContact O-N 2.97Å; N545-K547 VanDerWaalsContact C-N 3.29Å; N545-K547 PolarHBondContact O-N 3.23Å; K547-Y549 HydrophobicContact CB-CD2 4.44Å; K547-Y549 HydrophobicContact CB-CE2 3.54Å; K547-Y549 WeakPolarHBondContact CD-OH 3.42Å; K547-Y549 WeakPolarHBondContact O-CD2 3.47Å; K547-Y549 VanDerWaalsContact O-CE2 3.25Å; K547-Y549 WeakPolarHBondContact O-CE2 3.39Å
548	V	87.1	Confident	80.1	Confident	16 Å²	16	70.5 Å²	70.5	10%	0.097	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	133	178.4	-67.5	0	0	0	0	111.5	F527 T528 C529 C530 L536 F541 Y542	F527-V548 HydrophobicContact CE2-CG1 4.33Å; F527-V548 HydrophobicContact CE2-CG2 4.42Å; T528-V548 WeakPolarHBondContact O-CG2 3.46Å; C529-V548 CarbonylContact C-O 3.56Å; C529-V548 WeakPolarHBondContact CA-O 3.31Å; C530-V548 PolarHBondContact N-O 2.86Å; L536-V548 HydrophobicContact CD1-CB 3.97Å; L536-V548 HydrophobicContact CD1-CG2 3.91Å; F541-V548 HydrophobicContact CD2-CG1 4.44Å; Y542-V548 WeakPolarHBondContact O-CA 3.38Å
549	Y	86.6	Confident	78.6	Confident	43 Å²	43	75.1 Å²	75.1	17%	0.169	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	146.2	-179.8	-60.7	-89.5	0	0	0	109.6	C530 S531 F541 Y542 V544 K547	C530-Y549 HydrophobicContact CB-CE1 4.29Å; S531-Y549 WeakPolarHBondContact OG-CE1 3.39Å; F541-Y549 CarbonylContact C-O 3.46Å; F541-Y549 VanDerWaalsContact CA-O 3.23Å; F541-Y549 WeakPolarHBondContact CA-O 3.29Å; F541-Y549 WeakPolarHBondContact CB-O 3.41Å; Y542-Y549 PolarHBondContact N-O 2.85Å; Y542-Y549 PolarHBondContact O-N 2.9Å; V544-Y549 HydrophobicContact CB-CD2 4.36Å; V544-Y549 HydrophobicContact CB-CE2 3.97Å; V544-Y549 HydrophobicContact CG2-CD2 4.27Å; V544-Y549 HydrophobicContact CG2-CE2 4.34Å; K547-Y549 HydrophobicContact CB-CD2 4.44Å; K547-Y549 HydrophobicContact CB-CE2 3.54Å; K547-Y549 WeakPolarHBondContact CD-OH 3.42Å; K547-Y549 WeakPolarHBondContact O-CD2 3.47Å; K547-Y549 VanDerWaalsContact O-CE2 3.25Å; K547-Y549 WeakPolarHBondContact O-CE2 3.39Å
550	C	88.8	Confident	77.2	Confident	6 Å²	6	72.5 Å²	72.5	4%	0.041	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	156	163.3	42.2	0	0	0	0	109.5	C529 C532 L536 E552 D553 F554	C529-C550 HydrophobicContact CB-CB 4.46Å; C532-C550 PolarHBondContact SG-SG 3.47Å; L536-C550 HydrophobicContact CD2-CB 3.47Å; L536-C550 VanDerWaalsContact CD2-CB 3.47Å; C550-E552 VanDerWaalsContact C-N 3.31Å; C550-E552 PolarHBondContact O-N 2.97Å; C550-D553 PolarHBondContact O-N 3.25Å; C550-D553 VanDerWaalsContact O-N 3.11Å; C550-D553 PolarHBondContact SG-OD1 3.26Å; C550-F554 WeakPolarHBondContact O-CB 3.39Å; C550-F554 PolarHBondContact O-N 3.2Å
551	E	84.3	Confident	75.7	Confident	94 Å²	94	79.6 Å²	79.6	44%	0.439	41%	0.409	S	S	.	.	H	α-helix	trans	-39	-54.9	171.8	-178.8	172.3	-159.4	0	0	113.7	A540 Y542 D553 F554 L555	A540-E551 HydrophobicContact CB-CB 4.25Å; A540-E551 PolarHBondContact O-N 3.22Å; Y542-E551 HydrophobicContact CE2-CB 4.01Å; Y542-E551 HydrophobicContact CE2-CG 4.17Å; E551-D553 PolarHBondContact O-N 3.04Å; E551-F554 PolarHBondContact O-N 3.07Å; E551-L555 HydrophobicContact CG-CD1 4.02Å; E551-L555 WeakPolarHBondContact O-CB 3.41Å; E551-L555 VanDerWaalsContact O-CG 3.26Å; E551-L555 WeakPolarHBondContact O-CG 3.11Å; E551-L555 PolarHBondContact O-N 3.17Å
552	E	79.9	Confident	74.1	Confident	87 Å²	87	82.4 Å²	82.4	41%	0.407	43%	0.431	S	S	.	.	H	α-helix	trans	-53.9	-54.9	177.5	-60.2	169.4	-114.5	0	0	112.7	R534 C550 F554 L555 Y556	R534-E552 IonicContact CZ-OE1 2.63Å; R534-E552 VanDerWaalsContact CZ-OE1 3.31Å; R534-E552 IonicContact CZ-OE2 3.68Å; R534-E552 IonicContact NH1-OE1 3.86Å; R534-E552 PolarHBondContact NH1-OE1 3.24Å; R534-E552 IonicContact NH1-OE2 2.73Å; R534-E552 PolarHBondContact NH1-OE2 3Å; R534-E552 VanDerWaalsContact NH2-CD 3.25Å; R534-E552 IonicContact NH2-OE1 3.61Å; R534-E552 PolarHBondContact NH2-OE1 3.14Å; R534-E552 IonicContact NH2-OE2 3.45Å; R534-E552 PolarHBondContact NH2-OE2 3.3Å; C550-E552 VanDerWaalsContact C-N 3.31Å; C550-E552 PolarHBondContact O-N 2.97Å; E552-F554 VanDerWaalsContact C-N 3.32Å; E552-F554 PolarHBondContact O-N 3.47Å; E552-L555 PolarHBondContact O-N 2.85Å; E552-Y556 WeakPolarHBondContact O-CB 3.39Å; E552-Y556 PolarHBondContact O-N 3.02Å
553	D	79.1	Confident	73	Confident	16 Å²	16	79 Å²	79	9%	0.086	42%	0.422	C	S	.	.	H	α-helix	trans	-70.7	-28.9	-176.2	-68	34.5	0	0	0	111.7	C529 S531 C532 R534 C550 E551 S557	C529-D553 PolarHBondContact SG-OD2 2.7Å; S531-D553 WeakPolarHBondContact CB-OD2 3.42Å; C532-D553 WeakPolarHBondContact CB-OD2 3.17Å; C532-D553 PolarHBondContact N-OD2 3.25Å; C532-D553 VanDerWaalsContact SG-CG 3.58Å; C532-D553 PolarHBondContact SG-OD2 2.53Å; R534-D553 IonicContact CZ-OD1 3.94Å; R534-D553 IonicContact NH2-OD1 2.72Å; R534-D553 PolarHBondContact NH2-OD1 2.95Å; C550-D553 PolarHBondContact O-N 3.25Å; C550-D553 VanDerWaalsContact O-N 3.11Å; C550-D553 PolarHBondContact SG-OD1 3.26Å; E551-D553 PolarHBondContact O-N 3.04Å; D553-S557 WeakPolarHBondContact O-CA 3.36Å; D553-S557 WeakPolarHBondContact O-CB 3.26Å; D553-S557 PolarHBondContact O-N 2.86Å; D553-S557 PolarHBondContact O-OG 3.15Å
554	F	79.4	Confident	72.3	Confident	50 Å²	50	79 Å²	79	22%	0.219	42%	0.42	C	S	.	.	H	α-helix	trans	-69.6	-48.5	174.9	170.9	-107.4	0	0	0	111.3	Y542 V544 C550 E551 E552 Y556 G558	Y542-F554 VanDerWaalsContact CB-CD2 3.49Å; Y542-F554 VanDerWaalsContact CB-CG 3.41Å; Y542-F554 AromaticContact CD1-CD1 3.6Å; Y542-F554 HydrophobicContact CD1-CD1 3.6Å; Y542-F554 AromaticContact CD1-CE1 3.39Å; Y542-F554 HydrophobicContact CD1-CE1 3.39Å; Y542-F554 HydrophobicContact CD1-CE2 4.39Å; Y542-F554 HydrophobicContact CD1-CG 4.19Å; Y542-F554 AromaticContact CD1-CZ 3.82Å; Y542-F554 HydrophobicContact CD1-CZ 3.82Å; Y542-F554 HydrophobicContact CD2-CB 3.86Å; Y542-F554 AromaticContact CD2-CD1 3.43Å; Y542-F554 HydrophobicContact CD2-CD1 3.43Å; Y542-F554 VanDerWaalsContact CD2-CD1 3.43Å; Y542-F554 HydrophobicContact CD2-CE1 4.12Å; Y542-F554 AromaticContact CD2-CG 3.73Å; Y542-F554 HydrophobicContact CD2-CG 3.73Å; Y542-F554 HydrophobicContact CE1-CD1 4.01Å; Y542-F554 AromaticContact CE1-CE1 3.72Å; Y542-F554 HydrophobicContact CE1-CE1 3.72Å; Y542-F554 HydrophobicContact CE1-CZ 4.47Å; Y542-F554 AromaticContact CE2-CD1 3.87Å; Y542-F554 HydrophobicContact CE2-CD1 3.87Å; Y542-F554 HydrophobicContact CE2-CE1 4.42Å; Y542-F554 HydrophobicContact CG-CB 4.07Å; Y542-F554 AromaticContact CG-CD1 3.29Å; Y542-F554 HydrophobicContact CG-CD1 3.29Å; Y542-F554 HydrophobicContact CG-CD2 4.02Å; Y542-F554 AromaticContact CG-CE1 3.61Å; Y542-F554 HydrophobicContact CG-CE1 3.61Å; Y542-F554 HydrophobicContact CG-CE2 4.29Å; Y542-F554 AromaticContact CG-CG 3.51Å; Y542-F554 HydrophobicContact CG-CG 3.51Å; Y542-F554 HydrophobicContact CG-CZ 4.1Å; V544-F554 HydrophobicContact CG2-CD2 3.72Å; V544-F554 HydrophobicContact CG2-CE2 3.53Å; C550-F554 WeakPolarHBondContact O-CB 3.39Å; C550-F554 PolarHBondContact O-N 3.2Å; E551-F554 PolarHBondContact O-N 3.07Å; E552-F554 VanDerWaalsContact C-N 3.32Å; E552-F554 PolarHBondContact O-N 3.47Å; F554-Y556 VanDerWaalsContact C-N 3.32Å; F554-Y556 PolarHBondContact O-N 3.15Å; F554-G558 VanDerWaalsContact O-CA 3.28Å; F554-G558 WeakPolarHBondContact O-CA 3.08Å; F554-G558 PolarHBondContact O-N 2.79Å
555	L	74.1	Confident	72.3	Confident	92 Å²	92	83.3 Å²	83.3	48%	0.482	44%	0.435	S	S	.	.	H	α-helix	trans	-62.1	-42.3	176.2	-67.6	168	0	0	0	111	E551 E552 Q560	E551-L555 HydrophobicContact CG-CD1 4.02Å; E551-L555 WeakPolarHBondContact O-CB 3.41Å; E551-L555 VanDerWaalsContact O-CG 3.26Å; E551-L555 WeakPolarHBondContact O-CG 3.11Å; E551-L555 PolarHBondContact O-N 3.17Å; E552-L555 PolarHBondContact O-N 2.85Å; L555-Q560 VanDerWaalsContact O-CD 3.31Å; L555-Q560 WeakPolarHBondContact O-CG 3.28Å
556	Y	66.7	Low	72.6	Confident	98 Å²	98	75.8 Å²	75.8	38%	0.384	40%	0.395	S	S	.	.	H	α-helix	trans	-77.9	-32.3	-176.8	-165	-96.2	0	0	0	114.3	E552 F554 L572 M574	E552-Y556 WeakPolarHBondContact O-CB 3.39Å; E552-Y556 PolarHBondContact O-N 3.02Å; F554-Y556 VanDerWaalsContact C-N 3.32Å; F554-Y556 PolarHBondContact O-N 3.15Å; Y556-L572 HydrophobicContact CD2-CD2 4.25Å; Y556-L572 HydrophobicContact CE1-CD2 4.4Å; Y556-L572 HydrophobicContact CE2-CB 3.96Å; Y556-L572 HydrophobicContact CE2-CD2 3.82Å; Y556-L572 HydrophobicContact CE2-CG 4.37Å; Y556-M574 HydrophobicContact CD2-CE 4.15Å; Y556-M574 HydrophobicContact CD2-CG 4.3Å; Y556-M574 HydrophobicContact CD2-SD 3.86Å; Y556-M574 HydrophobicContact CE2-CG 4.35Å; Y556-M574 HydrophobicContact CE2-SD 3.94Å
557	S	64.9	Low	72.8	Confident	71 Å²	71	79 Å²	79	50%	0.497	39%	0.391	S	S	.	.	H	α-helix	trans	-109.8	-22.7	-174.1	-36	0	0	0	0	114.4	D553	D553-S557 WeakPolarHBondContact O-CA 3.36Å; D553-S557 WeakPolarHBondContact O-CB 3.26Å; D553-S557 PolarHBondContact O-N 2.86Å; D553-S557 PolarHBondContact O-OG 3.15Å
558	G	56.6	Low	72.8	Confident	39 Å²	39	77 Å²	77	40%	0.402	39%	0.388	S	S	.	.	H	α-helix	trans	-85.6	-30.7	-166	0	0	0	0	0	115.2	F554	F554-G558 VanDerWaalsContact O-CA 3.28Å; F554-G558 WeakPolarHBondContact O-CA 3.08Å; F554-G558 PolarHBondContact O-N 2.79Å
559	F	52.2	Low	72.6	Confident	184 Å²	184	78.5 Å²	78.5	81%	0.807	40%	0.399	S	S	*	.	S	Bend	trans	-137.5	-5.2	-174.1	-114.1	-98.2	0	0	0	114.7	Q561	F559-Q561 PolarHBondContact O-N 3.09Å
560	Q	54.8	Low	72.1	Confident	67 Å²	67	78.8 Å²	78.8	31%	0.313	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-92.5	35	-166	-86.9	-167.2	-4.1	0	0	115.3	L555 T562 A563	L555-Q560 VanDerWaalsContact O-CD 3.31Å; L555-Q560 WeakPolarHBondContact O-CG 3.28Å; Q560-T562 PolarHBondContact O-N 3.5Å; Q560-A563 HydrophobicContact CB-CB 3.63Å; Q560-A563 HydrophobicContact CG-CB 3.82Å; Q560-A563 WeakPolarHBondContact O-CB 3.49Å; Q560-A563 PolarHBondContact O-N 3.48Å
561	Q	50.9	Low	71.5	Confident	196 Å²	196	84.6 Å²	84.6	92%	0.916	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-62.1	-20.2	165.5	-72.4	-78.3	35.1	0	0	112.4	F559	F559-Q561 PolarHBondContact O-N 3.09Å
562	T	54.8	Low	71.2	Confident	127 Å²	127	81.6 Å²	81.6	78%	0.779	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-101.4	9.4	173	47.8	0	0	0	0	113.7	Q560 E564	Q560-T562 PolarHBondContact O-N 3.5Å; T562-E564 PolarHBondContact O-N 3.11Å
563	A	62.6	Low	71	Confident	20 Å²	20	78 Å²	78	17%	0.165	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-67	119.5	176.1	0	0	0	0	0	111	Q560 K565 L572	Q560-A563 HydrophobicContact CB-CB 3.63Å; Q560-A563 HydrophobicContact CG-CB 3.82Å; Q560-A563 WeakPolarHBondContact O-CB 3.49Å; Q560-A563 PolarHBondContact O-N 3.48Å; A563-K565 PolarHBondContact O-N 2.72Å; A563-L572 HydrophobicContact CB-CD2 3.69Å; A563-L572 HydrophobicContact CB-CG 4.07Å
564	E	71.9	Confident	70.4	Confident	68 Å²	68	83 Å²	83	32%	0.318	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-66.6	122.4	179.6	-57.4	-173	147.1	0	0	109.8	T562 I573 Q579 S584	T562-E564 PolarHBondContact O-N 3.11Å; E564-I573 PolarHBondContact O-N 2.86Å; E564-Q579 PolarHBondContact OE1-NE2 3.36Å; E564-S584 VanDerWaalsContact OE2-CB 3.29Å; E564-S584 WeakPolarHBondContact OE2-CB 3.33Å; E564-S584 PolarHBondContact OE2-OG 2.64Å
565	K	81.8	Confident	69.7	Low	138 Å²	138	88.7 Å²	88.7	60%	0.6	46%	0.463	S	S	*	.	B	Isolated β-bridge	trans	-86.1	136.7	176	-62.8	179.9	-175.3	174	0	108.8	A563 F567 L572	A563-K565 PolarHBondContact O-N 2.72Å; K565-F567 PolarHBondContact O-N 3.23Å; K565-L572 HydrophobicContact CD-CD1 4.4Å; K565-L572 HydrophobicContact CG-CD1 4.04Å; K565-L572 HydrophobicContact CG-CG 4.28Å
566	C	85	Confident	69.1	Low	2 Å²	2	91 Å²	91	1%	0.014	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-64	124.5	177.1	173.9	0	0	0	0	110.6	V568 C569 G570 H571 I573 S584 H586	C566-V568 PolarHBondContact O-N 3.11Å; C566-V568 VanDerWaalsContact O-N 3.12Å; C566-V568 PolarHBondContact SG-N 2.87Å; C566-V568 VanDerWaalsContact SG-N 3.45Å; C566-C569 PolarHBondContact O-N 2.84Å; C566-G570 WeakPolarHBondContact O-CA 3.06Å; C566-G570 PolarHBondContact O-N 3.35Å; C566-H571 PolarHBondContact N-O 2.95Å; C566-I573 HydrophobicContact CB-CD1 4.12Å; C566-I573 HydrophobicContact CB-CG1 3.96Å; C566-S584 VanDerWaalsContact CA-O 3.31Å; C566-S584 WeakPolarHBondContact CA-O 3.48Å; C566-H586 WeakPolarHBondContact CB-CE1 3.41Å; C566-H586 WeakPolarHBondContact CB-ND1 2.99Å
567	F	83.6	Confident	69.1	Low	132 Å²	132	90.3 Å²	90.3	58%	0.579	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-25.8	-178.8	-173.9	-103.4	0	0	0	113.5	K565 K583 S584 Y585	K565-F567 PolarHBondContact O-N 3.23Å; F567-K583 HydrophobicContact CB-CB 4.39Å; F567-K583 HydrophobicContact CB-CD 4.46Å; F567-K583 HydrophobicContact CD1-CD 4.03Å; F567-K583 HydrophobicContact CD2-CD 3.9Å; F567-K583 HydrophobicContact CD2-CG 4.47Å; F567-K583 HydrophobicContact CE1-CD 4.26Å; F567-K583 HydrophobicContact CE2-CD 4.14Å; F567-K583 HydrophobicContact CG-CD 3.86Å; F567-K583 HydrophobicContact CZ-CD 4.33Å; F567-K583 VanDerWaalsContact CZ-NZ 3.32Å; F567-S584 PolarHBondContact N-O 3.2Å; F567-Y585 HydrophobicContact CB-CE1 3.95Å; F567-Y585 HydrophobicContact CD1-CE1 4.29Å
568	V	83.6	Confident	69.3	Low	72 Å²	72	88.5 Å²	88.5	44%	0.436	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-33	-176.8	173.8	0	0	0	0	113.6	C566 Y585 C589	C566-V568 PolarHBondContact O-N 3.11Å; C566-V568 VanDerWaalsContact O-N 3.12Å; C566-V568 PolarHBondContact SG-N 2.87Å; C566-V568 VanDerWaalsContact SG-N 3.45Å; V568-Y585 HydrophobicContact CG2-CD1 3.74Å; V568-Y585 HydrophobicContact CG2-CE1 3.81Å; V568-C589 HydrophobicContact CB-CB 4.1Å; V568-C589 HydrophobicContact CG1-CB 4.24Å
569	C	82.8	Confident	70.2	Confident	47 Å²	47	92.1 Å²	92.1	32%	0.318	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.3	-3.7	-174.9	76.7	0	0	0	0	115.5	C566 H571 H586	C566-C569 PolarHBondContact O-N 2.84Å; C569-H571 PolarHBondContact O-N 2.74Å; C569-H571 PolarHBondContact O-ND1 2.86Å; C569-H571 PolarHBondContact SG-ND1 3.06Å; C569-H586 PolarHBondContact SG-CE1 2.96Å; C569-H586 PolarHBondContact SG-ND1 3.48Å; C569-H586 VanDerWaalsContact SG-ND1 3.42Å
570	G	76.3	Confident	71.2	Confident	49 Å²	49	83.9 Å²	83.9	51%	0.505	43%	0.431	S	S	.	.			trans	72.6	-17.1	177.9	0	0	0	0	0	116	C566	C566-G570 WeakPolarHBondContact O-CA 3.06Å; C566-G570 PolarHBondContact O-N 3.35Å
571	H	77.3	Confident	72.3	Confident	127 Å²	127	85.4 Å²	85.4	59%	0.588	44%	0.442	S	S	*	.	S	Bend	trans	-69.7	150.9	175.7	-54	119.3	0	0	0	111.9	C566 C569	C566-H571 PolarHBondContact N-O 2.95Å; C569-H571 PolarHBondContact O-N 2.74Å; C569-H571 PolarHBondContact O-ND1 2.86Å; C569-H571 PolarHBondContact SG-ND1 3.06Å
572	L	77.7	Confident	73.6	Confident	32 Å²	32	79.7 Å²	79.7	17%	0.168	44%	0.435	C	S	.	.	B	Isolated β-bridge	trans	-64	145.1	175	-77.6	67.5	0	0	0	110.3	Y556 A563 K565 H586	Y556-L572 HydrophobicContact CD2-CD2 4.25Å; Y556-L572 HydrophobicContact CE1-CD2 4.4Å; Y556-L572 HydrophobicContact CE2-CB 3.96Å; Y556-L572 HydrophobicContact CE2-CD2 3.82Å; Y556-L572 HydrophobicContact CE2-CG 4.37Å; A563-L572 HydrophobicContact CB-CD2 3.69Å; A563-L572 HydrophobicContact CB-CG 4.07Å; K565-L572 HydrophobicContact CD-CD1 4.4Å; K565-L572 HydrophobicContact CG-CD1 4.04Å; K565-L572 HydrophobicContact CG-CG 4.28Å; L572-H586 PolarHBondContact O-NE2 2.9Å
573	I	75.4	Confident	74.9	Confident	11 Å²	11	76.2 Å²	76.2	6%	0.056	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-91.7	116.5	172.1	-55.5	162.7	0	0	0	107.8	E564 C566 I577	E564-I573 PolarHBondContact O-N 2.86Å; C566-I573 HydrophobicContact CB-CD1 4.12Å; C566-I573 HydrophobicContact CB-CG1 3.96Å; I573-I577 HydrophobicContact CB-CG2 4.1Å; I573-I577 HydrophobicContact CD1-CG2 4.19Å; I573-I577 HydrophobicContact CG2-CG2 3.71Å
574	M	65.9	Low	76.1	Confident	122 Å²	122	75.6 Å²	75.6	60%	0.601	40%	0.404	S	S	*	.			trans	-98.1	-9	-177.6	-64	179.7	66.9	0	0	113.5	Y556	Y556-M574 HydrophobicContact CD2-CE 4.15Å; Y556-M574 HydrophobicContact CD2-CG 4.3Å; Y556-M574 HydrophobicContact CD2-SD 3.86Å; Y556-M574 HydrophobicContact CE2-CG 4.35Å; Y556-M574 HydrophobicContact CE2-SD 3.94Å
575	E	64	Low	76.8	Confident	169 Å²	169	72.7 Å²	72.7	79%	0.79	39%	0.39	S	S	*	.	S	Bend	trans	-129.1	-156.5	-172.8	-61.3	-174.8	156.2	0	0	110.3	I577	E575-I577 PolarHBondContact O-N 3.45Å; E575-I577 VanDerWaalsContact O-N 3.11Å
576	M	62	Low	77	Confident	141 Å²	141	68.3 Å²	68.3	70%	0.695	37%	0.371	S	S	*	.			trans	-51	117.7	179.4	-90.1	175.2	58.6	0	0	112.3
577	I	66.6	Low	76.8	Confident	83 Å²	83	70.5 Å²	70.5	43%	0.426	39%	0.385	S	S	.	.			trans	-78.5	116.5	173.1	47.4	167	0	0	0	110.2	I573 E575 Q579	I573-I577 HydrophobicContact CB-CG2 4.1Å; I573-I577 HydrophobicContact CD1-CG2 4.19Å; I573-I577 HydrophobicContact CG2-CG2 3.71Å; E575-I577 PolarHBondContact O-N 3.45Å; E575-I577 VanDerWaalsContact O-N 3.11Å; I577-Q579 PolarHBondContact O-N 2.83Å
578	L	69.1	Low	76.7	Confident	32 Å²	32	67 Å²	67	17%	0.168	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	103.5	157.9	-66.8	-174.7	0	0	0	107.2	Y585 P587 F590 D600	L578-Y585 PolarHBondContact N-O 3.3Å; L578-Y585 PolarHBondContact O-N 3.43Å; L578-P587 HydrophobicContact CD1-CB 4.35Å; L578-P587 HydrophobicContact CG-CG 4.48Å; L578-F590 HydrophobicContact CD1-CB 3.75Å; L578-F590 HydrophobicContact CD1-CD1 3.83Å; L578-F590 HydrophobicContact CD1-CG 3.99Å; L578-D600 HydrophobicContact CD1-CB 4.07Å
579	Q	76.9	Confident	76.9	Confident	115 Å²	115	64.6 Å²	64.6	54%	0.537	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	112.8	178.7	-162.1	179	68.1	0	0	109.4	E564 I577 K583	E564-Q579 PolarHBondContact OE1-NE2 3.36Å; I577-Q579 PolarHBondContact O-N 2.83Å; Q579-K583 CarbonylContact C-O 3.6Å; Q579-K583 WeakPolarHBondContact CA-O 3.45Å
580	A	72.1	Confident	77.1	Confident	11 Å²	11	62.6 Å²	62.6	9%	0.091	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	132.6	-177.6	0	0	0	0	0	109.8	G582 K583 Y585 F590 F604	A580-G582 PolarHBondContact O-N 3.11Å; A580-K583 PolarHBondContact N-O 2.94Å; A580-K583 PolarHBondContact O-N 3.27Å; A580-Y585 HydrophobicContact CB-CD2 4.4Å; A580-Y585 HydrophobicContact CB-CE2 4.11Å; A580-F590 HydrophobicContact CB-CE2 3.7Å; A580-F590 HydrophobicContact CB-CZ 4.09Å; A580-F604 HydrophobicContact CB-CE2 4.31Å; A580-F604 HydrophobicContact CB-CZ 3.95Å
581	L	78.3	Confident	77.8	Confident	100 Å²	100	65.2 Å²	65.2	52%	0.524	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	34	-175.1	-52.9	-173.4	0	0	0	114.6	K583 V606	L581-K583 PolarHBondContact O-N 3.44Å; L581-V606 HydrophobicContact CD1-CB 3.78Å; L581-V606 HydrophobicContact CD1-CG1 3.5Å; L581-V606 HydrophobicContact CD1-CG2 3.82Å; L581-V606 HydrophobicContact CG-CG2 4.34Å
582	G	77.6	Confident	78.5	Confident	75 Å²	75	59.2 Å²	59.2	77%	0.773	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.1	14.5	-175.9	0	0	0	0	0	114.5	A580	A580-G582 PolarHBondContact O-N 3.11Å
583	K	83.4	Confident	79.1	Confident	54 Å²	54	61.4 Å²	61.4	24%	0.235	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	152.3	172.7	-66.2	174.3	179.4	178.2	0	109.3	F567 Q579 A580 L581 Y585	F567-K583 HydrophobicContact CB-CB 4.39Å; F567-K583 HydrophobicContact CB-CD 4.46Å; F567-K583 HydrophobicContact CD1-CD 4.03Å; F567-K583 HydrophobicContact CD2-CD 3.9Å; F567-K583 HydrophobicContact CD2-CG 4.47Å; F567-K583 HydrophobicContact CE1-CD 4.26Å; F567-K583 HydrophobicContact CE2-CD 4.14Å; F567-K583 HydrophobicContact CG-CD 3.86Å; F567-K583 HydrophobicContact CZ-CD 4.33Å; F567-K583 VanDerWaalsContact CZ-NZ 3.32Å; Q579-K583 CarbonylContact C-O 3.6Å; Q579-K583 WeakPolarHBondContact CA-O 3.45Å; A580-K583 PolarHBondContact N-O 2.94Å; A580-K583 PolarHBondContact O-N 3.27Å; L581-K583 PolarHBondContact O-N 3.44Å; K583-Y585 HydrophobicContact CB-CE2 3.7Å; K583-Y585 WeakPolarHBondContact O-CE2 3.46Å
584	S	86.3	Confident	79.7	Confident	8 Å²	8	64.1 Å²	64.1	6%	0.056	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	144.1	-174.7	-48.1	0	0	0	0	111.3	E564 C566 F567	E564-S584 VanDerWaalsContact OE2-CB 3.29Å; E564-S584 WeakPolarHBondContact OE2-CB 3.33Å; E564-S584 PolarHBondContact OE2-OG 2.64Å; C566-S584 VanDerWaalsContact CA-O 3.31Å; C566-S584 WeakPolarHBondContact CA-O 3.48Å; F567-S584 PolarHBondContact N-O 3.2Å
585	Y	86.4	Confident	80.8	Confident	7 Å²	7	60.6 Å²	60.6	3%	0.027	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	141.5	-173.4	-54.7	-95.3	0	0	0	110.6	F567 V568 L578 A580 K583 F590 I612	F567-Y585 HydrophobicContact CB-CE1 3.95Å; F567-Y585 HydrophobicContact CD1-CE1 4.29Å; V568-Y585 HydrophobicContact CG2-CD1 3.74Å; V568-Y585 HydrophobicContact CG2-CE1 3.81Å; L578-Y585 PolarHBondContact N-O 3.3Å; L578-Y585 PolarHBondContact O-N 3.43Å; A580-Y585 HydrophobicContact CB-CD2 4.4Å; A580-Y585 HydrophobicContact CB-CE2 4.11Å; K583-Y585 HydrophobicContact CB-CE2 3.7Å; K583-Y585 WeakPolarHBondContact O-CE2 3.46Å; Y585-F590 HydrophobicContact CD1-CD2 4.29Å; Y585-F590 AromaticContact CD2-CD2 3.84Å; Y585-F590 HydrophobicContact CD2-CD2 3.84Å; Y585-F590 HydrophobicContact CD2-CE2 4.31Å; Y585-F590 HydrophobicContact CE2-CD2 4.37Å; Y585-F590 HydrophobicContact CE2-CE2 4.49Å; Y585-F590 HydrophobicContact CG-CB 4.48Å; Y585-F590 AromaticContact CG-CD2 3.81Å; Y585-F590 HydrophobicContact CG-CD2 3.81Å; Y585-I612 HydrophobicContact CE1-CD1 3.92Å
586	H	85.9	Confident	82	Confident	46 Å²	46	59.9 Å²	59.9	21%	0.213	34%	0.338	C	S	.	.			trans	-65.9	147.7	161.2	-56.4	100.5	0	0	0	109.1	C566 C569 L572 G588 C589 F590	C566-H586 WeakPolarHBondContact CB-CE1 3.41Å; C566-H586 WeakPolarHBondContact CB-ND1 2.99Å; C569-H586 PolarHBondContact SG-CE1 2.96Å; C569-H586 PolarHBondContact SG-ND1 3.48Å; C569-H586 VanDerWaalsContact SG-ND1 3.42Å; L572-H586 PolarHBondContact O-NE2 2.9Å; H586-G588 VanDerWaalsContact C-N 3.32Å; H586-G588 PolarHBondContact O-N 3.46Å; H586-C589 HydrophobicContact CB-CB 4.13Å; H586-C589 CarbonylContact O-C 3.42Å; H586-C589 WeakPolarHBondContact O-CA 3.21Å; H586-C589 WeakPolarHBondContact O-CB 3.49Å; H586-C589 PolarHBondContact O-N 2.85Å; H586-F590 PolarHBondContact O-N 3.04Å
587	P	82.4	Confident	83.2	Confident	47 Å²	47	59.2 Å²	59.2	31%	0.305	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-50.7	-46.1	176.8	-30.2	36.1	0	0	0	114	L578 C589 F590	L578-P587 HydrophobicContact CD1-CB 4.35Å; L578-P587 HydrophobicContact CG-CG 4.48Å; P587-C589 PolarHBondContact O-N 2.93Å; P587-F590 PolarHBondContact O-N 2.87Å
588	G	81.7	Confident	84.2	Confident	59 Å²	59	57.5 Å²	57.5	61%	0.608	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-72.2	-8.8	175.5	0	0	0	0	0	115.8	H586 R591	H586-G588 VanDerWaalsContact C-N 3.32Å; H586-G588 PolarHBondContact O-N 3.46Å; G588-R591 PolarHBondContact O-NH1 3.41Å
589	C	86	Confident	85	Confident	21 Å²	21	56.2 Å²	56.2	14%	0.142	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-99.3	-18.9	173.2	-73.5	0	0	0	0	113.2	V568 H586 P587 R591	V568-C589 HydrophobicContact CB-CB 4.1Å; V568-C589 HydrophobicContact CG1-CB 4.24Å; H586-C589 HydrophobicContact CB-CB 4.13Å; H586-C589 CarbonylContact O-C 3.42Å; H586-C589 WeakPolarHBondContact O-CA 3.21Å; H586-C589 WeakPolarHBondContact O-CB 3.49Å; H586-C589 PolarHBondContact O-N 2.85Å; P587-C589 PolarHBondContact O-N 2.93Å; C589-R591 PolarHBondContact O-N 3.36Å; C589-R591 VanDerWaalsContact O-N 3.14Å
590	F	88.6	Confident	85.4	Confident	5 Å²	5	54.8 Å²	54.8	2%	0.022	33%	0.325	C	S	.	.			trans	-83.1	84	175.2	-167.8	-108.7	0	0	0	110.1	L578 A580 Y585 H586 P587 G598 L599 F604 I612	L578-F590 HydrophobicContact CD1-CB 3.75Å; L578-F590 HydrophobicContact CD1-CD1 3.83Å; L578-F590 HydrophobicContact CD1-CG 3.99Å; A580-F590 HydrophobicContact CB-CE2 3.7Å; A580-F590 HydrophobicContact CB-CZ 4.09Å; Y585-F590 HydrophobicContact CD1-CD2 4.29Å; Y585-F590 AromaticContact CD2-CD2 3.84Å; Y585-F590 HydrophobicContact CD2-CD2 3.84Å; Y585-F590 HydrophobicContact CD2-CE2 4.31Å; Y585-F590 HydrophobicContact CE2-CD2 4.37Å; Y585-F590 HydrophobicContact CE2-CE2 4.49Å; Y585-F590 HydrophobicContact CG-CB 4.48Å; Y585-F590 AromaticContact CG-CD2 3.81Å; Y585-F590 HydrophobicContact CG-CD2 3.81Å; H586-F590 PolarHBondContact O-N 3.04Å; P587-F590 PolarHBondContact O-N 2.87Å; F590-G598 WeakPolarHBondContact O-CA 3.5Å; F590-L599 HydrophobicContact CD1-CB 3.78Å; F590-L599 HydrophobicContact CE1-CB 3.64Å; F590-L599 PolarHBondContact O-N 2.87Å; F590-F604 AromaticContact CE1-CD1 3.75Å; F590-F604 HydrophobicContact CE1-CD1 3.75Å; F590-F604 AromaticContact CE1-CE1 3.92Å; F590-F604 HydrophobicContact CE1-CE1 3.92Å; F590-F604 HydrophobicContact CE1-CG 4.17Å; F590-F604 HydrophobicContact CE1-CZ 4.48Å; F590-F604 AromaticContact CZ-CD1 3.64Å; F590-F604 HydrophobicContact CZ-CD1 3.64Å; F590-F604 AromaticContact CZ-CD2 3.89Å; F590-F604 HydrophobicContact CZ-CD2 3.89Å; F590-F604 AromaticContact CZ-CE1 3.59Å; F590-F604 HydrophobicContact CZ-CE1 3.59Å; F590-F604 AromaticContact CZ-CE2 3.84Å; F590-F604 HydrophobicContact CZ-CE2 3.84Å; F590-F604 AromaticContact CZ-CG 3.8Å; F590-F604 HydrophobicContact CZ-CG 3.8Å; F590-F604 AromaticContact CZ-CZ 3.7Å; F590-F604 HydrophobicContact CZ-CZ 3.7Å; F590-I612 HydrophobicContact CD2-CD1 4.01Å; F590-I612 HydrophobicContact CE2-CD1 3.77Å; F590-I612 HydrophobicContact CE2-CG2 4.2Å; F590-I612 HydrophobicContact CZ-CG2 4.22Å
591	R	91.2	Very high	85.9	Confident	104 Å²	104	58.2 Å²	58.2	39%	0.392	36%	0.362	S	S	.	.	B	Isolated β-bridge	trans	-135.6	154.5	-173.1	60.4	-179.5	172	-103.4	-6.4	111.9	G588 C589 E597	G588-R591 PolarHBondContact O-NH1 3.41Å; C589-R591 PolarHBondContact O-N 3.36Å; C589-R591 VanDerWaalsContact O-N 3.14Å; R591-E597 WeakPolarHBondContact CA-O 3.46Å; R591-E597 VanDerWaalsContact CB-O 3.22Å; R591-E597 WeakPolarHBondContact CB-O 3.44Å
592	C	91.2	Very high	86.2	Confident	2 Å²	2	56.6 Å²	56.6	1%	0.014	36%	0.356	C	S	.	.			trans	-65.1	142.6	175.9	-178.9	0	0	0	0	111.8	V594 C595 K596 E597 L599 I612 C614 D617	C592-V594 VanDerWaalsContact C-N 3.27Å; C592-V594 PolarHBondContact O-N 2.99Å; C592-V594 PolarHBondContact SG-N 3.26Å; C592-C595 VanDerWaalsContact CB-SG 3.57Å; C592-K596 WeakPolarHBondContact O-CA 3.36Å; C592-K596 PolarHBondContact O-N 3.19Å; C592-E597 PolarHBondContact N-O 3.2Å; C592-E597 VanDerWaalsContact N-O 3.07Å; C592-L599 HydrophobicContact CB-CD1 4.07Å; C592-L599 HydrophobicContact CB-CD2 4.31Å; C592-L599 HydrophobicContact CB-CG 4.47Å; C592-I612 WeakPolarHBondContact CA-O 3.18Å; C592-C614 HydrophobicContact CB-CB 4.27Å; C592-C614 PolarHBondContact SG-N 2.84Å; C592-D617 PolarHBondContact SG-OD2 3.13Å
593	V	89.5	Confident	86.5	Confident	77 Å²	77	57.6 Å²	57.6	47%	0.467	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-32.7	172.6	175.9	0	0	0	0	112.5	N611 I612 Y613	V593-N611 HydrophobicContact CG2-CB 4.27Å; V593-I612 PolarHBondContact N-O 3.13Å; V593-Y613 HydrophobicContact CB-CE1 4.4Å
594	V	88.8	Confident	86.7	Confident	69 Å²	69	58.9 Å²	58.9	42%	0.418	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-75.9	-175.8	179.6	0	0	0	0	111.7	C592 K596 Y613 D617 V621	C592-V594 VanDerWaalsContact C-N 3.27Å; C592-V594 PolarHBondContact O-N 2.99Å; C592-V594 PolarHBondContact SG-N 3.26Å; V594-K596 VanDerWaalsContact C-N 3.28Å; V594-K596 PolarHBondContact O-N 3.47Å; V594-Y613 HydrophobicContact CG2-CD1 3.89Å; V594-Y613 HydrophobicContact CG2-CE1 3.77Å; V594-D617 HydrophobicContact CB-CB 3.87Å; V594-D617 WeakPolarHBondContact CB-OD2 3.26Å; V594-D617 HydrophobicContact CG1-CB 4.09Å; V594-D617 HydrophobicContact CG2-CB 4.26Å; V594-V621 HydrophobicContact CG2-CG2 4.27Å
595	C	89.4	Confident	86.8	Confident	48 Å²	48	60.3 Å²	60.3	32%	0.324	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-19	-177.7	71.8	0	0	0	0	114.8	C592 E597 D617	C592-C595 VanDerWaalsContact CB-SG 3.57Å; C595-E597 HydrophobicContact CB-CG 4.23Å; C595-E597 PolarHBondContact O-N 3Å; C595-E597 VanDerWaalsContact O-N 3.15Å; C595-E597 PolarHBondContact SG-N 2.83Å; C595-D617 WeakPolarHBondContact CB-OD2 3.5Å; C595-D617 PolarHBondContact N-OD2 2.95Å; C595-D617 PolarHBondContact SG-OD2 2.81Å; C595-D617 VanDerWaalsContact SG-OD2 3.36Å
596	K	88.3	Confident	86.9	Confident	153 Å²	153	61.8 Å²	61.8	67%	0.665	37%	0.373	S	S	*	.			trans	62.5	7.7	-175.5	-56.4	174.2	-173.5	172.5	0	115.6	C592 V594	C592-K596 WeakPolarHBondContact O-CA 3.36Å; C592-K596 PolarHBondContact O-N 3.19Å; V594-K596 VanDerWaalsContact C-N 3.28Å; V594-K596 PolarHBondContact O-N 3.47Å
597	E	87.9	Confident	86.9	Confident	128 Å²	128	61 Å²	61	60%	0.598	37%	0.37	S	S	*	.			trans	-66.7	146.5	169.1	-58.7	-175.3	134	0	0	110.8	R591 C592 C595	R591-E597 WeakPolarHBondContact CA-O 3.46Å; R591-E597 VanDerWaalsContact CB-O 3.22Å; R591-E597 WeakPolarHBondContact CB-O 3.44Å; C592-E597 PolarHBondContact N-O 3.2Å; C592-E597 VanDerWaalsContact N-O 3.07Å; C595-E597 HydrophobicContact CB-CG 4.23Å; C595-E597 PolarHBondContact O-N 3Å; C595-E597 VanDerWaalsContact O-N 3.15Å; C595-E597 PolarHBondContact SG-N 2.83Å
598	G	87.3	Confident	87.1	Confident	46 Å²	46	65.3 Å²	65.3	47%	0.474	40%	0.395	S	S	.	.	B	Isolated β-bridge	trans	-70.3	137.6	174.2	0	0	0	0	0	111	F590	F590-G598 WeakPolarHBondContact O-CA 3.5Å
599	L	86.8	Confident	87.2	Confident	5 Å²	5	69.1 Å²	69.1	3%	0.026	40%	0.397	C	S	.	.			trans	-104.1	22.5	-174.2	-54.6	177.4	0	0	0	112.6	F590 C592 G601 V602 F604 I612 C614	F590-L599 HydrophobicContact CD1-CB 3.78Å; F590-L599 HydrophobicContact CE1-CB 3.64Å; F590-L599 PolarHBondContact O-N 2.87Å; C592-L599 HydrophobicContact CB-CD1 4.07Å; C592-L599 HydrophobicContact CB-CD2 4.31Å; C592-L599 HydrophobicContact CB-CG 4.47Å; L599-G601 PolarHBondContact O-N 3.45Å; L599-V602 HydrophobicContact CB-CB 4.42Å; L599-V602 HydrophobicContact CD2-CB 4.44Å; L599-V602 HydrophobicContact CD2-CG1 4.28Å; L599-V602 PolarHBondContact O-N 3.44Å; L599-V602 VanDerWaalsContact O-N 3.16Å; L599-F604 HydrophobicContact CB-CB 4.45Å; L599-F604 HydrophobicContact CD1-CB 3.85Å; L599-I612 HydrophobicContact CD1-CG2 3.72Å; L599-C614 HydrophobicContact CD2-CB 3.55Å
600	D	85.1	Confident	87.1	Confident	86 Å²	86	72.1 Å²	72.1	46%	0.46	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	120.8	175.5	-168.3	8.8	0	0	0	110.2	L578 V602	L578-D600 HydrophobicContact CD1-CB 4.07Å; D600-V602 PolarHBondContact O-N 2.87Å
601	G	81.1	Confident	87	Confident	83 Å²	83	74.4 Å²	74.4	86%	0.856	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.6	3.2	-171.8	0	0	0	0	0	116.1	L599	L599-G601 PolarHBondContact O-N 3.45Å
602	V	84.6	Confident	86.9	Confident	65 Å²	65	70.2 Å²	70.2	39%	0.394	41%	0.409	S	S	.	.	S	Bend	trans	-101.6	135.6	-178.4	-177.1	0	0	0	0	109.9	L599 D600 F604	L599-V602 HydrophobicContact CB-CB 4.42Å; L599-V602 HydrophobicContact CD2-CB 4.44Å; L599-V602 HydrophobicContact CD2-CG1 4.28Å; L599-V602 PolarHBondContact O-N 3.44Å; L599-V602 VanDerWaalsContact O-N 3.16Å; D600-V602 PolarHBondContact O-N 2.87Å; V602-F604 PolarHBondContact O-N 2.98Å
603	P	84.6	Confident	86.8	Confident	97 Å²	97	71.1 Å²	71.1	63%	0.63	41%	0.413	S	S	*	.			trans	-62.3	128.7	173	27	-34.9	0	0	0	110.6	V615	P603-V615 HydrophobicContact CB-CG2 4.11Å; P603-V615 WeakPolarHBondContact O-CG2 3.43Å
604	F	88.6	Confident	86.8	Confident	80 Å²	80	67.9 Å²	67.9	35%	0.351	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	157.7	-176.8	68.4	-90.8	0	0	0	110.4	A580 F590 L599 V602 V606 I612 Y613	A580-F604 HydrophobicContact CB-CE2 4.31Å; A580-F604 HydrophobicContact CB-CZ 3.95Å; F590-F604 AromaticContact CE1-CD1 3.75Å; F590-F604 HydrophobicContact CE1-CD1 3.75Å; F590-F604 AromaticContact CE1-CE1 3.92Å; F590-F604 HydrophobicContact CE1-CE1 3.92Å; F590-F604 HydrophobicContact CE1-CG 4.17Å; F590-F604 HydrophobicContact CE1-CZ 4.48Å; F590-F604 AromaticContact CZ-CD1 3.64Å; F590-F604 HydrophobicContact CZ-CD1 3.64Å; F590-F604 AromaticContact CZ-CD2 3.89Å; F590-F604 HydrophobicContact CZ-CD2 3.89Å; F590-F604 AromaticContact CZ-CE1 3.59Å; F590-F604 HydrophobicContact CZ-CE1 3.59Å; F590-F604 AromaticContact CZ-CE2 3.84Å; F590-F604 HydrophobicContact CZ-CE2 3.84Å; F590-F604 AromaticContact CZ-CG 3.8Å; F590-F604 HydrophobicContact CZ-CG 3.8Å; F590-F604 AromaticContact CZ-CZ 3.7Å; F590-F604 HydrophobicContact CZ-CZ 3.7Å; L599-F604 HydrophobicContact CB-CB 4.45Å; L599-F604 HydrophobicContact CD1-CB 3.85Å; V602-F604 PolarHBondContact O-N 2.98Å; F604-V606 HydrophobicContact CD2-CG2 3.92Å; F604-V606 HydrophobicContact CE2-CG2 3.96Å; F604-I612 HydrophobicContact CD2-CG2 4.24Å; F604-Y613 WeakPolarHBondContact CA-O 3.34Å; F604-Y613 WeakPolarHBondContact CB-O 3.39Å
605	T	87.3	Confident	86.7	Confident	39 Å²	39	67 Å²	67	24%	0.239	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	163	170.5	52.2	0	0	0	0	109.3	Y613 V615 Y618	T605-Y613 PolarHBondContact N-O 2.99Å; T605-Y613 PolarHBondContact O-N 2.9Å; T605-Y613 VanDerWaalsContact O-O 3.14Å; T605-V615 HydrophobicContact CG2-CG2 4.13Å; T605-Y618 HydrophobicContact CG2-CD1 4.26Å; T605-Y618 HydrophobicContact CG2-CG 4.44Å; T605-Y618 WeakPolarHBondContact OG1-CB 3.44Å; T605-Y618 WeakPolarHBondContact OG1-CD2 3.35Å
606	V	88.3	Confident	86.5	Confident	37 Å²	37	72.4 Å²	72.4	22%	0.224	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	133.5	177.6	-173.1	0	0	0	0	109.1	L581 F604 N610 N611 I612	L581-V606 HydrophobicContact CD1-CB 3.78Å; L581-V606 HydrophobicContact CD1-CG1 3.5Å; L581-V606 HydrophobicContact CD1-CG2 3.82Å; L581-V606 HydrophobicContact CG-CG2 4.34Å; F604-V606 HydrophobicContact CD2-CG2 3.92Å; F604-V606 HydrophobicContact CE2-CG2 3.96Å; V606-N610 HydrophobicContact CG1-CB 4.48Å; V606-N611 WeakPolarHBondContact CA-O 3.25Å; V606-N611 WeakPolarHBondContact CG1-O 3.21Å; V606-I612 HydrophobicContact CG2-CG1 4.11Å; V606-I612 HydrophobicContact CG2-CG2 4.43Å
607	D	86.1	Confident	86.4	Confident	31 Å²	31	66.3 Å²	66.3	17%	0.166	38%	0.381	C	S	.	.			trans	-82.5	170.7	-179.3	-175.5	31.1	0	0	0	112.4	E609 N610 N611 Y613 F622	D607-E609 PolarHBondContact O-N 2.84Å; D607-E609 VanDerWaalsContact O-N 3.13Å; D607-N610 WeakPolarHBondContact O-CA 3.37Å; D607-N610 PolarHBondContact O-N 2.82Å; D607-N611 PolarHBondContact N-O 3.17Å; D607-Y613 HydrophobicContact CB-CD2 4.22Å; D607-Y613 HydrophobicContact CB-CE2 3.69Å; D607-F622 HydrophobicContact CB-CZ 4.29Å
608	V	85.9	Confident	86.4	Confident	136 Å²	136	63.3 Å²	63.3	82%	0.824	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-25.9	-179.4	-61	0	0	0	0	113.6	N610	V608-N610 PolarHBondContact O-N 2.9Å
609	E	85.3	Confident	86.3	Confident	140 Å²	140	64 Å²	64	65%	0.654	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	6.1	174.3	-61.1	-171.5	166.3	0	0	113.9	D607 N611	D607-E609 PolarHBondContact O-N 2.84Å; D607-E609 VanDerWaalsContact O-N 3.13Å; E609-N611 WeakPolarHBondContact CB-ND2 3.31Å; E609-N611 PolarHBondContact O-N 3.14Å; E609-N611 PolarHBondContact OE2-ND2 3.45Å
610	N	83.6	Confident	86.1	Confident	84 Å²	84	66.6 Å²	66.6	45%	0.449	37%	0.371	S	S	.	.			trans	61	17.8	-168.1	-59.7	132.4	0	0	0	115.3	V606 D607 V608	V606-N610 HydrophobicContact CG1-CB 4.48Å; D607-N610 WeakPolarHBondContact O-CA 3.37Å; D607-N610 PolarHBondContact O-N 2.82Å; V608-N610 PolarHBondContact O-N 2.9Å
611	N	87.2	Confident	85.9	Confident	52 Å²	52	65.8 Å²	65.8	28%	0.278	37%	0.369	S	S	.	.			trans	-74.5	128	174.9	-74.7	-40.9	0	0	0	111.2	V593 V606 D607 E609 Y613	V593-N611 HydrophobicContact CG2-CB 4.27Å; V606-N611 WeakPolarHBondContact CA-O 3.25Å; V606-N611 WeakPolarHBondContact CG1-O 3.21Å; D607-N611 PolarHBondContact N-O 3.17Å; E609-N611 WeakPolarHBondContact CB-ND2 3.31Å; E609-N611 PolarHBondContact O-N 3.14Å; E609-N611 PolarHBondContact OE2-ND2 3.45Å; N611-Y613 HydrophobicContact CB-CD2 4.49Å; N611-Y613 HydrophobicContact CB-CE2 3.55Å; N611-Y613 WeakPolarHBondContact O-CD2 3.45Å; N611-Y613 WeakPolarHBondContact O-CE2 3.23Å
612	I	87.8	Confident	86	Confident	16 Å²	16	66.2 Å²	66.2	8%	0.082	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	127.1	-173.1	-54.5	161.2	0	0	0	110.6	Y585 F590 C592 V593 L599 F604 V606	Y585-I612 HydrophobicContact CE1-CD1 3.92Å; F590-I612 HydrophobicContact CD2-CD1 4.01Å; F590-I612 HydrophobicContact CE2-CD1 3.77Å; F590-I612 HydrophobicContact CE2-CG2 4.2Å; F590-I612 HydrophobicContact CZ-CG2 4.22Å; C592-I612 WeakPolarHBondContact CA-O 3.18Å; V593-I612 PolarHBondContact N-O 3.13Å; L599-I612 HydrophobicContact CD1-CG2 3.72Å; F604-I612 HydrophobicContact CD2-CG2 4.24Å; V606-I612 HydrophobicContact CG2-CG1 4.11Å; V606-I612 HydrophobicContact CG2-CG2 4.43Å
613	Y	89.1	Confident	86	Confident	22 Å²	22	63.8 Å²	63.8	9%	0.086	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	146	179.6	-61.8	-91.1	0	0	0	111.4	V593 V594 F604 T605 D607 N611 Y618 F622	V593-Y613 HydrophobicContact CB-CE1 4.4Å; V594-Y613 HydrophobicContact CG2-CD1 3.89Å; V594-Y613 HydrophobicContact CG2-CE1 3.77Å; F604-Y613 WeakPolarHBondContact CA-O 3.34Å; F604-Y613 WeakPolarHBondContact CB-O 3.39Å; T605-Y613 PolarHBondContact N-O 2.99Å; T605-Y613 PolarHBondContact O-N 2.9Å; T605-Y613 VanDerWaalsContact O-O 3.14Å; D607-Y613 HydrophobicContact CB-CD2 4.22Å; D607-Y613 HydrophobicContact CB-CE2 3.69Å; N611-Y613 HydrophobicContact CB-CD2 4.49Å; N611-Y613 HydrophobicContact CB-CE2 3.55Å; N611-Y613 WeakPolarHBondContact O-CD2 3.45Å; N611-Y613 WeakPolarHBondContact O-CE2 3.23Å; Y613-Y618 HydrophobicContact CD2-CD2 4.04Å; Y613-Y618 HydrophobicContact CG-CD2 4.14Å; Y613-F622 HydrophobicContact CD2-CE2 4.32Å; Y613-F622 HydrophobicContact CE1-CE2 4.27Å; Y613-F622 HydrophobicContact CE2-CE2 4Å; Y613-F622 HydrophobicContact CE2-CZ 4.35Å; Y613-F622 AromaticContact CZ-CE2 3.99Å
614	C	90.4	Very high	86.1	Confident	9 Å²	9	60.9 Å²	60.9	6%	0.061	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	149.4	160.8	83.3	0	0	0	0	108.3	C592 L599 K616 D617 Y618	C592-C614 HydrophobicContact CB-CB 4.27Å; C592-C614 PolarHBondContact SG-N 2.84Å; L599-C614 HydrophobicContact CD2-CB 3.55Å; C614-K616 PolarHBondContact O-N 3.4Å; C614-K616 VanDerWaalsContact O-N 3.1Å; C614-D617 PolarHBondContact O-N 3.49Å; C614-D617 VanDerWaalsContact O-N 3.12Å; C614-D617 PolarHBondContact SG-N 3.29Å; C614-D617 PolarHBondContact SG-OD2 2.85Å; C614-D617 VanDerWaalsContact SG-OD2 3.33Å; C614-Y618 WeakPolarHBondContact O-CB 3.23Å; C614-Y618 PolarHBondContact O-N 2.88Å
615	V	86.2	Confident	86.2	Confident	49 Å²	49	63.1 Å²	63.1	30%	0.297	33%	0.325	S	S	.	.	H	α-helix	trans	-52.4	-37.5	-178.8	165	0	0	0	0	112.3	P603 T605 H619	P603-V615 HydrophobicContact CB-CG2 4.11Å; P603-V615 WeakPolarHBondContact O-CG2 3.43Å; T605-V615 HydrophobicContact CG2-CG2 4.13Å; V615-H619 PolarHBondContact O-CD2 2.85Å; V615-H619 PolarHBondContact O-N 3.36Å; V615-H619 VanDerWaalsContact O-N 3.11Å
616	K	84.3	Confident	86.4	Confident	162 Å²	162	61.3 Å²	61.3	70%	0.704	31%	0.314	S	S	*	.	H	α-helix	trans	-62.6	-53.1	178.1	-56.7	174.5	-175.5	170.5	0	111.9	C614 Y618 H619 T620	C614-K616 PolarHBondContact O-N 3.4Å; C614-K616 VanDerWaalsContact O-N 3.1Å; K616-Y618 VanDerWaalsContact C-N 3.33Å; K616-Y618 PolarHBondContact O-N 2.98Å; K616-H619 PolarHBondContact O-N 2.93Å; K616-T620 WeakPolarHBondContact O-CG2 3.47Å; K616-T620 PolarHBondContact O-N 3.33Å; K616-T620 PolarHBondContact O-OG1 3.09Å
617	D	87.9	Confident	86.4	Confident	26 Å²	26	61.5 Å²	61.5	14%	0.139	32%	0.319	C	S	.	.	H	α-helix	trans	-69.3	-32.8	-178.2	-69.3	-22.3	0	0	0	112.1	C592 V594 C595 C614 T620 V621	C592-D617 PolarHBondContact SG-OD2 3.13Å; V594-D617 HydrophobicContact CB-CB 3.87Å; V594-D617 WeakPolarHBondContact CB-OD2 3.26Å; V594-D617 HydrophobicContact CG1-CB 4.09Å; V594-D617 HydrophobicContact CG2-CB 4.26Å; C595-D617 WeakPolarHBondContact CB-OD2 3.5Å; C595-D617 PolarHBondContact N-OD2 2.95Å; C595-D617 PolarHBondContact SG-OD2 2.81Å; C595-D617 VanDerWaalsContact SG-OD2 3.36Å; C614-D617 PolarHBondContact O-N 3.49Å; C614-D617 VanDerWaalsContact O-N 3.12Å; C614-D617 PolarHBondContact SG-N 3.29Å; C614-D617 PolarHBondContact SG-OD2 2.85Å; C614-D617 VanDerWaalsContact SG-OD2 3.33Å; D617-T620 WeakPolarHBondContact CA-OG1 3.48Å; D617-T620 PolarHBondContact O-N 2.94Å; D617-T620 PolarHBondContact O-OG1 3.37Å; D617-V621 WeakPolarHBondContact O-CB 3.43Å; D617-V621 VanDerWaalsContact O-CG2 3.27Å; D617-V621 WeakPolarHBondContact O-CG2 3.29Å; D617-V621 PolarHBondContact O-N 2.95Å
618	Y	88	Confident	86.5	Confident	65 Å²	65	62.7 Å²	62.7	26%	0.255	33%	0.331	S	S	.	.	H	α-helix	trans	-60.8	-49.6	173.1	-172.7	-101.2	0	0	0	110.9	T605 Y613 C614 K616 V621 F622	T605-Y618 HydrophobicContact CG2-CD1 4.26Å; T605-Y618 HydrophobicContact CG2-CG 4.44Å; T605-Y618 WeakPolarHBondContact OG1-CB 3.44Å; T605-Y618 WeakPolarHBondContact OG1-CD2 3.35Å; Y613-Y618 HydrophobicContact CD2-CD2 4.04Å; Y613-Y618 HydrophobicContact CG-CD2 4.14Å; C614-Y618 WeakPolarHBondContact O-CB 3.23Å; C614-Y618 PolarHBondContact O-N 2.88Å; K616-Y618 VanDerWaalsContact C-N 3.33Å; K616-Y618 PolarHBondContact O-N 2.98Å; Y618-V621 PolarHBondContact O-N 2.76Å; Y618-F622 AromaticContact CD2-CD2 3.47Å; Y618-F622 HydrophobicContact CD2-CD2 3.47Å; Y618-F622 VanDerWaalsContact CD2-CD2 3.47Å; Y618-F622 AromaticContact CD2-CE2 3.7Å; Y618-F622 HydrophobicContact CD2-CE2 3.7Å; Y618-F622 AromaticContact CE2-CD2 3.56Å; Y618-F622 HydrophobicContact CE2-CD2 3.56Å; Y618-F622 AromaticContact CE2-CE2 3.76Å; Y618-F622 HydrophobicContact CE2-CE2 3.76Å; Y618-F622 HydrophobicContact CE2-CG 4.32Å; Y618-F622 HydrophobicContact CG-CD2 4.05Å; Y618-F622 WeakPolarHBondContact O-CB 3.25Å; Y618-F622 WeakPolarHBondContact O-CD2 3.42Å; Y618-F622 PolarHBondContact O-N 3.28Å
619	H	84.4	Confident	86.7	Confident	60 Å²	60	58.5 Å²	58.5	28%	0.278	31%	0.307	S	S	.	.	H	α-helix	trans	-67.3	-36.4	176.6	-66.6	-59.8	0	0	0	112.5	V615 K616 V621 A623 L634	V615-H619 PolarHBondContact O-CD2 2.85Å; V615-H619 PolarHBondContact O-N 3.36Å; V615-H619 VanDerWaalsContact O-N 3.11Å; K616-H619 PolarHBondContact O-N 2.93Å; H619-V621 PolarHBondContact O-N 2.58Å; H619-A623 WeakPolarHBondContact O-CA 3.24Å; H619-A623 WeakPolarHBondContact O-CB 3.18Å; H619-A623 PolarHBondContact O-N 3.16Å; H619-L634 HydrophobicContact CB-CD2 3.61Å
620	T	82	Confident	86.8	Confident	59 Å²	59	57.3 Å²	57.3	36%	0.362	31%	0.305	S	S	.	.	H	α-helix	trans	-70.2	-29.7	177.6	58.3	0	0	0	0	113.9	K616 D617 L634	K616-T620 WeakPolarHBondContact O-CG2 3.47Å; K616-T620 PolarHBondContact O-N 3.33Å; K616-T620 PolarHBondContact O-OG1 3.09Å; D617-T620 WeakPolarHBondContact CA-OG1 3.48Å; D617-T620 PolarHBondContact O-N 2.94Å; D617-T620 PolarHBondContact O-OG1 3.37Å; T620-L634 HydrophobicContact CG2-CD1 4.15Å; T620-L634 HydrophobicContact CG2-CD2 4.02Å
621	V	81.1	Confident	87	Confident	70 Å²	70	59 Å²	59	42%	0.424	31%	0.31	S	S	.	.	H	α-helix	trans	-81.3	-44.2	176.9	173.1	0	0	0	0	112.1	V594 D617 Y618 H619	V594-V621 HydrophobicContact CG2-CG2 4.27Å; D617-V621 WeakPolarHBondContact O-CB 3.43Å; D617-V621 VanDerWaalsContact O-CG2 3.27Å; D617-V621 WeakPolarHBondContact O-CG2 3.29Å; D617-V621 PolarHBondContact O-N 2.95Å; Y618-V621 PolarHBondContact O-N 2.76Å; H619-V621 PolarHBondContact O-N 2.58Å
622	F	83.3	Confident	87.1	Confident	91 Å²	91	57.8 Å²	57.8	40%	0.399	31%	0.305	S	S	.	.	H	α-helix	trans	-106.2	-6.8	-169	-61.8	-77.3	0	0	0	115.4	D607 Y613 Y618	D607-F622 HydrophobicContact CB-CZ 4.29Å; Y613-F622 HydrophobicContact CD2-CE2 4.32Å; Y613-F622 HydrophobicContact CE1-CE2 4.27Å; Y613-F622 HydrophobicContact CE2-CE2 4Å; Y613-F622 HydrophobicContact CE2-CZ 4.35Å; Y613-F622 AromaticContact CZ-CE2 3.99Å; Y618-F622 AromaticContact CD2-CD2 3.47Å; Y618-F622 HydrophobicContact CD2-CD2 3.47Å; Y618-F622 VanDerWaalsContact CD2-CD2 3.47Å; Y618-F622 AromaticContact CD2-CE2 3.7Å; Y618-F622 HydrophobicContact CD2-CE2 3.7Å; Y618-F622 AromaticContact CE2-CD2 3.56Å; Y618-F622 HydrophobicContact CE2-CD2 3.56Å; Y618-F622 AromaticContact CE2-CE2 3.76Å; Y618-F622 HydrophobicContact CE2-CE2 3.76Å; Y618-F622 HydrophobicContact CE2-CG 4.32Å; Y618-F622 HydrophobicContact CG-CD2 4.05Å; Y618-F622 WeakPolarHBondContact O-CB 3.25Å; Y618-F622 WeakPolarHBondContact O-CD2 3.42Å; Y618-F622 PolarHBondContact O-N 3.28Å
623	A	84.7	Confident	87	Confident	15 Å²	15	57.1 Å²	57.1	12%	0.124	30%	0.301	C	S	.	.	S	Bend	trans	-68.4	149.6	176.2	0	0	0	0	0	112.5	H619 P632	H619-A623 WeakPolarHBondContact O-CA 3.24Å; H619-A623 WeakPolarHBondContact O-CB 3.18Å; H619-A623 PolarHBondContact O-N 3.16Å; A623-P632 HydrophobicContact CB-CB 4.06Å
624	P	87.4	Confident	86.7	Confident	36 Å²	36	60 Å²	60	23%	0.234	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-56.5	143	168.1	25.1	-34.4	0	0	0	110.8	I633 D651	P624-I633 PolarHBondContact O-N 2.86Å; P624-D651 HydrophobicContact CB-CB 4Å; P624-D651 WeakPolarHBondContact CB-OD2 3.12Å
625	K	89.6	Confident	86.2	Confident	127 Å²	127	61.1 Å²	61.1	55%	0.552	33%	0.325	S	S	*	.	B	Isolated β-bridge	trans	-101	130.4	-180	-64.8	177	-175	174.3	0	109.6	A627 Q631	K625-A627 PolarHBondContact O-N 3.43Å; K625-Q631 WeakPolarHBondContact CA-O 3.4Å
626	C	91.5	Very high	85.6	Confident	0 Å²	0	62 Å²	62	0%	0	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-64.1	124	178.4	172.1	0	0	0	0	110.7	S628 C629 N630 Q631 I633 D651 H653 C656	C626-S628 VanDerWaalsContact C-N 3.29Å; C626-S628 PolarHBondContact O-N 3.35Å; C626-C629 PolarHBondContact O-N 3.08Å; C626-C629 VanDerWaalsContact SG-SG 3.66Å; C626-N630 VanDerWaalsContact O-CA 3.22Å; C626-N630 WeakPolarHBondContact O-CA 3.38Å; C626-N630 PolarHBondContact O-N 3.4Å; C626-Q631 PolarHBondContact N-O 2.87Å; C626-I633 HydrophobicContact CB-CD1 4.18Å; C626-I633 HydrophobicContact CB-CG1 4.01Å; C626-D651 CarbonylContact C-O 3.53Å; C626-D651 VanDerWaalsContact CA-O 3.28Å; C626-D651 WeakPolarHBondContact CA-O 3.31Å; C626-H653 VanDerWaalsContact CB-CE1 3.47Å; C626-H653 WeakPolarHBondContact CB-CE1 3.26Å; C626-H653 WeakPolarHBondContact CB-ND1 3.28Å; C626-H653 PolarHBondContact SG-N 3.02Å; C626-H653 VanDerWaalsContact SG-N 3.41Å; C626-H653 PolarHBondContact SG-ND1 3.46Å; C626-C656 WeakPolarHBondContact SG-CB 3.29Å
627	A	89.5	Confident	84.8	Confident	41 Å²	41	64.4 Å²	64.4	34%	0.339	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-30	-175.5	0	0	0	0	0	113.9	K625 K650 D651 Y652	K625-A627 PolarHBondContact O-N 3.43Å; A627-K650 HydrophobicContact CB-CB 4.02Å; A627-K650 HydrophobicContact CB-CD 4.1Å; A627-K650 HydrophobicContact CB-CG 4.29Å; A627-D651 PolarHBondContact N-O 3.42Å; A627-Y652 HydrophobicContact CB-CD1 4.44Å; A627-Y652 HydrophobicContact CB-CE1 3.83Å
628	S	87.8	Confident	83.7	Confident	57 Å²	57	67.4 Å²	67.4	40%	0.399	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-41.9	177.9	-40.2	0	0	0	0	114.1	C626 Y652 C656	C626-S628 VanDerWaalsContact C-N 3.29Å; C626-S628 PolarHBondContact O-N 3.35Å; S628-Y652 VanDerWaalsContact OG-CD1 3.24Å; S628-Y652 WeakPolarHBondContact OG-CD1 3.36Å; S628-Y652 WeakPolarHBondContact OG-CE1 3.35Å; S628-C656 PolarHBondContact OG-O 2.84Å
629	C	89.8	Confident	82.9	Confident	48 Å²	48	66.5 Å²	66.5	32%	0.324	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.6	-4.7	-171.7	72.1	0	0	0	0	114.9	C626 Q631 H653	C626-C629 PolarHBondContact O-N 3.08Å; C626-C629 VanDerWaalsContact SG-SG 3.66Å; C629-Q631 PolarHBondContact O-N 3.35Å; C629-H653 VanDerWaalsContact SG-CE1 3.58Å; C629-H653 PolarHBondContact SG-ND1 2.87Å; C629-H653 VanDerWaalsContact SG-ND1 3.39Å
630	N	87.6	Confident	81.9	Confident	114 Å²	114	73.4 Å²	73.4	61%	0.61	42%	0.424	S	S	*	.			trans	59.3	7.8	-179.8	-64.7	-88.1	0	0	0	116.1	C626	C626-N630 VanDerWaalsContact O-CA 3.22Å; C626-N630 WeakPolarHBondContact O-CA 3.38Å; C626-N630 PolarHBondContact O-N 3.4Å
631	Q	87.8	Confident	81.6	Confident	119 Å²	119	78 Å²	78	56%	0.556	44%	0.442	S	S	*	.			trans	-82.1	148.7	174.5	-59.3	-53.6	-43.2	0	0	111.8	K625 C626 C629	K625-Q631 WeakPolarHBondContact CA-O 3.4Å; C626-Q631 PolarHBondContact N-O 2.87Å; C629-Q631 PolarHBondContact O-N 3.35Å
632	P	87.9	Confident	81.5	Confident	27 Å²	27	77.5 Å²	77.5	18%	0.175	44%	0.439	C	S	.	.	B	Isolated β-bridge	trans	-66.5	135	174.3	28	-33.9	0	0	0	111.3	A623 L634	A623-P632 HydrophobicContact CB-CB 4.06Å; P632-L634 HydrophobicContact CB-CD2 4.25Å; P632-L634 HydrophobicContact CG-CD2 4.39Å; P632-L634 PolarHBondContact O-N 2.87Å; P632-L634 VanDerWaalsContact O-N 3.14Å
633	I	86.8	Confident	81.5	Confident	2 Å²	2	79.2 Å²	79.2	1%	0.01	45%	0.451	C	S	.	.			trans	-82.2	92.3	177.5	-52.2	172.4	0	0	0	108.6	P624 C626 R644 D651	P624-I633 PolarHBondContact O-N 2.86Å; C626-I633 HydrophobicContact CB-CD1 4.18Å; C626-I633 HydrophobicContact CB-CG1 4.01Å; I633-R644 HydrophobicContact CD1-CB 3.85Å; I633-R644 HydrophobicContact CG2-CB 4.16Å; I633-D651 HydrophobicContact CD1-CB 3.8Å
634	L	83.2	Confident	81.7	Confident	83 Å²	83	83.8 Å²	83.8	44%	0.435	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-81.4	150.1	179.6	-57.1	179.5	0	0	0	111.5	H619 T620 P632	H619-L634 HydrophobicContact CB-CD2 3.61Å; T620-L634 HydrophobicContact CG2-CD1 4.15Å; T620-L634 HydrophobicContact CG2-CD2 4.02Å; P632-L634 HydrophobicContact CB-CD2 4.25Å; P632-L634 HydrophobicContact CG-CD2 4.39Å; P632-L634 PolarHBondContact O-N 2.87Å; P632-L634 VanDerWaalsContact O-N 3.14Å
635	P	80.2	Confident	81.8	Confident	32 Å²	32	83.9 Å²	83.9	21%	0.208	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-66.2	151.7	171.4	27.1	-32.3	0	0	0	111	T642	P635-T642 HydrophobicContact CB-CG2 3.78Å; P635-T642 HydrophobicContact CG-CG2 4.14Å
636	A	73.8	Confident	81.9	Confident	69 Å²	69	82 Å²	82	57%	0.57	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-68.6	153.7	176.4	0	0	0	0	0	110.9	G638 S639	A636-G638 PolarHBondContact O-N 3Å; A636-S639 PolarHBondContact N-OG 2.87Å; A636-S639 PolarHBondContact O-N 3.41Å; A636-S639 PolarHBondContact O-OG 3.45Å
637	Q	66.8	Low	81.6	Confident	211 Å²	211	83 Å²	83	99%	0.986	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	94.6	-175.8	-63.3	-178.6	22.9	0	0	110.9
638	G	65.1	Low	81.5	Confident	89 Å²	89	84.8 Å²	84.8	92%	0.918	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	114.8	-0.3	-177.5	0	0	0	0	0	115.4	A636	A636-G638 PolarHBondContact O-N 3Å
639	S	70	Confident	81.4	Confident	47 Å²	47	90.2 Å²	90.2	33%	0.329	50%	0.497	S	S	.	.			trans	-106.4	135.4	167.2	68.5	0	0	0	0	110.8	A636 E641	A636-S639 PolarHBondContact N-OG 2.87Å; A636-S639 PolarHBondContact O-N 3.41Å; A636-S639 PolarHBondContact O-OG 3.45Å; S639-E641 VanDerWaalsContact C-N 3.3Å; S639-E641 PolarHBondContact OG-O 2.9Å; S639-E641 VanDerWaalsContact OG-O 3.08Å
640	E	65.1	Low	81.5	Confident	205 Å²	205	91.9 Å²	91.9	96%	0.958	50%	0.499	S	S	*	.	S	Bend	trans	-78	-21	170.9	-62.7	-176.7	165	0	0	111.7
641	E	74.1	Confident	81.7	Confident	156 Å²	156	87.8 Å²	87.8	73%	0.729	48%	0.477	S	S	*	.	S	Bend	trans	-85.3	137.5	178.6	-61.3	-176.3	163.7	0	0	112	S639	S639-E641 VanDerWaalsContact C-N 3.3Å; S639-E641 PolarHBondContact OG-O 2.9Å; S639-E641 VanDerWaalsContact OG-O 3.08Å
642	T	79.1	Confident	81.8	Confident	58 Å²	58	82.5 Å²	82.5	36%	0.356	45%	0.452	S	S	.	.			trans	-94.8	109.2	171.9	43.1	0	0	0	0	110.8	P635 R644	P635-T642 HydrophobicContact CB-CG2 3.78Å; P635-T642 HydrophobicContact CG-CG2 4.14Å; T642-R644 PolarHBondContact O-N 2.89Å
643	I	84.7	Confident	82	Confident	128 Å²	128	83.4 Å²	83.4	66%	0.656	45%	0.454	S	S	*	.			trans	-79.1	113.2	175.2	-54.4	178.2	0	0	0	109.1	V654	I643-V654 HydrophobicContact CG2-CG2 3.78Å
644	R	88.9	Confident	82.1	Confident	111 Å²	111	86.5 Å²	86.5	42%	0.419	47%	0.473	S	S	.	.			trans	-136.1	145.2	175.5	64.6	-172.4	176.8	145.2	-9.1	110.1	I633 T642 V646 D651	I633-R644 HydrophobicContact CD1-CB 3.85Å; I633-R644 HydrophobicContact CG2-CB 4.16Å; T642-R644 PolarHBondContact O-N 2.89Å; R644-V646 HydrophobicContact CG-CG2 4.18Å; R644-D651 VanDerWaalsContact CD-OD1 3.27Å; R644-D651 WeakPolarHBondContact CD-OD1 3.49Å; R644-D651 IonicContact CZ-OD1 3.17Å; R644-D651 IonicContact NE-OD1 2.8Å; R644-D651 IonicContact NH1-OD1 2.64Å; R644-D651 PolarHBondContact NH1-OD1 2.92Å; R644-D651 IonicContact NH1-OD2 2.82Å; R644-D651 PolarHBondContact NH1-OD2 3.36Å
645	V	89.6	Confident	82.4	Confident	38 Å²	38	90.6 Å²	90.6	23%	0.23	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	128.7	168.2	-172.7	0	0	0	0	108	D651 Y652 V654 Y657	V645-D651 CarbonylContact O-C 3.5Å; V645-Y652 PolarHBondContact N-O 3.42Å; V645-Y652 PolarHBondContact O-N 3.48Å; V645-V654 HydrophobicContact CG2-CG2 4.32Å; V645-Y657 HydrophobicContact CB-CD1 4.26Å; V645-Y657 HydrophobicContact CB-CD2 4.31Å; V645-Y657 HydrophobicContact CB-CG 4.1Å; V645-Y657 HydrophobicContact CG1-CD1 3.73Å; V645-Y657 HydrophobicContact CG1-CD2 3.99Å; V645-Y657 HydrophobicContact CG1-CE1 3.66Å; V645-Y657 HydrophobicContact CG1-CE2 3.93Å; V645-Y657 HydrophobicContact CG1-CG 3.9Å; V645-Y657 HydrophobicContact CG2-CD1 4.19Å; V645-Y657 HydrophobicContact CG2-CG 4.25Å
646	V	89.9	Confident	82.9	Confident	86 Å²	86	90.1 Å²	90.1	52%	0.521	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	124.4	178.6	-171.7	0	0	0	0	108.3	R644 K650	R644-V646 HydrophobicContact CG-CG2 4.18Å; V646-K650 WeakPolarHBondContact CA-O 3.11Å
647	S	86.9	Confident	83.7	Confident	22 Å²	22	87.3 Å²	87.3	15%	0.154	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	135.7	-178.6	-76.1	0	0	0	0	111.3	D649 K650 Y657	S647-D649 VanDerWaalsContact C-N 3.25Å; S647-D649 PolarHBondContact O-N 3.5Å; S647-K650 PolarHBondContact N-O 3.23Å; S647-K650 WeakPolarHBondContact O-CB 3.29Å; S647-K650 PolarHBondContact O-N 2.87Å; S647-Y657 PolarHBondContact OG-OH 3.29Å
648	M	86.4	Confident	84.9	Confident	78 Å²	78	80.7 Å²	80.7	38%	0.384	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	51	42.5	-174.7	-51.4	-162.5	77.7	0	0	113.5	K650 P676 G679	M648-K650 PolarHBondContact O-N 3.44Å; M648-K650 VanDerWaalsContact O-N 3.07Å; M648-P676 HydrophobicContact CE-CB 3.99Å; M648-P676 HydrophobicContact CG-CB 3.71Å; M648-P676 HydrophobicContact CG-CG 4.47Å; M648-P676 HydrophobicContact SD-CB 3.39Å; M648-P676 WeakPolarHBondContact SD-CB 3.38Å; M648-G679 VanDerWaalsContact SD-CA 3.58Å
649	D	86.9	Confident	86.2	Confident	171 Å²	171	76.4 Å²	76.4	91%	0.914	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	20.9	-175.5	-51.7	-44.3	0	0	0	114.8	S647	S647-D649 VanDerWaalsContact C-N 3.25Å; S647-D649 PolarHBondContact O-N 3.5Å
650	K	90.3	Very high	87.1	Confident	84 Å²	84	78.8 Å²	78.8	37%	0.365	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	148.9	175.3	-63.5	165.3	-172.7	173.2	0	110.5	A627 V646 S647 M648 Y652 G679	A627-K650 HydrophobicContact CB-CB 4.02Å; A627-K650 HydrophobicContact CB-CD 4.1Å; A627-K650 HydrophobicContact CB-CG 4.29Å; V646-K650 WeakPolarHBondContact CA-O 3.11Å; S647-K650 PolarHBondContact N-O 3.23Å; S647-K650 WeakPolarHBondContact O-CB 3.29Å; S647-K650 PolarHBondContact O-N 2.87Å; M648-K650 PolarHBondContact O-N 3.44Å; M648-K650 VanDerWaalsContact O-N 3.07Å; K650-Y652 HydrophobicContact CB-CD2 4.44Å; K650-Y652 HydrophobicContact CB-CE2 3.6Å; K650-Y652 WeakPolarHBondContact CD-OH 3.39Å; K650-G679 PolarHBondContact NZ-O 3.39Å
651	D	91.6	Very high	88.2	Confident	28 Å²	28	72.9 Å²	72.9	15%	0.15	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	146.3	174.9	-70.9	-61.1	0	0	0	111.9	P624 C626 A627 I633 R644 V645	P624-D651 HydrophobicContact CB-CB 4Å; P624-D651 WeakPolarHBondContact CB-OD2 3.12Å; C626-D651 CarbonylContact C-O 3.53Å; C626-D651 VanDerWaalsContact CA-O 3.28Å; C626-D651 WeakPolarHBondContact CA-O 3.31Å; A627-D651 PolarHBondContact N-O 3.42Å; I633-D651 HydrophobicContact CD1-CB 3.8Å; R644-D651 VanDerWaalsContact CD-OD1 3.27Å; R644-D651 WeakPolarHBondContact CD-OD1 3.49Å; R644-D651 IonicContact CZ-OD1 3.17Å; R644-D651 IonicContact NE-OD1 2.8Å; R644-D651 IonicContact NH1-OD1 2.64Å; R644-D651 PolarHBondContact NH1-OD1 2.92Å; R644-D651 IonicContact NH1-OD2 2.82Å; R644-D651 PolarHBondContact NH1-OD2 3.36Å; V645-D651 CarbonylContact O-C 3.5Å
652	Y	91.2	Very high	89	Confident	8 Å²	8	68.9 Å²	68.9	3%	0.031	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	142.2	179.6	-62	-91.9	0	0	0	111.6	A627 S628 V645 K650 Y657 L681	A627-Y652 HydrophobicContact CB-CD1 4.44Å; A627-Y652 HydrophobicContact CB-CE1 3.83Å; S628-Y652 VanDerWaalsContact OG-CD1 3.24Å; S628-Y652 WeakPolarHBondContact OG-CD1 3.36Å; S628-Y652 WeakPolarHBondContact OG-CE1 3.35Å; V645-Y652 PolarHBondContact N-O 3.42Å; V645-Y652 PolarHBondContact O-N 3.48Å; K650-Y652 HydrophobicContact CB-CD2 4.44Å; K650-Y652 HydrophobicContact CB-CE2 3.6Å; K650-Y652 WeakPolarHBondContact CD-OH 3.39Å; Y652-Y657 HydrophobicContact CD1-CD2 4.34Å; Y652-Y657 HydrophobicContact CD2-CD2 4Å; Y652-Y657 HydrophobicContact CD2-CE2 4.29Å; Y652-Y657 AromaticContact CG-CD2 3.87Å; Y652-Y657 HydrophobicContact CG-CD2 3.87Å; Y652-L681 HydrophobicContact CD1-CD1 4.17Å; Y652-L681 HydrophobicContact CE1-CD1 3.63Å; Y652-L681 HydrophobicContact CE2-CD1 4.19Å
653	H	91.3	Very high	89.4	Confident	46 Å²	46	68.6 Å²	68.6	21%	0.213	37%	0.365	C	S	.	.			trans	-65	148.9	159.1	-59.8	104.2	0	0	0	109.2	C626 C629 E655 C656 Y657	C626-H653 VanDerWaalsContact CB-CE1 3.47Å; C626-H653 WeakPolarHBondContact CB-CE1 3.26Å; C626-H653 WeakPolarHBondContact CB-ND1 3.28Å; C626-H653 PolarHBondContact SG-N 3.02Å; C626-H653 VanDerWaalsContact SG-N 3.41Å; C626-H653 PolarHBondContact SG-ND1 3.46Å; C629-H653 VanDerWaalsContact SG-CE1 3.58Å; C629-H653 PolarHBondContact SG-ND1 2.87Å; C629-H653 VanDerWaalsContact SG-ND1 3.39Å; H653-E655 PolarHBondContact O-N 3.18Å; H653-C656 HydrophobicContact CB-CB 3.92Å; H653-C656 CarbonylContact O-C 3.56Å; H653-C656 WeakPolarHBondContact O-CA 3.37Å; H653-C656 PolarHBondContact O-N 3.49Å; H653-Y657 PolarHBondContact O-N 3.48Å
654	V	89.4	Confident	89.6	Confident	67 Å²	67	65.8 Å²	65.8	41%	0.406	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-54.9	-39.1	176.7	-174.6	0	0	0	0	111.8	I643 V645 Q665	I643-V654 HydrophobicContact CG2-CG2 3.78Å; V645-V654 HydrophobicContact CG2-CG2 4.32Å; V654-Q665 PolarHBondContact O-NE2 3.12Å
655	E	88.6	Confident	89.7	Confident	169 Å²	169	65.4 Å²	65.4	79%	0.79	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-71.5	-27.5	175.9	-60	173.9	-178.1	0	0	113.5	H653 Y657	H653-E655 PolarHBondContact O-N 3.18Å; E655-Y657 VanDerWaalsContact C-N 3.32Å
656	C	90.3	Very high	89.7	Confident	22 Å²	22	63.9 Å²	63.9	15%	0.149	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-88.4	0.6	-179.2	-70.6	0	0	0	0	113.3	C626 S628 H653	C626-C656 WeakPolarHBondContact SG-CB 3.29Å; S628-C656 PolarHBondContact OG-O 2.84Å; H653-C656 HydrophobicContact CB-CB 3.92Å; H653-C656 CarbonylContact O-C 3.56Å; H653-C656 WeakPolarHBondContact O-CA 3.37Å; H653-C656 PolarHBondContact O-N 3.49Å
657	Y	92.1	Very high	89.6	Confident	9 Å²	9	62.7 Å²	62.7	4%	0.035	34%	0.335	C	S	.	.			trans	-99.7	87.2	-175.6	-167.4	-117.1	0	0	0	110.5	V645 S647 Y652 H653 E655 L666 C674 L681	V645-Y657 HydrophobicContact CB-CD1 4.26Å; V645-Y657 HydrophobicContact CB-CD2 4.31Å; V645-Y657 HydrophobicContact CB-CG 4.1Å; V645-Y657 HydrophobicContact CG1-CD1 3.73Å; V645-Y657 HydrophobicContact CG1-CD2 3.99Å; V645-Y657 HydrophobicContact CG1-CE1 3.66Å; V645-Y657 HydrophobicContact CG1-CE2 3.93Å; V645-Y657 HydrophobicContact CG1-CG 3.9Å; V645-Y657 HydrophobicContact CG2-CD1 4.19Å; V645-Y657 HydrophobicContact CG2-CG 4.25Å; S647-Y657 PolarHBondContact OG-OH 3.29Å; Y652-Y657 HydrophobicContact CD1-CD2 4.34Å; Y652-Y657 HydrophobicContact CD2-CD2 4Å; Y652-Y657 HydrophobicContact CD2-CE2 4.29Å; Y652-Y657 AromaticContact CG-CD2 3.87Å; Y652-Y657 HydrophobicContact CG-CD2 3.87Å; H653-Y657 PolarHBondContact O-N 3.48Å; E655-Y657 VanDerWaalsContact C-N 3.32Å; Y657-L666 HydrophobicContact CD1-CB 3.67Å; Y657-L666 VanDerWaalsContact CD1-O 3.32Å; Y657-L666 WeakPolarHBondContact CD1-O 3.35Å; Y657-L666 HydrophobicContact CE1-CB 3.5Å; Y657-L666 VanDerWaalsContact CE1-CB 3.5Å; Y657-L666 HydrophobicContact CE1-CD1 4.48Å; Y657-L666 PolarHBondContact O-N 3.23Å; Y657-C674 WeakPolarHBondContact OH-CB 3.43Å; Y657-C674 PolarHBondContact OH-SG 3.07Å; Y657-L681 HydrophobicContact CD2-CD1 3.58Å; Y657-L681 HydrophobicContact CE2-CD1 3.57Å; Y657-L681 HydrophobicContact CE2-CD2 3.76Å; Y657-L681 HydrophobicContact CE2-CG 4.31Å
658	H	92.3	Very high	89.6	Confident	72 Å²	72	68.8 Å²	68.8	33%	0.333	37%	0.366	S	S	.	.	B	Isolated β-bridge	trans	-138.5	159.6	-175.4	51.9	-105.3	0	0	0	111.9	E660 L664	H658-E660 PolarHBondContact O-N 3.28Å; H658-L664 CarbonylContact C-O 3.58Å; H658-L664 VanDerWaalsContact CA-O 3.28Å; H658-L664 WeakPolarHBondContact CA-O 3.4Å; H658-L664 WeakPolarHBondContact CB-O 3.38Å
659	C	91.9	Very high	89.6	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	37%	0.372	C	S	.	.			trans	-65.3	125	172.1	-179.3	0	0	0	0	110.5	D661 C662 G663 L664 L666 L681 C683	C659-D661 VanDerWaalsContact C-N 3.28Å; C659-D661 PolarHBondContact O-N 3.14Å; C659-C662 VanDerWaalsContact CB-SG 3.6Å; C659-C662 PolarHBondContact O-N 3.19Å; C659-C662 PolarHBondContact SG-SG 3Å; C659-G663 WeakPolarHBondContact O-CA 3.34Å; C659-G663 PolarHBondContact O-N 2.87Å; C659-L664 HydrophobicContact CB-CB 4.32Å; C659-L664 PolarHBondContact N-O 2.92Å; C659-L666 HydrophobicContact CB-CD2 4.29Å; C659-L681 WeakPolarHBondContact CA-O 3.47Å; C659-C683 HydrophobicContact CB-CB 4.21Å; C659-C683 PolarHBondContact SG-N 3.47Å
660	E	88.2	Confident	89.2	Confident	96 Å²	96	69.4 Å²	69.4	45%	0.449	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-32	-179.5	-71.1	171.7	-136	0	0	113	H658 H680 L681	H658-E660 PolarHBondContact O-N 3.28Å; E660-H680 WeakPolarHBondContact OE1-CA 3.24Å; E660-H680 IonicContact OE1-ND1 3.73Å; E660-H680 IonicContact OE2-CE1 2.65Å; E660-H680 IonicContact OE2-CG 2.73Å; E660-H680 IonicContact OE2-ND1 2.74Å; E660-H680 PolarHBondContact OE2-ND1 3.22Å; E660-L681 PolarHBondContact N-O 3.3Å; E660-L681 PolarHBondContact OE1-N 3.44Å
661	D	88.8	Confident	88.6	Confident	81 Å²	81	67.9 Å²	67.9	43%	0.433	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-17.1	-174.5	-70.3	-15.6	0	0	0	114	C659 L682 C686 R690	C659-D661 VanDerWaalsContact C-N 3.28Å; C659-D661 PolarHBondContact O-N 3.14Å; D661-L682 HydrophobicContact CB-CD2 4.35Å; D661-L682 VanDerWaalsContact OD2-CD2 3.25Å; D661-L682 WeakPolarHBondContact OD2-CD2 3.41Å; D661-C686 HydrophobicContact CB-CB 3.88Å; D661-R690 IonicContact OD1-CZ 2.66Å; D661-R690 IonicContact OD1-NH1 3.88Å; D661-R690 PolarHBondContact OD1-NH1 3.02Å; D661-R690 IonicContact OD2-CZ 2.63Å; D661-R690 IonicContact OD2-NH1 3.89Å; D661-R690 PolarHBondContact OD2-NH1 3.32Å
662	C	90.8	Very high	88.2	Confident	72 Å²	72	70 Å²	70	49%	0.486	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.6	0.1	-176.1	71.8	0	0	0	0	116.3	C659 L664 C686	C659-C662 VanDerWaalsContact CB-SG 3.6Å; C659-C662 PolarHBondContact O-N 3.19Å; C659-C662 PolarHBondContact SG-SG 3Å; C662-L664 PolarHBondContact O-N 2.85Å; C662-L664 VanDerWaalsContact O-N 3.12Å; C662-C686 VanDerWaalsContact SG-SG 3.67Å
663	G	87.6	Confident	88	Confident	53 Å²	53	73.8 Å²	73.8	55%	0.546	39%	0.394	S	S	.	.			trans	70.1	0.2	178	0	0	0	0	0	115.7	C659 Q665	C659-G663 WeakPolarHBondContact O-CA 3.34Å; C659-G663 PolarHBondContact O-N 2.87Å; G663-Q665 PolarHBondContact O-N 2.82Å
664	L	89.5	Confident	87.8	Confident	69 Å²	69	73.6 Å²	73.6	36%	0.361	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-60.7	121.7	177.1	-177.8	65.9	0	0	0	110.1	H658 C659 C662 L666 C683	H658-L664 CarbonylContact C-O 3.58Å; H658-L664 VanDerWaalsContact CA-O 3.28Å; H658-L664 WeakPolarHBondContact CA-O 3.4Å; H658-L664 WeakPolarHBondContact CB-O 3.38Å; C659-L664 HydrophobicContact CB-CB 4.32Å; C659-L664 PolarHBondContact N-O 2.92Å; C662-L664 PolarHBondContact O-N 2.85Å; C662-L664 VanDerWaalsContact O-N 3.12Å; L664-L666 PolarHBondContact O-N 2.64Å; L664-C683 HydrophobicContact CD2-CB 3.93Å
665	Q	91.2	Very high	87.8	Confident	102 Å²	102	74 Å²	74	48%	0.477	39%	0.392	S	S	.	.	B	Isolated β-bridge	trans	-61.4	132.6	173.8	-168	173.9	19.1	0	0	109.6	V654 G663	V654-Q665 PolarHBondContact O-NE2 3.12Å; G663-Q665 PolarHBondContact O-N 2.82Å
666	L	89.2	Confident	87.7	Confident	6 Å²	6	69.1 Å²	69.1	3%	0.031	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-96.9	144.7	-177.9	-59.3	172.5	0	0	0	109.4	Y657 C659 L664 H672 C674 L681 C683	Y657-L666 HydrophobicContact CD1-CB 3.67Å; Y657-L666 VanDerWaalsContact CD1-O 3.32Å; Y657-L666 WeakPolarHBondContact CD1-O 3.35Å; Y657-L666 HydrophobicContact CE1-CB 3.5Å; Y657-L666 VanDerWaalsContact CE1-CB 3.5Å; Y657-L666 HydrophobicContact CE1-CD1 4.48Å; Y657-L666 PolarHBondContact O-N 3.23Å; C659-L666 HydrophobicContact CB-CD2 4.29Å; L664-L666 PolarHBondContact O-N 2.64Å; L666-H672 VanDerWaalsContact CA-O 3.27Å; L666-H672 WeakPolarHBondContact CA-O 3.49Å; L666-H672 WeakPolarHBondContact CD2-O 3.43Å; L666-C674 HydrophobicContact CD1-CB 3.99Å; L666-L681 HydrophobicContact CD1-CB 4.11Å; L666-C683 HydrophobicContact CD2-CB 3.8Å
667	N	88.2	Confident	87.6	Confident	61 Å²	61	69.4 Å²	69.4	33%	0.326	38%	0.375	S	S	.	.			trans	-152.9	-172.3	173.3	72.7	21.1	0	0	0	109.4	E669 H672 R673	N667-E669 VanDerWaalsContact C-N 3.35Å; N667-E669 VanDerWaalsContact ND2-CD 3.33Å; N667-E669 PolarHBondContact ND2-OE2 3.13Å; N667-E669 PolarHBondContact O-N 3.14Å; N667-E669 WeakPolarHBondContact OD1-CB 3.18Å; N667-E669 VanDerWaalsContact OD1-CG 3.29Å; N667-E669 WeakPolarHBondContact OD1-CG 3.24Å; N667-E669 PolarHBondContact OD1-N 2.95Å; N667-E669 PolarHBondContact OD1-OE2 3.43Å; N667-H672 PolarHBondContact N-O 3.48Å; N667-H672 CarbonylContact O-C 3.51Å; N667-H672 WeakPolarHBondContact OD1-CB 3.18Å; N667-R673 VanDerWaalsContact O-CA 3.22Å; N667-R673 WeakPolarHBondContact O-CA 3.49Å; N667-R673 PolarHBondContact O-N 2.96Å
668	D	85.4	Confident	87.2	Confident	150 Å²	150	76 Å²	76	80%	0.802	41%	0.406	S	S	*	.	S	Bend	trans	-81.6	-6.7	-177	-63.8	-44.1	0	0	0	114.9	R673	D668-R673 PolarHBondContact O-NE 3.49Å
669	E	87	Confident	86.7	Confident	111 Å²	111	73.6 Å²	73.6	52%	0.519	40%	0.401	S	S	.	.	S	Bend	trans	-72.1	152.8	-175	-56.4	173.7	142.1	0	0	113.3	N667 G671 H672 R673	N667-E669 VanDerWaalsContact C-N 3.35Å; N667-E669 VanDerWaalsContact ND2-CD 3.33Å; N667-E669 PolarHBondContact ND2-OE2 3.13Å; N667-E669 PolarHBondContact O-N 3.14Å; N667-E669 WeakPolarHBondContact OD1-CB 3.18Å; N667-E669 VanDerWaalsContact OD1-CG 3.29Å; N667-E669 WeakPolarHBondContact OD1-CG 3.24Å; N667-E669 PolarHBondContact OD1-N 2.95Å; N667-E669 PolarHBondContact OD1-OE2 3.43Å; E669-G671 PolarHBondContact O-N 3.43Å; E669-G671 VanDerWaalsContact O-N 3.12Å; E669-H672 PolarHBondContact O-N 3.21Å; E669-H672 VanDerWaalsContact O-N 3.11Å; E669-H672 IonicContact OE2-CE1 3.87Å; E669-H672 IonicContact OE2-ND1 3.63Å; E669-H672 PolarHBondContact OE2-ND1 3.46Å; E669-H672 VanDerWaalsContact OE2-ND1 3.14Å; E669-R673 WeakPolarHBondContact O-CG 3.38Å; E669-R673 PolarHBondContact O-N 3.37Å
670	E	79.1	Confident	86.5	Confident	151 Å²	151	76.4 Å²	76.4	71%	0.706	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	117.5	174.2	-76.4	70	-131.4	0	0	112.4	R673	E670-R673 IonicContact OE1-CZ 3.86Å; E670-R673 IonicContact OE1-NH2 3.14Å; E670-R673 PolarHBondContact OE1-NH2 3.01Å
671	G	77.3	Confident	86.6	Confident	52 Å²	52	72 Å²	72	54%	0.536	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.5	-29.1	179.5	0	0	0	0	0	114.4	E669	E669-G671 PolarHBondContact O-N 3.43Å; E669-G671 VanDerWaalsContact O-N 3.12Å
672	H	82.8	Confident	86.6	Confident	72 Å²	72	68.1 Å²	68.1	33%	0.333	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-7.9	178.4	-61.3	131.9	0	0	0	113.5	L666 N667 E669	L666-H672 VanDerWaalsContact CA-O 3.27Å; L666-H672 WeakPolarHBondContact CA-O 3.49Å; L666-H672 WeakPolarHBondContact CD2-O 3.43Å; N667-H672 PolarHBondContact N-O 3.48Å; N667-H672 CarbonylContact O-C 3.51Å; N667-H672 WeakPolarHBondContact OD1-CB 3.18Å; E669-H672 PolarHBondContact O-N 3.21Å; E669-H672 VanDerWaalsContact O-N 3.11Å; E669-H672 IonicContact OE2-CE1 3.87Å; E669-H672 IonicContact OE2-ND1 3.63Å; E669-H672 PolarHBondContact OE2-ND1 3.46Å; E669-H672 VanDerWaalsContact OE2-ND1 3.14Å
673	R	86.4	Confident	86.7	Confident	88 Å²	88	65 Å²	65	33%	0.332	35%	0.352	S	S	.	.			trans	-55.5	145.6	177.7	-50.3	-159.5	-160	138.4	-1.2	113.8	N667 D668 E669 E670 Y675	N667-R673 VanDerWaalsContact O-CA 3.22Å; N667-R673 WeakPolarHBondContact O-CA 3.49Å; N667-R673 PolarHBondContact O-N 2.96Å; D668-R673 PolarHBondContact O-NE 3.49Å; E669-R673 WeakPolarHBondContact O-CG 3.38Å; E669-R673 PolarHBondContact O-N 3.37Å; E670-R673 IonicContact OE1-CZ 3.86Å; E670-R673 IonicContact OE1-NH2 3.14Å; E670-R673 PolarHBondContact OE1-NH2 3.01Å; R673-Y675 HydrophobicContact CB-CE2 4Å; R673-Y675 VanDerWaalsContact O-CD2 3.24Å; R673-Y675 WeakPolarHBondContact O-CD2 3.15Å; R673-Y675 WeakPolarHBondContact O-CE2 3.04Å
674	C	88.4	Confident	86.8	Confident	42 Å²	42	66.8 Å²	66.8	28%	0.284	35%	0.346	S	S	.	.	B	Isolated β-bridge	trans	-74.9	141.8	172.5	59.1	0	0	0	0	112.9	Y657 L666 L682	Y657-C674 WeakPolarHBondContact OH-CB 3.43Å; Y657-C674 PolarHBondContact OH-SG 3.07Å; L666-C674 HydrophobicContact CD1-CB 3.99Å; C674-L682 CarbonylContact C-O 3.57Å; C674-L682 WeakPolarHBondContact CA-O 3.46Å
675	Y	88.8	Confident	86.8	Confident	75 Å²	75	68.2 Å²	68.2	29%	0.294	35%	0.354	S	S	.	.			trans	-128.6	81.8	173.7	-70.1	-94.7	0	0	0	108.7	R673 L677 L682 H684 H687	R673-Y675 HydrophobicContact CB-CE2 4Å; R673-Y675 VanDerWaalsContact O-CD2 3.24Å; R673-Y675 WeakPolarHBondContact O-CD2 3.15Å; R673-Y675 WeakPolarHBondContact O-CE2 3.04Å; Y675-L677 PolarHBondContact O-N 3.19Å; Y675-L682 PolarHBondContact N-O 2.95Å; Y675-H684 HydrophobicContact CD2-CB 3.9Å; Y675-H684 AromaticContact CE1-CD2 3.95Å; Y675-H684 HydrophobicContact CE2-CB 3.62Å; Y675-H684 AromaticContact CE2-CD2 3.93Å; Y675-H684 AromaticContact CZ-CD2 3.65Å; Y675-H687 HydrophobicContact CG-CB 4.4Å; Y675-H687 PolarHBondContact O-CD2 3.18Å
676	P	86.8	Confident	86.8	Confident	68 Å²	68	63.7 Å²	63.7	44%	0.442	33%	0.333	S	S	.	.			trans	-65.4	130	-172.8	24.2	-33.1	0	0	0	112.4	M648 H680	M648-P676 HydrophobicContact CE-CB 3.99Å; M648-P676 HydrophobicContact CG-CB 3.71Å; M648-P676 HydrophobicContact CG-CG 4.47Å; M648-P676 HydrophobicContact SD-CB 3.39Å; M648-P676 WeakPolarHBondContact SD-CB 3.38Å; P676-H680 WeakPolarHBondContact CA-O 3.38Å
677	L	87.8	Confident	86.8	Confident	28 Å²	28	65.2 Å²	65.2	15%	0.147	34%	0.34	C	S	.	.	B	Isolated β-bridge	trans	-136	119.5	179.7	-172.6	64.7	0	0	0	110.6	Y675 G679 H680 L682 R690 L691	Y675-L677 PolarHBondContact O-N 3.19Å; L677-G679 PolarHBondContact O-N 3.22Å; L677-H680 PolarHBondContact N-O 3.24Å; L677-H680 VanDerWaalsContact N-O 3.17Å; L677-H680 WeakPolarHBondContact O-CB 3.48Å; L677-H680 PolarHBondContact O-CD2 2.95Å; L677-H680 PolarHBondContact O-N 2.96Å; L677-L682 HydrophobicContact CB-CD1 3.84Å; L677-L682 HydrophobicContact CD2-CD1 4.26Å; L677-R690 HydrophobicContact CD2-CB 4.25Å; L677-R690 HydrophobicContact CD2-CG 4.34Å; L677-L691 HydrophobicContact CD1-CD2 4.06Å; L677-L691 HydrophobicContact CD2-CD2 3.95Å; L677-L691 HydrophobicContact CD2-CG 4.12Å
678	E	83.9	Confident	86.9	Confident	146 Å²	146	65.2 Å²	65.2	68%	0.682	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	20	178.3	-72.8	167.3	-155.5	0	0	115.9	K694	E678-K694 IonicContact OE1-NZ 2.64Å; E678-K694 PolarHBondContact OE1-NZ 3.12Å; E678-K694 IonicContact OE2-NZ 2.72Å; E678-K694 PolarHBondContact OE2-NZ 3.23Å
679	G	82.8	Confident	87	Confident	22 Å²	22	63 Å²	63	23%	0.227	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	105.2	-4.3	-178.6	0	0	0	0	0	114.8	M648 K650 L677	M648-G679 VanDerWaalsContact SD-CA 3.58Å; K650-G679 PolarHBondContact NZ-O 3.39Å; L677-G679 PolarHBondContact O-N 3.22Å
680	H	86.6	Confident	87	Confident	59 Å²	59	60.2 Å²	60.2	27%	0.273	31%	0.309	S	S	.	.	B	Isolated β-bridge	trans	-93.6	140.1	179.2	-61.1	-76.5	0	0	0	112.9	E660 P676 L677 L682 R690	E660-H680 WeakPolarHBondContact OE1-CA 3.24Å; E660-H680 IonicContact OE1-ND1 3.73Å; E660-H680 IonicContact OE2-CE1 2.65Å; E660-H680 IonicContact OE2-CG 2.73Å; E660-H680 IonicContact OE2-ND1 2.74Å; E660-H680 PolarHBondContact OE2-ND1 3.22Å; P676-H680 WeakPolarHBondContact CA-O 3.38Å; L677-H680 PolarHBondContact N-O 3.24Å; L677-H680 VanDerWaalsContact N-O 3.17Å; L677-H680 WeakPolarHBondContact O-CB 3.48Å; L677-H680 PolarHBondContact O-CD2 2.95Å; L677-H680 PolarHBondContact O-N 2.96Å; H680-L682 HydrophobicContact CB-CD2 4.39Å; H680-L682 HydrophobicContact CB-CG 4.32Å; H680-R690 PolarHBondContact CD2-NH2 3.47Å; H680-R690 PolarHBondContact CE1-NH2 2.96Å; H680-R690 VanDerWaalsContact CG-NH2 3.34Å; H680-R690 PolarHBondContact ND1-NH2 3.21Å; H680-R690 PolarHBondContact NE2-NH2 3Å
681	L	89.7	Confident	87.3	Confident	4 Å²	4	56.6 Å²	56.6	2%	0.021	29%	0.294	C	S	.	.			trans	-84.3	117.3	170.3	-64.4	-177.7	0	0	0	110.5	Y652 Y657 C659 E660 L666	Y652-L681 HydrophobicContact CD1-CD1 4.17Å; Y652-L681 HydrophobicContact CE1-CD1 3.63Å; Y652-L681 HydrophobicContact CE2-CD1 4.19Å; Y657-L681 HydrophobicContact CD2-CD1 3.58Å; Y657-L681 HydrophobicContact CE2-CD1 3.57Å; Y657-L681 HydrophobicContact CE2-CD2 3.76Å; Y657-L681 HydrophobicContact CE2-CG 4.31Å; C659-L681 WeakPolarHBondContact CA-O 3.47Å; E660-L681 PolarHBondContact N-O 3.3Å; E660-L681 PolarHBondContact OE1-N 3.44Å; L666-L681 HydrophobicContact CD1-CB 4.11Å
682	L	89.8	Confident	87.6	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.296	C	S	.	.			trans	-129.6	147.2	-178.3	-54.5	173.5	0	0	0	111.2	D661 C674 Y675 L677 H680 C686 H687 R690	D661-L682 HydrophobicContact CB-CD2 4.35Å; D661-L682 VanDerWaalsContact OD2-CD2 3.25Å; D661-L682 WeakPolarHBondContact OD2-CD2 3.41Å; C674-L682 CarbonylContact C-O 3.57Å; C674-L682 WeakPolarHBondContact CA-O 3.46Å; Y675-L682 PolarHBondContact N-O 2.95Å; L677-L682 HydrophobicContact CB-CD1 3.84Å; L677-L682 HydrophobicContact CD2-CD1 4.26Å; H680-L682 HydrophobicContact CB-CD2 4.39Å; H680-L682 HydrophobicContact CB-CG 4.32Å; L682-C686 HydrophobicContact CB-CB 4.43Å; L682-C686 HydrophobicContact CD2-CB 4.32Å; L682-H687 HydrophobicContact CB-CB 4.12Å; L682-H687 HydrophobicContact CD1-CB 4.3Å; L682-R690 HydrophobicContact CD1-CB 4.34Å
683	C	91.9	Very high	87.2	Confident	7 Å²	7	61.1 Å²	61.1	5%	0.047	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	-80	165.4	161.8	74.4	0	0	0	0	110.6	C659 L664 L666 N685 C686 H687	C659-C683 HydrophobicContact CB-CB 4.21Å; C659-C683 PolarHBondContact SG-N 3.47Å; L664-C683 HydrophobicContact CD2-CB 3.93Å; L666-C683 HydrophobicContact CD2-CB 3.8Å; C683-N685 VanDerWaalsContact C-N 3.26Å; C683-N685 PolarHBondContact O-N 3.44Å; C683-N685 VanDerWaalsContact O-N 3.14Å; C683-C686 PolarHBondContact O-N 2.97Å; C683-C686 VanDerWaalsContact SG-SG 3.69Å; C683-H687 WeakPolarHBondContact O-CB 3.44Å; C683-H687 PolarHBondContact O-N 3.04Å
684	H	89.8	Confident	86.2	Confident	90 Å²	90	61.3 Å²	61.3	42%	0.417	32%	0.315	S	S	.	.	H	α-helix	trans	-48.8	-43.1	-177.9	-176.4	-107.1	0	0	0	114.2	Y675 I688	Y675-H684 HydrophobicContact CD2-CB 3.9Å; Y675-H684 AromaticContact CE1-CD2 3.95Å; Y675-H684 HydrophobicContact CE2-CB 3.62Å; Y675-H684 AromaticContact CE2-CD2 3.93Å; Y675-H684 AromaticContact CZ-CD2 3.65Å; H684-I688 VanDerWaalsContact CE1-CD1 3.44Å; H684-I688 WeakPolarHBondContact CE1-CD1 3.43Å; H684-I688 WeakPolarHBondContact O-CG1 3.39Å; H684-I688 PolarHBondContact O-N 3.08Å
685	N	89.3	Confident	84.8	Confident	99 Å²	99	65.6 Å²	65.6	53%	0.529	33%	0.334	S	S	.	.	H	α-helix	trans	-69.5	-47.8	-177.9	-170.2	39.8	0	0	0	112.2	C683 H687 I688 Q689	C683-N685 VanDerWaalsContact C-N 3.26Å; C683-N685 PolarHBondContact O-N 3.44Å; C683-N685 VanDerWaalsContact O-N 3.14Å; N685-H687 VanDerWaalsContact C-N 3.34Å; N685-H687 PolarHBondContact O-N 3.18Å; N685-I688 PolarHBondContact O-N 3.42Å; N685-Q689 PolarHBondContact ND2-NE2 2.95Å; N685-Q689 WeakPolarHBondContact O-CG 3.43Å; N685-Q689 PolarHBondContact O-N 3.09Å
686	C	90.9	Very high	83.1	Confident	7 Å²	7	66.3 Å²	66.3	5%	0.047	35%	0.348	C	S	.	.	H	α-helix	trans	-66.3	-37.3	178.3	-63.7	0	0	0	0	111.7	D661 C662 L682 C683 I688 Q689 R690	D661-C686 HydrophobicContact CB-CB 3.88Å; C662-C686 VanDerWaalsContact SG-SG 3.67Å; L682-C686 HydrophobicContact CB-CB 4.43Å; L682-C686 HydrophobicContact CD2-CB 4.32Å; C683-C686 PolarHBondContact O-N 2.97Å; C683-C686 VanDerWaalsContact SG-SG 3.69Å; C686-I688 PolarHBondContact O-N 3.23Å; C686-Q689 PolarHBondContact O-N 3.15Å; C686-R690 VanDerWaalsContact O-CB 3.3Å; C686-R690 WeakPolarHBondContact O-CB 3.47Å; C686-R690 PolarHBondContact O-N 3.17Å
687	H	89.8	Confident	81.4	Confident	38 Å²	38	68 Å²	68	18%	0.176	37%	0.367	C	S	.	.	H	α-helix	trans	-56.3	-48.3	172.4	173.7	-99	0	0	0	112.3	Y675 L682 C683 N685 R690 L691	Y675-H687 HydrophobicContact CG-CB 4.4Å; Y675-H687 PolarHBondContact O-CD2 3.18Å; L682-H687 HydrophobicContact CB-CB 4.12Å; L682-H687 HydrophobicContact CD1-CB 4.3Å; C683-H687 WeakPolarHBondContact O-CB 3.44Å; C683-H687 PolarHBondContact O-N 3.04Å; N685-H687 VanDerWaalsContact C-N 3.34Å; N685-H687 PolarHBondContact O-N 3.18Å; H687-R690 PolarHBondContact O-N 3.28Å; H687-L691 VanDerWaalsContact CE1-CD1 3.41Å; H687-L691 WeakPolarHBondContact CE1-CD1 3.48Å; H687-L691 WeakPolarHBondContact O-CG 3.39Å; H687-L691 PolarHBondContact O-N 2.94Å
688	I	89.8	Confident	79.7	Confident	60 Å²	60	74.2 Å²	74.2	31%	0.308	40%	0.396	S	S	.	.	H	α-helix	trans	-63.8	-44.1	177.1	-70.4	172	0	0	0	111.2	H684 N685 C686 R690 L691 Q692	H684-I688 VanDerWaalsContact CE1-CD1 3.44Å; H684-I688 WeakPolarHBondContact CE1-CD1 3.43Å; H684-I688 WeakPolarHBondContact O-CG1 3.39Å; H684-I688 PolarHBondContact O-N 3.08Å; N685-I688 PolarHBondContact O-N 3.42Å; C686-I688 PolarHBondContact O-N 3.23Å; I688-R690 PolarHBondContact O-N 3.03Å; I688-L691 PolarHBondContact O-N 3.37Å; I688-Q692 HydrophobicContact CG2-CG 4.29Å; I688-Q692 WeakPolarHBondContact O-CB 3.48Å; I688-Q692 WeakPolarHBondContact O-CG 3.26Å; I688-Q692 PolarHBondContact O-N 3.35Å
689	Q	87.8	Confident	78.3	Confident	104 Å²	104	72.5 Å²	72.5	49%	0.486	40%	0.397	S	S	.	.	H	α-helix	trans	-61.1	-43.1	177.7	-69.7	176.8	10.7	0	0	112.1	N685 C686 L691 Q692 S693	N685-Q689 PolarHBondContact ND2-NE2 2.95Å; N685-Q689 WeakPolarHBondContact O-CG 3.43Å; N685-Q689 PolarHBondContact O-N 3.09Å; C686-Q689 PolarHBondContact O-N 3.15Å; Q689-L691 VanDerWaalsContact C-N 3.33Å; Q689-L691 PolarHBondContact O-N 3.11Å; Q689-Q692 PolarHBondContact O-N 2.87Å; Q689-S693 WeakPolarHBondContact O-CB 3.43Å; Q689-S693 PolarHBondContact O-N 2.82Å; Q689-S693 PolarHBondContact O-OG 3.13Å; Q689-S693 VanDerWaalsContact O-OG 3.07Å
690	R	86.8	Confident	77	Confident	52 Å²	52	76.8 Å²	76.8	20%	0.196	42%	0.421	C	S	.	.	H	α-helix	trans	-71.3	-24.8	-179.5	-154.8	-179.9	-169.3	121.2	-10.9	113.1	D661 L677 H680 L682 C686 H687 I688 S693 K694	D661-R690 IonicContact OD1-CZ 2.66Å; D661-R690 IonicContact OD1-NH1 3.88Å; D661-R690 PolarHBondContact OD1-NH1 3.02Å; D661-R690 IonicContact OD2-CZ 2.63Å; D661-R690 IonicContact OD2-NH1 3.89Å; D661-R690 PolarHBondContact OD2-NH1 3.32Å; L677-R690 HydrophobicContact CD2-CB 4.25Å; L677-R690 HydrophobicContact CD2-CG 4.34Å; H680-R690 PolarHBondContact CD2-NH2 3.47Å; H680-R690 PolarHBondContact CE1-NH2 2.96Å; H680-R690 VanDerWaalsContact CG-NH2 3.34Å; H680-R690 PolarHBondContact ND1-NH2 3.21Å; H680-R690 PolarHBondContact NE2-NH2 3Å; L682-R690 HydrophobicContact CD1-CB 4.34Å; C686-R690 VanDerWaalsContact O-CB 3.3Å; C686-R690 WeakPolarHBondContact O-CB 3.47Å; C686-R690 PolarHBondContact O-N 3.17Å; H687-R690 PolarHBondContact O-N 3.28Å; I688-R690 PolarHBondContact O-N 3.03Å; R690-S693 WeakPolarHBondContact CA-OG 3.18Å; R690-S693 PolarHBondContact O-OG 3.41Å; R690-K694 WeakPolarHBondContact O-CD 3.34Å; R690-K694 WeakPolarHBondContact O-CG 3.49Å
691	L	86.6	Confident	75.5	Confident	75 Å²	75	79 Å²	79	39%	0.393	44%	0.441	S	S	.	.	H	α-helix	trans	-75.9	-46.9	167.2	-73.5	175.8	0	0	0	111.8	L677 H687 I688 Q689 S693 K694 L695	L677-L691 HydrophobicContact CD1-CD2 4.06Å; L677-L691 HydrophobicContact CD2-CD2 3.95Å; L677-L691 HydrophobicContact CD2-CG 4.12Å; H687-L691 VanDerWaalsContact CE1-CD1 3.41Å; H687-L691 WeakPolarHBondContact CE1-CD1 3.48Å; H687-L691 WeakPolarHBondContact O-CG 3.39Å; H687-L691 PolarHBondContact O-N 2.94Å; I688-L691 PolarHBondContact O-N 3.37Å; Q689-L691 VanDerWaalsContact C-N 3.33Å; Q689-L691 PolarHBondContact O-N 3.11Å; L691-S693 VanDerWaalsContact C-N 3.32Å; L691-S693 PolarHBondContact O-N 3Å; L691-K694 PolarHBondContact O-N 3.4Å; L691-L695 PolarHBondContact O-N 3.27Å
692	Q	83.1	Confident	73.5	Confident	126 Å²	126	86.5 Å²	86.5	59%	0.589	48%	0.481	S	S	*	.	H	α-helix	trans	-61.4	-39.1	180	-75	175.7	-7.8	0	0	112.2	I688 Q689 K694 L695	I688-Q692 HydrophobicContact CG2-CG 4.29Å; I688-Q692 WeakPolarHBondContact O-CB 3.48Å; I688-Q692 WeakPolarHBondContact O-CG 3.26Å; I688-Q692 PolarHBondContact O-N 3.35Å; Q689-Q692 PolarHBondContact O-N 2.87Å; Q692-K694 PolarHBondContact O-N 3.38Å; Q692-L695 PolarHBondContact O-N 3.43Å
693	S	73.6	Confident	71.6	Confident	94 Å²	94	95.4 Å²	95.4	66%	0.657	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-12.4	175.7	58.7	0	0	0	0	114.7	Q689 R690 L691	Q689-S693 WeakPolarHBondContact O-CB 3.43Å; Q689-S693 PolarHBondContact O-N 2.82Å; Q689-S693 PolarHBondContact O-OG 3.13Å; Q689-S693 VanDerWaalsContact O-OG 3.07Å; R690-S693 WeakPolarHBondContact CA-OG 3.18Å; R690-S693 PolarHBondContact O-OG 3.41Å; L691-S693 VanDerWaalsContact C-N 3.32Å; L691-S693 PolarHBondContact O-N 3Å
694	K	66.3	Low	69.7	Low	92 Å²	92	100.2 Å²	100.2	40%	0.4	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-16.8	175.7	-77.6	176	175.7	177.2	0	113.6	E678 R690 L691 Q692 P696	E678-K694 IonicContact OE1-NZ 2.64Å; E678-K694 PolarHBondContact OE1-NZ 3.12Å; E678-K694 IonicContact OE2-NZ 2.72Å; E678-K694 PolarHBondContact OE2-NZ 3.23Å; R690-K694 WeakPolarHBondContact O-CD 3.34Å; R690-K694 WeakPolarHBondContact O-CG 3.49Å; L691-K694 PolarHBondContact O-N 3.4Å; Q692-K694 PolarHBondContact O-N 3.38Å; K694-P696 WeakPolarHBondContact O-CD 3.21Å
695	L	59.4	Low	67.8	Low	131 Å²	131	103.6 Å²	103.6	69%	0.686	57%	0.567	S	S	*	*	S	Bend	trans	-74.3	119.1	170.8	-68	174.5	0	0	0	108.5	L691 Q692 A697	L691-L695 PolarHBondContact O-N 3.27Å; Q692-L695 PolarHBondContact O-N 3.43Å; L695-A697 PolarHBondContact O-N 3.25Å
696	P	52.3	Low	66	Low	91 Å²	91	107 Å²	107	59%	0.591	58%	0.58	S	S	*	*			trans	-62.7	133.4	173.2	26.7	-33	0	0	0	109	K694 H698	K694-P696 WeakPolarHBondContact O-CD 3.21Å; P696-H698 PolarHBondContact O-CD2 2.8Å; P696-H698 PolarHBondContact O-N 2.88Å
697	A	51.3	Low	64.1	Low	102 Å²	102	112.5 Å²	112.5	84%	0.843	61%	0.613	S	S	*	*			trans	-70.4	80.1	178.3	0	0	0	0	0	110.7	L695 P699	L695-A697 PolarHBondContact O-N 3.25Å; A697-P699 WeakPolarHBondContact O-CD 3.49Å
698	H	51.9	Low	62.4	Low	160 Å²	160	116.4 Å²	116.4	74%	0.741	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-60.6	119.2	166.7	-75.5	-83.6	0	0	0	108.5	P696	P696-H698 PolarHBondContact O-CD2 2.8Å; P696-H698 PolarHBondContact O-N 2.88Å
699	P	55.8	Low	60.8	Low	109 Å²	109	122.4 Å²	122.4	71%	0.708	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-63.3	147.1	170.4	28.5	-33.8	0	0	0	109	A697	A697-P699 WeakPolarHBondContact O-CD 3.49Å
700	P	54.8	Low	59.1	Low	112 Å²	112	129 Å²	129	73%	0.727	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-60.7	142.1	-179.9	25.8	-34.3	0	0	0	110.5	N702	P700-N702 PolarHBondContact O-N 3.15Å
701	P	54.3	Low	57.7	Low	107 Å²	107	132.9 Å²	132.9	70%	0.695	73%	0.729	S	S	*	*			trans	-62.9	110.6	174.1	26.3	-32.9	0	0	0	108.9	Y703	P701-Y703 VanDerWaalsContact C-N 3.33Å; P701-Y703 HydrophobicContact CB-CD2 4.44Å; P701-Y703 HydrophobicContact CB-CE2 4.49Å; P701-Y703 PolarHBondContact O-N 2.97Å
702	N	49.2	Very low	56.2	Low	161 Å²	161	135.9 Å²	135.9	86%	0.861	75%	0.746	S	S	*	*			trans	-74.1	84.3	-174.7	-168.3	19.2	0	0	0	110.1	P700 P704	P700-N702 PolarHBondContact O-N 3.15Å; N702-P704 VanDerWaalsContact O-CD 3.28Å; N702-P704 WeakPolarHBondContact O-CD 3.48Å
703	Y	49.4	Very low	54.7	Low	186 Å²	186	136.4 Å²	136.4	73%	0.729	76%	0.755	S	S	*	*			trans	-69.6	115.5	178.1	-96.9	-89.1	0	0	0	110.6	P701 L705	P701-Y703 VanDerWaalsContact C-N 3.33Å; P701-Y703 HydrophobicContact CB-CD2 4.44Å; P701-Y703 HydrophobicContact CB-CE2 4.49Å; P701-Y703 PolarHBondContact O-N 2.97Å; Y703-L705 PolarHBondContact O-N 2.85Å; Y703-L705 VanDerWaalsContact O-N 3.09Å
704	P	52.5	Low	53.6	Low	109 Å²	109	138.9 Å²	138.9	71%	0.708	76%	0.761	S	S	*	*			trans	-74.8	102.3	173.5	30.8	-31.9	0	0	0	109.1	N702 H706	N702-P704 VanDerWaalsContact O-CD 3.28Å; N702-P704 WeakPolarHBondContact O-CD 3.48Å; P704-H706 VanDerWaalsContact C-N 3.34Å; P704-H706 PolarHBondContact O-N 3.43Å
705	L	49.7	Very low	52.8	Low	160 Å²	160	141.9 Å²	141.9	84%	0.838	78%	0.783	S	S	*	*			trans	-69.3	93.5	168.4	-71	178.2	0	0	0	109.1	Y703 V707	Y703-L705 PolarHBondContact O-N 2.85Å; Y703-L705 VanDerWaalsContact O-N 3.09Å; L705-V707 PolarHBondContact O-N 2.72Å; L705-V707 VanDerWaalsContact O-N 3.07Å
706	H	51.5	Low	52.4	Low	171 Å²	171	142.6 Å²	142.6	79%	0.792	79%	0.79	S	S	*	*			trans	-70	101.4	172.8	-133.8	-69.6	0	0	0	108.6	P704 T708	P704-H706 VanDerWaalsContact C-N 3.34Å; P704-H706 PolarHBondContact O-N 3.43Å; H706-T708 PolarHBondContact O-N 2.97Å
707	V	50.8	Low	52.4	Low	123 Å²	123	146.3 Å²	146.3	75%	0.745	80%	0.804	S	S	*	*			trans	-73.6	109.4	173.2	-179.2	0	0	0	0	108	L705	L705-V707 PolarHBondContact O-N 2.72Å; L705-V707 VanDerWaalsContact O-N 3.07Å
708	T	52.6	Low	52.5	Low	119 Å²	119	149.7 Å²	149.7	73%	0.73	80%	0.801	S	S	*	*			trans	-90.4	112.1	163.1	47.4	0	0	0	0	108.7	H706	H706-T708 PolarHBondContact O-N 2.97Å
709	E	56.2	Low	52.5	Low	186 Å²	186	148.8 Å²	148.8	87%	0.869	81%	0.806	S	S	*	*			trans	-68.7	138.5	168.2	-61.8	179.6	124.6	0	0	110.4
710	L	53.2	Low	52.2	Low	243 Å²	243	152.5 Å²	152.5	100%	1.272	82%	0.815	S	S	*	*			trans	-150	0	168	-87	177.6	0	0	0	109

Retrieved 710 of 710 residues in 238.8 ms (Link to these results)

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