A0A077Z770_TRITR Loading...

Phosphoribosylaminoimidazole carboxylase

AlphaFold DB , UniProt , Accession A0A077Z770, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,043 aa.

						>A0A077Z770_TRITR|A0A077Z770
MFQYPDPSFPTPSQPTEAEIIEIKKITTSIKRLIKSQRITVNGQPASFDKLVTHKRTESGIEVVFVVTDPRAGNTDRTPSVWDPSVSTFTKKLICKGILSLVPGVKDTIKCEEVKDGDGQYPDPSFPTPSQPTEVETVEITKITTSIKRLIKSQRITVNGQPASFDKLVTHKRTESGIEVVFVVKDPRADNTDGASTVLDPSISTFSKKLICKGILSLVPGVKDTIKCEALKGGEKQVGGYSTQRLLGVRLDHKPNHGLPTEAEITEIRKVTTSIQRVIVIQGITVNGQPAHFDKLVTHKKTESGFEVVFIVRDPRADNTGGTSSSVDPSGSLTVLGITKKLICKGTLSIVPGVRDNIKCEEIKDSVEERPKPNLPGGGHLALEDITEIVKITTSIKRLLVTKGIRVNGQLAHFETLITHKKTESGIEILFTVTDPRSDAPGDPSSGVDPSGTFTTVTQTTRLICEGILSLVLGVNNDIKCEDPKDNFEKYPIPSFATPIYSLREAVEQIIRITASIKRLIVSEGITVNGQLARFETLITHKKTQSGIEIVFTVIDPRADSTSRIFSGMDPTKTSATLLYSKKLICKGILSLVRGVKNHVKCEEIKDSDEQIDPSLPSSPSAPWANDPATTVVDTVEYVKILSKVKRLVFVEKMTVGGYYVRVDKLTKLEKVVTGMNIAFTIIPTTCATKVTPLGPQPSDPSDPEVVETTEIAEITTQIKTTIITKRFIINGQHARLDKLISHKKVDNGVQVEFTIMETTCDGNVHVTMEQLYGLSCIRHGYSKKLICKGIITTVPGMHPNIECSERDDVDEFDPSLPSTSHSDVIIDATTVSSQKVTISVQKLMLSESMTIKGHHVRVEKLTKVQKVISGVLVEFTISETTCSGRLRLTLEVIYSERCSVVQSTTVIVCKGLLPVRQGISHTIRCSGGDKLTEEYPGGPLYPSDSDGQMDKDSIYLLLKKTLFNKAIHLNGWYARLVSLDKIQRSIRNELLVSFTIAPSKCRSERKAVATRGRKLTEDAVKIIEKPTAAAVTVADTMEYLYA
					

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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	35	Very low	37.6	Very low	233 Å²	233	161.9 Å²	161.9	100%	1.148	85%	0.846	S	S	*	*				0	109.2	0	-162.6	166.5	-178.7	0	0	106.8
2	F	34.7	Very low	37.6	Very low	186 Å²	186	158.8 Å²	158.8	82%	0.816	84%	0.843	S	S	*	*			trans	30.6	106.6	173.6	-63	-79.7	0	0	0	121.1
3	Q	35.9	Very low	38.2	Very low	184 Å²	184	155.3 Å²	155.3	86%	0.86	84%	0.839	S	S	*	*			trans	-58.9	136.4	154.8	-92.5	158.3	-36.5	0	0	111.7
4	Y	38.2	Very low	39.4	Very low	219 Å²	219	157.1 Å²	157.1	86%	0.859	84%	0.84	S	S	*	*			trans	-134.4	117.5	150.4	-85.3	-84.8	0	0	0	107.9
5	P	47.7	Very low	41.1	Very low	116 Å²	116	151.3 Å²	151.3	75%	0.753	81%	0.814	S	S	*	*			trans	-85.1	135.8	165.1	12.3	3.9	0	0	0	110.7
6	D	38.4	Very low	43.4	Very low	164 Å²	164	146.9 Å²	146.9	88%	0.877	79%	0.794	S	S	*	*			trans	-52.4	131.7	174.3	-118.2	-28.5	0	0	0	113.2
7	P	41.1	Very low	45.5	Very low	115 Å²	115	147.4 Å²	147.4	75%	0.747	79%	0.79	S	S	*	*			trans	-104.7	103.1	175.2	34.6	-24.2	0	0	0	111.7
8	S	37.6	Very low	47.2	Very low	113 Å²	113	143.1 Å²	143.1	79%	0.79	78%	0.778	S	S	*	*			trans	179.7	79	146.4	54.4	0	0	0	0	112.1
9	F	32.7	Very low	48.8	Very low	201 Å²	201	140.6 Å²	140.6	88%	0.882	76%	0.761	S	S	*	*			trans	-95.9	130.5	150	-83.9	-85.9	0	0	0	107.5	T11	F9-T11 PolarHBondContact O-N 2.68Å; F9-T11 VanDerWaalsContact O-N 3.11Å
10	P	34.1	Very low	50.4	Low	121 Å²	121	138.1 Å²	138.1	79%	0.786	75%	0.746	S	S	*	*			trans	-64.8	115.6	172.1	25.5	-29.1	0	0	0	108.3
11	T	37.8	Very low	52	Low	129 Å²	129	135.6 Å²	135.6	79%	0.791	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-51.1	133.2	165.9	6.8	0	0	0	0	109.1	F9 S13	F9-T11 PolarHBondContact O-N 2.68Å; F9-T11 VanDerWaalsContact O-N 3.11Å; T11-S13 PolarHBondContact O-N 3.1Å; T11-S13 VanDerWaalsContact O-N 3.11Å
12	P	38.3	Very low	54.3	Low	124 Å²	124	127.7 Å²	127.7	81%	0.805	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-56.1	122.1	177.4	23.8	-33.3	0	0	0	108.8	Q14	P12-Q14 PolarHBondContact O-N 2.85Å
13	S	45.4	Very low	56.8	Low	114 Å²	114	121.7 Å²	121.7	80%	0.797	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-50.1	126.2	177.9	40	0	0	0	0	110	T11	T11-S13 PolarHBondContact O-N 3.1Å; T11-S13 VanDerWaalsContact O-N 3.11Å
14	Q	54.7	Low	59.3	Low	181 Å²	181	120.2 Å²	120.2	85%	0.846	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-53.6	139.6	172.5	-79	-176	-56.2	0	0	109.6	P12 T16	P12-Q14 PolarHBondContact O-N 2.85Å; Q14-T16 PolarHBondContact O-N 3.42Å
15	P	65	Low	61.6	Low	70 Å²	70	116.6 Å²	116.6	46%	0.455	65%	0.647	S	S	.	*	P	Polyproline II helix	trans	-58.4	136.1	179.5	22.8	-31.6	0	0	0	110.3	E19 I20	P15-E19 WeakPolarHBondContact CA-OE2 2.94Å; P15-E19 HydrophobicContact CB-CB 4.11Å; P15-I20 HydrophobicContact CB-CG1 4.15Å; P15-I20 HydrophobicContact CG-CD1 4.41Å; P15-I20 HydrophobicContact CG-CG1 4.07Å
16	T	77.7	Confident	63.6	Low	81 Å²	81	111.3 Å²	111.3	50%	0.497	61%	0.612	S	S	.	*	P	Polyproline II helix	trans	-61.2	154.4	175.8	55.4	0	0	0	0	110.7	Q14 A18 E19 I20	Q14-T16 PolarHBondContact O-N 3.42Å; T16-A18 PolarHBondContact O-N 3.44Å; T16-A18 VanDerWaalsContact O-N 3.12Å; T16-E19 PolarHBondContact N-OE2 2.89Å; T16-E19 WeakPolarHBondContact O-CA 3.32Å; T16-E19 WeakPolarHBondContact O-CB 3.45Å; T16-E19 PolarHBondContact O-N 2.9Å; T16-E19 VanDerWaalsContact OG1-CD 3.3Å; T16-E19 VanDerWaalsContact OG1-CG 3.27Å; T16-E19 WeakPolarHBondContact OG1-CG 3.32Å; T16-E19 PolarHBondContact OG1-N 3.18Å; T16-E19 PolarHBondContact OG1-OE2 3.32Å; T16-I20 WeakPolarHBondContact O-CG1 3.44Å; T16-I20 PolarHBondContact O-N 3.11Å
17	E	79.6	Confident	66	Low	155 Å²	155	104.7 Å²	104.7	72%	0.724	58%	0.578	S	S	*	*	H	α-helix	trans	-55.5	-33.6	178.9	-169.2	176.4	-178.3	0	0	112.3	I20 I21	E17-I20 PolarHBondContact O-N 3.11Å; E17-I21 HydrophobicContact CG-CD1 4.32Å; E17-I21 VanDerWaalsContact O-CG1 3.28Å; E17-I21 WeakPolarHBondContact O-CG1 3.48Å; E17-I21 PolarHBondContact O-N 2.98Å
18	A	75.8	Confident	68.3	Low	69 Å²	69	103.6 Å²	103.6	57%	0.57	57%	0.569	S	S	*	*	H	α-helix	trans	-63.4	-45.3	173.2	0	0	0	0	0	112.7	T16 I20 I21 E22	T16-A18 PolarHBondContact O-N 3.44Å; T16-A18 VanDerWaalsContact O-N 3.12Å; A18-I20 VanDerWaalsContact C-N 3.33Å; A18-I20 PolarHBondContact O-N 3.07Å; A18-I21 PolarHBondContact O-N 2.72Å; A18-E22 PolarHBondContact O-N 2.87Å
19	E	77.8	Confident	70.6	Confident	96 Å²	96	101.3 Å²	101.3	45%	0.449	55%	0.553	S	S	.	*	H	α-helix	trans	-63.8	-38.4	175.1	-73.7	167.3	147.1	0	0	111.2	P15 T16 E22 I23	P15-E19 WeakPolarHBondContact CA-OE2 2.94Å; P15-E19 HydrophobicContact CB-CB 4.11Å; T16-E19 PolarHBondContact N-OE2 2.89Å; T16-E19 WeakPolarHBondContact O-CA 3.32Å; T16-E19 WeakPolarHBondContact O-CB 3.45Å; T16-E19 PolarHBondContact O-N 2.9Å; T16-E19 VanDerWaalsContact OG1-CD 3.3Å; T16-E19 VanDerWaalsContact OG1-CG 3.27Å; T16-E19 WeakPolarHBondContact OG1-CG 3.32Å; T16-E19 PolarHBondContact OG1-N 3.18Å; T16-E19 PolarHBondContact OG1-OE2 3.32Å; E19-E22 PolarHBondContact O-N 3.5Å; E19-I23 WeakPolarHBondContact O-CB 3.31Å; E19-I23 WeakPolarHBondContact O-CD1 3.3Å; E19-I23 WeakPolarHBondContact O-CG1 3.48Å; E19-I23 PolarHBondContact O-N 3.41Å
20	I	81.5	Confident	73.3	Confident	91 Å²	91	91.7 Å²	91.7	47%	0.467	51%	0.511	S	S	.	.	H	α-helix	trans	-63.2	-44.2	175.3	-63.3	172.9	0	0	0	110.9	P15 T16 E17 A18 K24	P15-I20 HydrophobicContact CB-CG1 4.15Å; P15-I20 HydrophobicContact CG-CD1 4.41Å; P15-I20 HydrophobicContact CG-CG1 4.07Å; T16-I20 WeakPolarHBondContact O-CG1 3.44Å; T16-I20 PolarHBondContact O-N 3.11Å; E17-I20 PolarHBondContact O-N 3.11Å; A18-I20 VanDerWaalsContact C-N 3.33Å; A18-I20 PolarHBondContact O-N 3.07Å; I20-K24 VanDerWaalsContact O-CB 3.3Å; I20-K24 WeakPolarHBondContact O-CB 3.4Å; I20-K24 PolarHBondContact O-N 3.23Å
21	I	82.8	Confident	76	Confident	86 Å²	86	92 Å²	92	44%	0.441	50%	0.5	S	S	.	.	H	α-helix	trans	-63.8	-41.5	177.3	-69.2	166.1	0	0	0	110.9	E17 A18 K24 K25	E17-I21 HydrophobicContact CG-CD1 4.32Å; E17-I21 VanDerWaalsContact O-CG1 3.28Å; E17-I21 WeakPolarHBondContact O-CG1 3.48Å; E17-I21 PolarHBondContact O-N 2.98Å; A18-I21 PolarHBondContact O-N 2.72Å; I21-K24 PolarHBondContact O-N 2.76Å; I21-K25 HydrophobicContact CG2-CD 4.41Å; I21-K25 WeakPolarHBondContact O-CG 3.26Å; I21-K25 PolarHBondContact O-N 3.31Å
22	E	84	Confident	78.3	Confident	66 Å²	66	95.7 Å²	95.7	31%	0.308	50%	0.499	S	S	.	.	H	α-helix	trans	-65.9	-49.5	177.9	-175.2	166.2	-166.5	0	0	111.7	A18 E19 K24 K25 I26	A18-E22 PolarHBondContact O-N 2.87Å; E19-E22 PolarHBondContact O-N 3.5Å; E22-K24 PolarHBondContact O-N 2.87Å; E22-K25 WeakPolarHBondContact O-CB 3.25Å; E22-K25 PolarHBondContact O-N 2.83Å; E22-K25 VanDerWaalsContact O-N 3.08Å; E22-I26 HydrophobicContact CG-CD1 3.9Å; E22-I26 HydrophobicContact CG-CG1 4.47Å; E22-I26 WeakPolarHBondContact O-CG1 3.47Å; E22-I26 PolarHBondContact O-N 2.91Å
23	I	85.9	Confident	80.6	Confident	60 Å²	60	90 Å²	90	31%	0.308	46%	0.462	S	S	.	.	H	α-helix	trans	-58	-38.9	176.3	-69.3	166.7	0	0	0	110.7	E19 I26 T27 L51	E19-I23 WeakPolarHBondContact O-CB 3.31Å; E19-I23 WeakPolarHBondContact O-CD1 3.3Å; E19-I23 WeakPolarHBondContact O-CG1 3.48Å; E19-I23 PolarHBondContact O-N 3.41Å; I23-I26 PolarHBondContact O-N 3.09Å; I23-T27 VanDerWaalsContact O-CB 3.29Å; I23-T27 WeakPolarHBondContact O-CB 3.45Å; I23-T27 PolarHBondContact O-N 3Å; I23-T27 PolarHBondContact O-OG1 3.12Å; I23-L51 HydrophobicContact CG2-CD2 4.49Å
24	K	89.2	Confident	82.6	Confident	153 Å²	153	85.1 Å²	85.1	67%	0.665	43%	0.427	S	S	*	.	H	α-helix	trans	-66.4	-39.7	176.9	-166.6	174.4	-176	176.6	0	112.4	I20 I21 E22 T28	I20-K24 VanDerWaalsContact O-CB 3.3Å; I20-K24 WeakPolarHBondContact O-CB 3.4Å; I20-K24 PolarHBondContact O-N 3.23Å; I21-K24 PolarHBondContact O-N 2.76Å; E22-K24 PolarHBondContact O-N 2.87Å; K24-T28 WeakPolarHBondContact O-CB 3.5Å; K24-T28 PolarHBondContact O-N 3.29Å; K24-T28 PolarHBondContact O-OG1 3.36Å
25	K	87.1	Confident	84	Confident	143 Å²	143	85.3 Å²	85.3	62%	0.622	43%	0.425	S	S	*	.	H	α-helix	trans	-65	-47.9	173.9	-75	175.7	-178.5	176.1	0	111.3	I21 E22 T27 T28 S29	I21-K25 HydrophobicContact CG2-CD 4.41Å; I21-K25 WeakPolarHBondContact O-CG 3.26Å; I21-K25 PolarHBondContact O-N 3.31Å; E22-K25 WeakPolarHBondContact O-CB 3.25Å; E22-K25 PolarHBondContact O-N 2.83Å; E22-K25 VanDerWaalsContact O-N 3.08Å; K25-T27 VanDerWaalsContact C-N 3.35Å; K25-T27 PolarHBondContact O-N 3.08Å; K25-T28 PolarHBondContact O-N 3.15Å; K25-S29 PolarHBondContact O-N 2.96Å; K25-S29 PolarHBondContact O-OG 2.91Å
26	I	88.4	Confident	84.9	Confident	6 Å²	6	86.4 Å²	86.4	3%	0.031	43%	0.434	C	S	.	.	H	α-helix	trans	-58.6	-47.5	177.3	-66.6	169.1	0	0	0	110.3	E22 I23 T28 S29 I30 L51 H54 I61 V63 L99	E22-I26 HydrophobicContact CG-CD1 3.9Å; E22-I26 HydrophobicContact CG-CG1 4.47Å; E22-I26 WeakPolarHBondContact O-CG1 3.47Å; E22-I26 PolarHBondContact O-N 2.91Å; I23-I26 PolarHBondContact O-N 3.09Å; I26-T28 VanDerWaalsContact C-N 3.31Å; I26-T28 PolarHBondContact O-N 3.4Å; I26-S29 WeakPolarHBondContact O-CB 3.2Å; I26-S29 PolarHBondContact O-N 3.28Å; I26-I30 HydrophobicContact CG2-CD1 3.76Å; I26-I30 HydrophobicContact CG2-CG1 4.37Å; I26-I30 WeakPolarHBondContact O-CG1 3.35Å; I26-I30 PolarHBondContact O-N 3.3Å; I26-L51 HydrophobicContact CG2-CD1 4.41Å; I26-L51 HydrophobicContact CG2-CD2 4.02Å; I26-H54 HydrophobicContact CD1-CB 4.17Å; I26-H54 VanDerWaalsContact CD1-CD2 3.45Å; I26-H54 WeakPolarHBondContact CD1-CD2 3.48Å; I26-I61 HydrophobicContact CD1-CD1 4.29Å; I26-I61 HydrophobicContact CD1-CG2 4.09Å; I26-I61 HydrophobicContact CG1-CD1 4Å; I26-V63 HydrophobicContact CG2-CG1 3.96Å; I26-L99 HydrophobicContact CG2-CD1 4.21Å
27	T	89.9	Confident	85.1	Confident	25 Å²	25	86.2 Å²	86.2	15%	0.153	43%	0.427	C	S	.	.	H	α-helix	trans	-60.2	-39.6	178.4	-58.5	0	0	0	0	112.2	I23 K25 I30 K31 F48	I23-T27 VanDerWaalsContact O-CB 3.29Å; I23-T27 WeakPolarHBondContact O-CB 3.45Å; I23-T27 PolarHBondContact O-N 3Å; I23-T27 PolarHBondContact O-OG1 3.12Å; K25-T27 VanDerWaalsContact C-N 3.35Å; K25-T27 PolarHBondContact O-N 3.08Å; T27-I30 PolarHBondContact O-N 2.93Å; T27-K31 HydrophobicContact CG2-CD 4.47Å; T27-K31 WeakPolarHBondContact O-CG 3.28Å; T27-K31 PolarHBondContact O-N 3.44Å; T27-F48 HydrophobicContact CG2-CD1 4.02Å; T27-F48 HydrophobicContact CG2-CE1 3.57Å; T27-F48 HydrophobicContact CG2-CZ 3.91Å
28	T	88.3	Confident	85.4	Confident	91 Å²	91	89 Å²	89	56%	0.558	43%	0.431	S	S	*	.	H	α-helix	trans	-65.9	-41.8	177	-55.6	0	0	0	0	111.3	K24 K25 I26 K31 R32	K24-T28 WeakPolarHBondContact O-CB 3.5Å; K24-T28 PolarHBondContact O-N 3.29Å; K24-T28 PolarHBondContact O-OG1 3.36Å; K25-T28 PolarHBondContact O-N 3.15Å; I26-T28 VanDerWaalsContact C-N 3.31Å; I26-T28 PolarHBondContact O-N 3.4Å; T28-K31 PolarHBondContact O-N 3.49Å; T28-R32 PolarHBondContact O-N 2.95Å; T28-R32 VanDerWaalsContact O-N 3.09Å
29	S	87.5	Confident	85.8	Confident	65 Å²	65	86.7 Å²	86.7	46%	0.455	41%	0.409	S	S	.	.	H	α-helix	trans	-62.9	-43.2	174	-63.7	0	0	0	0	112	K25 I26 R32 L33	K25-S29 PolarHBondContact O-N 2.96Å; K25-S29 PolarHBondContact O-OG 2.91Å; I26-S29 WeakPolarHBondContact O-CB 3.2Å; I26-S29 PolarHBondContact O-N 3.28Å; S29-R32 WeakPolarHBondContact O-CB 3.27Å; S29-R32 PolarHBondContact O-N 3.12Å; S29-L33 WeakPolarHBondContact O-CB 3.44Å; S29-L33 PolarHBondContact O-N 2.97Å
30	I	89.9	Confident	86.1	Confident	0 Å²	0	85.4 Å²	85.4	0%	0	41%	0.408	C	S	.	.	H	α-helix	trans	-62.1	-45.6	176.8	-67.9	167.8	0	0	0	111.2	I26 T27 R32 L33 I34 F48 L51 F65 L99	I26-I30 HydrophobicContact CG2-CD1 3.76Å; I26-I30 HydrophobicContact CG2-CG1 4.37Å; I26-I30 WeakPolarHBondContact O-CG1 3.35Å; I26-I30 PolarHBondContact O-N 3.3Å; T27-I30 PolarHBondContact O-N 2.93Å; I30-R32 VanDerWaalsContact C-N 3.26Å; I30-R32 PolarHBondContact O-N 3.41Å; I30-L33 WeakPolarHBondContact O-CB 3.49Å; I30-L33 PolarHBondContact O-N 2.96Å; I30-L33 VanDerWaalsContact O-N 3.08Å; I30-I34 HydrophobicContact CG2-CD1 3.87Å; I30-I34 HydrophobicContact CG2-CG1 4.33Å; I30-I34 WeakPolarHBondContact O-CG1 3.07Å; I30-I34 PolarHBondContact O-N 2.8Å; I30-F48 HydrophobicContact CB-CD2 4.33Å; I30-F48 HydrophobicContact CB-CE2 4.34Å; I30-F48 HydrophobicContact CD1-CE2 4.08Å; I30-F48 HydrophobicContact CG2-CD2 3.48Å; I30-F48 VanDerWaalsContact CG2-CD2 3.48Å; I30-F48 HydrophobicContact CG2-CE2 3.79Å; I30-L51 HydrophobicContact CD1-CD1 3.72Å; I30-F65 HydrophobicContact CD1-CB 4.37Å; I30-F65 HydrophobicContact CD1-CD1 3.8Å; I30-F65 HydrophobicContact CD1-CE1 4.29Å; I30-F65 HydrophobicContact CD1-CG 4.14Å; I30-F65 HydrophobicContact CG1-CD1 4.2Å; I30-F65 HydrophobicContact CG1-CE1 4.18Å; I30-F65 HydrophobicContact CG2-CD1 4.05Å; I30-F65 HydrophobicContact CG2-CD2 3.66Å; I30-F65 HydrophobicContact CG2-CE1 3.9Å; I30-F65 HydrophobicContact CG2-CE2 3.51Å; I30-F65 HydrophobicContact CG2-CG 3.93Å; I30-F65 HydrophobicContact CG2-CZ 3.65Å; I30-L99 HydrophobicContact CG1-CD1 3.96Å
31	K	89.6	Confident	86.1	Confident	126 Å²	126	81.3 Å²	81.3	55%	0.548	39%	0.387	S	S	.	.	H	α-helix	trans	-58.8	-38.2	175.6	-73.6	179.6	179	-174.8	0	112	T27 T28 K35 F48	T27-K31 HydrophobicContact CG2-CD 4.47Å; T27-K31 WeakPolarHBondContact O-CG 3.28Å; T27-K31 PolarHBondContact O-N 3.44Å; T28-K31 PolarHBondContact O-N 3.49Å; K31-K35 PolarHBondContact O-N 3.37Å; K31-F48 HydrophobicContact CG-CB 4.05Å; K31-F48 HydrophobicContact CG-CG 4.46Å
32	R	86.2	Confident	85.8	Confident	207 Å²	207	81.8 Å²	81.8	78%	0.781	39%	0.391	S	S	*	.	H	α-helix	trans	-68.5	-38.3	174.7	-165.2	179.6	-168.2	162.2	3.9	111.9	T28 S29 I30 K35 S36	T28-R32 PolarHBondContact O-N 2.95Å; T28-R32 VanDerWaalsContact O-N 3.09Å; S29-R32 WeakPolarHBondContact O-CB 3.27Å; S29-R32 PolarHBondContact O-N 3.12Å; I30-R32 VanDerWaalsContact C-N 3.26Å; I30-R32 PolarHBondContact O-N 3.41Å; R32-K35 PolarHBondContact O-N 3.14Å; R32-S36 VanDerWaalsContact O-CB 3.26Å; R32-S36 WeakPolarHBondContact O-CB 3.24Å; R32-S36 PolarHBondContact O-N 3.01Å
33	L	86.8	Confident	85.3	Confident	5 Å²	5	81.4 Å²	81.4	3%	0.026	41%	0.405	C	S	.	.	H	α-helix	trans	-65.2	-46.3	178	-175.7	148.6	0	0	0	111.9	S29 I30 K35 S36 Q37 I39 L99 D107 I109	S29-L33 WeakPolarHBondContact O-CB 3.44Å; S29-L33 PolarHBondContact O-N 2.97Å; I30-L33 WeakPolarHBondContact O-CB 3.49Å; I30-L33 PolarHBondContact O-N 2.96Å; I30-L33 VanDerWaalsContact O-N 3.08Å; L33-K35 PolarHBondContact O-N 3.49Å; L33-S36 PolarHBondContact O-N 2.86Å; L33-S36 VanDerWaalsContact O-N 3.07Å; L33-Q37 HydrophobicContact CD2-CG 4.18Å; L33-Q37 HydrophobicContact CG-CG 4.12Å; L33-Q37 PolarHBondContact O-N 3.49Å; L33-I39 HydrophobicContact CD2-CD1 3.8Å; L33-L99 HydrophobicContact CD1-CD2 3.45Å; L33-L99 VanDerWaalsContact CD1-CD2 3.45Å; L33-D107 HydrophobicContact CD1-CB 3.4Å; L33-D107 WeakPolarHBondContact CD1-OD2 3.24Å; L33-I109 HydrophobicContact CD1-CD1 3.72Å; L33-I109 HydrophobicContact CD1-CG1 3.75Å; L33-I109 HydrophobicContact CD2-CB 4.18Å; L33-I109 HydrophobicContact CD2-CD1 4.09Å; L33-I109 HydrophobicContact CD2-CG1 4.18Å; L33-I109 HydrophobicContact CD2-CG2 4.36Å
34	I	87.1	Confident	85	Confident	12 Å²	12	81.7 Å²	81.7	6%	0.062	41%	0.405	C	S	.	.	H	α-helix	trans	-54.5	-43.7	176.6	-69.1	164.7	0	0	0	110.5	I30 R38 I39 A46 F48 F65 V67	I30-I34 HydrophobicContact CG2-CD1 3.87Å; I30-I34 HydrophobicContact CG2-CG1 4.33Å; I30-I34 WeakPolarHBondContact O-CG1 3.07Å; I30-I34 PolarHBondContact O-N 2.8Å; I34-R38 PolarHBondContact O-N 3.45Å; I34-I39 HydrophobicContact CG1-CD1 4.2Å; I34-I39 HydrophobicContact CG2-CB 4.32Å; I34-I39 PolarHBondContact O-N 2.93Å; I34-A46 HydrophobicContact CG2-CB 4.12Å; I34-A46 WeakPolarHBondContact CG2-O 3.28Å; I34-F48 HydrophobicContact CD1-CB 3.83Å; I34-F48 HydrophobicContact CD1-CD2 4.42Å; I34-F65 HydrophobicContact CD1-CE2 4.15Å; I34-F65 HydrophobicContact CG1-CE2 4.24Å; I34-V67 HydrophobicContact CD1-CG1 3.64Å; I34-V67 HydrophobicContact CG1-CG1 4.19Å
35	K	85.2	Confident	84.7	Confident	185 Å²	185	78.9 Å²	78.9	80%	0.804	40%	0.402	S	S	*	.	H	α-helix	trans	-69.2	-40.7	176.4	-167.6	174.6	-177.4	176.6	0	113	K31 R32 L33	K31-K35 PolarHBondContact O-N 3.37Å; R32-K35 PolarHBondContact O-N 3.14Å; L33-K35 PolarHBondContact O-N 3.49Å
36	S	82.7	Confident	84.8	Confident	93 Å²	93	72.5 Å²	72.5	65%	0.65	38%	0.376	S	S	*	.	H	α-helix	trans	-68	-48.4	-178.9	170.5	0	0	0	0	112.8	R32 L33 R38	R32-S36 VanDerWaalsContact O-CB 3.26Å; R32-S36 WeakPolarHBondContact O-CB 3.24Å; R32-S36 PolarHBondContact O-N 3.01Å; L33-S36 PolarHBondContact O-N 2.86Å; L33-S36 VanDerWaalsContact O-N 3.07Å; S36-R38 VanDerWaalsContact C-N 3.27Å; S36-R38 PolarHBondContact O-N 3.1Å
37	Q	82.7	Confident	84.8	Confident	76 Å²	76	74.7 Å²	74.7	36%	0.355	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	1.5	-177.1	-63.3	-167.5	4.2	0	0	113.2	L33 I39 D107	L33-Q37 HydrophobicContact CD2-CG 4.18Å; L33-Q37 HydrophobicContact CG-CG 4.12Å; L33-Q37 PolarHBondContact O-N 3.49Å; Q37-I39 VanDerWaalsContact C-N 3.27Å; Q37-I39 HydrophobicContact CB-CG1 4.13Å; Q37-I39 PolarHBondContact O-N 3.19Å; Q37-D107 PolarHBondContact NE2-O 3.09Å; Q37-D107 VanDerWaalsContact NE2-O 3.16Å
38	R	85.5	Confident	84.8	Confident	214 Å²	214	75.2 Å²	75.2	81%	0.808	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	44.6	-178.5	-56.5	-176.8	178.4	-167.2	-0.8	112.2	I34 S36 T40	I34-R38 PolarHBondContact O-N 3.45Å; S36-R38 VanDerWaalsContact C-N 3.27Å; S36-R38 PolarHBondContact O-N 3.1Å; R38-T40 PolarHBondContact O-N 3.05Å
39	I	83.8	Confident	84.9	Confident	20 Å²	20	74 Å²	74	10%	0.103	38%	0.382	C	S	.	.			trans	-66	122.6	175.6	-57	177.2	0	0	0	107.4	L33 I34 Q37 A46 V67	L33-I39 HydrophobicContact CD2-CD1 3.8Å; I34-I39 HydrophobicContact CG1-CD1 4.2Å; I34-I39 HydrophobicContact CG2-CB 4.32Å; I34-I39 PolarHBondContact O-N 2.93Å; Q37-I39 VanDerWaalsContact C-N 3.27Å; Q37-I39 HydrophobicContact CB-CG1 4.13Å; Q37-I39 PolarHBondContact O-N 3.19Å; I39-A46 HydrophobicContact CB-CB 4.4Å; I39-A46 HydrophobicContact CG2-CB 3.93Å; I39-A46 WeakPolarHBondContact O-CB 3.09Å; I39-A46 PolarHBondContact O-N 2.79Å; I39-V67 HydrophobicContact CG2-CG2 4.32Å
40	T	84.4	Confident	85	Confident	70 Å²	70	75.2 Å²	75.2	43%	0.429	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	146	179.4	55.6	0	0	0	0	111.3	R38 Q44	R38-T40 PolarHBondContact O-N 3.05Å; T40-Q44 CarbonylContact C-O 3.53Å; T40-Q44 WeakPolarHBondContact CA-O 3.32Å; T40-Q44 WeakPolarHBondContact CB-O 3.24Å
41	V	80.6	Confident	85.1	Confident	4 Å²	4	77 Å²	77	2%	0.024	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	123.4	166.5	179.8	0	0	0	0	105.9	G43 Q44 A46 V67 D69 K91 L93	V41-G43 PolarHBondContact O-N 3.03Å; V41-G43 VanDerWaalsContact O-N 3.12Å; V41-Q44 PolarHBondContact N-O 2.86Å; V41-Q44 PolarHBondContact O-N 2.91Å; V41-A46 HydrophobicContact CG2-CB 3.74Å; V41-V67 HydrophobicContact CG2-CG2 4.15Å; V41-D69 HydrophobicContact CB-CB 4.45Å; V41-D69 HydrophobicContact CG1-CB 4.06Å; V41-K91 HydrophobicContact CG1-CB 3.91Å; V41-K91 WeakPolarHBondContact CG1-O 3.32Å; V41-L93 HydrophobicContact CG2-CD1 3.72Å; V41-L93 HydrophobicContact CG2-CG 3.98Å
42	N	76.3	Confident	85	Confident	96 Å²	96	73.5 Å²	73.5	51%	0.513	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	35.3	-175.2	-62.6	-29	0	0	0	114.1	Q44 K91	N42-Q44 PolarHBondContact O-N 2.71Å; N42-K91 WeakPolarHBondContact OD1-CD 3.22Å
43	G	75.1	Confident	85.2	Confident	59 Å²	59	67.4 Å²	67.4	61%	0.608	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.9	-6.8	-179	0	0	0	0	0	115.6	V41	V41-G43 PolarHBondContact O-N 3.03Å; V41-G43 VanDerWaalsContact O-N 3.12Å
44	Q	79.3	Confident	85.3	Confident	66 Å²	66	70.5 Å²	70.5	31%	0.308	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	147.9	170.7	-65.2	-78.2	-80.2	0	0	110.2	T40 V41 N42 A46 P70 R71	T40-Q44 CarbonylContact C-O 3.53Å; T40-Q44 WeakPolarHBondContact CA-O 3.32Å; T40-Q44 WeakPolarHBondContact CB-O 3.24Å; V41-Q44 PolarHBondContact N-O 2.86Å; V41-Q44 PolarHBondContact O-N 2.91Å; N42-Q44 PolarHBondContact O-N 2.71Å; Q44-A46 PolarHBondContact O-N 3.39Å; Q44-P70 HydrophobicContact CB-CG 4.32Å; Q44-R71 VanDerWaalsContact OE1-NE 3.12Å
45	P	83	Confident	85.3	Confident	93 Å²	93	76.6 Å²	76.6	60%	0.604	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.2	124.6	172.5	-22.6	32.8	0	0	0	110.4	P70	P45-P70 WeakPolarHBondContact O-CD 3.38Å; P45-P70 WeakPolarHBondContact O-CG 3.14Å
46	A	87.7	Confident	85.1	Confident	10 Å²	10	76.2 Å²	76.2	8%	0.083	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-63.1	145	-176.9	0	0	0	0	0	111	I34 I39 V41 Q44 V67	I34-A46 HydrophobicContact CG2-CB 4.12Å; I34-A46 WeakPolarHBondContact CG2-O 3.28Å; I39-A46 HydrophobicContact CB-CB 4.4Å; I39-A46 HydrophobicContact CG2-CB 3.93Å; I39-A46 WeakPolarHBondContact O-CB 3.09Å; I39-A46 PolarHBondContact O-N 2.79Å; V41-A46 HydrophobicContact CG2-CB 3.74Å; Q44-A46 PolarHBondContact O-N 3.39Å; A46-V67 HydrophobicContact CB-CB 3.86Å; A46-V67 HydrophobicContact CB-CG1 4.48Å; A46-V67 HydrophobicContact CB-CG2 3.85Å
47	S	89.2	Confident	84.8	Confident	52 Å²	52	73.9 Å²	73.9	36%	0.364	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	141	170.4	-169.8	0	0	0	0	109.9	D49 V67 T68	S47-D49 PolarHBondContact O-N 3.04Å; S47-V67 CarbonylContact O-C 3.56Å; S47-V67 WeakPolarHBondContact O-CA 3.47Å; S47-V67 WeakPolarHBondContact O-CB 3.34Å; S47-T68 PolarHBondContact N-O 2.96Å; S47-T68 PolarHBondContact O-N 2.92Å
48	F	90.6	Very high	84.4	Confident	36 Å²	36	80.4 Å²	80.4	16%	0.158	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	121.5	172.8	174.4	-94.4	0	0	0	109.9	T27 I30 K31 I34 L51 F65	T27-F48 HydrophobicContact CG2-CD1 4.02Å; T27-F48 HydrophobicContact CG2-CE1 3.57Å; T27-F48 HydrophobicContact CG2-CZ 3.91Å; I30-F48 HydrophobicContact CB-CD2 4.33Å; I30-F48 HydrophobicContact CB-CE2 4.34Å; I30-F48 HydrophobicContact CD1-CE2 4.08Å; I30-F48 HydrophobicContact CG2-CD2 3.48Å; I30-F48 VanDerWaalsContact CG2-CD2 3.48Å; I30-F48 HydrophobicContact CG2-CE2 3.79Å; K31-F48 HydrophobicContact CG-CB 4.05Å; K31-F48 HydrophobicContact CG-CG 4.46Å; I34-F48 HydrophobicContact CD1-CB 3.83Å; I34-F48 HydrophobicContact CD1-CD2 4.42Å; F48-L51 HydrophobicContact CE2-CB 4.48Å; F48-L51 HydrophobicContact CZ-CB 3.99Å; F48-L51 VanDerWaalsContact CZ-N 3.33Å; F48-F65 HydrophobicContact CD2-CB 4.42Å; F48-F65 HydrophobicContact CD2-CD2 4.1Å; F48-F65 HydrophobicContact CD2-CG 4.5Å; F48-F65 HydrophobicContact CE2-CB 3.83Å; F48-F65 HydrophobicContact CE2-CD2 4.3Å; F48-F65 HydrophobicContact CE2-CG 4.25Å
49	D	88.7	Confident	83.7	Confident	65 Å²	65	73.3 Å²	73.3	35%	0.348	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	-65.6	178.7	-169.5	21.2	0	0	0	110.2	S47 V66 T68 K92	S47-D49 PolarHBondContact O-N 3.04Å; D49-V66 HydrophobicContact CB-CB 4.19Å; D49-V66 HydrophobicContact CB-CG1 4.11Å; D49-V66 WeakPolarHBondContact CB-O 3.45Å; D49-V66 PolarHBondContact N-O 3.28Å; D49-T68 HydrophobicContact CB-CG2 3.84Å; D49-K92 IonicContact OD2-NZ 3.33Å; D49-K92 PolarHBondContact OD2-NZ 2.87Å
50	K	91.1	Very high	83.7	Confident	91 Å²	91	72.4 Å²	72.4	40%	0.396	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	151.2	-179.7	64.5	179.4	-176.8	177.7	0	113.3	F65 V66 Y121	K50-F65 CarbonylContact O-C 3.49Å; K50-F65 VanDerWaalsContact O-CA 3.26Å; K50-F65 WeakPolarHBondContact O-CA 3.31Å; K50-F65 VanDerWaalsContact O-CB 3.29Å; K50-F65 WeakPolarHBondContact O-CB 3.39Å; K50-V66 HydrophobicContact CG-CB 4.15Å; K50-V66 HydrophobicContact CG-CG2 4.23Å; K50-V66 PolarHBondContact N-O 2.82Å; K50-V66 PolarHBondContact O-N 2.85Å; K50-Y121 PolarHBondContact NZ-OH 3.38Å
51	L	90.6	Very high	83.9	Confident	36 Å²	36	70 Å²	70	19%	0.188	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	124.1	165.4	-176	66.2	0	0	0	108.1	I23 I26 I30 F48 H54 V63 F65	I23-L51 HydrophobicContact CG2-CD2 4.49Å; I26-L51 HydrophobicContact CG2-CD1 4.41Å; I26-L51 HydrophobicContact CG2-CD2 4.02Å; I30-L51 HydrophobicContact CD1-CD1 3.72Å; F48-L51 HydrophobicContact CE2-CB 4.48Å; F48-L51 HydrophobicContact CZ-CB 3.99Å; F48-L51 VanDerWaalsContact CZ-N 3.33Å; L51-H54 HydrophobicContact CD2-CB 4.29Å; L51-V63 HydrophobicContact CD1-CB 4.23Å; L51-V63 HydrophobicContact CD1-CG1 4.39Å; L51-F65 HydrophobicContact CD1-CB 4.14Å
52	V	89.1	Confident	84.3	Confident	54 Å²	54	74.3 Å²	74.3	33%	0.327	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	-51.6	-179.6	-174.6	0	0	0	0	110.4	V64 V66	V52-V64 WeakPolarHBondContact CA-O 3.21Å; V52-V64 HydrophobicContact CB-CB 4.16Å; V52-V64 HydrophobicContact CB-CG1 3.92Å; V52-V64 WeakPolarHBondContact CB-O 3.32Å; V52-V64 HydrophobicContact CG1-CG1 4.4Å; V52-V64 HydrophobicContact CG2-CG1 4.22Å; V52-V64 PolarHBondContact N-O 2.96Å; V52-V66 HydrophobicContact CG2-CG2 3.8Å
53	T	89.7	Confident	85.1	Confident	78 Å²	78	69.8 Å²	69.8	48%	0.479	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	156.7	176	60.9	0	0	0	0	110.9	V64	T53-V64 PolarHBondContact N-O 3.25Å; T53-V64 PolarHBondContact O-N 3.45Å; T53-V64 WeakPolarHBondContact OG1-CB 3.37Å; T53-V64 WeakPolarHBondContact OG1-CG2 3.31Å
54	H	89.1	Confident	85.9	Confident	70 Å²	70	68 Å²	68	32%	0.324	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	147	166.6	67.3	-75	0	0	0	110.4	I26 L51 I61 E62 V63	I26-H54 HydrophobicContact CD1-CB 4.17Å; I26-H54 VanDerWaalsContact CD1-CD2 3.45Å; I26-H54 WeakPolarHBondContact CD1-CD2 3.48Å; L51-H54 HydrophobicContact CD2-CB 4.29Å; H54-I61 HydrophobicContact CB-CG2 4.25Å; H54-E62 CarbonylContact C-O 3.57Å; H54-E62 WeakPolarHBondContact CA-O 3.38Å; H54-V63 HydrophobicContact CB-CG1 4.11Å
55	K	85.6	Confident	86.6	Confident	141 Å²	141	64.9 Å²	64.9	61%	0.613	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.5	129.4	175.8	-175.4	-179.3	178.3	-176.2	0	109.9	E62	K55-E62 PolarHBondContact N-O 2.94Å; K55-E62 PolarHBondContact O-N 2.8Å
56	R	81.3	Confident	86.9	Confident	177 Å²	177	60.9 Å²	60.9	67%	0.668	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.1	128.8	175.3	-159.3	169.4	-179.6	171.8	-3.1	109.9
57	T	77.7	Confident	87.1	Confident	44 Å²	44	60.4 Å²	60.4	27%	0.27	30%	0.301	S	S	.	.			trans	-121.5	171.5	178	66.2	0	0	0	0	110	S59 G60 E62	T57-S59 PolarHBondContact O-N 2.99Å; T57-S59 PolarHBondContact OG1-OG 3.27Å; T57-G60 PolarHBondContact N-O 3.44Å; T57-G60 VanDerWaalsContact O-O 3.1Å; T57-G60 PolarHBondContact OG1-N 2.8Å; T57-G60 PolarHBondContact OG1-O 2.99Å; T57-E62 HydrophobicContact CG2-CB 4.12Å
58	E	73.1	Confident	87	Confident	213 Å²	213	58.7 Å²	58.7	100%	0.995	29%	0.288	S	S	*	.	S	Bend	trans	-63.1	-27.9	174.6	-70.5	-179.3	175.9	0	0	112.7
59	S	72.3	Confident	86.5	Confident	65 Å²	65	58 Å²	58	46%	0.455	29%	0.287	S	S	.	.	S	Bend	trans	-92	-15.5	-178	53.9	0	0	0	0	114.7	T57	T57-S59 PolarHBondContact O-N 2.99Å; T57-S59 PolarHBondContact OG1-OG 3.27Å
60	G	84	Confident	85.6	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.01	29%	0.291	C	S	.	.	S	Bend	trans	163.6	-149.8	-176.5	0	0	0	0	0	113.9	T57 L99	T57-G60 PolarHBondContact N-O 3.44Å; T57-G60 VanDerWaalsContact O-O 3.1Å; T57-G60 PolarHBondContact OG1-N 2.8Å; T57-G60 PolarHBondContact OG1-O 2.99Å; G60-L99 CarbonylContact C-O 3.59Å; G60-L99 WeakPolarHBondContact CA-O 3.39Å
61	I	88.1	Confident	84.5	Confident	18 Å²	18	61.9 Å²	61.9	9%	0.092	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	110.5	171	-52.8	176.4	0	0	0	107.4	I26 H54 V63 L99 L101	I26-I61 HydrophobicContact CD1-CD1 4.29Å; I26-I61 HydrophobicContact CD1-CG2 4.09Å; I26-I61 HydrophobicContact CG1-CD1 4Å; H54-I61 HydrophobicContact CB-CG2 4.25Å; I61-V63 HydrophobicContact CG2-CG1 3.82Å; I61-V63 PolarHBondContact O-N 2.97Å; I61-L99 HydrophobicContact CB-CB 4.38Å; I61-L99 PolarHBondContact N-O 2.9Å; I61-L99 PolarHBondContact O-N 2.87Å; I61-L101 HydrophobicContact CD1-CD2 4.01Å; I61-L101 HydrophobicContact CG1-CD1 4.26Å; I61-L101 HydrophobicContact CG1-CD2 4.11Å; I61-L101 HydrophobicContact CG1-CG 4.22Å
62	E	88.6	Confident	82.9	Confident	96 Å²	96	62 Å²	62	45%	0.449	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	125.4	171.1	-173.3	177.7	-165.9	0	0	108.6	H54 K55 T57 G97	H54-E62 CarbonylContact C-O 3.57Å; H54-E62 WeakPolarHBondContact CA-O 3.38Å; K55-E62 PolarHBondContact N-O 2.94Å; K55-E62 PolarHBondContact O-N 2.8Å; T57-E62 HydrophobicContact CG2-CB 4.12Å; E62-G97 WeakPolarHBondContact CA-O 3.44Å
63	V	92.2	Very high	81.2	Confident	0 Å²	0	63 Å²	63	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	143.5	-175.7	-65	0	0	0	0	111.7	I26 L51 H54 I61 F65 G97 L99 I109	I26-V63 HydrophobicContact CG2-CG1 3.96Å; L51-V63 HydrophobicContact CD1-CB 4.23Å; L51-V63 HydrophobicContact CD1-CG1 4.39Å; H54-V63 HydrophobicContact CB-CG1 4.11Å; I61-V63 HydrophobicContact CG2-CG1 3.82Å; I61-V63 PolarHBondContact O-N 2.97Å; V63-F65 HydrophobicContact CB-CD1 4.41Å; V63-F65 HydrophobicContact CG2-CD1 3.98Å; V63-F65 HydrophobicContact CG2-CE1 3.96Å; V63-G97 PolarHBondContact N-O 3.32Å; V63-G97 PolarHBondContact O-N 3.41Å; V63-G97 VanDerWaalsContact O-N 3.14Å; V63-L99 HydrophobicContact CG1-CD1 3.72Å; V63-L99 HydrophobicContact CG1-CG 4.23Å; V63-L99 HydrophobicContact CG2-CD1 3.99Å; V63-L99 HydrophobicContact CG2-CD2 4.46Å; V63-L99 HydrophobicContact CG2-CG 3.81Å; V63-I109 HydrophobicContact CG2-CD1 3.87Å
64	V	92.8	Very high	79.1	Confident	22 Å²	22	66.3 Å²	66.3	13%	0.133	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	122.2	166.3	-176.8	0	0	0	0	107.6	V52 T53 I94 C95 K96	V52-V64 WeakPolarHBondContact CA-O 3.21Å; V52-V64 HydrophobicContact CB-CB 4.16Å; V52-V64 HydrophobicContact CB-CG1 3.92Å; V52-V64 WeakPolarHBondContact CB-O 3.32Å; V52-V64 HydrophobicContact CG1-CG1 4.4Å; V52-V64 HydrophobicContact CG2-CG1 4.22Å; V52-V64 PolarHBondContact N-O 2.96Å; T53-V64 PolarHBondContact N-O 3.25Å; T53-V64 PolarHBondContact O-N 3.45Å; T53-V64 WeakPolarHBondContact OG1-CB 3.37Å; T53-V64 WeakPolarHBondContact OG1-CG2 3.31Å; V64-I94 HydrophobicContact CG1-CD1 3.92Å; V64-I94 HydrophobicContact CG1-CG1 3.95Å; V64-C95 WeakPolarHBondContact CA-O 3.2Å; V64-K96 HydrophobicContact CB-CG 4.47Å; V64-K96 HydrophobicContact CG1-CG 4Å; V64-K96 HydrophobicContact CG2-CG 4.02Å
65	F	93.3	Very high	76.7	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	160.5	178.3	60.8	-86.6	0	0	0	111.4	I30 I34 F48 K50 L51 V63 V67 C95 I109	I30-F65 HydrophobicContact CD1-CB 4.37Å; I30-F65 HydrophobicContact CD1-CD1 3.8Å; I30-F65 HydrophobicContact CD1-CE1 4.29Å; I30-F65 HydrophobicContact CD1-CG 4.14Å; I30-F65 HydrophobicContact CG1-CD1 4.2Å; I30-F65 HydrophobicContact CG1-CE1 4.18Å; I30-F65 HydrophobicContact CG2-CD1 4.05Å; I30-F65 HydrophobicContact CG2-CD2 3.66Å; I30-F65 HydrophobicContact CG2-CE1 3.9Å; I30-F65 HydrophobicContact CG2-CE2 3.51Å; I30-F65 HydrophobicContact CG2-CG 3.93Å; I30-F65 HydrophobicContact CG2-CZ 3.65Å; I34-F65 HydrophobicContact CD1-CE2 4.15Å; I34-F65 HydrophobicContact CG1-CE2 4.24Å; F48-F65 HydrophobicContact CD2-CB 4.42Å; F48-F65 HydrophobicContact CD2-CD2 4.1Å; F48-F65 HydrophobicContact CD2-CG 4.5Å; F48-F65 HydrophobicContact CE2-CB 3.83Å; F48-F65 HydrophobicContact CE2-CD2 4.3Å; F48-F65 HydrophobicContact CE2-CG 4.25Å; K50-F65 CarbonylContact O-C 3.49Å; K50-F65 VanDerWaalsContact O-CA 3.26Å; K50-F65 WeakPolarHBondContact O-CA 3.31Å; K50-F65 VanDerWaalsContact O-CB 3.29Å; K50-F65 WeakPolarHBondContact O-CB 3.39Å; L51-F65 HydrophobicContact CD1-CB 4.14Å; V63-F65 HydrophobicContact CB-CD1 4.41Å; V63-F65 HydrophobicContact CG2-CD1 3.98Å; V63-F65 HydrophobicContact CG2-CE1 3.96Å; F65-V67 HydrophobicContact CD2-CG1 3.72Å; F65-V67 HydrophobicContact CE2-CG1 3.58Å; F65-C95 HydrophobicContact CD1-CB 4.24Å; F65-C95 HydrophobicContact CD2-CB 3.92Å; F65-C95 HydrophobicContact CE1-CB 3.87Å; F65-C95 HydrophobicContact CE2-CB 3.51Å; F65-C95 HydrophobicContact CG-CB 4.27Å; F65-C95 HydrophobicContact CZ-CB 3.48Å; F65-C95 VanDerWaalsContact CZ-CB 3.48Å; F65-C95 PolarHBondContact N-O 3.42Å; F65-C95 PolarHBondContact O-N 3.25Å; F65-I109 HydrophobicContact CE1-CD1 3.52Å; F65-I109 HydrophobicContact CE1-CG2 4.25Å; F65-I109 HydrophobicContact CZ-CD1 3.96Å; F65-I109 HydrophobicContact CZ-CG2 4.03Å
66	V	90.6	Very high	74.4	Confident	9 Å²	9	70.4 Å²	70.4	6%	0.055	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	138.6	178.1	-178.4	0	0	0	0	109	D49 K50 V52 K92 L93	D49-V66 HydrophobicContact CB-CB 4.19Å; D49-V66 HydrophobicContact CB-CG1 4.11Å; D49-V66 WeakPolarHBondContact CB-O 3.45Å; D49-V66 PolarHBondContact N-O 3.28Å; K50-V66 HydrophobicContact CG-CB 4.15Å; K50-V66 HydrophobicContact CG-CG2 4.23Å; K50-V66 PolarHBondContact N-O 2.82Å; K50-V66 PolarHBondContact O-N 2.85Å; V52-V66 HydrophobicContact CG2-CG2 3.8Å; V66-K92 HydrophobicContact CG1-CB 3.99Å; V66-K92 HydrophobicContact CG1-CD 4Å; V66-L93 WeakPolarHBondContact CA-O 3.33Å
67	V	90.4	Very high	72.4	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	147.1	170.1	-57.7	0	0	0	0	110.6	I34 I39 V41 A46 S47 F65 K92 L93	I34-V67 HydrophobicContact CD1-CG1 3.64Å; I34-V67 HydrophobicContact CG1-CG1 4.19Å; I39-V67 HydrophobicContact CG2-CG2 4.32Å; V41-V67 HydrophobicContact CG2-CG2 4.15Å; A46-V67 HydrophobicContact CB-CB 3.86Å; A46-V67 HydrophobicContact CB-CG1 4.48Å; A46-V67 HydrophobicContact CB-CG2 3.85Å; S47-V67 CarbonylContact O-C 3.56Å; S47-V67 WeakPolarHBondContact O-CA 3.47Å; S47-V67 WeakPolarHBondContact O-CB 3.34Å; F65-V67 HydrophobicContact CD2-CG1 3.72Å; F65-V67 HydrophobicContact CE2-CG1 3.58Å; V67-K92 WeakPolarHBondContact O-CA 3.36Å; V67-L93 HydrophobicContact CG2-CB 3.69Å; V67-L93 HydrophobicContact CG2-CD1 4.21Å; V67-L93 HydrophobicContact CG2-CG 4.32Å; V67-L93 PolarHBondContact N-O 3.46Å; V67-L93 PolarHBondContact O-N 3.12Å
68	T	87.7	Confident	70.4	Confident	16 Å²	16	77.8 Å²	77.8	10%	0.098	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	166.5	-178.2	53.2	0	0	0	0	111.4	S47 D49 K92	S47-T68 PolarHBondContact N-O 2.96Å; S47-T68 PolarHBondContact O-N 2.92Å; D49-T68 HydrophobicContact CB-CG2 3.84Å; T68-K92 HydrophobicContact CG2-CB 4.39Å; T68-K92 HydrophobicContact CG2-CD 3.76Å; T68-K92 HydrophobicContact CG2-CG 3.67Å
69	D	79.6	Confident	68.5	Low	23 Å²	23	73.8 Å²	73.8	12%	0.123	41%	0.412	C	S	.	.			trans	-64.4	126.1	166.7	-170.1	-34.3	0	0	0	109.6	V41 R71 A72	V41-D69 HydrophobicContact CB-CB 4.45Å; V41-D69 HydrophobicContact CG1-CB 4.06Å; D69-R71 PolarHBondContact O-N 3.12Å; D69-R71 WeakPolarHBondContact OD1-CB 3.41Å; D69-R71 PolarHBondContact OD1-N 3.16Å; D69-A72 WeakPolarHBondContact O-CB 3.3Å; D69-A72 PolarHBondContact O-N 3.04Å
70	P	70.6	Confident	66.9	Low	66 Å²	66	75.9 Å²	75.9	43%	0.429	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-57.1	-19.4	176.7	22.4	-33.5	0	0	0	114	Q44 P45	Q44-P70 HydrophobicContact CB-CG 4.32Å; P45-P70 WeakPolarHBondContact O-CD 3.38Å; P45-P70 WeakPolarHBondContact O-CG 3.14Å
71	R	68.7	Low	64.8	Low	171 Å²	171	81.5 Å²	81.5	65%	0.645	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-81.9	-11.5	177.1	-61	-179.1	-172.6	-153.6	0.7	113.9	Q44 D69 G73 N74	Q44-R71 VanDerWaalsContact OE1-NE 3.12Å; D69-R71 PolarHBondContact O-N 3.12Å; D69-R71 WeakPolarHBondContact OD1-CB 3.41Å; D69-R71 PolarHBondContact OD1-N 3.16Å; R71-G73 PolarHBondContact O-N 3.34Å; R71-G73 VanDerWaalsContact O-N 3.11Å; R71-N74 PolarHBondContact O-N 3.05Å
72	A	57.5	Low	62.3	Low	38 Å²	38	92 Å²	92	31%	0.314	50%	0.499	S	S	.	.	G	3₁₀ helix	trans	-62.7	-17.2	-178.9	0	0	0	0	0	113.9	D69 T90	D69-A72 WeakPolarHBondContact O-CB 3.3Å; D69-A72 PolarHBondContact O-N 3.04Å; A72-T90 HydrophobicContact CB-CG2 3.38Å
73	G	51.9	Low	59.5	Low	75 Å²	75	92.9 Å²	92.9	77%	0.773	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-91.5	10.4	-176.2	0	0	0	0	0	116.1	R71	R71-G73 PolarHBondContact O-N 3.34Å; R71-G73 VanDerWaalsContact O-N 3.11Å
74	N	45.5	Very low	56.8	Low	147 Å²	147	99.1 Å²	99.1	79%	0.786	55%	0.547	S	S	*	.			trans	-122.4	61.3	-169	-135.2	12.3	0	0	0	113	R71	R71-N74 PolarHBondContact O-N 3.05Å
75	T	39	Very low	54.2	Low	130 Å²	130	102.8 Å²	102.8	80%	0.798	57%	0.573	S	S	*	*			trans	-134.8	77.5	166.9	51.5	0	0	0	0	110.3
76	D	37.3	Very low	51.5	Low	168 Å²	168	107.5 Å²	107.5	90%	0.898	60%	0.602	S	S	*	*			trans	-105	30.2	164.2	-136.2	5.8	0	0	0	110.4
77	R	38.9	Very low	48.8	Very low	237 Å²	237	111 Å²	111	89%	0.894	63%	0.627	S	S	*	*	S	Bend	trans	-115.5	111.3	176.5	-82.7	-174.3	174	174.9	-1.8	110.1
78	T	35.5	Very low	46.4	Very low	139 Å²	139	116.9 Å²	116.9	85%	0.853	66%	0.663	S	S	*	*			trans	-36.6	129.1	164	15.9	0	0	0	0	111.6
79	P	33.5	Very low	44.6	Very low	129 Å²	129	122.2 Å²	122.2	84%	0.838	69%	0.685	S	S	*	*			trans	-83.3	132.1	-167.7	30.4	-32.1	0	0	0	112.3
80	S	38.9	Very low	43.7	Very low	109 Å²	109	124.4 Å²	124.4	76%	0.762	70%	0.699	S	S	*	*			trans	-120	110.1	164	62.7	0	0	0	0	110.3
81	V	40.8	Very low	43.6	Very low	119 Å²	119	125 Å²	125	72%	0.721	70%	0.695	S	S	*	*	S	Bend	trans	63	97.8	141.6	-167	0	0	0	0	118.5
82	W	35.8	Very low	44.3	Very low	239 Å²	239	120.9 Å²	120.9	91%	0.905	68%	0.682	S	S	*	*			trans	51.8	90.7	139.5	-56.5	-24.1	0	0	0	121.3
83	D	29.8	Very low	45.7	Very low	113 Å²	113	120.1 Å²	120.1	60%	0.604	67%	0.672	S	S	*	*			trans	-127.9	109.9	133	-170.1	-21	0	0	0	107.9	S85	D83-S85 VanDerWaalsContact C-N 3.25Å; D83-S85 PolarHBondContact O-N 2.98Å; D83-S85 PolarHBondContact OD1-N 3.08Å; D83-S85 PolarHBondContact OD1-OG 3.47Å
84	P	34.8	Very low	47.5	Very low	131 Å²	131	118.7 Å²	118.7	85%	0.851	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	7.5	-171.7	-11.8	28.2	0	0	0	115.7
85	S	37.3	Very low	49.7	Very low	99 Å²	99	111.7 Å²	111.7	69%	0.692	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110	0.3	-170.8	63.6	0	0	0	0	115.7	D83	D83-S85 VanDerWaalsContact C-N 3.25Å; D83-S85 PolarHBondContact O-N 2.98Å; D83-S85 PolarHBondContact OD1-N 3.08Å; D83-S85 PolarHBondContact OD1-OG 3.47Å
86	V	37.4	Very low	52.2	Low	100 Å²	100	111 Å²	111	61%	0.606	60%	0.595	S	S	*	*			trans	-111.3	78.7	179.3	-169.9	0	0	0	0	109.9	T88	V86-T88 HydrophobicContact CG1-CG2 4.24Å; V86-T88 PolarHBondContact O-N 3.28Å; V86-T88 VanDerWaalsContact O-N 3.09Å
87	S	33.6	Very low	54.7	Low	83 Å²	83	103.7 Å²	103.7	58%	0.58	56%	0.559	S	S	*	*			trans	-69.7	105	163.4	52.5	0	0	0	0	107.9	F89	S87-F89 VanDerWaalsContact CB-CD2 3.49Å; S87-F89 VanDerWaalsContact CB-CE2 3.42Å; S87-F89 PolarHBondContact O-N 3.35Å; S87-F89 WeakPolarHBondContact OG-CD2 3.5Å; S87-F89 WeakPolarHBondContact OG-CE2 3.21Å
88	T	41.4	Very low	57	Low	122 Å²	122	94.4 Å²	94.4	75%	0.748	53%	0.527	S	S	*	.			trans	-70	70.6	172.5	51.7	0	0	0	0	109.1	V86 T90	V86-T88 HydrophobicContact CG1-CG2 4.24Å; V86-T88 PolarHBondContact O-N 3.28Å; V86-T88 VanDerWaalsContact O-N 3.09Å; T88-T90 PolarHBondContact O-N 2.95Å
89	F	49.2	Very low	59.4	Low	129 Å²	129	88.3 Å²	88.3	57%	0.566	49%	0.489	S	S	*	.			trans	-67.3	100.8	169.5	-82	-82.8	0	0	0	107.6	S87 K91 D116	S87-F89 VanDerWaalsContact CB-CD2 3.49Å; S87-F89 VanDerWaalsContact CB-CE2 3.42Å; S87-F89 PolarHBondContact O-N 3.35Å; S87-F89 WeakPolarHBondContact OG-CD2 3.5Å; S87-F89 WeakPolarHBondContact OG-CE2 3.21Å; F89-K91 VanDerWaalsContact C-N 3.27Å; F89-K91 PolarHBondContact O-N 2.86Å; F89-D116 VanDerWaalsContact CD1-OD2 3.31Å; F89-D116 WeakPolarHBondContact CD1-OD2 3.37Å; F89-D116 HydrophobicContact CE1-CB 4.36Å
90	T	59.8	Low	61.5	Low	68 Å²	68	83.4 Å²	83.4	42%	0.417	46%	0.458	S	S	.	.			trans	-65.6	90.6	170.1	43.9	0	0	0	0	108.3	A72 T88 K92	A72-T90 HydrophobicContact CB-CG2 3.38Å; T88-T90 PolarHBondContact O-N 2.95Å; T90-K92 PolarHBondContact O-N 3.48Å
91	K	68.3	Low	62.9	Low	78 Å²	78	82.9 Å²	82.9	34%	0.339	45%	0.446	S	S	.	.			trans	-54.3	123.9	178	-70.6	-159.5	-176.9	-174.2	0	110	V41 N42 F89 E113	V41-K91 HydrophobicContact CG1-CB 3.91Å; V41-K91 WeakPolarHBondContact CG1-O 3.32Å; N42-K91 WeakPolarHBondContact OD1-CD 3.22Å; F89-K91 VanDerWaalsContact C-N 3.27Å; F89-K91 PolarHBondContact O-N 2.86Å; K91-E113 WeakPolarHBondContact CD-OE1 3.21Å; K91-E113 IonicContact NZ-OE1 3.04Å; K91-E113 PolarHBondContact NZ-OE1 3.26Å; K91-E113 IonicContact NZ-OE2 3.82Å
92	K	83.3	Confident	63.8	Low	85 Å²	85	80.6 Å²	80.6	37%	0.37	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	135.7	169.9	-57	-156.2	176.5	-160.5	0	108.8	D49 V66 V67 T68 T90 V114	D49-K92 IonicContact OD2-NZ 3.33Å; D49-K92 PolarHBondContact OD2-NZ 2.87Å; V66-K92 HydrophobicContact CG1-CB 3.99Å; V66-K92 HydrophobicContact CG1-CD 4Å; V67-K92 WeakPolarHBondContact O-CA 3.36Å; T68-K92 HydrophobicContact CG2-CB 4.39Å; T68-K92 HydrophobicContact CG2-CD 3.76Å; T68-K92 HydrophobicContact CG2-CG 3.67Å; T90-K92 PolarHBondContact O-N 3.48Å; K92-V114 HydrophobicContact CB-CG2 4.26Å; K92-V114 PolarHBondContact O-N 3.15Å; K92-V114 VanDerWaalsContact O-N 3.09Å
93	L	86.9	Confident	64.9	Low	22 Å²	22	74 Å²	74	12%	0.115	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	134.9	169.2	-55.1	175.2	0	0	0	109	V41 V66 V67 C111 E112 E113	V41-L93 HydrophobicContact CG2-CD1 3.72Å; V41-L93 HydrophobicContact CG2-CG 3.98Å; V66-L93 WeakPolarHBondContact CA-O 3.33Å; V67-L93 HydrophobicContact CG2-CB 3.69Å; V67-L93 HydrophobicContact CG2-CD1 4.21Å; V67-L93 HydrophobicContact CG2-CG 4.32Å; V67-L93 PolarHBondContact N-O 3.46Å; V67-L93 PolarHBondContact O-N 3.12Å; L93-C111 HydrophobicContact CB-CB 4.18Å; L93-C111 HydrophobicContact CD1-CB 4.32Å; L93-E112 CarbonylContact C-O 3.59Å; L93-E112 VanDerWaalsContact CA-O 3.26Å; L93-E112 WeakPolarHBondContact CA-O 3.31Å; L93-E113 HydrophobicContact CD2-CB 4.11Å; L93-E113 HydrophobicContact CD2-CG 3.36Å
94	I	90.6	Very high	66.4	Low	45 Å²	45	72.6 Å²	72.6	23%	0.231	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	120.7	167.2	-169.1	166.8	0	0	0	108.8	V64 C111 E112 V114	V64-I94 HydrophobicContact CG1-CD1 3.92Å; V64-I94 HydrophobicContact CG1-CG1 3.95Å; I94-C111 CarbonylContact O-C 3.41Å; I94-C111 VanDerWaalsContact O-CA 3.29Å; I94-C111 WeakPolarHBondContact O-CA 3.31Å; I94-E112 HydrophobicContact CG2-CB 4.37Å; I94-E112 PolarHBondContact N-O 2.78Å; I94-E112 PolarHBondContact O-N 2.81Å; I94-V114 HydrophobicContact CB-CG2 4.16Å; I94-V114 HydrophobicContact CG2-CG2 4.36Å
95	C	91.6	Very high	68	Low	0 Å²	0	70.2 Å²	70.2	0%	0	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	130.1	179.3	-60.8	0	0	0	0	110.1	V64 F65 I109 K110 C111	V64-C95 WeakPolarHBondContact CA-O 3.2Å; F65-C95 HydrophobicContact CD1-CB 4.24Å; F65-C95 HydrophobicContact CD2-CB 3.92Å; F65-C95 HydrophobicContact CE1-CB 3.87Å; F65-C95 HydrophobicContact CE2-CB 3.51Å; F65-C95 HydrophobicContact CG-CB 4.27Å; F65-C95 HydrophobicContact CZ-CB 3.48Å; F65-C95 VanDerWaalsContact CZ-CB 3.48Å; F65-C95 PolarHBondContact N-O 3.42Å; F65-C95 PolarHBondContact O-N 3.25Å; C95-I109 HydrophobicContact CB-CG2 3.94Å; C95-K110 CarbonylContact C-O 3.52Å; C95-K110 VanDerWaalsContact CA-O 3.31Å; C95-K110 WeakPolarHBondContact CA-O 3.36Å; C95-C111 HydrophobicContact CB-CB 4.1Å; C95-C111 WeakPolarHBondContact CB-SG 3.32Å; C95-C111 WeakPolarHBondContact SG-CB 3.35Å; C95-C111 CovalentContact SG-SG 2.04Å; C95-C111 PolarHBondContact SG-SG 3.32Å
96	K	92.4	Very high	69.6	Low	115 Å²	115	74.3 Å²	74.3	50%	0.5	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	138.9	179	-61.2	-176.1	179.3	172.6	0	109.9	V64 K110	V64-K96 HydrophobicContact CB-CG 4.47Å; V64-K96 HydrophobicContact CG1-CG 4Å; V64-K96 HydrophobicContact CG2-CG 4.02Å; K96-K110 PolarHBondContact N-O 2.82Å; K96-K110 PolarHBondContact O-N 2.85Å
97	G	90	Very high	71.6	Confident	15 Å²	15	72 Å²	72	16%	0.155	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.6	-174.6	179.7	0	0	0	0	0	115.6	E62 V63 T108	E62-G97 WeakPolarHBondContact CA-O 3.44Å; V63-G97 PolarHBondContact N-O 3.32Å; V63-G97 PolarHBondContact O-N 3.41Å; V63-G97 VanDerWaalsContact O-N 3.14Å; G97-T108 WeakPolarHBondContact CA-O 3.28Å
98	I	87.2	Confident	73.8	Confident	42 Å²	42	71 Å²	71	22%	0.215	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	123.9	176.6	-54.9	175.5	0	0	0	109.4	D107 T108	I98-D107 WeakPolarHBondContact O-CA 3.46Å; I98-T108 PolarHBondContact N-O 2.89Å; I98-T108 PolarHBondContact O-N 3.21Å
99	L	85.2	Confident	76	Confident	12 Å²	12	66.1 Å²	66.1	6%	0.063	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	114.9	166	-61.6	174.4	0	0	0	108.4	I26 I30 L33 G60 I61 V63 L101 D107 I109	I26-L99 HydrophobicContact CG2-CD1 4.21Å; I30-L99 HydrophobicContact CG1-CD1 3.96Å; L33-L99 HydrophobicContact CD1-CD2 3.45Å; L33-L99 VanDerWaalsContact CD1-CD2 3.45Å; G60-L99 CarbonylContact C-O 3.59Å; G60-L99 WeakPolarHBondContact CA-O 3.39Å; I61-L99 HydrophobicContact CB-CB 4.38Å; I61-L99 PolarHBondContact N-O 2.9Å; I61-L99 PolarHBondContact O-N 2.87Å; V63-L99 HydrophobicContact CG1-CD1 3.72Å; V63-L99 HydrophobicContact CG1-CG 4.23Å; V63-L99 HydrophobicContact CG2-CD1 3.99Å; V63-L99 HydrophobicContact CG2-CD2 4.46Å; V63-L99 HydrophobicContact CG2-CG 3.81Å; L99-L101 PolarHBondContact O-N 3.25Å; L99-D107 WeakPolarHBondContact CA-OD1 3.1Å; L99-I109 HydrophobicContact CD2-CD1 3.88Å
100	S	78.5	Confident	77.8	Confident	26 Å²	26	67.4 Å²	67.4	18%	0.182	37%	0.37	C	S	.	.			trans	-75.4	130.4	-177.1	-162.6	0	0	0	0	111.4	V102 V105 D107	S100-V102 VanDerWaalsContact C-N 3.26Å; S100-V102 PolarHBondContact OG-N 3.2Å; S100-V102 PolarHBondContact OG-O 2.88Å; S100-V105 WeakPolarHBondContact OG-CB 3.45Å; S100-V105 WeakPolarHBondContact OG-CG1 3.29Å; S100-D107 PolarHBondContact N-OD1 3.14Å
101	L	67.9	Low	79.2	Confident	97 Å²	97	66.2 Å²	66.2	51%	0.508	36%	0.364	S	S	.	.	S	Bend	trans	-81	-11.8	171.4	-67.9	174.3	0	0	0	112.1	I61 L99 P103	I61-L101 HydrophobicContact CD1-CD2 4.01Å; I61-L101 HydrophobicContact CG1-CD1 4.26Å; I61-L101 HydrophobicContact CG1-CD2 4.11Å; I61-L101 HydrophobicContact CG1-CG 4.22Å; L99-L101 PolarHBondContact O-N 3.25Å; L101-P103 WeakPolarHBondContact O-CD 3.09Å
102	V	59.3	Low	80	Confident	72 Å²	72	68.7 Å²	68.7	44%	0.436	38%	0.377	S	S	.	.	S	Bend	trans	-89.4	116.6	176.4	-172.5	0	0	0	0	106.9	S100 V105 I869	S100-V102 VanDerWaalsContact C-N 3.26Å; S100-V102 PolarHBondContact OG-N 3.2Å; S100-V102 PolarHBondContact OG-O 2.88Å; V102-V105 HydrophobicContact CB-CB 4.31Å; V102-V105 HydrophobicContact CB-CG2 3.76Å; V102-V105 HydrophobicContact CG1-CG2 3.8Å; V102-V105 PolarHBondContact O-N 3.43Å; V102-I869 HydrophobicContact CG1-CD1 4.27Å
103	P	59.7	Low	79.8	Confident	99 Å²	99	70.2 Å²	70.2	64%	0.643	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	153.9	174.7	-19.2	29.5	0	0	0	109.9	L101 V105 I869	L101-P103 WeakPolarHBondContact O-CD 3.09Å; P103-V105 PolarHBondContact O-N 2.87Å; P103-I869 HydrophobicContact CB-CD1 3.98Å; P103-I869 WeakPolarHBondContact O-CD1 3.41Å
104	G	61.2	Low	78.9	Confident	85 Å²	85	72.4 Å²	72.4	88%	0.876	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.5	-14.5	177.5	0	0	0	0	0	117.4
105	V	67.9	Low	77.3	Confident	80 Å²	80	79.7 Å²	79.7	49%	0.485	43%	0.429	S	S	.	.	S	Bend	trans	-80.8	131.1	165.9	178.5	0	0	0	0	107.9	S100 V102 P103	S100-V105 WeakPolarHBondContact OG-CB 3.45Å; S100-V105 WeakPolarHBondContact OG-CG1 3.29Å; V102-V105 HydrophobicContact CB-CB 4.31Å; V102-V105 HydrophobicContact CB-CG2 3.76Å; V102-V105 HydrophobicContact CG1-CG2 3.8Å; V102-V105 PolarHBondContact O-N 3.43Å; P103-V105 PolarHBondContact O-N 2.87Å
106	K	70.2	Confident	75.2	Confident	186 Å²	186	85.1 Å²	85.1	81%	0.809	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-71.5	134.2	-179.3	-77.7	-175.9	177.4	179.1	0	110.3	T108	K106-T108 PolarHBondContact O-N 3.37Å
107	D	80.1	Confident	72.7	Confident	52 Å²	52	82.7 Å²	82.7	28%	0.278	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-63.7	130.8	168	-55.3	-44.7	0	0	0	109.9	L33 Q37 I98 L99 S100 I109	L33-D107 HydrophobicContact CD1-CB 3.4Å; L33-D107 WeakPolarHBondContact CD1-OD2 3.24Å; Q37-D107 PolarHBondContact NE2-O 3.09Å; Q37-D107 VanDerWaalsContact NE2-O 3.16Å; I98-D107 WeakPolarHBondContact O-CA 3.46Å; L99-D107 WeakPolarHBondContact CA-OD1 3.1Å; S100-D107 PolarHBondContact N-OD1 3.14Å; D107-I109 PolarHBondContact O-N 2.05Å
108	T	80.2	Confident	70.1	Confident	61 Å²	61	89.7 Å²	89.7	37%	0.374	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	75.7	-175.3	48.8	0	0	0	0	110.2	G97 I98 K106	G97-T108 WeakPolarHBondContact CA-O 3.28Å; I98-T108 PolarHBondContact N-O 2.89Å; I98-T108 PolarHBondContact O-N 3.21Å; K106-T108 PolarHBondContact O-N 3.37Å
109	I	86	Confident	67.4	Low	19 Å²	19	91.5 Å²	91.5	10%	0.097	53%	0.529	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	130.9	-178.6	-57.3	-136.8	0	0	0	111	L33 V63 F65 C95 L99 D107	L33-I109 HydrophobicContact CD1-CD1 3.72Å; L33-I109 HydrophobicContact CD1-CG1 3.75Å; L33-I109 HydrophobicContact CD2-CB 4.18Å; L33-I109 HydrophobicContact CD2-CD1 4.09Å; L33-I109 HydrophobicContact CD2-CG1 4.18Å; L33-I109 HydrophobicContact CD2-CG2 4.36Å; V63-I109 HydrophobicContact CG2-CD1 3.87Å; F65-I109 HydrophobicContact CE1-CD1 3.52Å; F65-I109 HydrophobicContact CE1-CG2 4.25Å; F65-I109 HydrophobicContact CZ-CD1 3.96Å; F65-I109 HydrophobicContact CZ-CG2 4.03Å; C95-I109 HydrophobicContact CB-CG2 3.94Å; L99-I109 HydrophobicContact CD2-CD1 3.88Å; D107-I109 PolarHBondContact O-N 2.05Å
110	K	87.5	Confident	64.9	Low	157 Å²	157	99.5 Å²	99.5	68%	0.683	57%	0.566	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-121.6	138.8	171.3	-69.1	-176	178.7	179.4	0	109.6	C95 K96	C95-K110 CarbonylContact C-O 3.52Å; C95-K110 VanDerWaalsContact CA-O 3.31Å; C95-K110 WeakPolarHBondContact CA-O 3.36Å; K96-K110 PolarHBondContact N-O 2.82Å; K96-K110 PolarHBondContact O-N 2.85Å
111	C	89.2	Confident	62.9	Low	42 Å²	42	105.9 Å²	105.9	28%	0.284	59%	0.587	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.3	137.7	179.5	-55.4	0	0	0	0	110.7	L93 I94 C95	L93-C111 HydrophobicContact CB-CB 4.18Å; L93-C111 HydrophobicContact CD1-CB 4.32Å; I94-C111 CarbonylContact O-C 3.41Å; I94-C111 VanDerWaalsContact O-CA 3.29Å; I94-C111 WeakPolarHBondContact O-CA 3.31Å; C95-C111 HydrophobicContact CB-CB 4.1Å; C95-C111 WeakPolarHBondContact CB-SG 3.32Å; C95-C111 WeakPolarHBondContact SG-CB 3.35Å; C95-C111 CovalentContact SG-SG 2.04Å; C95-C111 PolarHBondContact SG-SG 3.32Å
112	E	86.2	Confident	61.3	Low	131 Å²	131	106.9 Å²	106.9	61%	0.612	60%	0.599	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-127.6	146.7	-179.3	-65.6	175.3	177.8	0	0	110	L93 I94	L93-E112 CarbonylContact C-O 3.59Å; L93-E112 VanDerWaalsContact CA-O 3.26Å; L93-E112 WeakPolarHBondContact CA-O 3.31Å; I94-E112 HydrophobicContact CG2-CB 4.37Å; I94-E112 PolarHBondContact N-O 2.78Å; I94-E112 PolarHBondContact O-N 2.81Å
113	E	78.6	Confident	60	Low	117 Å²	117	108.9 Å²	108.9	55%	0.547	61%	0.608	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-67.7	133.3	175.5	-75.8	-175.9	168.5	0	0	110.9	K91 L93 K115	K91-E113 WeakPolarHBondContact CD-OE1 3.21Å; K91-E113 IonicContact NZ-OE1 3.04Å; K91-E113 PolarHBondContact NZ-OE1 3.26Å; K91-E113 IonicContact NZ-OE2 3.82Å; L93-E113 HydrophobicContact CD2-CB 4.11Å; L93-E113 HydrophobicContact CD2-CG 3.36Å; E113-K115 PolarHBondContact O-N 3.15Å
114	V	67.7	Low	58.8	Low	68 Å²	68	110.5 Å²	110.5	41%	0.412	62%	0.618	S	S	.	*			trans	-74	116.1	170.7	-174.5	0	0	0	0	107.2	K92 I94 D116	K92-V114 HydrophobicContact CB-CG2 4.26Å; K92-V114 PolarHBondContact O-N 3.15Å; K92-V114 VanDerWaalsContact O-N 3.09Å; I94-V114 HydrophobicContact CB-CG2 4.16Å; I94-V114 HydrophobicContact CG2-CG2 4.36Å; V114-D116 PolarHBondContact O-N 2.91Å
115	K	57.1	Low	57.4	Low	197 Å²	197	109.4 Å²	109.4	86%	0.857	60%	0.597	S	S	*	*			trans	-70.7	109.3	172.9	-68.7	-174.3	178.4	-178.2	0	108.3	E113 G117	E113-K115 PolarHBondContact O-N 3.15Å; K115-G117 PolarHBondContact O-N 3.39Å
116	D	46.8	Very low	55.5	Low	115 Å²	115	113.9 Å²	113.9	62%	0.615	61%	0.61	S	S	*	*			trans	-61.2	116.7	174	-69.1	-44.3	0	0	0	109.7	F89 V114	F89-D116 VanDerWaalsContact CD1-OD2 3.31Å; F89-D116 WeakPolarHBondContact CD1-OD2 3.37Å; F89-D116 HydrophobicContact CE1-CB 4.36Å; V114-D116 PolarHBondContact O-N 2.91Å
117	G	39.4	Very low	53.7	Low	63 Å²	63	111 Å²	111	65%	0.649	61%	0.61	S	S	*	*			trans	178.5	86.5	-178.3	0	0	0	0	0	108.6	K115	K115-G117 PolarHBondContact O-N 3.39Å
118	D	35.7	Very low	51.4	Low	163 Å²	163	114.4 Å²	114.4	87%	0.872	63%	0.633	S	S	*	*			trans	44.5	97.7	159.5	-54.7	-22.4	0	0	0	118	Q120	D118-Q120 PolarHBondContact O-N 2.99Å
119	G	31.1	Very low	49	Very low	80 Å²	80	116.6 Å²	116.6	83%	0.825	65%	0.649	S	S	*	*			trans	11.7	88.6	146.2	0	0	0	0	0	119.3
120	Q	32.7	Very low	46.6	Very low	180 Å²	180	120.4 Å²	120.4	84%	0.841	68%	0.677	S	S	*	*			trans	-157.9	112.8	137.8	-160	82.5	9.9	0	0	106.7	D118	D118-Q120 PolarHBondContact O-N 2.99Å
121	Y	37.4	Very low	44.6	Very low	160 Å²	160	120.9 Å²	120.9	63%	0.627	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-59.5	134.1	168.6	-95.5	-93.6	0	0	0	108.1	K50 D123	K50-Y121 PolarHBondContact NZ-OH 3.38Å; Y121-D123 PolarHBondContact O-N 3.07Å; Y121-D123 VanDerWaalsContact O-N 3.09Å
122	P	33.5	Very low	42.4	Very low	117 Å²	117	121.8 Å²	121.8	76%	0.76	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-60.9	119.3	173.5	22.2	-28.6	0	0	0	108.6
123	D	32.2	Very low	41	Very low	115 Å²	115	119.5 Å²	119.5	62%	0.615	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-47.8	130.3	171.5	-177.8	13.3	0	0	0	109.6	Y121 S125	Y121-D123 PolarHBondContact O-N 3.07Å; Y121-D123 VanDerWaalsContact O-N 3.09Å; D123-S125 PolarHBondContact O-N 2.96Å; D123-S125 PolarHBondContact OD1-OG 2.95Å; D123-S125 PolarHBondContact OD2-OG 2.96Å
124	P	33.6	Very low	39.8	Very low	133 Å²	133	120.5 Å²	120.5	86%	0.864	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	13.3	-175.4	-19.7	32.1	0	0	0	115.9
125	S	31.6	Very low	39.5	Very low	62 Å²	62	122.5 Å²	122.5	43%	0.434	70%	0.699	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102	2.6	-164.3	60.7	0	0	0	0	115.6	D123	D123-S125 PolarHBondContact O-N 2.96Å; D123-S125 PolarHBondContact OD1-OG 2.95Å; D123-S125 PolarHBondContact OD2-OG 2.96Å
126	F	29.2	Very low	39.8	Very low	174 Å²	174	116.8 Å²	116.8	76%	0.763	68%	0.675	S	S	*	*	S	Bend	trans	-132.2	121	174.7	-75.6	-87.7	0	0	0	113.1	T128	F126-T128 PolarHBondContact O-N 3.02Å; F126-T128 VanDerWaalsContact O-N 3.07Å
127	P	31.7	Very low	40.9	Very low	124 Å²	124	114.3 Å²	114.3	81%	0.805	66%	0.664	S	S	*	*			trans	-72	106.2	177	28.5	-30.1	0	0	0	109.4
128	T	31.2	Very low	42.5	Very low	125 Å²	125	115 Å²	115	77%	0.767	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-61.7	137.2	159.2	-37	0	0	0	0	107.7	F126 S130	F126-T128 PolarHBondContact O-N 3.02Å; F126-T128 VanDerWaalsContact O-N 3.07Å; T128-S130 PolarHBondContact O-N 2.78Å
129	P	30	Very low	44.3	Very low	107 Å²	107	109.8 Å²	109.8	70%	0.695	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-53.7	116.9	-171.2	-22.8	31.5	0	0	0	110.5	Q131	P129-Q131 PolarHBondContact O-N 3.39Å; P129-Q131 VanDerWaalsContact O-N 3.1Å
130	S	36.9	Very low	46.7	Very low	98 Å²	98	108.5 Å²	108.5	69%	0.685	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-56.1	117.2	-179.6	39.4	0	0	0	0	109.6	T128	T128-S130 PolarHBondContact O-N 2.78Å
131	Q	44.1	Very low	49.1	Very low	167 Å²	167	103.7 Å²	103.7	78%	0.78	58%	0.583	S	S	*	*	P	Polyproline II helix	trans	-51.9	131.9	160.6	-168.1	172.1	4.5	0	0	107.1	P129 T133	P129-Q131 PolarHBondContact O-N 3.39Å; P129-Q131 VanDerWaalsContact O-N 3.1Å; Q131-T133 PolarHBondContact O-N 3.23Å; Q131-T133 VanDerWaalsContact O-N 3.16Å
132	P	43.5	Very low	51.1	Low	61 Å²	61	102.8 Å²	102.8	40%	0.396	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-56	127.5	-169	17.7	-29.3	0	0	0	109.8	E136 T137 I140	P132-E136 VanDerWaalsContact CA-OE2 3.29Å; P132-E136 WeakPolarHBondContact CA-OE2 3.34Å; P132-E136 HydrophobicContact CB-CB 3.71Å; P132-T137 PolarHBondContact O-OG1 2.69Å; P132-I140 HydrophobicContact CB-CD1 4.05Å; P132-I140 HydrophobicContact CG-CD1 4.46Å
133	T	56.5	Low	53.6	Low	83 Å²	83	97.4 Å²	97.4	51%	0.509	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-53.5	157	172.5	35.7	0	0	0	0	110	Q131 V135 E136 T137	Q131-T133 PolarHBondContact O-N 3.23Å; Q131-T133 VanDerWaalsContact O-N 3.16Å; T133-V135 PolarHBondContact O-N 2.91Å; T133-E136 PolarHBondContact N-OE2 3.04Å; T133-E136 CarbonylContact O-C 3.55Å; T133-E136 WeakPolarHBondContact O-CA 3.42Å; T133-E136 PolarHBondContact O-N 2.88Å; T133-E136 WeakPolarHBondContact OG1-CG 3.46Å; T133-E136 PolarHBondContact OG1-OE2 3.46Å; T133-T137 PolarHBondContact O-N 2.75Å; T133-T137 PolarHBondContact O-OG1 3.27Å; T133-T137 VanDerWaalsContact O-OG1 3.05Å
134	E	54.7	Low	56.2	Low	138 Å²	138	93.2 Å²	93.2	65%	0.645	53%	0.525	S	S	*	.	H	α-helix	trans	-55.2	-31.9	-179.7	-153.8	175.5	-164	0	0	111.5	T137 V138	E134-T137 PolarHBondContact O-N 3.11Å; E134-V138 WeakPolarHBondContact O-CG2 3.42Å; E134-V138 PolarHBondContact O-N 2.98Å
135	V	59.7	Low	58.6	Low	111 Å²	111	89.6 Å²	89.6	67%	0.673	50%	0.501	S	S	*	.	H	α-helix	trans	-65.7	-48	171.9	-174.9	0	0	0	0	112.3	T133 T137 V138 E139	T133-V135 PolarHBondContact O-N 2.91Å; V135-T137 VanDerWaalsContact C-N 3.28Å; V135-T137 PolarHBondContact O-N 2.78Å; V135-V138 PolarHBondContact O-N 3.05Å; V135-E139 PolarHBondContact O-N 3.39Å
136	E	63.7	Low	61.1	Low	77 Å²	77	89.2 Å²	89.2	36%	0.36	50%	0.498	S	S	.	.	H	α-helix	trans	-63.8	-33.7	174	-76.5	173.2	142.4	0	0	111.6	P132 T133 E139 I140	P132-E136 VanDerWaalsContact CA-OE2 3.29Å; P132-E136 WeakPolarHBondContact CA-OE2 3.34Å; P132-E136 HydrophobicContact CB-CB 3.71Å; T133-E136 PolarHBondContact N-OE2 3.04Å; T133-E136 CarbonylContact O-C 3.55Å; T133-E136 WeakPolarHBondContact O-CA 3.42Å; T133-E136 PolarHBondContact O-N 2.88Å; T133-E136 WeakPolarHBondContact OG1-CG 3.46Å; T133-E136 PolarHBondContact OG1-OE2 3.46Å; E136-E139 PolarHBondContact O-N 2.88Å; E136-I140 VanDerWaalsContact O-CB 3.29Å; E136-I140 WeakPolarHBondContact O-CB 3.45Å; E136-I140 WeakPolarHBondContact O-CD1 3.15Å; E136-I140 WeakPolarHBondContact O-CG1 3.22Å; E136-I140 PolarHBondContact O-N 3.45Å
137	T	69.6	Low	63.9	Low	63 Å²	63	81 Å²	81	39%	0.387	46%	0.462	S	S	.	.	H	α-helix	trans	-67.7	-41.7	177.2	-53.8	0	0	0	0	111	P132 T133 E134 V135 T141	P132-T137 PolarHBondContact O-OG1 2.69Å; T133-T137 PolarHBondContact O-N 2.75Å; T133-T137 PolarHBondContact O-OG1 3.27Å; T133-T137 VanDerWaalsContact O-OG1 3.05Å; E134-T137 PolarHBondContact O-N 3.11Å; V135-T137 VanDerWaalsContact C-N 3.28Å; V135-T137 PolarHBondContact O-N 2.78Å; T137-T141 VanDerWaalsContact O-CB 3.28Å; T137-T141 WeakPolarHBondContact O-CB 3.29Å; T137-T141 PolarHBondContact O-N 3.21Å; T137-T141 PolarHBondContact O-OG1 3.35Å
138	V	73	Confident	66.5	Low	76 Å²	76	80.9 Å²	80.9	46%	0.461	45%	0.449	S	S	.	.	H	α-helix	trans	-64.1	-41.6	173.4	171.7	0	0	0	0	110.9	E134 V135 T141 K142	E134-V138 WeakPolarHBondContact O-CG2 3.42Å; E134-V138 PolarHBondContact O-N 2.98Å; V135-V138 PolarHBondContact O-N 3.05Å; V138-T141 PolarHBondContact O-N 2.73Å; V138-K142 HydrophobicContact CG1-CD 4.24Å; V138-K142 WeakPolarHBondContact O-CG 3.39Å; V138-K142 PolarHBondContact O-N 2.98Å
139	E	75	Confident	68.9	Low	54 Å²	54	81 Å²	81	25%	0.252	44%	0.436	S	S	.	.	H	α-helix	trans	-66.2	-48.6	177.8	-172.1	166.2	-157.6	0	0	111.9	V135 E136 T141 K142 I143 R173	V135-E139 PolarHBondContact O-N 3.39Å; E136-E139 PolarHBondContact O-N 2.88Å; E139-T141 VanDerWaalsContact C-N 3.28Å; E139-T141 PolarHBondContact O-N 3.46Å; E139-K142 WeakPolarHBondContact O-CB 3.28Å; E139-K142 PolarHBondContact O-N 3.3Å; E139-K142 VanDerWaalsContact O-N 3.15Å; E139-I143 HydrophobicContact CG-CD1 3.92Å; E139-I143 VanDerWaalsContact O-CG1 3.31Å; E139-I143 WeakPolarHBondContact O-CG1 3.33Å; E139-I143 PolarHBondContact O-N 2.84Å; E139-R173 IonicContact OE1-NH1 2.78Å
140	I	80.9	Confident	71.5	Confident	53 Å²	53	76 Å²	76	27%	0.272	40%	0.403	S	S	.	.	H	α-helix	trans	-59.4	-39.3	175.7	-69.5	165.5	0	0	0	110.8	P132 E136 I143 T144	P132-I140 HydrophobicContact CB-CD1 4.05Å; P132-I140 HydrophobicContact CG-CD1 4.46Å; E136-I140 VanDerWaalsContact O-CB 3.29Å; E136-I140 WeakPolarHBondContact O-CB 3.45Å; E136-I140 WeakPolarHBondContact O-CD1 3.15Å; E136-I140 WeakPolarHBondContact O-CG1 3.22Å; E136-I140 PolarHBondContact O-N 3.45Å; I140-I143 PolarHBondContact O-N 2.67Å; I140-T144 VanDerWaalsContact O-CB 3.28Å; I140-T144 WeakPolarHBondContact O-CB 3.41Å; I140-T144 PolarHBondContact O-N 3.45Å; I140-T144 PolarHBondContact O-OG1 3.35Å
141	T	82.4	Confident	73.8	Confident	80 Å²	80	72 Å²	72	49%	0.491	37%	0.374	S	S	.	.	H	α-helix	trans	-65.6	-42.1	176.8	-58.6	0	0	0	0	111.6	T137 V138 E139 T145	T137-T141 VanDerWaalsContact O-CB 3.28Å; T137-T141 WeakPolarHBondContact O-CB 3.29Å; T137-T141 PolarHBondContact O-N 3.21Å; T137-T141 PolarHBondContact O-OG1 3.35Å; V138-T141 PolarHBondContact O-N 2.73Å; E139-T141 VanDerWaalsContact C-N 3.28Å; E139-T141 PolarHBondContact O-N 3.46Å; T141-T145 WeakPolarHBondContact O-CB 3.39Å; T141-T145 PolarHBondContact O-N 3.29Å; T141-T145 PolarHBondContact O-OG1 2.87Å
142	K	80.1	Confident	75.6	Confident	141 Å²	141	72.8 Å²	72.8	61%	0.613	37%	0.374	S	S	*	.	H	α-helix	trans	-63.6	-47.6	174.9	-75.2	174.2	-179.1	177.7	0	111.4	V138 E139 T144 T145 S146	V138-K142 HydrophobicContact CG1-CD 4.24Å; V138-K142 WeakPolarHBondContact O-CG 3.39Å; V138-K142 PolarHBondContact O-N 2.98Å; E139-K142 WeakPolarHBondContact O-CB 3.28Å; E139-K142 PolarHBondContact O-N 3.3Å; E139-K142 VanDerWaalsContact O-N 3.15Å; K142-T144 PolarHBondContact O-N 2.86Å; K142-T145 PolarHBondContact O-N 3.44Å; K142-S146 PolarHBondContact O-N 2.98Å; K142-S146 PolarHBondContact O-OG 2.89Å
143	I	85	Confident	77.2	Confident	4 Å²	4	73.9 Å²	73.9	2%	0.021	38%	0.384	C	S	.	.	H	α-helix	trans	-59	-47.8	177.3	-67.6	167.5	0	0	0	110.3	E139 I140 T145 S146 I147 L168 H171 I178 V180 L216	E139-I143 HydrophobicContact CG-CD1 3.92Å; E139-I143 VanDerWaalsContact O-CG1 3.31Å; E139-I143 WeakPolarHBondContact O-CG1 3.33Å; E139-I143 PolarHBondContact O-N 2.84Å; I140-I143 PolarHBondContact O-N 2.67Å; I143-T145 VanDerWaalsContact C-N 3.33Å; I143-T145 PolarHBondContact O-N 2.9Å; I143-S146 WeakPolarHBondContact O-CB 2.87Å; I143-S146 PolarHBondContact O-N 2.67Å; I143-I147 HydrophobicContact CG2-CD1 3.78Å; I143-I147 HydrophobicContact CG2-CG1 4.41Å; I143-I147 WeakPolarHBondContact O-CG1 3.3Å; I143-I147 PolarHBondContact O-N 2.95Å; I143-L168 HydrophobicContact CG2-CD1 4.39Å; I143-L168 HydrophobicContact CG2-CD2 4.02Å; I143-H171 HydrophobicContact CD1-CB 4.11Å; I143-I178 HydrophobicContact CD1-CD1 4.3Å; I143-I178 HydrophobicContact CD1-CG2 4.03Å; I143-I178 HydrophobicContact CG1-CD1 3.95Å; I143-I178 HydrophobicContact CG1-CG2 4.37Å; I143-V180 HydrophobicContact CG2-CG1 3.96Å; I143-L216 HydrophobicContact CG2-CD1 4.28Å
144	T	87.8	Confident	78.3	Confident	26 Å²	26	73.8 Å²	73.8	16%	0.16	38%	0.377	C	S	.	.	H	α-helix	trans	-61.6	-40.3	179.3	-58.3	0	0	0	0	111.9	I140 K142 I147 K148 F165	I140-T144 VanDerWaalsContact O-CB 3.28Å; I140-T144 WeakPolarHBondContact O-CB 3.41Å; I140-T144 PolarHBondContact O-N 3.45Å; I140-T144 PolarHBondContact O-OG1 3.35Å; K142-T144 PolarHBondContact O-N 2.86Å; T144-I147 PolarHBondContact O-N 2.87Å; T144-K148 HydrophobicContact CG2-CD 4.45Å; T144-K148 WeakPolarHBondContact O-CG 3.45Å; T144-K148 PolarHBondContact O-N 3.22Å; T144-F165 HydrophobicContact CG2-CD1 4.18Å; T144-F165 HydrophobicContact CG2-CE1 3.64Å; T144-F165 HydrophobicContact CG2-CZ 3.88Å
145	T	83.6	Confident	79.7	Confident	57 Å²	57	77.6 Å²	77.6	35%	0.35	39%	0.386	S	S	.	.	H	α-helix	trans	-64.8	-41.4	176.3	-56.6	0	0	0	0	111.5	T141 K142 I143 K148 R149	T141-T145 WeakPolarHBondContact O-CB 3.39Å; T141-T145 PolarHBondContact O-N 3.29Å; T141-T145 PolarHBondContact O-OG1 2.87Å; K142-T145 PolarHBondContact O-N 3.44Å; I143-T145 VanDerWaalsContact C-N 3.33Å; I143-T145 PolarHBondContact O-N 2.9Å; T145-K148 PolarHBondContact O-N 3.19Å; T145-R149 WeakPolarHBondContact O-CG 3.5Å; T145-R149 PolarHBondContact O-N 3.23Å; T145-R149 VanDerWaalsContact O-N 3.09Å
146	S	84	Confident	80.7	Confident	55 Å²	55	73.4 Å²	73.4	39%	0.385	36%	0.359	S	S	.	.	H	α-helix	trans	-63.7	-43.3	174.7	-64.5	0	0	0	0	112.2	K142 I143 R149 L150	K142-S146 PolarHBondContact O-N 2.98Å; K142-S146 PolarHBondContact O-OG 2.89Å; I143-S146 WeakPolarHBondContact O-CB 2.87Å; I143-S146 PolarHBondContact O-N 2.67Å; S146-R149 PolarHBondContact O-N 2.97Å; S146-L150 WeakPolarHBondContact O-CB 3.29Å; S146-L150 PolarHBondContact O-N 3.4Å
147	I	87.6	Confident	81.6	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-62.1	-45.5	176.5	-67.3	167.7	0	0	0	111.1	I143 T144 R149 L150 I151 F165 L168 V180 F182 L216	I143-I147 HydrophobicContact CG2-CD1 3.78Å; I143-I147 HydrophobicContact CG2-CG1 4.41Å; I143-I147 WeakPolarHBondContact O-CG1 3.3Å; I143-I147 PolarHBondContact O-N 2.95Å; T144-I147 PolarHBondContact O-N 2.87Å; I147-R149 VanDerWaalsContact C-N 3.3Å; I147-R149 PolarHBondContact O-N 2.86Å; I147-L150 WeakPolarHBondContact O-CB 3.38Å; I147-L150 PolarHBondContact O-N 2.91Å; I147-L150 VanDerWaalsContact O-N 3.1Å; I147-I151 HydrophobicContact CG2-CD1 3.9Å; I147-I151 HydrophobicContact CG2-CG1 4.39Å; I147-I151 WeakPolarHBondContact O-CG1 3.48Å; I147-I151 PolarHBondContact O-N 3.02Å; I147-F165 HydrophobicContact CB-CD2 4.4Å; I147-F165 HydrophobicContact CB-CE2 4.35Å; I147-F165 HydrophobicContact CD1-CE2 4.21Å; I147-F165 HydrophobicContact CG2-CD2 3.53Å; I147-F165 HydrophobicContact CG2-CE2 3.78Å; I147-L168 HydrophobicContact CD1-CD1 3.67Å; I147-V180 HydrophobicContact CD1-CB 4.45Å; I147-V180 HydrophobicContact CD1-CG1 4.45Å; I147-F182 HydrophobicContact CD1-CB 4.36Å; I147-F182 HydrophobicContact CD1-CD1 4.01Å; I147-F182 HydrophobicContact CD1-CG 4.23Å; I147-F182 HydrophobicContact CG1-CD1 4.35Å; I147-F182 HydrophobicContact CG1-CE1 4.44Å; I147-F182 HydrophobicContact CG2-CD1 4.1Å; I147-F182 HydrophobicContact CG2-CD2 3.62Å; I147-F182 HydrophobicContact CG2-CE1 4.06Å; I147-F182 HydrophobicContact CG2-CE2 3.56Å; I147-F182 HydrophobicContact CG2-CG 3.9Å; I147-F182 HydrophobicContact CG2-CZ 3.78Å; I147-L216 HydrophobicContact CG1-CD1 4Å
148	K	87.3	Confident	82	Confident	123 Å²	123	70.3 Å²	70.3	54%	0.535	35%	0.346	S	S	.	.	H	α-helix	trans	-59.6	-39.2	176.3	-73.7	179.2	178.7	-175.9	0	112.2	T144 T145 K152 F165	T144-K148 HydrophobicContact CG2-CD 4.45Å; T144-K148 WeakPolarHBondContact O-CG 3.45Å; T144-K148 PolarHBondContact O-N 3.22Å; T145-K148 PolarHBondContact O-N 3.19Å; K148-K152 PolarHBondContact O-N 3.3Å; K148-F165 HydrophobicContact CG-CB 4.02Å; K148-F165 HydrophobicContact CG-CG 4.34Å
149	R	82.4	Confident	82	Confident	128 Å²	128	71.1 Å²	71.1	48%	0.483	35%	0.348	S	S	.	.	H	α-helix	trans	-66.3	-38.6	173.8	-74.6	178.6	-175.5	158.2	1.8	112.2	T145 S146 I147 K152 S153 I987	T145-R149 WeakPolarHBondContact O-CG 3.5Å; T145-R149 PolarHBondContact O-N 3.23Å; T145-R149 VanDerWaalsContact O-N 3.09Å; S146-R149 PolarHBondContact O-N 2.97Å; I147-R149 VanDerWaalsContact C-N 3.3Å; I147-R149 PolarHBondContact O-N 2.86Å; R149-K152 PolarHBondContact O-N 2.85Å; R149-S153 WeakPolarHBondContact O-CB 3.27Å; R149-S153 PolarHBondContact O-N 2.63Å; R149-S153 PolarHBondContact O-OG 3.14Å; R149-I987 VanDerWaalsContact NH2-CG2 3.26Å
150	L	84.2	Confident	81.9	Confident	2 Å²	2	71.3 Å²	71.3	1%	0.01	36%	0.364	C	S	.	.	H	α-helix	trans	-67.9	-42.8	179.9	-176	137.2	0	0	0	112.9	S146 I147 K152 S153 Q154 I156 L216 D224 I226	S146-L150 WeakPolarHBondContact O-CB 3.29Å; S146-L150 PolarHBondContact O-N 3.4Å; I147-L150 WeakPolarHBondContact O-CB 3.38Å; I147-L150 PolarHBondContact O-N 2.91Å; I147-L150 VanDerWaalsContact O-N 3.1Å; L150-K152 PolarHBondContact O-N 2.93Å; L150-S153 WeakPolarHBondContact CA-OG 3.37Å; L150-S153 PolarHBondContact O-N 2.93Å; L150-S153 VanDerWaalsContact O-N 3.13Å; L150-S153 PolarHBondContact O-OG 2.83Å; L150-Q154 HydrophobicContact CD2-CG 4.23Å; L150-Q154 HydrophobicContact CG-CG 4.07Å; L150-Q154 WeakPolarHBondContact O-CB 3.41Å; L150-Q154 PolarHBondContact O-N 2.93Å; L150-I156 HydrophobicContact CD2-CD1 3.97Å; L150-L216 HydrophobicContact CD1-CD2 3.86Å; L150-D224 HydrophobicContact CD1-CB 3.25Å; L150-D224 WeakPolarHBondContact CD1-OD2 3.41Å; L150-I226 HydrophobicContact CD1-CD1 3.53Å; L150-I226 HydrophobicContact CD2-CB 4.22Å; L150-I226 HydrophobicContact CD2-CD1 3.34Å; L150-I226 HydrophobicContact CD2-CG1 4.32Å; L150-I226 HydrophobicContact CD2-CG2 4.4Å; L150-I226 HydrophobicContact CG-CD1 4.01Å
151	I	85.4	Confident	81.8	Confident	13 Å²	13	71.9 Å²	71.9	7%	0.067	37%	0.366	C	S	.	.	H	α-helix	trans	-55	-42.1	174.3	-68.9	164.6	0	0	0	110.1	I147 R155 I156 A163 F165 F182 V184	I147-I151 HydrophobicContact CG2-CD1 3.9Å; I147-I151 HydrophobicContact CG2-CG1 4.39Å; I147-I151 WeakPolarHBondContact O-CG1 3.48Å; I147-I151 PolarHBondContact O-N 3.02Å; I151-R155 PolarHBondContact O-N 3.05Å; I151-I156 HydrophobicContact CG1-CD1 4.22Å; I151-I156 HydrophobicContact CG2-CB 4.34Å; I151-I156 PolarHBondContact O-N 2.96Å; I151-A163 HydrophobicContact CG2-CB 4.14Å; I151-A163 WeakPolarHBondContact CG2-O 3.35Å; I151-F165 HydrophobicContact CD1-CB 3.86Å; I151-F165 HydrophobicContact CD1-CD2 4.33Å; I151-F182 HydrophobicContact CD1-CE2 4.1Å; I151-F182 HydrophobicContact CG1-CE2 4.2Å; I151-V184 HydrophobicContact CD1-CG1 3.7Å; I151-V184 HydrophobicContact CG1-CG1 4.24Å
152	K	81.3	Confident	81.8	Confident	183 Å²	183	72.4 Å²	72.4	80%	0.796	37%	0.371	S	S	*	.	H	α-helix	trans	-70.1	-40.8	176.5	-168.2	175	-177.8	175.5	0	113	K148 R149 L150	K148-K152 PolarHBondContact O-N 3.3Å; R149-K152 PolarHBondContact O-N 2.85Å; L150-K152 PolarHBondContact O-N 2.93Å
153	S	77	Confident	82	Confident	85 Å²	85	66.2 Å²	66.2	59%	0.594	35%	0.345	S	S	*	.	H	α-helix	trans	-76.4	-38.6	-176.5	70.7	0	0	0	0	113.4	R149 L150 R155	R149-S153 WeakPolarHBondContact O-CB 3.27Å; R149-S153 PolarHBondContact O-N 2.63Å; R149-S153 PolarHBondContact O-OG 3.14Å; L150-S153 WeakPolarHBondContact CA-OG 3.37Å; L150-S153 PolarHBondContact O-N 2.93Å; L150-S153 VanDerWaalsContact O-N 3.13Å; L150-S153 PolarHBondContact O-OG 2.83Å; S153-R155 VanDerWaalsContact C-N 3.28Å; S153-R155 PolarHBondContact O-N 3.47Å
154	Q	79.4	Confident	82.2	Confident	80 Å²	80	68.2 Å²	68.2	37%	0.374	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	1.5	178.7	-65.3	-169.1	1.6	0	0	113.3	L150 I156 D224	L150-Q154 HydrophobicContact CD2-CG 4.23Å; L150-Q154 HydrophobicContact CG-CG 4.07Å; L150-Q154 WeakPolarHBondContact O-CB 3.41Å; L150-Q154 PolarHBondContact O-N 2.93Å; Q154-I156 VanDerWaalsContact C-N 3.26Å; Q154-I156 HydrophobicContact CB-CG1 4.08Å; Q154-I156 PolarHBondContact O-N 3.31Å; Q154-D224 PolarHBondContact NE2-O 3.19Å
155	R	83.2	Confident	82.3	Confident	219 Å²	219	68.6 Å²	68.6	83%	0.826	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	44.2	-179.3	-57.3	-176	177.5	-162.1	-0.6	112.4	I151 S153 T157	I151-R155 PolarHBondContact O-N 3.05Å; S153-R155 VanDerWaalsContact C-N 3.28Å; S153-R155 PolarHBondContact O-N 3.47Å; R155-T157 PolarHBondContact O-N 3.11Å
156	I	81.3	Confident	82.5	Confident	22 Å²	22	67.9 Å²	67.9	11%	0.113	35%	0.353	C	S	.	.			trans	-65.7	124.6	177.4	-56.2	180	0	0	0	107.7	L150 I151 Q154 A163	L150-I156 HydrophobicContact CD2-CD1 3.97Å; I151-I156 HydrophobicContact CG1-CD1 4.22Å; I151-I156 HydrophobicContact CG2-CB 4.34Å; I151-I156 PolarHBondContact O-N 2.96Å; Q154-I156 VanDerWaalsContact C-N 3.26Å; Q154-I156 HydrophobicContact CB-CG1 4.08Å; Q154-I156 PolarHBondContact O-N 3.31Å; I156-A163 HydrophobicContact CB-CB 4.33Å; I156-A163 HydrophobicContact CG2-CB 3.9Å; I156-A163 WeakPolarHBondContact O-CB 3.41Å; I156-A163 PolarHBondContact O-N 3Å
157	T	82.6	Confident	82.8	Confident	72 Å²	72	71 Å²	71	44%	0.442	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	147.1	179.5	55.4	0	0	0	0	111.4	R155 Q161	R155-T157 PolarHBondContact O-N 3.11Å; T157-Q161 CarbonylContact C-O 3.56Å; T157-Q161 WeakPolarHBondContact CA-O 3.42Å; T157-Q161 WeakPolarHBondContact CB-O 3.07Å
158	V	78.5	Confident	83	Confident	3 Å²	3	73 Å²	73	2%	0.018	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	121.2	167.3	178.4	0	0	0	0	105.9	G160 Q161 A163 V184 D186 K208 L210	V158-G160 PolarHBondContact O-N 2.85Å; V158-G160 VanDerWaalsContact O-N 3.15Å; V158-Q161 PolarHBondContact N-O 3.45Å; V158-Q161 PolarHBondContact O-N 3.27Å; V158-A163 HydrophobicContact CG2-CB 3.73Å; V158-V184 HydrophobicContact CG2-CG2 4.14Å; V158-D186 HydrophobicContact CB-CB 4.43Å; V158-D186 HydrophobicContact CG1-CB 3.98Å; V158-K208 HydrophobicContact CG1-CB 4.36Å; V158-K208 VanDerWaalsContact CG1-O 3.27Å; V158-K208 WeakPolarHBondContact CG1-O 3.47Å; V158-L210 HydrophobicContact CG2-CD1 3.82Å; V158-L210 HydrophobicContact CG2-CG 4.08Å
159	N	73.6	Confident	83	Confident	94 Å²	94	70.5 Å²	70.5	50%	0.503	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	35.9	-176	-59.2	-32	0	0	0	114.2	Q161	N159-Q161 PolarHBondContact O-N 3.07Å
160	G	72.4	Confident	83.3	Confident	58 Å²	58	68.2 Å²	68.2	60%	0.598	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.1	-3.3	-178.5	0	0	0	0	0	115.3	V158	V158-G160 PolarHBondContact O-N 2.85Å; V158-G160 VanDerWaalsContact O-N 3.15Å
161	Q	77.5	Confident	83.5	Confident	65 Å²	65	71.4 Å²	71.4	30%	0.304	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	147.1	170.9	-63.9	-62.9	-64.2	0	0	110.7	T157 V158 N159 A163 R188	T157-Q161 CarbonylContact C-O 3.56Å; T157-Q161 WeakPolarHBondContact CA-O 3.42Å; T157-Q161 WeakPolarHBondContact CB-O 3.07Å; V158-Q161 PolarHBondContact N-O 3.45Å; V158-Q161 PolarHBondContact O-N 3.27Å; N159-Q161 PolarHBondContact O-N 3.07Å; Q161-A163 PolarHBondContact O-N 3Å; Q161-R188 VanDerWaalsContact CD-NH2 3.26Å
162	P	82.4	Confident	83.4	Confident	91 Å²	91	77.3 Å²	77.3	59%	0.591	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-54.4	124.3	173	-23.5	33.4	0	0	0	110.7	P187	P162-P187 WeakPolarHBondContact O-CD 3.29Å; P162-P187 WeakPolarHBondContact O-CG 3.35Å
163	A	86	Confident	83.3	Confident	10 Å²	10	76.6 Å²	76.6	8%	0.083	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-64.2	142.6	-177.9	0	0	0	0	0	110.7	I151 I156 V158 Q161 V184	I151-A163 HydrophobicContact CG2-CB 4.14Å; I151-A163 WeakPolarHBondContact CG2-O 3.35Å; I156-A163 HydrophobicContact CB-CB 4.33Å; I156-A163 HydrophobicContact CG2-CB 3.9Å; I156-A163 WeakPolarHBondContact O-CB 3.41Å; I156-A163 PolarHBondContact O-N 3Å; V158-A163 HydrophobicContact CG2-CB 3.73Å; Q161-A163 PolarHBondContact O-N 3Å; A163-V184 HydrophobicContact CB-CB 3.94Å; A163-V184 HydrophobicContact CB-CG1 4.48Å; A163-V184 HydrophobicContact CB-CG2 3.98Å
164	S	88	Confident	83.1	Confident	46 Å²	46	74.5 Å²	74.5	32%	0.322	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	141	171.3	-172.8	0	0	0	0	110.3	D166 V184 K185	S164-D166 PolarHBondContact O-N 3.05Å; S164-V184 CarbonylContact O-C 3.6Å; S164-V184 WeakPolarHBondContact O-CA 3.49Å; S164-V184 WeakPolarHBondContact O-CB 3.48Å; S164-K185 PolarHBondContact N-O 2.67Å; S164-K185 PolarHBondContact O-N 2.88Å
165	F	90.3	Very high	82.4	Confident	35 Å²	35	77.5 Å²	77.5	15%	0.154	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	122.6	174	175.6	-94.7	0	0	0	110.2	T144 I147 K148 I151 K167 L168 F182	T144-F165 HydrophobicContact CG2-CD1 4.18Å; T144-F165 HydrophobicContact CG2-CE1 3.64Å; T144-F165 HydrophobicContact CG2-CZ 3.88Å; I147-F165 HydrophobicContact CB-CD2 4.4Å; I147-F165 HydrophobicContact CB-CE2 4.35Å; I147-F165 HydrophobicContact CD1-CE2 4.21Å; I147-F165 HydrophobicContact CG2-CD2 3.53Å; I147-F165 HydrophobicContact CG2-CE2 3.78Å; K148-F165 HydrophobicContact CG-CB 4.02Å; K148-F165 HydrophobicContact CG-CG 4.34Å; I151-F165 HydrophobicContact CD1-CB 3.86Å; I151-F165 HydrophobicContact CD1-CD2 4.33Å; F165-K167 VanDerWaalsContact CZ-C 3.47Å; F165-L168 HydrophobicContact CZ-CB 4.06Å; F165-F182 HydrophobicContact CD2-CD2 4.2Å; F165-F182 HydrophobicContact CE2-CB 3.97Å; F165-F182 HydrophobicContact CE2-CD2 4.39Å; F165-F182 HydrophobicContact CE2-CG 4.42Å
166	D	88.6	Confident	81.6	Confident	42 Å²	42	70.5 Å²	70.5	23%	0.225	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	-62.2	178.2	-167.4	32.4	0	0	0	110.5	S164 V183 K185 K209	S164-D166 PolarHBondContact O-N 3.05Å; D166-V183 HydrophobicContact CB-CB 4.17Å; D166-V183 HydrophobicContact CB-CG1 4.04Å; D166-V183 WeakPolarHBondContact CB-O 3.47Å; D166-V183 PolarHBondContact N-O 2.83Å; D166-K185 HydrophobicContact CB-CB 4.43Å; D166-K185 HydrophobicContact CB-CD 4.12Å; D166-K185 HydrophobicContact CB-CG 4.06Å; D166-K185 WeakPolarHBondContact OD1-CD 3.43Å; D166-K185 WeakPolarHBondContact OD1-CE 3.3Å; D166-K185 IonicContact OD1-NZ 3.88Å; D166-K209 IonicContact OD2-NZ 3.47Å; D166-K209 PolarHBondContact OD2-NZ 3.35Å
167	K	90.6	Very high	81.6	Confident	121 Å²	121	69.5 Å²	69.5	53%	0.526	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	153.8	-179.7	62.7	179.5	179.9	-178.7	0	113.4	F165 F182 V183	F165-K167 VanDerWaalsContact CZ-C 3.47Å; K167-F182 CarbonylContact O-C 3.59Å; K167-F182 VanDerWaalsContact O-CA 3.3Å; K167-F182 WeakPolarHBondContact O-CA 3.27Å; K167-F182 WeakPolarHBondContact O-CB 3.32Å; K167-V183 HydrophobicContact CG-CB 4.09Å; K167-V183 HydrophobicContact CG-CG2 4.19Å; K167-V183 PolarHBondContact N-O 2.85Å; K167-V183 PolarHBondContact O-N 2.92Å
168	L	89.9	Confident	81.7	Confident	40 Å²	40	66.9 Å²	66.9	21%	0.209	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	125.9	165.8	-176.1	65.2	0	0	0	108.6	I143 I147 F165 H171 V180 F182	I143-L168 HydrophobicContact CG2-CD1 4.39Å; I143-L168 HydrophobicContact CG2-CD2 4.02Å; I147-L168 HydrophobicContact CD1-CD1 3.67Å; F165-L168 HydrophobicContact CZ-CB 4.06Å; L168-H171 HydrophobicContact CD2-CB 4.34Å; L168-V180 HydrophobicContact CD1-CB 4.37Å; L168-V180 HydrophobicContact CD1-CG1 4.49Å; L168-F182 HydrophobicContact CD1-CB 4.21Å
169	V	88.3	Confident	82.1	Confident	72 Å²	72	71 Å²	71	44%	0.436	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	-51.6	-179.2	-175.7	0	0	0	0	110.4	V181 V183	V169-V181 WeakPolarHBondContact CA-O 3.4Å; V169-V181 HydrophobicContact CB-CB 4.17Å; V169-V181 HydrophobicContact CB-CG1 3.97Å; V169-V181 WeakPolarHBondContact CB-O 3.18Å; V169-V181 HydrophobicContact CG1-CG1 4.4Å; V169-V181 HydrophobicContact CG2-CG1 4.3Å; V169-V181 PolarHBondContact N-O 3.37Å; V169-V183 HydrophobicContact CG2-CG2 3.78Å
170	T	89.2	Confident	82.9	Confident	80 Å²	80	66.6 Å²	66.6	49%	0.491	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	153	176.6	57.5	0	0	0	0	110.7	V181	T170-V181 PolarHBondContact N-O 2.93Å; T170-V181 PolarHBondContact O-N 2.92Å; T170-V181 WeakPolarHBondContact OG1-CB 3.36Å; T170-V181 VanDerWaalsContact OG1-CG2 3.29Å; T170-V181 WeakPolarHBondContact OG1-CG2 3.42Å
171	H	87.9	Confident	83.8	Confident	69 Å²	69	64.9 Å²	64.9	32%	0.319	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	146.7	166.4	67.2	-77.7	0	0	0	110.1	I143 L168 I178 E179 V180	I143-H171 HydrophobicContact CD1-CB 4.11Å; L168-H171 HydrophobicContact CD2-CB 4.34Å; H171-I178 HydrophobicContact CB-CG2 4.31Å; H171-E179 CarbonylContact C-O 3.55Å; H171-E179 VanDerWaalsContact CA-O 3.23Å; H171-E179 WeakPolarHBondContact CA-O 3.18Å; H171-V180 HydrophobicContact CB-CG1 4.28Å
172	K	84.1	Confident	84.6	Confident	136 Å²	136	61.8 Å²	61.8	59%	0.591	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.2	124.3	175.1	-175.8	-177.3	176.7	-171.3	0	109.2	T174 E179	K172-T174 PolarHBondContact O-N 3.44Å; K172-E179 HydrophobicContact CB-CB 4.41Å; K172-E179 PolarHBondContact N-O 3.17Å; K172-E179 WeakPolarHBondContact O-CB 3.16Å; K172-E179 PolarHBondContact O-N 3.02Å
173	R	77.9	Confident	85	Confident	169 Å²	169	57.8 Å²	57.8	64%	0.638	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.3	124.5	173.2	-161.1	168.1	179.2	163.6	-6.1	109.2	E139	E139-R173 IonicContact OE1-NH1 2.78Å
174	T	73	Confident	85.1	Confident	40 Å²	40	57.3 Å²	57.3	25%	0.245	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	170.8	176.3	65.5	0	0	0	0	109.5	K172 S176 G177 E179	K172-T174 PolarHBondContact O-N 3.44Å; T174-S176 PolarHBondContact O-N 3.09Å; T174-S176 PolarHBondContact OG1-OG 3.19Å; T174-S176 VanDerWaalsContact OG1-OG 3.09Å; T174-G177 CarbonylContact C-O 3.49Å; T174-G177 PolarHBondContact N-O 2.84Å; T174-G177 PolarHBondContact O-N 3.32Å; T174-G177 PolarHBondContact OG1-N 3.09Å; T174-G177 PolarHBondContact OG1-O 3.08Å; T174-G177 VanDerWaalsContact OG1-O 3.1Å; T174-E179 HydrophobicContact CG2-CB 4.07Å
175	E	65.5	Low	85.1	Confident	143 Å²	143	56.4 Å²	56.4	67%	0.668	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-24	175.5	-70.3	172.4	163	0	0	112.5	R512	E175-R512 VanDerWaalsContact CD-NH2 3.31Å; E175-R512 IonicContact OE1-CZ 2.67Å; E175-R512 IonicContact OE1-NH2 3.14Å; E175-R512 PolarHBondContact OE1-NH2 3.46Å; E175-R512 IonicContact OE2-NH2 2.85Å; E175-R512 PolarHBondContact OE2-NH2 3.2Å
176	S	66.1	Low	84.8	Confident	72 Å²	72	55.7 Å²	55.7	50%	0.503	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-10.4	179.4	48.5	0	0	0	0	114.6	T174	T174-S176 PolarHBondContact O-N 3.09Å; T174-S176 PolarHBondContact OG1-OG 3.19Å; T174-S176 VanDerWaalsContact OG1-OG 3.09Å
177	G	81	Confident	84	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.01	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	153.3	-150.5	-176.1	0	0	0	0	0	113.4	T174 L216	T174-G177 CarbonylContact C-O 3.49Å; T174-G177 PolarHBondContact N-O 2.84Å; T174-G177 PolarHBondContact O-N 3.32Å; T174-G177 PolarHBondContact OG1-N 3.09Å; T174-G177 PolarHBondContact OG1-O 3.08Å; T174-G177 VanDerWaalsContact OG1-O 3.1Å; G177-L216 CarbonylContact C-O 3.56Å; G177-L216 WeakPolarHBondContact CA-O 3.21Å
178	I	85.9	Confident	83	Confident	18 Å²	18	58.1 Å²	58.1	9%	0.092	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	109.5	172.6	-52.4	177.3	0	0	0	107.3	I143 H171 V180 L216 L218	I143-I178 HydrophobicContact CD1-CD1 4.3Å; I143-I178 HydrophobicContact CD1-CG2 4.03Å; I143-I178 HydrophobicContact CG1-CD1 3.95Å; I143-I178 HydrophobicContact CG1-CG2 4.37Å; H171-I178 HydrophobicContact CB-CG2 4.31Å; I178-V180 HydrophobicContact CG2-CG1 3.83Å; I178-V180 PolarHBondContact O-N 2.95Å; I178-L216 HydrophobicContact CB-CB 4.33Å; I178-L216 PolarHBondContact N-O 2.89Å; I178-L216 PolarHBondContact O-N 2.87Å; I178-L218 HydrophobicContact CD1-CD2 4.06Å; I178-L218 HydrophobicContact CG1-CD1 4.34Å; I178-L218 HydrophobicContact CG1-CD2 4.19Å; I178-L218 HydrophobicContact CG1-CG 4.29Å
179	E	86.5	Confident	81.6	Confident	90 Å²	90	57.9 Å²	57.9	42%	0.421	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	124.3	171.1	-174.5	179.7	-166.3	0	0	108.6	H171 K172 T174 G214	H171-E179 CarbonylContact C-O 3.55Å; H171-E179 VanDerWaalsContact CA-O 3.23Å; H171-E179 WeakPolarHBondContact CA-O 3.18Å; K172-E179 HydrophobicContact CB-CB 4.41Å; K172-E179 PolarHBondContact N-O 3.17Å; K172-E179 WeakPolarHBondContact O-CB 3.16Å; K172-E179 PolarHBondContact O-N 3.02Å; T174-E179 HydrophobicContact CG2-CB 4.07Å; E179-G214 WeakPolarHBondContact CA-O 3.33Å
180	V	90.8	Very high	80	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	142.8	-175.2	-65.2	0	0	0	0	111.8	I143 I147 L168 H171 I178 F182 K213 G214 L216 I226	I143-V180 HydrophobicContact CG2-CG1 3.96Å; I147-V180 HydrophobicContact CD1-CB 4.45Å; I147-V180 HydrophobicContact CD1-CG1 4.45Å; L168-V180 HydrophobicContact CD1-CB 4.37Å; L168-V180 HydrophobicContact CD1-CG1 4.49Å; H171-V180 HydrophobicContact CB-CG1 4.28Å; I178-V180 HydrophobicContact CG2-CG1 3.83Å; I178-V180 PolarHBondContact O-N 2.95Å; V180-F182 HydrophobicContact CB-CD1 4.46Å; V180-F182 HydrophobicContact CG2-CD1 4.06Å; V180-F182 HydrophobicContact CG2-CE1 4.09Å; V180-K213 WeakPolarHBondContact O-CA 3.33Å; V180-G214 PolarHBondContact N-O 3.43Å; V180-G214 PolarHBondContact O-N 2.94Å; V180-G214 VanDerWaalsContact O-N 3.08Å; V180-L216 HydrophobicContact CG1-CD1 3.73Å; V180-L216 HydrophobicContact CG1-CG 4.19Å; V180-L216 HydrophobicContact CG2-CD1 4.09Å; V180-L216 HydrophobicContact CG2-CD2 4.4Å; V180-L216 HydrophobicContact CG2-CG 3.84Å; V180-I226 HydrophobicContact CG2-CD1 4.47Å
181	V	91.2	Very high	78	Confident	23 Å²	23	62.3 Å²	62.3	14%	0.139	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	123.7	167.4	-175.7	0	0	0	0	107.6	V169 T170 I211 C212 K213	V169-V181 WeakPolarHBondContact CA-O 3.4Å; V169-V181 HydrophobicContact CB-CB 4.17Å; V169-V181 HydrophobicContact CB-CG1 3.97Å; V169-V181 WeakPolarHBondContact CB-O 3.18Å; V169-V181 HydrophobicContact CG1-CG1 4.4Å; V169-V181 HydrophobicContact CG2-CG1 4.3Å; V169-V181 PolarHBondContact N-O 3.37Å; T170-V181 PolarHBondContact N-O 2.93Å; T170-V181 PolarHBondContact O-N 2.92Å; T170-V181 WeakPolarHBondContact OG1-CB 3.36Å; T170-V181 VanDerWaalsContact OG1-CG2 3.29Å; T170-V181 WeakPolarHBondContact OG1-CG2 3.42Å; V181-I211 HydrophobicContact CG1-CD1 3.86Å; V181-I211 HydrophobicContact CG1-CG1 3.94Å; V181-C212 WeakPolarHBondContact CA-O 3.17Å; V181-K213 HydrophobicContact CB-CG 4.48Å; V181-K213 HydrophobicContact CG1-CG 3.97Å; V181-K213 HydrophobicContact CG2-CG 4.06Å
182	F	93	Very high	75.7	Confident	0 Å²	0	65 Å²	65	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	161.1	-178.3	62.5	-84.5	0	0	0	111.6	I147 I151 F165 K167 L168 V180 V184 C212 I226	I147-F182 HydrophobicContact CD1-CB 4.36Å; I147-F182 HydrophobicContact CD1-CD1 4.01Å; I147-F182 HydrophobicContact CD1-CG 4.23Å; I147-F182 HydrophobicContact CG1-CD1 4.35Å; I147-F182 HydrophobicContact CG1-CE1 4.44Å; I147-F182 HydrophobicContact CG2-CD1 4.1Å; I147-F182 HydrophobicContact CG2-CD2 3.62Å; I147-F182 HydrophobicContact CG2-CE1 4.06Å; I147-F182 HydrophobicContact CG2-CE2 3.56Å; I147-F182 HydrophobicContact CG2-CG 3.9Å; I147-F182 HydrophobicContact CG2-CZ 3.78Å; I151-F182 HydrophobicContact CD1-CE2 4.1Å; I151-F182 HydrophobicContact CG1-CE2 4.2Å; F165-F182 HydrophobicContact CD2-CD2 4.2Å; F165-F182 HydrophobicContact CE2-CB 3.97Å; F165-F182 HydrophobicContact CE2-CD2 4.39Å; F165-F182 HydrophobicContact CE2-CG 4.42Å; K167-F182 CarbonylContact O-C 3.59Å; K167-F182 VanDerWaalsContact O-CA 3.3Å; K167-F182 WeakPolarHBondContact O-CA 3.27Å; K167-F182 WeakPolarHBondContact O-CB 3.32Å; L168-F182 HydrophobicContact CD1-CB 4.21Å; V180-F182 HydrophobicContact CB-CD1 4.46Å; V180-F182 HydrophobicContact CG2-CD1 4.06Å; V180-F182 HydrophobicContact CG2-CE1 4.09Å; F182-V184 HydrophobicContact CD2-CG1 3.83Å; F182-V184 HydrophobicContact CE2-CG1 3.65Å; F182-C212 HydrophobicContact CD1-CB 4.11Å; F182-C212 HydrophobicContact CD2-CB 3.92Å; F182-C212 HydrophobicContact CE1-CB 3.69Å; F182-C212 HydrophobicContact CE2-CB 3.49Å; F182-C212 VanDerWaalsContact CE2-CB 3.49Å; F182-C212 HydrophobicContact CG-CB 4.22Å; F182-C212 HydrophobicContact CZ-CB 3.37Å; F182-C212 PolarHBondContact N-O 2.95Å; F182-C212 PolarHBondContact O-N 3.18Å; F182-I226 HydrophobicContact CE1-CD1 3.72Å; F182-I226 HydrophobicContact CE1-CG1 4.38Å; F182-I226 HydrophobicContact CE1-CG2 4.25Å; F182-I226 HydrophobicContact CZ-CD1 3.97Å; F182-I226 HydrophobicContact CZ-CG2 4.01Å
183	V	90.3	Very high	73.3	Confident	6 Å²	6	66.7 Å²	66.7	4%	0.036	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	138.4	179.4	-179	0	0	0	0	109.3	D166 K167 V169 K209 L210 L231	D166-V183 HydrophobicContact CB-CB 4.17Å; D166-V183 HydrophobicContact CB-CG1 4.04Å; D166-V183 WeakPolarHBondContact CB-O 3.47Å; D166-V183 PolarHBondContact N-O 2.83Å; K167-V183 HydrophobicContact CG-CB 4.09Å; K167-V183 HydrophobicContact CG-CG2 4.19Å; K167-V183 PolarHBondContact N-O 2.85Å; K167-V183 PolarHBondContact O-N 2.92Å; V169-V183 HydrophobicContact CG2-CG2 3.78Å; V183-K209 HydrophobicContact CG1-CB 4.01Å; V183-K209 HydrophobicContact CG1-CD 4.05Å; V183-K209 HydrophobicContact CG1-CG 4.46Å; V183-L210 WeakPolarHBondContact CA-O 3.36Å; V183-L231 HydrophobicContact CB-CD1 4.49Å; V183-L231 HydrophobicContact CG1-CD1 3.65Å; V183-L231 HydrophobicContact CG2-CD1 4.06Å
184	V	89.9	Confident	71.1	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	148.7	170.7	-58.5	0	0	0	0	110.6	I151 V158 A163 S164 F182 K209 L210	I151-V184 HydrophobicContact CD1-CG1 3.7Å; I151-V184 HydrophobicContact CG1-CG1 4.24Å; V158-V184 HydrophobicContact CG2-CG2 4.14Å; A163-V184 HydrophobicContact CB-CB 3.94Å; A163-V184 HydrophobicContact CB-CG1 4.48Å; A163-V184 HydrophobicContact CB-CG2 3.98Å; S164-V184 CarbonylContact O-C 3.6Å; S164-V184 WeakPolarHBondContact O-CA 3.49Å; S164-V184 WeakPolarHBondContact O-CB 3.48Å; F182-V184 HydrophobicContact CD2-CG1 3.83Å; F182-V184 HydrophobicContact CE2-CG1 3.65Å; V184-K209 WeakPolarHBondContact O-CA 3.37Å; V184-L210 HydrophobicContact CG2-CB 3.7Å; V184-L210 HydrophobicContact CG2-CD1 4.3Å; V184-L210 HydrophobicContact CG2-CG 4.34Å; V184-L210 PolarHBondContact N-O 3.38Å; V184-L210 PolarHBondContact O-N 2.73Å
185	K	87.9	Confident	69.1	Low	27 Å²	27	65.3 Å²	65.3	12%	0.117	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	162.1	-179.3	63.4	178.3	177.8	177.3	0	111.4	S164 D166 D190 K209	S164-K185 PolarHBondContact N-O 2.67Å; S164-K185 PolarHBondContact O-N 2.88Å; D166-K185 HydrophobicContact CB-CB 4.43Å; D166-K185 HydrophobicContact CB-CD 4.12Å; D166-K185 HydrophobicContact CB-CG 4.06Å; D166-K185 WeakPolarHBondContact OD1-CD 3.43Å; D166-K185 WeakPolarHBondContact OD1-CE 3.3Å; D166-K185 IonicContact OD1-NZ 3.88Å; K185-D190 VanDerWaalsContact CE-OD2 3.3Å; K185-D190 WeakPolarHBondContact CE-OD2 3.43Å; K185-D190 IonicContact NZ-OD1 2.77Å; K185-D190 PolarHBondContact NZ-OD1 2.87Å; K185-D190 IonicContact NZ-OD2 3.65Å; K185-D190 PolarHBondContact NZ-OD2 2.95Å; K185-K209 HydrophobicContact CB-CG 4.35Å
186	D	82.4	Confident	67.6	Low	20 Å²	20	63.6 Å²	63.6	11%	0.107	38%	0.384	C	S	.	.			trans	-64.6	125	167.9	-168.3	-34	0	0	0	108.9	V158 R188 A189	V158-D186 HydrophobicContact CB-CB 4.43Å; V158-D186 HydrophobicContact CG1-CB 3.98Å; D186-R188 PolarHBondContact O-N 3.48Å; D186-R188 VanDerWaalsContact O-N 3.12Å; D186-R188 WeakPolarHBondContact OD1-CB 3.26Å; D186-R188 PolarHBondContact OD1-N 2.8Å; D186-A189 HydrophobicContact CB-CB 4.5Å; D186-A189 VanDerWaalsContact O-CB 3.25Å; D186-A189 WeakPolarHBondContact O-CB 3.45Å; D186-A189 PolarHBondContact O-N 2.84Å
187	P	72.3	Confident	66.1	Low	56 Å²	56	65.7 Å²	65.7	36%	0.364	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-59.1	-19.4	177.2	22.6	-32.8	0	0	0	113.6	P162 A189	P162-P187 WeakPolarHBondContact O-CD 3.29Å; P162-P187 WeakPolarHBondContact O-CG 3.35Å; P187-A189 VanDerWaalsContact C-N 3.29Å
188	R	69.4	Low	63.9	Low	158 Å²	158	71.7 Å²	71.7	60%	0.596	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-79.9	-9.7	176.5	-59.4	-179.8	-176.4	-163.5	-0.2	113.6	Q161 D186 D190	Q161-R188 VanDerWaalsContact CD-NH2 3.26Å; D186-R188 PolarHBondContact O-N 3.48Å; D186-R188 VanDerWaalsContact O-N 3.12Å; D186-R188 WeakPolarHBondContact OD1-CB 3.26Å; D186-R188 PolarHBondContact OD1-N 2.8Å; R188-D190 PolarHBondContact O-N 2.82Å
189	A	60.3	Low	61.5	Low	36 Å²	36	78.7 Å²	78.7	30%	0.298	47%	0.467	S	S	.	.	G	3₁₀ helix	trans	-73	-10.9	-178.2	0	0	0	0	0	114.1	D186 P187	D186-A189 HydrophobicContact CB-CB 4.5Å; D186-A189 VanDerWaalsContact O-CB 3.25Å; D186-A189 WeakPolarHBondContact O-CB 3.45Å; D186-A189 PolarHBondContact O-N 2.84Å; P187-A189 VanDerWaalsContact C-N 3.29Å
190	D	54.8	Low	58.8	Low	106 Å²	106	81 Å²	81	57%	0.567	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-95.3	10.9	-179.6	-74	-12	0	0	0	113.5	K185 R188	K185-D190 VanDerWaalsContact CE-OD2 3.3Å; K185-D190 WeakPolarHBondContact CE-OD2 3.43Å; K185-D190 IonicContact NZ-OD1 2.77Å; K185-D190 PolarHBondContact NZ-OD1 2.87Å; K185-D190 IonicContact NZ-OD2 3.65Å; K185-D190 PolarHBondContact NZ-OD2 2.95Å; R188-D190 PolarHBondContact O-N 2.82Å
191	N	47.6	Very low	55.9	Low	139 Å²	139	87 Å²	87	74%	0.743	52%	0.521	S	S	*	.			trans	-100.4	37.8	-175.6	-83.3	-7.4	0	0	0	115.2
192	T	38.8	Very low	53.2	Low	126 Å²	126	90.6 Å²	90.6	77%	0.773	55%	0.547	S	S	*	.			trans	-127.1	71.9	173.2	47.1	0	0	0	0	111
193	D	33.8	Very low	50.3	Low	171 Å²	171	97.3 Å²	97.3	91%	0.914	58%	0.582	S	S	*	*			trans	-141.1	99.9	157.3	-83.5	-35	0	0	0	107.4
194	G	32.1	Very low	47.5	Very low	75 Å²	75	101.6 Å²	101.6	77%	0.773	61%	0.612	S	S	*	*	S	Bend	trans	131.1	95.9	169.8	0	0	0	0	0	116.5
195	A	30.7	Very low	44.9	Very low	104 Å²	104	107.5 Å²	107.5	86%	0.86	65%	0.648	S	S	*	*			trans	30.5	111.6	147.1	0	0	0	0	0	120.2
196	S	35.4	Very low	42.8	Very low	108 Å²	108	113.9 Å²	113.9	76%	0.755	68%	0.676	S	S	*	*				174.4	116	109.8	-151.8	0	0	0	0	112.4
197	T	34.7	Very low	41.4	Very low	116 Å²	116	116.8 Å²	116.8	71%	0.712	70%	0.698	S	S	*	*			trans	25.5	119.6	140.5	58.4	0	0	0	0	122.5
198	V	34.3	Very low	41	Very low	126 Å²	126	119.9 Å²	119.9	76%	0.764	71%	0.706	S	S	*	*				84.8	123.4	127.3	178.1	0	0	0	0	118.3
199	L	34.9	Very low	41.7	Very low	165 Å²	165	116.6 Å²	116.6	86%	0.864	70%	0.696	S	S	*	*			trans	91.9	88.5	168.2	-60.5	155.2	0	0	0	117.5
200	D	31.1	Very low	42.9	Very low	140 Å²	140	116.4 Å²	116.4	75%	0.749	69%	0.69	S	S	*	*				164.3	118.5	103.5	-141.7	-9.1	0	0	0	110.6	S202	D200-S202 PolarHBondContact O-N 2.92Å
201	P	30	Very low	44.5	Very low	126 Å²	126	112.9 Å²	112.9	82%	0.818	67%	0.67	S	S	*	*			trans	-95.8	79.7	-171.5	35.9	-29.5	0	0	0	111.6
202	S	33.4	Very low	46.6	Very low	97 Å²	97	106.2 Å²	106.2	68%	0.678	64%	0.635	S	S	*	*			trans	-157.8	11.4	172.2	51.5	0	0	0	0	118	D200	D200-S202 PolarHBondContact O-N 2.92Å
203	I	32.2	Very low	49.1	Very low	142 Å²	142	105 Å²	105	73%	0.728	62%	0.618	S	S	*	*			trans	-134	83.5	175.9	-45.5	178.9	0	0	0	111.1	T205	I203-T205 VanDerWaalsContact C-N 3.34Å; I203-T205 HydrophobicContact CG2-CG2 3.79Å; I203-T205 PolarHBondContact O-N 3.28Å
204	S	31	Very low	51.7	Low	95 Å²	95	97.5 Å²	97.5	66%	0.664	58%	0.582	S	S	*	*			trans	-69.9	90.3	167.3	64	0	0	0	0	109.4	F206	S204-F206 VanDerWaalsContact C-N 3.32Å; S204-F206 WeakPolarHBondContact O-CD2 3.46Å; S204-F206 PolarHBondContact O-N 3.22Å; S204-F206 WeakPolarHBondContact OG-CE2 3.36Å
205	T	34.9	Very low	54.1	Low	124 Å²	124	96.6 Å²	96.6	76%	0.761	56%	0.559	S	S	*	*			trans	-75.2	84.3	175.3	40.4	0	0	0	0	109.7	I203 S207	I203-T205 VanDerWaalsContact C-N 3.34Å; I203-T205 HydrophobicContact CG2-CG2 3.79Å; I203-T205 PolarHBondContact O-N 3.28Å; T205-S207 PolarHBondContact O-N 3.33Å
206	F	45.5	Very low	56.6	Low	162 Å²	162	92.1 Å²	92.1	71%	0.711	52%	0.521	S	S	*	.			trans	-54.5	113.6	172	-75.9	-89	0	0	0	110.1	S204 K208	S204-F206 VanDerWaalsContact C-N 3.32Å; S204-F206 WeakPolarHBondContact O-CD2 3.46Å; S204-F206 PolarHBondContact O-N 3.22Å; S204-F206 WeakPolarHBondContact OG-CE2 3.36Å; F206-K208 VanDerWaalsContact C-N 3.32Å; F206-K208 PolarHBondContact O-N 3.05Å
207	S	52.1	Low	58.5	Low	81 Å²	81	88.2 Å²	88.2	57%	0.566	49%	0.493	S	S	*	.			trans	-63.6	88	172.4	45.6	0	0	0	0	109.9	T205 K209	T205-S207 PolarHBondContact O-N 3.33Å; S207-K209 PolarHBondContact O-N 2.92Å
208	K	64.4	Low	59.7	Low	121 Å²	121	87.3 Å²	87.3	53%	0.526	48%	0.484	S	S	.	.			trans	-67.7	117.7	-179.2	-71.9	180	-174.4	168.5	0	110	V158 F206	V158-K208 HydrophobicContact CG1-CB 4.36Å; V158-K208 VanDerWaalsContact CG1-O 3.27Å; V158-K208 WeakPolarHBondContact CG1-O 3.47Å; F206-K208 VanDerWaalsContact C-N 3.32Å; F206-K208 PolarHBondContact O-N 3.05Å
209	K	82.9	Confident	60.6	Low	89 Å²	89	84.1 Å²	84.1	39%	0.387	46%	0.464	S	S	.	.			trans	-91.3	143.4	165.2	-61.7	-168.2	179.3	-161.7	0	109.5	D166 V183 V184 K185 S207 L231	D166-K209 IonicContact OD2-NZ 3.47Å; D166-K209 PolarHBondContact OD2-NZ 3.35Å; V183-K209 HydrophobicContact CG1-CB 4.01Å; V183-K209 HydrophobicContact CG1-CD 4.05Å; V183-K209 HydrophobicContact CG1-CG 4.46Å; V184-K209 WeakPolarHBondContact O-CA 3.37Å; K185-K209 HydrophobicContact CB-CG 4.35Å; S207-K209 PolarHBondContact O-N 2.92Å; K209-L231 HydrophobicContact CB-CB 4.3Å; K209-L231 HydrophobicContact CB-CD1 3.59Å; K209-L231 WeakPolarHBondContact O-CB 3.37Å; K209-L231 PolarHBondContact O-N 3.14Å
210	L	85.9	Confident	61.3	Low	32 Å²	32	81.2 Å²	81.2	17%	0.168	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	139.8	169.7	-53.4	176	0	0	0	109.2	V158 V183 V184 C228 E229 A230	V158-L210 HydrophobicContact CG2-CD1 3.82Å; V158-L210 HydrophobicContact CG2-CG 4.08Å; V183-L210 WeakPolarHBondContact CA-O 3.36Å; V184-L210 HydrophobicContact CG2-CB 3.7Å; V184-L210 HydrophobicContact CG2-CD1 4.3Å; V184-L210 HydrophobicContact CG2-CG 4.34Å; V184-L210 PolarHBondContact N-O 3.38Å; V184-L210 PolarHBondContact O-N 2.73Å; L210-C228 HydrophobicContact CB-CB 4.33Å; L210-C228 HydrophobicContact CD1-CB 4.39Å; L210-E229 CarbonylContact C-O 3.45Å; L210-E229 VanDerWaalsContact CA-O 3.26Å; L210-E229 WeakPolarHBondContact CA-O 3.41Å; L210-A230 HydrophobicContact CD2-CB 4.2Å
211	I	89.5	Confident	62.1	Low	31 Å²	31	78.6 Å²	78.6	16%	0.159	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	125.9	168.3	-172.6	169.6	0	0	0	108.6	V181 C228 E229 L231	V181-I211 HydrophobicContact CG1-CD1 3.86Å; V181-I211 HydrophobicContact CG1-CG1 3.94Å; I211-C228 CarbonylContact O-C 3.57Å; I211-C228 VanDerWaalsContact O-CA 3.31Å; I211-C228 WeakPolarHBondContact O-CA 3.47Å; I211-E229 HydrophobicContact CG2-CG 3.37Å; I211-E229 PolarHBondContact N-O 2.81Å; I211-E229 PolarHBondContact O-N 3.09Å; I211-L231 HydrophobicContact CB-CD1 4.03Å; I211-L231 HydrophobicContact CB-CG 4.03Å; I211-L231 HydrophobicContact CG2-CG 4.3Å
212	C	91	Very high	63.6	Low	0 Å²	0	76.5 Å²	76.5	0%	0	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	133	-179.2	-60.6	0	0	0	0	109.7	V181 F182 I226 K227 C228	V181-C212 WeakPolarHBondContact CA-O 3.17Å; F182-C212 HydrophobicContact CD1-CB 4.11Å; F182-C212 HydrophobicContact CD2-CB 3.92Å; F182-C212 HydrophobicContact CE1-CB 3.69Å; F182-C212 HydrophobicContact CE2-CB 3.49Å; F182-C212 VanDerWaalsContact CE2-CB 3.49Å; F182-C212 HydrophobicContact CG-CB 4.22Å; F182-C212 HydrophobicContact CZ-CB 3.37Å; F182-C212 PolarHBondContact N-O 2.95Å; F182-C212 PolarHBondContact O-N 3.18Å; C212-I226 HydrophobicContact CB-CG2 3.99Å; C212-K227 CarbonylContact C-O 3.55Å; C212-K227 WeakPolarHBondContact CA-O 3.2Å; C212-C228 HydrophobicContact CB-CB 4.12Å; C212-C228 WeakPolarHBondContact CB-SG 3.46Å; C212-C228 WeakPolarHBondContact SG-CB 3.41Å; C212-C228 CovalentContact SG-SG 2.05Å; C212-C228 PolarHBondContact SG-SG 3.38Å
213	K	91.2	Very high	65	Low	99 Å²	99	80.8 Å²	80.8	43%	0.43	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	138.7	-179.3	-64.3	173.8	-178.4	152.6	0	109.5	V180 V181 I226 K227 E229	V180-K213 WeakPolarHBondContact O-CA 3.33Å; V181-K213 HydrophobicContact CB-CG 4.48Å; V181-K213 HydrophobicContact CG1-CG 3.97Å; V181-K213 HydrophobicContact CG2-CG 4.06Å; K213-I226 WeakPolarHBondContact O-CA 3.43Å; K213-K227 PolarHBondContact N-O 3.29Å; K213-K227 PolarHBondContact O-N 3.03Å; K213-E229 IonicContact NZ-OE1 2.88Å; K213-E229 PolarHBondContact NZ-OE1 3.41Å
214	G	87.9	Confident	67.1	Low	15 Å²	15	76.6 Å²	76.6	16%	0.155	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.1	-173.5	-179.5	0	0	0	0	0	116	E179 V180 T225	E179-G214 WeakPolarHBondContact CA-O 3.33Å; V180-G214 PolarHBondContact N-O 3.43Å; V180-G214 PolarHBondContact O-N 2.94Å; V180-G214 VanDerWaalsContact O-N 3.08Å; G214-T225 CarbonylContact C-O 3.43Å; G214-T225 WeakPolarHBondContact CA-O 3.46Å
215	I	83.9	Confident	69.2	Low	55 Å²	55	76.3 Å²	76.3	28%	0.282	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	123.5	178.1	-55.7	174.8	0	0	0	109	T225	I215-T225 PolarHBondContact N-O 3.3Å; I215-T225 PolarHBondContact O-N 2.86Å
216	L	82.9	Confident	71.5	Confident	11 Å²	11	71.4 Å²	71.4	6%	0.058	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	116.9	167.4	-59.1	175.8	0	0	0	108.5	I143 I147 L150 G177 I178 V180 D224 I226	I143-L216 HydrophobicContact CG2-CD1 4.28Å; I147-L216 HydrophobicContact CG1-CD1 4Å; L150-L216 HydrophobicContact CD1-CD2 3.86Å; G177-L216 CarbonylContact C-O 3.56Å; G177-L216 WeakPolarHBondContact CA-O 3.21Å; I178-L216 HydrophobicContact CB-CB 4.33Å; I178-L216 PolarHBondContact N-O 2.89Å; I178-L216 PolarHBondContact O-N 2.87Å; V180-L216 HydrophobicContact CG1-CD1 3.73Å; V180-L216 HydrophobicContact CG1-CG 4.19Å; V180-L216 HydrophobicContact CG2-CD1 4.09Å; V180-L216 HydrophobicContact CG2-CD2 4.4Å; V180-L216 HydrophobicContact CG2-CG 3.84Å; L216-D224 WeakPolarHBondContact CA-OD1 3.39Å; L216-I226 HydrophobicContact CD2-CD1 3.83Å
217	S	74.6	Confident	73.4	Confident	26 Å²	26	72.3 Å²	72.3	18%	0.182	40%	0.398	C	S	.	.			trans	-76.7	134.1	-177.7	-163.6	0	0	0	0	111.6	V219 V222 D224	S217-V219 VanDerWaalsContact C-N 3.25Å; S217-V219 PolarHBondContact OG-N 3.14Å; S217-V222 VanDerWaalsContact OG-CB 3.3Å; S217-V222 WeakPolarHBondContact OG-CB 3.49Å; S217-V222 WeakPolarHBondContact OG-CG1 3.49Å; S217-D224 PolarHBondContact N-OD1 2.84Å
218	L	61.3	Low	75.1	Confident	97 Å²	97	70.7 Å²	70.7	51%	0.508	39%	0.387	S	S	.	.	S	Bend	trans	-83.5	-5.4	169.9	-66.8	173.6	0	0	0	112.2	I178 P220	I178-L218 HydrophobicContact CD1-CD2 4.06Å; I178-L218 HydrophobicContact CG1-CD1 4.34Å; I178-L218 HydrophobicContact CG1-CD2 4.19Å; I178-L218 HydrophobicContact CG1-CG 4.29Å; L218-P220 WeakPolarHBondContact O-CD 3.4Å
219	V	52.5	Low	76.2	Confident	59 Å²	59	69.9 Å²	69.9	36%	0.358	38%	0.384	S	S	.	.	S	Bend	trans	-98.4	115.7	-175.7	-175.7	0	0	0	0	109.5	S217 G221 V222	S217-V219 VanDerWaalsContact C-N 3.25Å; S217-V219 PolarHBondContact OG-N 3.14Å; V219-G221 PolarHBondContact O-N 2.75Å; V219-G221 VanDerWaalsContact O-N 3.13Å; V219-V222 HydrophobicContact CB-CB 4.23Å; V219-V222 HydrophobicContact CB-CG2 3.75Å; V219-V222 HydrophobicContact CG1-CG2 3.77Å; V219-V222 PolarHBondContact O-N 2.98Å; V219-V222 VanDerWaalsContact O-N 3.12Å
220	P	49.7	Very low	76	Confident	104 Å²	104	68.9 Å²	68.9	68%	0.675	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	119.1	175.7	-22.4	32.3	0	0	0	111.2	L218	L218-P220 WeakPolarHBondContact O-CD 3.4Å
221	G	48.6	Very low	75.1	Confident	84 Å²	84	71.1 Å²	71.1	87%	0.866	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.6	-10.4	179.9	0	0	0	0	0	115.2	V219	V219-G221 PolarHBondContact O-N 2.75Å; V219-G221 VanDerWaalsContact O-N 3.13Å
222	V	60	Low	73.6	Confident	82 Å²	82	79.4 Å²	79.4	50%	0.497	44%	0.44	S	S	.	.	S	Bend	trans	-87.7	125.7	170.4	177.2	0	0	0	0	108.5	S217 V219 D224	S217-V222 VanDerWaalsContact OG-CB 3.3Å; S217-V222 WeakPolarHBondContact OG-CB 3.49Å; S217-V222 WeakPolarHBondContact OG-CG1 3.49Å; V219-V222 HydrophobicContact CB-CB 4.23Å; V219-V222 HydrophobicContact CB-CG2 3.75Å; V219-V222 HydrophobicContact CG1-CG2 3.77Å; V219-V222 PolarHBondContact O-N 2.98Å; V219-V222 VanDerWaalsContact O-N 3.12Å; V222-D224 PolarHBondContact O-N 3.44Å
223	K	62.7	Low	71.1	Confident	187 Å²	187	83.3 Å²	83.3	81%	0.813	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-67.4	132.4	179.7	-77.5	-176.6	178.6	176.8	0	110.4
224	D	76.7	Confident	68.3	Low	55 Å²	55	82.2 Å²	82.2	29%	0.294	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-60.6	134.7	166.6	-59.4	-39.4	0	0	0	110	L150 Q154 L216 S217 V222	L150-D224 HydrophobicContact CD1-CB 3.25Å; L150-D224 WeakPolarHBondContact CD1-OD2 3.41Å; Q154-D224 PolarHBondContact NE2-O 3.19Å; L216-D224 WeakPolarHBondContact CA-OD1 3.39Å; S217-D224 PolarHBondContact N-OD1 2.84Å; V222-D224 PolarHBondContact O-N 3.44Å
225	T	74.8	Confident	65.6	Low	89 Å²	89	91 Å²	91	55%	0.546	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	100.1	-177.1	44.5	0	0	0	0	109.1	G214 I215	G214-T225 CarbonylContact C-O 3.43Å; G214-T225 WeakPolarHBondContact CA-O 3.46Å; I215-T225 PolarHBondContact N-O 3.3Å; I215-T225 PolarHBondContact O-N 2.86Å
226	I	83	Confident	63	Low	21 Å²	21	97.6 Å²	97.6	11%	0.108	56%	0.56	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-124.9	136.2	179.2	-76.4	167.7	0	0	0	109.9	L150 V180 F182 C212 K213 L216	L150-I226 HydrophobicContact CD1-CD1 3.53Å; L150-I226 HydrophobicContact CD2-CB 4.22Å; L150-I226 HydrophobicContact CD2-CD1 3.34Å; L150-I226 HydrophobicContact CD2-CG1 4.32Å; L150-I226 HydrophobicContact CD2-CG2 4.4Å; L150-I226 HydrophobicContact CG-CD1 4.01Å; V180-I226 HydrophobicContact CG2-CD1 4.47Å; F182-I226 HydrophobicContact CE1-CD1 3.72Å; F182-I226 HydrophobicContact CE1-CG1 4.38Å; F182-I226 HydrophobicContact CE1-CG2 4.25Å; F182-I226 HydrophobicContact CZ-CD1 3.97Å; F182-I226 HydrophobicContact CZ-CG2 4.01Å; C212-I226 HydrophobicContact CB-CG2 3.99Å; K213-I226 WeakPolarHBondContact O-CA 3.43Å; L216-I226 HydrophobicContact CD2-CD1 3.83Å
227	K	86.5	Confident	60.4	Low	180 Å²	180	106.5 Å²	106.5	78%	0.783	60%	0.601	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-123.1	136.2	171.7	-67.9	-176.3	179	-179.8	0	109.1	C212 K213	C212-K227 CarbonylContact C-O 3.55Å; C212-K227 WeakPolarHBondContact CA-O 3.2Å; K213-K227 PolarHBondContact N-O 3.29Å; K213-K227 PolarHBondContact O-N 3.03Å
228	C	87.7	Confident	58.2	Low	48 Å²	48	111.4 Å²	111.4	32%	0.324	63%	0.63	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115	137	178.6	-57.2	0	0	0	0	110.8	L210 I211 C212	L210-C228 HydrophobicContact CB-CB 4.33Å; L210-C228 HydrophobicContact CD1-CB 4.39Å; I211-C228 CarbonylContact O-C 3.57Å; I211-C228 VanDerWaalsContact O-CA 3.31Å; I211-C228 WeakPolarHBondContact O-CA 3.47Å; C212-C228 HydrophobicContact CB-CB 4.12Å; C212-C228 WeakPolarHBondContact CB-SG 3.46Å; C212-C228 WeakPolarHBondContact SG-CB 3.41Å; C212-C228 CovalentContact SG-SG 2.05Å; C212-C228 PolarHBondContact SG-SG 3.38Å
229	E	86.3	Confident	56.4	Low	103 Å²	103	110.5 Å²	110.5	48%	0.481	64%	0.644	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-129.1	155.3	178.7	63.3	-171.5	167.2	0	0	110.5	L210 I211 K213 L231	L210-E229 CarbonylContact C-O 3.45Å; L210-E229 VanDerWaalsContact CA-O 3.26Å; L210-E229 WeakPolarHBondContact CA-O 3.41Å; I211-E229 HydrophobicContact CG2-CG 3.37Å; I211-E229 PolarHBondContact N-O 2.81Å; I211-E229 PolarHBondContact O-N 3.09Å; K213-E229 IonicContact NZ-OE1 2.88Å; K213-E229 PolarHBondContact NZ-OE1 3.41Å; E229-L231 PolarHBondContact O-N 2.7Å
230	A	79.1	Confident	55.2	Low	69 Å²	69	111.3 Å²	111.3	57%	0.57	67%	0.665	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-67.9	131.7	179.7	0	0	0	0	0	111.5	L210 K232	L210-A230 HydrophobicContact CD2-CB 4.2Å; A230-K232 PolarHBondContact O-N 2.84Å; A230-K232 VanDerWaalsContact O-N 3.11Å
231	L	67.7	Low	54	Low	79 Å²	79	117 Å²	117	41%	0.414	67%	0.674	S	S	.	*			trans	-68.4	107	170.2	-97.9	139	0	0	0	108.8	V183 K209 I211 E229 G233	V183-L231 HydrophobicContact CB-CD1 4.49Å; V183-L231 HydrophobicContact CG1-CD1 3.65Å; V183-L231 HydrophobicContact CG2-CD1 4.06Å; K209-L231 HydrophobicContact CB-CB 4.3Å; K209-L231 HydrophobicContact CB-CD1 3.59Å; K209-L231 WeakPolarHBondContact O-CB 3.37Å; K209-L231 PolarHBondContact O-N 3.14Å; I211-L231 HydrophobicContact CB-CD1 4.03Å; I211-L231 HydrophobicContact CB-CG 4.03Å; I211-L231 HydrophobicContact CG2-CG 4.3Å; E229-L231 PolarHBondContact O-N 2.7Å; L231-G233 PolarHBondContact O-N 2.81Å
232	K	58.2	Low	53.1	Low	205 Å²	205	118.5 Å²	118.5	89%	0.891	67%	0.671	S	S	*	*			trans	-67.2	112.7	170.4	-69.1	-173.5	177.6	-178.1	0	108.4	A230	A230-K232 PolarHBondContact O-N 2.84Å; A230-K232 VanDerWaalsContact O-N 3.11Å
233	G	38.7	Very low	51.5	Low	82 Å²	82	120.7 Å²	120.7	85%	0.845	69%	0.685	S	S	*	*			trans	-71.3	150.2	-173.5	0	0	0	0	0	114.4	L231	L231-G233 PolarHBondContact O-N 2.81Å
234	G	32.6	Very low	49.9	Very low	75 Å²	75	121.2 Å²	121.2	77%	0.773	69%	0.69	S	S	*	*			trans	170.1	78.8	175.4	0	0	0	0	0	108.3	K236	G234-K236 PolarHBondContact O-N 2.87Å
235	E	29.7	Very low	47.5	Very low	199 Å²	199	129.5 Å²	129.5	93%	0.93	72%	0.717	S	S	*	*			trans	-60	116	169.4	-74.7	179	138.8	0	0	109.4
236	K	30.5	Very low	45.4	Very low	194 Å²	194	133.2 Å²	133.2	84%	0.843	73%	0.733	S	S	*	*			trans	-131.6	106.6	151.4	-79.6	-168.2	176.9	-178.7	0	108.2	G234 V238	G234-K236 PolarHBondContact O-N 2.87Å; K236-V238 PolarHBondContact O-N 3.09Å
237	Q	27	Very low	42.8	Very low	198 Å²	198	140.2 Å²	140.2	93%	0.925	77%	0.77	S	S	*	*			trans	-64.1	105.3	156.1	-69.6	-179.1	17	0	0	107.9
238	V	28.2	Very low	39.9	Very low	130 Å²	130	135.1 Å²	135.1	79%	0.788	77%	0.768	S	S	*	*			trans	-154.1	132	156.4	-168.3	0	0	0	0	107.6	K236	K236-V238 PolarHBondContact O-N 3.09Å
239	G	24.9	Very low	37	Very low	77 Å²	77	139.6 Å²	139.6	79%	0.794	79%	0.794	S	S	*	*			trans	-63	165.1	171.3	0	0	0	0	0	113.1
240	G	26.2	Very low	34.2	Very low	77 Å²	77	146.1 Å²	146.1	79%	0.794	81%	0.814	S	S	*	*			trans	138.1	115.7	171	0	0	0	0	0	113.2
241	Y	24.7	Very low	31.7	Very low	224 Å²	224	150.3 Å²	150.3	88%	0.878	83%	0.826	S	S	*	*			trans	-59	129.2	163.2	-73.9	-99.4	0	0	0	110.4
242	S	29.6	Very low	29.8	Very low	115 Å²	115	153.7 Å²	153.7	80%	0.804	85%	0.845	S	S	*	*			trans	-169.2	123.3	148.4	-175.5	0	0	0	0	112.1
243	T	26.6	Very low	28.4	Very low	127 Å²	127	153 Å²	153	78%	0.779	84%	0.844	S	S	*	*			trans	-72.1	131.8	161.8	38.1	0	0	0	0	111.3
244	Q	29.9	Very low	28	Very low	198 Å²	198	158.8 Å²	158.8	93%	0.925	85%	0.846	S	S	*	*			trans	-172.1	161.7	138.6	-106.4	172	22.8	0	0	114.2
245	R	26.5	Very low	27.7	Very low	229 Å²	229	159.7 Å²	159.7	86%	0.864	84%	0.838	S	S	*	*			trans	-73.4	154.3	-159.9	-59.7	168.2	178.6	172.3	-1.8	115.8
246	L	30.8	Very low	27.9	Very low	168 Å²	168	157.3 Å²	157.3	88%	0.88	83%	0.832	S	S	*	*			trans	-167.1	94.8	145	-101.6	137.1	0	0	0	108
247	L	27.9	Very low	28.2	Very low	168 Å²	168	154 Å²	154	88%	0.88	82%	0.819	S	S	*	*				58.3	111.1	93.4	-82.4	166.3	0	0	0	116.2
248	G	24.3	Very low	28.5	Very low	73 Å²	73	146.2 Å²	146.2	75%	0.753	79%	0.792	S	S	*	*				102.5	84.6	126.7	0	0	0	0	0	119.2
249	V	28.5	Very low	29.3	Very low	141 Å²	141	146.1 Å²	146.1	86%	0.855	79%	0.786	S	S	*	*			trans	-147	116.9	141.2	-176.4	0	0	0	0	109.1
250	R	25.7	Very low	30.1	Very low	240 Å²	240	144.6 Å²	144.6	91%	0.906	76%	0.762	S	S	*	*			trans	-75.4	139.5	167.5	-88.6	176.4	166.5	146.2	-5.1	109.6
251	L	28.1	Very low	31.4	Very low	157 Å²	157	144.1 Å²	144.1	82%	0.822	74%	0.744	S	S	*	*			trans	-155.4	148.1	148.6	-95.4	166.6	0	0	0	108.8
252	D	27.6	Very low	32.8	Very low	151 Å²	151	141.3 Å²	141.3	81%	0.807	74%	0.739	S	S	*	*			trans	-70.5	154.7	-144.3	-63.8	-74.4	0	0	0	119.7
253	H	28.1	Very low	34.3	Very low	189 Å²	189	139.3 Å²	139.3	88%	0.875	73%	0.73	S	S	*	*			trans	-68.4	139.8	172.1	-89.3	28.1	0	0	0	113.2
254	K	29.8	Very low	36	Very low	204 Å²	204	136.6 Å²	136.6	89%	0.887	71%	0.708	S	S	*	*			trans	-148.1	118.8	146.8	-145.5	173.1	-171	174.2	0	110
255	P	28.3	Very low	37.7	Very low	95 Å²	95	129.8 Å²	129.8	62%	0.617	68%	0.678	S	S	*	*			trans	-91	143	-175.1	34.8	-30.5	0	0	0	110.7
256	N	32.4	Very low	39.8	Very low	149 Å²	149	121.7 Å²	121.7	80%	0.797	65%	0.654	S	S	*	*			trans	-139.3	106.8	167.6	-100.8	-15.5	0	0	0	111.4
257	H	36.8	Very low	42	Very low	125 Å²	125	116.6 Å²	116.6	58%	0.579	63%	0.625	S	S	*	*			trans	42.6	120.4	134.8	-69	-79.5	0	0	0	121.4	Y501	H257-Y501 AromaticContact CE1-CE1 3.19Å; H257-Y501 WeakPolarHBondContact CE1-CE1 3.39Å; H257-Y501 AromaticContact CE1-CZ 3.55Å; H257-Y501 PolarHBondContact CE1-OH 3.3Å; H257-Y501 VanDerWaalsContact CE1-OH 3.27Å; H257-Y501 AromaticContact NE2-CE1 3.22Å; H257-Y501 WeakPolarHBondContact NE2-CE1 3.46Å; H257-Y501 AromaticContact NE2-CZ 3.59Å; H257-Y501 PolarHBondContact NE2-OH 3.23Å; H257-Y501 VanDerWaalsContact NE2-OH 3.08Å
258	G	34.3	Very low	44.2	Very low	34 Å²	34	111.5 Å²	111.5	35%	0.351	60%	0.598	S	S	.	*				42	91.9	123.9	0	0	0	0	0	117.7	P260	G258-P260 VanDerWaalsContact O-CD 3.31Å; G258-P260 WeakPolarHBondContact O-CD 3.49Å
259	L	45.2	Very low	46.9	Very low	127 Å²	127	114.7 Å²	114.7	67%	0.665	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-67.8	120.5	173.8	-149.6	80.7	0	0	0	109.5
260	P	41.2	Very low	49.3	Very low	45 Å²	45	114.4 Å²	114.4	29%	0.292	58%	0.575	S	S	.	*	P	Polyproline II helix	trans	-65.4	143.4	176.9	22.8	-29.8	0	0	0	111	G258 E264 I265	G258-P260 VanDerWaalsContact O-CD 3.31Å; G258-P260 WeakPolarHBondContact O-CD 3.49Å; P260-E264 VanDerWaalsContact CA-OE2 3.31Å; P260-E264 WeakPolarHBondContact CA-OE2 3.43Å; P260-E264 HydrophobicContact CB-CB 3.63Å; P260-I265 HydrophobicContact CB-CG1 3.94Å; P260-I265 HydrophobicContact CG-CD1 4.27Å; P260-I265 HydrophobicContact CG-CG1 3.62Å; P260-I265 WeakPolarHBondContact O-CD1 3.49Å
261	T	53	Low	52	Low	68 Å²	68	103 Å²	103	42%	0.417	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-58.5	157.2	169.2	53.5	0	0	0	0	110.9	A263 E264 I265	T261-A263 PolarHBondContact O-N 2.75Å; T261-A263 VanDerWaalsContact O-N 3.13Å; T261-E264 PolarHBondContact N-OE2 3.1Å; T261-E264 CarbonylContact O-C 3.59Å; T261-E264 WeakPolarHBondContact O-CA 3.42Å; T261-E264 WeakPolarHBondContact O-CB 3.41Å; T261-E264 PolarHBondContact O-N 2.89Å; T261-E264 VanDerWaalsContact OG1-CD 3.3Å; T261-E264 VanDerWaalsContact OG1-CG 3.26Å; T261-E264 WeakPolarHBondContact OG1-CG 2.92Å; T261-E264 PolarHBondContact OG1-N 3.47Å; T261-E264 PolarHBondContact OG1-OE2 2.91Å; T261-I265 WeakPolarHBondContact O-CG1 3.47Å; T261-I265 PolarHBondContact O-N 2.92Å
262	E	53.9	Low	54.6	Low	164 Å²	164	96.9 Å²	96.9	77%	0.766	50%	0.501	S	S	*	.	H	α-helix	trans	-57.4	-30.6	-179.9	-170.9	168	-171	0	0	112.8	T266	E262-T266 WeakPolarHBondContact O-CB 3.23Å; E262-T266 PolarHBondContact O-N 3.27Å; E262-T266 PolarHBondContact O-OG1 2.8Å
263	A	61.6	Low	57.1	Low	74 Å²	74	92.6 Å²	92.6	61%	0.612	48%	0.481	S	S	*	.	H	α-helix	trans	-65.1	-47.9	170.8	0	0	0	0	0	112.5	T261 I265 T266 E267	T261-A263 PolarHBondContact O-N 2.75Å; T261-A263 VanDerWaalsContact O-N 3.13Å; A263-I265 VanDerWaalsContact C-N 3.35Å; A263-I265 PolarHBondContact O-N 2.78Å; A263-T266 PolarHBondContact O-N 2.88Å; A263-E267 PolarHBondContact O-N 3.49Å
264	E	62	Low	59.7	Low	69 Å²	69	85.5 Å²	85.5	32%	0.322	45%	0.452	S	S	.	.	H	α-helix	trans	-64.7	-37	175.6	-73.2	168.7	142.7	0	0	111.8	P260 T261 T266 E267 I268	P260-E264 VanDerWaalsContact CA-OE2 3.31Å; P260-E264 WeakPolarHBondContact CA-OE2 3.43Å; P260-E264 HydrophobicContact CB-CB 3.63Å; T261-E264 PolarHBondContact N-OE2 3.1Å; T261-E264 CarbonylContact O-C 3.59Å; T261-E264 WeakPolarHBondContact O-CA 3.42Å; T261-E264 WeakPolarHBondContact O-CB 3.41Å; T261-E264 PolarHBondContact O-N 2.89Å; T261-E264 VanDerWaalsContact OG1-CD 3.3Å; T261-E264 VanDerWaalsContact OG1-CG 3.26Å; T261-E264 WeakPolarHBondContact OG1-CG 2.92Å; T261-E264 PolarHBondContact OG1-N 3.47Å; T261-E264 PolarHBondContact OG1-OE2 2.91Å; E264-T266 VanDerWaalsContact C-N 3.32Å; E264-T266 PolarHBondContact O-N 2.88Å; E264-E267 PolarHBondContact O-N 3.41Å; E264-I268 VanDerWaalsContact O-CB 3.29Å; E264-I268 WeakPolarHBondContact O-CB 3.39Å; E264-I268 WeakPolarHBondContact O-CD1 3.43Å; E264-I268 WeakPolarHBondContact O-CG1 3.33Å; E264-I268 PolarHBondContact O-N 3.49Å
265	I	65.5	Low	62.4	Low	56 Å²	56	75.8 Å²	75.8	29%	0.287	41%	0.41	S	S	.	.	H	α-helix	trans	-62.9	-41.7	173.7	-66.5	171.4	0	0	0	110.5	P260 T261 A263 R269	P260-I265 HydrophobicContact CB-CG1 3.94Å; P260-I265 HydrophobicContact CG-CD1 4.27Å; P260-I265 HydrophobicContact CG-CG1 3.62Å; P260-I265 WeakPolarHBondContact O-CD1 3.49Å; T261-I265 WeakPolarHBondContact O-CG1 3.47Å; T261-I265 PolarHBondContact O-N 2.92Å; A263-I265 VanDerWaalsContact C-N 3.35Å; A263-I265 PolarHBondContact O-N 2.78Å; I265-R269 WeakPolarHBondContact O-CB 3.45Å; I265-R269 WeakPolarHBondContact O-CG 3.22Å; I265-R269 PolarHBondContact O-N 2.91Å
266	T	71.6	Confident	65	Low	59 Å²	59	76.1 Å²	76.1	36%	0.362	40%	0.403	S	S	.	.	H	α-helix	trans	-68.9	-41.2	179.1	-60	0	0	0	0	111.6	E262 A263 E264 R269 K270	E262-T266 WeakPolarHBondContact O-CB 3.23Å; E262-T266 PolarHBondContact O-N 3.27Å; E262-T266 PolarHBondContact O-OG1 2.8Å; A263-T266 PolarHBondContact O-N 2.88Å; E264-T266 VanDerWaalsContact C-N 3.32Å; E264-T266 PolarHBondContact O-N 2.88Å; T266-R269 PolarHBondContact O-N 3.38Å; T266-K270 WeakPolarHBondContact O-CG 3.1Å; T266-K270 PolarHBondContact O-N 3.09Å
267	E	77.1	Confident	67.4	Low	60 Å²	60	76.7 Å²	76.7	28%	0.28	39%	0.394	S	S	.	.	H	α-helix	trans	-63.8	-50	174.5	-174	173.6	156.9	0	0	111.5	A263 E264 R269 K270 V271 H299 F306	A263-E267 PolarHBondContact O-N 3.49Å; E264-E267 PolarHBondContact O-N 3.41Å; E267-R269 VanDerWaalsContact C-N 3.27Å; E267-R269 PolarHBondContact O-N 3.24Å; E267-K270 WeakPolarHBondContact O-CB 3.36Å; E267-K270 PolarHBondContact O-N 2.77Å; E267-V271 HydrophobicContact CG-CG2 4.44Å; E267-V271 WeakPolarHBondContact O-CG2 3.42Å; E267-V271 PolarHBondContact O-N 2.89Å; E267-H299 IonicContact OE1-CD2 2.8Å; E267-H299 PolarHBondContact OE1-CD2 2.94Å; E267-H299 IonicContact OE1-NE2 2.69Å; E267-F306 HydrophobicContact CG-CE1 3.98Å; E267-F306 HydrophobicContact CG-CZ 4.47Å
268	I	74.4	Confident	69.6	Low	61 Å²	61	70.9 Å²	70.9	31%	0.313	37%	0.367	S	S	.	.	H	α-helix	trans	-59	-39.2	177.5	-69.4	165.8	0	0	0	110.6	E264 T272	E264-I268 VanDerWaalsContact O-CB 3.29Å; E264-I268 WeakPolarHBondContact O-CB 3.39Å; E264-I268 WeakPolarHBondContact O-CD1 3.43Å; E264-I268 WeakPolarHBondContact O-CG1 3.33Å; E264-I268 PolarHBondContact O-N 3.49Å; I268-T272 VanDerWaalsContact O-CB 3.29Å; I268-T272 WeakPolarHBondContact O-CB 3.5Å; I268-T272 PolarHBondContact O-N 3.21Å; I268-T272 PolarHBondContact O-OG1 2.91Å
269	R	79.9	Confident	72	Confident	140 Å²	140	69.9 Å²	69.9	53%	0.528	35%	0.354	S	S	.	.	H	α-helix	trans	-63.4	-44.3	173.6	-83	-179.9	-179.8	161.3	3.1	112.6	I265 T266 E267 T272 T273	I265-R269 WeakPolarHBondContact O-CB 3.45Å; I265-R269 WeakPolarHBondContact O-CG 3.22Å; I265-R269 PolarHBondContact O-N 2.91Å; T266-R269 PolarHBondContact O-N 3.38Å; E267-R269 VanDerWaalsContact C-N 3.27Å; E267-R269 PolarHBondContact O-N 3.24Å; R269-T272 PolarHBondContact O-N 3.12Å; R269-T273 WeakPolarHBondContact O-CB 3.15Å; R269-T273 PolarHBondContact O-N 3.23Å; R269-T273 PolarHBondContact O-OG1 2.91Å
270	K	78.8	Confident	73.6	Confident	135 Å²	135	68.7 Å²	68.7	59%	0.587	35%	0.352	S	S	*	.	H	α-helix	trans	-60.7	-49.3	176.8	-74.9	176	-179.4	178.3	0	110.8	T266 E267 T272 T273 S274	T266-K270 WeakPolarHBondContact O-CG 3.1Å; T266-K270 PolarHBondContact O-N 3.09Å; E267-K270 WeakPolarHBondContact O-CB 3.36Å; E267-K270 PolarHBondContact O-N 2.77Å; K270-T272 PolarHBondContact O-N 3.19Å; K270-T273 PolarHBondContact O-N 2.89Å; K270-S274 PolarHBondContact O-N 2.85Å; K270-S274 PolarHBondContact O-OG 3.21Å
271	V	83.4	Confident	75.4	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-59.9	-47.4	177.8	174.6	0	0	0	0	111.2	E267 T273 S274 I275 L296 H299 F306 V308 L348	E267-V271 HydrophobicContact CG-CG2 4.44Å; E267-V271 WeakPolarHBondContact O-CG2 3.42Å; E267-V271 PolarHBondContact O-N 2.89Å; V271-T273 PolarHBondContact O-N 2.83Å; V271-S274 PolarHBondContact O-N 3.07Å; V271-I275 HydrophobicContact CG1-CD1 3.86Å; V271-I275 HydrophobicContact CG1-CG1 4.49Å; V271-I275 WeakPolarHBondContact O-CG1 3.49Å; V271-I275 PolarHBondContact O-N 3Å; V271-L296 HydrophobicContact CG1-CD1 4.29Å; V271-L296 HydrophobicContact CG1-CD2 4.08Å; V271-H299 HydrophobicContact CG1-CB 4.37Å; V271-F306 HydrophobicContact CG2-CD1 3.67Å; V271-F306 HydrophobicContact CG2-CD2 4.25Å; V271-F306 HydrophobicContact CG2-CE1 3.83Å; V271-F306 HydrophobicContact CG2-CE2 4.38Å; V271-F306 HydrophobicContact CG2-CG 3.9Å; V271-F306 HydrophobicContact CG2-CZ 4.18Å; V271-V308 HydrophobicContact CG1-CG1 3.81Å; V271-L348 HydrophobicContact CG1-CD1 4.32Å
272	T	82.2	Confident	76.7	Confident	30 Å²	30	72.8 Å²	72.8	18%	0.184	37%	0.365	C	S	.	.	H	α-helix	trans	-64.4	-40.3	-179.2	-52.4	0	0	0	0	112	I268 R269 K270 S274 I275 Q276 F293	I268-T272 VanDerWaalsContact O-CB 3.29Å; I268-T272 WeakPolarHBondContact O-CB 3.5Å; I268-T272 PolarHBondContact O-N 3.21Å; I268-T272 PolarHBondContact O-OG1 2.91Å; R269-T272 PolarHBondContact O-N 3.12Å; K270-T272 PolarHBondContact O-N 3.19Å; T272-S274 VanDerWaalsContact C-N 3.34Å; T272-I275 PolarHBondContact O-N 3.18Å; T272-Q276 WeakPolarHBondContact O-CG 3.31Å; T272-Q276 PolarHBondContact O-N 3.24Å; T272-F293 HydrophobicContact CG2-CD1 4.31Å; T272-F293 HydrophobicContact CG2-CE1 3.79Å; T272-F293 HydrophobicContact CG2-CZ 4.02Å
273	T	79.5	Confident	78.1	Confident	61 Å²	61	67.3 Å²	67.3	37%	0.374	35%	0.353	S	S	.	.	H	α-helix	trans	-64.4	-40.3	176.6	-54.2	0	0	0	0	111.1	R269 K270 V271 Q276 R277	R269-T273 WeakPolarHBondContact O-CB 3.15Å; R269-T273 PolarHBondContact O-N 3.23Å; R269-T273 PolarHBondContact O-OG1 2.91Å; K270-T273 PolarHBondContact O-N 2.89Å; V271-T273 PolarHBondContact O-N 2.83Å; T273-Q276 PolarHBondContact O-N 2.93Å; T273-R277 WeakPolarHBondContact O-CG 3.37Å; T273-R277 PolarHBondContact O-N 3.09Å; T273-R277 VanDerWaalsContact O-N 3.14Å
274	S	82.8	Confident	79	Confident	40 Å²	40	64.6 Å²	64.6	28%	0.28	33%	0.328	S	S	.	.	H	α-helix	trans	-65.5	-42.3	175	-66.6	0	0	0	0	112	K270 V271 T272 Q276 R277 V278	K270-S274 PolarHBondContact O-N 2.85Å; K270-S274 PolarHBondContact O-OG 3.21Å; V271-S274 PolarHBondContact O-N 3.07Å; T272-S274 VanDerWaalsContact C-N 3.34Å; S274-Q276 PolarHBondContact O-N 3.42Å; S274-R277 WeakPolarHBondContact O-CB 2.98Å; S274-R277 PolarHBondContact O-N 3.18Å; S274-V278 WeakPolarHBondContact O-CG2 3.26Å; S274-V278 PolarHBondContact O-N 2.79Å
275	I	85.7	Confident	80	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-59.9	-45.9	175.8	-69.1	167.7	0	0	0	111.3	V271 T272 R277 V278 I279 F293 L296 F310 L348	V271-I275 HydrophobicContact CG1-CD1 3.86Å; V271-I275 HydrophobicContact CG1-CG1 4.49Å; V271-I275 WeakPolarHBondContact O-CG1 3.49Å; V271-I275 PolarHBondContact O-N 3Å; T272-I275 PolarHBondContact O-N 3.18Å; I275-R277 VanDerWaalsContact C-N 3.28Å; I275-R277 PolarHBondContact O-N 3.3Å; I275-V278 PolarHBondContact O-N 3.14Å; I275-V278 VanDerWaalsContact O-N 3.12Å; I275-I279 HydrophobicContact CG2-CD1 3.93Å; I275-I279 HydrophobicContact CG2-CG1 4.41Å; I275-I279 WeakPolarHBondContact O-CG1 3.33Å; I275-I279 PolarHBondContact O-N 3.27Å; I275-F293 HydrophobicContact CD1-CE2 4.16Å; I275-F293 HydrophobicContact CG2-CD2 3.57Å; I275-F293 HydrophobicContact CG2-CE2 3.84Å; I275-L296 HydrophobicContact CD1-CD1 3.63Å; I275-F310 HydrophobicContact CD1-CB 4.27Å; I275-F310 HydrophobicContact CD1-CD1 4.01Å; I275-F310 HydrophobicContact CD1-CG 4.17Å; I275-F310 HydrophobicContact CG1-CD1 4.22Å; I275-F310 HydrophobicContact CG1-CE1 4.34Å; I275-F310 HydrophobicContact CG2-CD1 4.21Å; I275-F310 HydrophobicContact CG2-CD2 3.64Å; I275-F310 HydrophobicContact CG2-CE1 4.19Å; I275-F310 HydrophobicContact CG2-CE2 3.6Å; I275-F310 HydrophobicContact CG2-CG 3.95Å; I275-F310 HydrophobicContact CG2-CZ 3.88Å; I275-L348 HydrophobicContact CG1-CD1 3.85Å
276	Q	84.6	Confident	80.6	Confident	102 Å²	102	62.4 Å²	62.4	48%	0.477	32%	0.322	S	S	.	.	H	α-helix	trans	-59.8	-38.3	176.9	-74	177.2	-18.8	0	0	112	T272 T273 S274 V280	T272-Q276 WeakPolarHBondContact O-CG 3.31Å; T272-Q276 PolarHBondContact O-N 3.24Å; T273-Q276 PolarHBondContact O-N 2.93Å; S274-Q276 PolarHBondContact O-N 3.42Å; Q276-V280 WeakPolarHBondContact O-CG2 3.19Å; Q276-V280 PolarHBondContact O-N 3.06Å
277	R	82.8	Confident	80.9	Confident	161 Å²	161	63.9 Å²	63.9	61%	0.608	33%	0.327	S	S	*	.	H	α-helix	trans	-65.1	-43.9	172.4	-70.1	-177.4	-155.8	174.2	6.1	112	T273 S274 I275 I279 V280 I281	T273-R277 WeakPolarHBondContact O-CG 3.37Å; T273-R277 PolarHBondContact O-N 3.09Å; T273-R277 VanDerWaalsContact O-N 3.14Å; S274-R277 WeakPolarHBondContact O-CB 2.98Å; S274-R277 PolarHBondContact O-N 3.18Å; I275-R277 VanDerWaalsContact C-N 3.28Å; I275-R277 PolarHBondContact O-N 3.3Å; R277-I279 PolarHBondContact O-N 2.91Å; R277-V280 PolarHBondContact O-N 2.04Å; R277-V280 VanDerWaalsContact O-N 3.16Å; R277-I281 HydrophobicContact CB-CD1 4.18Å; R277-I281 WeakPolarHBondContact O-CB 3.21Å; R277-I281 VanDerWaalsContact O-CG1 3.25Å; R277-I281 WeakPolarHBondContact O-CG1 3.31Å; R277-I281 PolarHBondContact O-N 3.49Å
278	V	82.9	Confident	80.7	Confident	2 Å²	2	63.9 Å²	63.9	1%	0.012	34%	0.343	C	S	.	.	H	α-helix	trans	-64.3	-39.7	-179.2	175.4	0	0	0	0	112.1	S274 I275 V280 I281 Q282 L348 D356 I358	S274-V278 WeakPolarHBondContact O-CG2 3.26Å; S274-V278 PolarHBondContact O-N 2.79Å; I275-V278 PolarHBondContact O-N 3.14Å; I275-V278 VanDerWaalsContact O-N 3.12Å; V278-V280 PolarHBondContact O-N 2.88Å; V278-I281 PolarHBondContact O-N 3.07Å; V278-Q282 HydrophobicContact CG1-CB 4.38Å; V278-Q282 HydrophobicContact CG1-CG 3.88Å; V278-Q282 WeakPolarHBondContact O-CB 3.22Å; V278-Q282 PolarHBondContact O-N 3.35Å; V278-L348 HydrophobicContact CB-CD2 4.46Å; V278-L348 HydrophobicContact CG2-CD2 3.54Å; V278-D356 HydrophobicContact CG2-CB 4Å; V278-D356 VanDerWaalsContact CG2-OD2 3.25Å; V278-D356 WeakPolarHBondContact CG2-OD2 3.23Å; V278-I358 HydrophobicContact CB-CD1 4.11Å; V278-I358 HydrophobicContact CG1-CB 4.36Å; V278-I358 HydrophobicContact CG1-CD1 3.5Å; V278-I358 HydrophobicContact CG1-CG1 3.93Å; V278-I358 HydrophobicContact CG2-CD1 4.31Å
279	I	83.3	Confident	80.8	Confident	13 Å²	13	64 Å²	64	7%	0.067	34%	0.343	C	S	.	.	H	α-helix	trans	-54.7	-42.7	174	-69.3	167	0	0	0	110.8	I275 R277 G283 I284 A291 F293 F310 V312	I275-I279 HydrophobicContact CG2-CD1 3.93Å; I275-I279 HydrophobicContact CG2-CG1 4.41Å; I275-I279 WeakPolarHBondContact O-CG1 3.33Å; I275-I279 PolarHBondContact O-N 3.27Å; R277-I279 PolarHBondContact O-N 2.91Å; I279-G283 PolarHBondContact O-N 2.81Å; I279-I284 HydrophobicContact CG1-CD1 4.16Å; I279-I284 HydrophobicContact CG2-CB 4.42Å; I279-I284 PolarHBondContact O-N 2.85Å; I279-I284 VanDerWaalsContact O-N 3.13Å; I279-A291 HydrophobicContact CG2-CB 4.35Å; I279-A291 VanDerWaalsContact CG2-O 3.25Å; I279-A291 WeakPolarHBondContact CG2-O 3.36Å; I279-F293 HydrophobicContact CD1-CB 3.93Å; I279-F310 HydrophobicContact CD1-CE2 4.29Å; I279-F310 HydrophobicContact CG1-CE2 4.26Å; I279-V312 HydrophobicContact CD1-CG1 3.77Å; I279-V312 HydrophobicContact CG1-CG1 4.26Å
280	V	80	Confident	80.8	Confident	102 Å²	102	61.9 Å²	61.9	62%	0.618	35%	0.347	S	S	*	.	H	α-helix	trans	-73.3	-44.2	177.9	177.9	0	0	0	0	111.9	Q276 R277 V278 T1028	Q276-V280 WeakPolarHBondContact O-CG2 3.19Å; Q276-V280 PolarHBondContact O-N 3.06Å; R277-V280 PolarHBondContact O-N 2.04Å; R277-V280 VanDerWaalsContact O-N 3.16Å; V278-V280 PolarHBondContact O-N 2.88Å; V280-T1028 HydrophobicContact CG1-CG2 4.49Å
281	I	77.6	Confident	81.1	Confident	124 Å²	124	55.9 Å²	55.9	64%	0.636	32%	0.322	S	S	*	.	H	α-helix	trans	-71.8	-43.1	-174.6	-69.4	167	0	0	0	112.2	R277 V278 G283	R277-I281 HydrophobicContact CB-CD1 4.18Å; R277-I281 WeakPolarHBondContact O-CB 3.21Å; R277-I281 VanDerWaalsContact O-CG1 3.25Å; R277-I281 WeakPolarHBondContact O-CG1 3.31Å; R277-I281 PolarHBondContact O-N 3.49Å; V278-I281 PolarHBondContact O-N 3.07Å; I281-G283 VanDerWaalsContact C-N 3.29Å
282	Q	81.1	Confident	81.2	Confident	76 Å²	76	60.4 Å²	60.4	36%	0.355	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-1.9	179.6	-69	-175	4.3	0	0	113.2	V278 I284 D356 I358	V278-Q282 HydrophobicContact CG1-CB 4.38Å; V278-Q282 HydrophobicContact CG1-CG 3.88Å; V278-Q282 WeakPolarHBondContact O-CB 3.22Å; V278-Q282 PolarHBondContact O-N 3.35Å; Q282-I284 HydrophobicContact CB-CG1 4.19Å; Q282-I284 PolarHBondContact O-N 3.34Å; Q282-D356 PolarHBondContact NE2-O 2.83Å; Q282-D356 VanDerWaalsContact NE2-O 3.12Å; Q282-I358 PolarHBondContact OE1-O 3.48Å
283	G	82.6	Confident	81.5	Confident	49 Å²	49	60.7 Å²	60.7	51%	0.505	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.6	40.4	178	0	0	0	0	0	113.1	I279 I281 T285	I279-G283 PolarHBondContact O-N 2.81Å; I281-G283 VanDerWaalsContact C-N 3.29Å; G283-T285 PolarHBondContact O-N 3.48Å
284	I	82.3	Confident	81.7	Confident	17 Å²	17	59.7 Å²	59.7	9%	0.087	33%	0.334	C	S	.	.			trans	-66.2	120.3	-179.8	-56.7	177.8	0	0	0	108.3	I279 Q282 A291 V312	I279-I284 HydrophobicContact CG1-CD1 4.16Å; I279-I284 HydrophobicContact CG2-CB 4.42Å; I279-I284 PolarHBondContact O-N 2.85Å; I279-I284 VanDerWaalsContact O-N 3.13Å; Q282-I284 HydrophobicContact CB-CG1 4.19Å; Q282-I284 PolarHBondContact O-N 3.34Å; I284-A291 HydrophobicContact CB-CB 4.39Å; I284-A291 HydrophobicContact CG2-CB 3.86Å; I284-A291 WeakPolarHBondContact O-CB 3.26Å; I284-A291 PolarHBondContact O-N 3.23Å; I284-V312 HydrophobicContact CG2-CG2 4.24Å
285	T	83	Confident	81.9	Confident	75 Å²	75	63.7 Å²	63.7	46%	0.46	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	145.2	179.5	56.7	0	0	0	0	111.6	G283 Q289	G283-T285 PolarHBondContact O-N 3.48Å; T285-Q289 CarbonylContact C-O 3.48Å; T285-Q289 WeakPolarHBondContact CA-O 3.49Å; T285-Q289 VanDerWaalsContact CB-O 3.26Å; T285-Q289 WeakPolarHBondContact CB-O 3.41Å
286	V	78.1	Confident	82	Confident	4 Å²	4	65.3 Å²	65.3	2%	0.024	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	121.4	168.3	179.7	0	0	0	0	105.9	G288 Q289 A291 V312 D314 K340 L342	V286-G288 PolarHBondContact O-N 2.82Å; V286-Q289 PolarHBondContact N-O 3.26Å; V286-Q289 PolarHBondContact O-N 3.16Å; V286-A291 HydrophobicContact CG2-CB 3.72Å; V286-V312 HydrophobicContact CG2-CG2 4.1Å; V286-D314 HydrophobicContact CG1-CB 3.95Å; V286-K340 HydrophobicContact CG1-CB 4.09Å; V286-K340 WeakPolarHBondContact CG1-O 3.07Å; V286-L342 HydrophobicContact CG2-CD1 3.68Å; V286-L342 HydrophobicContact CG2-CG 4.05Å
287	N	76.2	Confident	81.9	Confident	90 Å²	90	63.1 Å²	63.1	48%	0.481	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.7	34.4	-175.8	-59.5	-32.2	0	0	0	114.6	Q289 D314 K340	N287-Q289 PolarHBondContact O-N 2.85Å; N287-D314 PolarHBondContact ND2-OD2 2.83Å; N287-D314 VanDerWaalsContact ND2-OD2 3.1Å; N287-K340 WeakPolarHBondContact OD1-CD 3.43Å
288	G	73.6	Confident	82.1	Confident	59 Å²	59	58.3 Å²	58.3	61%	0.608	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.9	8.4	-177.6	0	0	0	0	0	114.8	V286	V286-G288 PolarHBondContact O-N 2.82Å
289	Q	76.1	Confident	82.1	Confident	65 Å²	65	61 Å²	61	30%	0.304	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	148.6	169.1	-64.4	-70	-89.3	0	0	110.1	T285 V286 N287 A291 P315 R316	T285-Q289 CarbonylContact C-O 3.48Å; T285-Q289 WeakPolarHBondContact CA-O 3.49Å; T285-Q289 VanDerWaalsContact CB-O 3.26Å; T285-Q289 WeakPolarHBondContact CB-O 3.41Å; V286-Q289 PolarHBondContact N-O 3.26Å; V286-Q289 PolarHBondContact O-N 3.16Å; N287-Q289 PolarHBondContact O-N 2.85Å; Q289-A291 PolarHBondContact O-N 3.35Å; Q289-P315 HydrophobicContact CB-CG 4.31Å; Q289-R316 VanDerWaalsContact OE1-NH2 3.1Å
290	P	81	Confident	82	Confident	94 Å²	94	66.3 Å²	66.3	61%	0.61	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-53.3	125	172.1	-24	33.5	0	0	0	110.5	P315	P290-P315 WeakPolarHBondContact O-CD 3.38Å
291	A	84.2	Confident	82	Confident	9 Å²	9	66.4 Å²	66.4	7%	0.074	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-66.5	139.2	-176.6	0	0	0	0	0	110.7	I279 I284 V286 Q289 V312	I279-A291 HydrophobicContact CG2-CB 4.35Å; I279-A291 VanDerWaalsContact CG2-O 3.25Å; I279-A291 WeakPolarHBondContact CG2-O 3.36Å; I284-A291 HydrophobicContact CB-CB 4.39Å; I284-A291 HydrophobicContact CG2-CB 3.86Å; I284-A291 WeakPolarHBondContact O-CB 3.26Å; I284-A291 PolarHBondContact O-N 3.23Å; V286-A291 HydrophobicContact CG2-CB 3.72Å; Q289-A291 PolarHBondContact O-N 3.35Å; A291-V312 HydrophobicContact CB-CB 3.84Å; A291-V312 HydrophobicContact CB-CG1 4.43Å; A291-V312 HydrophobicContact CB-CG2 3.83Å
292	H	85.4	Confident	81.9	Confident	95 Å²	95	62.5 Å²	62.5	44%	0.44	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	135.6	172.2	-166.8	-85.3	0	0	0	109.9	D294 V312 R313 P315	H292-D294 PolarHBondContact O-N 2.98Å; H292-V312 CarbonylContact O-C 3.53Å; H292-V312 VanDerWaalsContact O-CA 3.26Å; H292-V312 WeakPolarHBondContact O-CA 3.09Å; H292-V312 WeakPolarHBondContact O-CB 3.08Å; H292-R313 HydrophobicContact CB-CG 4.4Å; H292-R313 PolarHBondContact N-O 3.22Å; H292-R313 PolarHBondContact O-N 3.21Å; H292-P315 HydrophobicContact CB-CB 4.37Å
293	F	87.9	Confident	81.4	Confident	36 Å²	36	68.2 Å²	68.2	16%	0.158	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	122.1	172.2	175.5	-100.7	0	0	0	110.2	T272 I275 I279 L296 F310	T272-F293 HydrophobicContact CG2-CD1 4.31Å; T272-F293 HydrophobicContact CG2-CE1 3.79Å; T272-F293 HydrophobicContact CG2-CZ 4.02Å; I275-F293 HydrophobicContact CD1-CE2 4.16Å; I275-F293 HydrophobicContact CG2-CD2 3.57Å; I275-F293 HydrophobicContact CG2-CE2 3.84Å; I279-F293 HydrophobicContact CD1-CB 3.93Å; F293-L296 HydrophobicContact CE2-CB 4.49Å; F293-L296 HydrophobicContact CZ-CB 4.03Å; F293-F310 HydrophobicContact CD2-CD2 4.28Å; F293-F310 HydrophobicContact CE2-CB 4.03Å; F293-F310 HydrophobicContact CE2-CD2 4.49Å
294	D	84.9	Confident	80.7	Confident	41 Å²	41	69.7 Å²	69.7	22%	0.219	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-58.2	179.1	-167.3	25.7	0	0	0	110	H292 I311 R313 K341	H292-D294 PolarHBondContact O-N 2.98Å; D294-I311 HydrophobicContact CB-CB 4.29Å; D294-I311 HydrophobicContact CB-CG2 4.04Å; D294-I311 WeakPolarHBondContact CB-O 3.31Å; D294-I311 PolarHBondContact N-O 3.32Å; D294-R313 HydrophobicContact CB-CB 4.31Å; D294-R313 HydrophobicContact CB-CG 4.03Å; D294-R313 WeakPolarHBondContact OD1-CD 3.26Å; D294-R313 IonicContact OD1-CZ 3.88Å; D294-R313 IonicContact OD1-NE 3.73Å; D294-R313 IonicContact OD1-NH1 2.86Å; D294-R313 PolarHBondContact OD1-NH1 2.84Å; D294-K341 IonicContact OD2-NZ 3.96Å; D294-K341 PolarHBondContact OD2-NZ 3.13Å
295	K	87.5	Confident	80.6	Confident	123 Å²	123	68.9 Å²	68.9	54%	0.535	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	143.4	-173.6	162.9	175.2	173.3	179.8	0	112	F310 I311	K295-F310 CarbonylContact O-C 3.56Å; K295-F310 WeakPolarHBondContact O-CA 3.38Å; K295-F310 WeakPolarHBondContact O-CB 3.35Å; K295-I311 PolarHBondContact N-O 3.33Å; K295-I311 PolarHBondContact O-N 3.45Å
296	L	87.2	Confident	80.7	Confident	34 Å²	34	66.5 Å²	66.5	18%	0.178	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	123.8	161.6	-175.1	64	0	0	0	109.4	V271 I275 F293 H299 F310	V271-L296 HydrophobicContact CG1-CD1 4.29Å; V271-L296 HydrophobicContact CG1-CD2 4.08Å; I275-L296 HydrophobicContact CD1-CD1 3.63Å; F293-L296 HydrophobicContact CE2-CB 4.49Å; F293-L296 HydrophobicContact CZ-CB 4.03Å; L296-H299 HydrophobicContact CD2-CB 4.25Å; L296-F310 HydrophobicContact CD1-CB 4.24Å
297	V	83.3	Confident	81.1	Confident	56 Å²	56	71.2 Å²	71.2	34%	0.339	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	-52.3	-180	-176.8	0	0	0	0	110.2	V309 I311	V297-V309 WeakPolarHBondContact CA-O 3.21Å; V297-V309 HydrophobicContact CB-CB 4.09Å; V297-V309 HydrophobicContact CB-CG1 3.86Å; V297-V309 VanDerWaalsContact CB-O 3.32Å; V297-V309 WeakPolarHBondContact CB-O 3.48Å; V297-V309 HydrophobicContact CG1-CG1 4.24Å; V297-V309 HydrophobicContact CG2-CG1 4.2Å; V297-V309 PolarHBondContact N-O 3.06Å; V297-I311 HydrophobicContact CG2-CD1 3.81Å; V297-I311 HydrophobicContact CG2-CG1 3.72Å
298	T	85.4	Confident	81.8	Confident	61 Å²	61	67 Å²	67	37%	0.374	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	154	175.1	58.9	0	0	0	0	110.5	V309	T298-V309 PolarHBondContact N-O 3.1Å; T298-V309 VanDerWaalsContact N-O 3.15Å; T298-V309 PolarHBondContact O-N 3.04Å; T298-V309 WeakPolarHBondContact OG1-CB 3.41Å; T298-V309 WeakPolarHBondContact OG1-CG2 3.36Å
299	H	84.3	Confident	82.5	Confident	59 Å²	59	65.5 Å²	65.5	27%	0.273	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	150.3	165.2	67.3	-71.9	0	0	0	109.5	E267 V271 L296 E307 V308	E267-H299 IonicContact OE1-CD2 2.8Å; E267-H299 PolarHBondContact OE1-CD2 2.94Å; E267-H299 IonicContact OE1-NE2 2.69Å; V271-H299 HydrophobicContact CG1-CB 4.37Å; L296-H299 HydrophobicContact CD2-CB 4.25Å; H299-E307 CarbonylContact C-O 3.6Å; H299-E307 VanDerWaalsContact CA-O 3.3Å; H299-E307 WeakPolarHBondContact CA-O 3.46Å; H299-V308 HydrophobicContact CB-CG1 4.19Å
300	K	81.2	Confident	83.3	Confident	124 Å²	124	62.4 Å²	62.4	54%	0.539	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	122.8	173.3	-177.1	-175.8	175.5	-169.1	0	108.7	T302 E307	K300-T302 PolarHBondContact O-N 2.77Å; K300-E307 HydrophobicContact CB-CB 4.39Å; K300-E307 PolarHBondContact N-O 2.95Å; K300-E307 PolarHBondContact O-N 2.6Å
301	K	79.4	Confident	83.6	Confident	104 Å²	104	59.3 Å²	59.3	45%	0.452	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	128.8	170.8	-168.9	-177.2	176.2	-164.3	0	109	F306 E803	K301-F306 HydrophobicContact CB-CD1 4.27Å; K301-F306 HydrophobicContact CB-CE1 4.14Å; K301-F306 HydrophobicContact CG-CD1 4.5Å; K301-F306 HydrophobicContact CG-CE1 4.1Å; K301-E803 IonicContact NZ-OE1 2.81Å; K301-E803 PolarHBondContact NZ-OE1 3.02Å; K301-E803 VanDerWaalsContact NZ-OE1 3.17Å; K301-E803 IonicContact NZ-OE2 3.62Å
302	T	76	Confident	83.8	Confident	41 Å²	41	58.9 Å²	58.9	25%	0.252	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	168.8	173.5	64.2	0	0	0	0	109.8	K300 S304 G305 E307	K300-T302 PolarHBondContact O-N 2.77Å; T302-S304 PolarHBondContact O-N 3.16Å; T302-G305 PolarHBondContact N-O 2.93Å; T302-G305 PolarHBondContact O-N 2.81Å; T302-G305 VanDerWaalsContact O-O 3.1Å; T302-G305 PolarHBondContact OG1-N 3.41Å; T302-G305 PolarHBondContact OG1-O 3.15Å; T302-E307 HydrophobicContact CG2-CB 4.12Å
303	E	69.4	Low	83.8	Confident	197 Å²	197	57.2 Å²	57.2	92%	0.921	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-26.7	177.4	-67.7	-177.2	166.5	0	0	113.2
304	S	69	Low	83.4	Confident	79 Å²	79	56.3 Å²	56.3	55%	0.552	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	-5.8	-176.6	57	0	0	0	0	114.6	T302 S349	T302-S304 PolarHBondContact O-N 3.16Å; S304-S349 PolarHBondContact O-OG 3.16Å
305	G	80.4	Confident	82.6	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.01	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	161.3	-149.7	-169.8	0	0	0	0	0	115.6	T302 L348	T302-G305 PolarHBondContact N-O 2.93Å; T302-G305 PolarHBondContact O-N 2.81Å; T302-G305 VanDerWaalsContact O-O 3.1Å; T302-G305 PolarHBondContact OG1-N 3.41Å; T302-G305 PolarHBondContact OG1-O 3.15Å; G305-L348 CarbonylContact C-O 3.56Å; G305-L348 WeakPolarHBondContact CA-O 3.45Å
306	F	85.4	Confident	81.6	Confident	24 Å²	24	58.7 Å²	58.7	11%	0.105	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	125.8	169.3	-62.4	-86.7	0	0	0	109.9	E267 V271 K301 V308 T347 L348 I350	E267-F306 HydrophobicContact CG-CE1 3.98Å; E267-F306 HydrophobicContact CG-CZ 4.47Å; V271-F306 HydrophobicContact CG2-CD1 3.67Å; V271-F306 HydrophobicContact CG2-CD2 4.25Å; V271-F306 HydrophobicContact CG2-CE1 3.83Å; V271-F306 HydrophobicContact CG2-CE2 4.38Å; V271-F306 HydrophobicContact CG2-CG 3.9Å; V271-F306 HydrophobicContact CG2-CZ 4.18Å; K301-F306 HydrophobicContact CB-CD1 4.27Å; K301-F306 HydrophobicContact CB-CE1 4.14Å; K301-F306 HydrophobicContact CG-CD1 4.5Å; K301-F306 HydrophobicContact CG-CE1 4.1Å; F306-V308 HydrophobicContact CB-CG1 3.98Å; F306-T347 CarbonylContact O-C 3.54Å; F306-T347 WeakPolarHBondContact O-CA 3.4Å; F306-L348 HydrophobicContact CB-CB 4.27Å; F306-L348 PolarHBondContact N-O 2.74Å; F306-L348 PolarHBondContact O-N 3.42Å; F306-I350 HydrophobicContact CD2-CD1 4.07Å; F306-I350 HydrophobicContact CD2-CG1 3.86Å; F306-I350 HydrophobicContact CE2-CD1 3.7Å; F306-I350 HydrophobicContact CE2-CG1 3.56Å; F306-I350 HydrophobicContact CZ-CD1 4.18Å; F306-I350 HydrophobicContact CZ-CG1 4.46Å
307	E	86	Confident	80	Confident	103 Å²	103	58.8 Å²	58.8	48%	0.481	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	118.9	168.2	-158.2	177.2	-157.1	0	0	108	H299 K300 T302 T347	H299-E307 CarbonylContact C-O 3.6Å; H299-E307 VanDerWaalsContact CA-O 3.3Å; H299-E307 WeakPolarHBondContact CA-O 3.46Å; K300-E307 HydrophobicContact CB-CB 4.39Å; K300-E307 PolarHBondContact N-O 2.95Å; K300-E307 PolarHBondContact O-N 2.6Å; T302-E307 HydrophobicContact CG2-CB 4.12Å; E307-T347 HydrophobicContact CG-CG2 4.49Å
308	V	89.9	Confident	78.4	Confident	1 Å²	1	60.7 Å²	60.7	1%	0.006	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	144.1	-169.6	-64.8	0	0	0	0	113	V271 H299 F306 F310 K345 G346 L348	V271-V308 HydrophobicContact CG1-CG1 3.81Å; H299-V308 HydrophobicContact CB-CG1 4.19Å; F306-V308 HydrophobicContact CB-CG1 3.98Å; V308-F310 HydrophobicContact CG2-CD1 4.15Å; V308-F310 HydrophobicContact CG2-CE1 4.17Å; V308-K345 WeakPolarHBondContact O-CA 3.42Å; V308-G346 PolarHBondContact N-O 2.97Å; V308-G346 PolarHBondContact O-N 3.08Å; V308-G346 VanDerWaalsContact O-N 3.1Å; V308-L348 HydrophobicContact CB-CD1 4.42Å; V308-L348 HydrophobicContact CG1-CD1 3.71Å; V308-L348 HydrophobicContact CG1-CG 4.36Å; V308-L348 HydrophobicContact CG2-CD1 3.89Å; V308-L348 HydrophobicContact CG2-CG 3.87Å
309	V	89.3	Confident	76.4	Confident	28 Å²	28	64.5 Å²	64.5	17%	0.17	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	124.3	167.2	-175.5	0	0	0	0	108.2	V297 T298 I343 C344 K345	V297-V309 WeakPolarHBondContact CA-O 3.21Å; V297-V309 HydrophobicContact CB-CB 4.09Å; V297-V309 HydrophobicContact CB-CG1 3.86Å; V297-V309 VanDerWaalsContact CB-O 3.32Å; V297-V309 WeakPolarHBondContact CB-O 3.48Å; V297-V309 HydrophobicContact CG1-CG1 4.24Å; V297-V309 HydrophobicContact CG2-CG1 4.2Å; V297-V309 PolarHBondContact N-O 3.06Å; T298-V309 PolarHBondContact N-O 3.1Å; T298-V309 VanDerWaalsContact N-O 3.15Å; T298-V309 PolarHBondContact O-N 3.04Å; T298-V309 WeakPolarHBondContact OG1-CB 3.41Å; T298-V309 WeakPolarHBondContact OG1-CG2 3.36Å; V309-I343 HydrophobicContact CG1-CD1 4Å; V309-I343 HydrophobicContact CG1-CG1 4.03Å; V309-C344 WeakPolarHBondContact CA-O 3.34Å; V309-K345 HydrophobicContact CG1-CG 4.02Å; V309-K345 HydrophobicContact CG2-CG 4.06Å
310	F	91.7	Very high	74.1	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	160.8	-179.6	62.7	-82.7	0	0	0	112	I275 I279 F293 K295 L296 V308 V312 C344 I358	I275-F310 HydrophobicContact CD1-CB 4.27Å; I275-F310 HydrophobicContact CD1-CD1 4.01Å; I275-F310 HydrophobicContact CD1-CG 4.17Å; I275-F310 HydrophobicContact CG1-CD1 4.22Å; I275-F310 HydrophobicContact CG1-CE1 4.34Å; I275-F310 HydrophobicContact CG2-CD1 4.21Å; I275-F310 HydrophobicContact CG2-CD2 3.64Å; I275-F310 HydrophobicContact CG2-CE1 4.19Å; I275-F310 HydrophobicContact CG2-CE2 3.6Å; I275-F310 HydrophobicContact CG2-CG 3.95Å; I275-F310 HydrophobicContact CG2-CZ 3.88Å; I279-F310 HydrophobicContact CD1-CE2 4.29Å; I279-F310 HydrophobicContact CG1-CE2 4.26Å; F293-F310 HydrophobicContact CD2-CD2 4.28Å; F293-F310 HydrophobicContact CE2-CB 4.03Å; F293-F310 HydrophobicContact CE2-CD2 4.49Å; K295-F310 CarbonylContact O-C 3.56Å; K295-F310 WeakPolarHBondContact O-CA 3.38Å; K295-F310 WeakPolarHBondContact O-CB 3.35Å; L296-F310 HydrophobicContact CD1-CB 4.24Å; V308-F310 HydrophobicContact CG2-CD1 4.15Å; V308-F310 HydrophobicContact CG2-CE1 4.17Å; F310-V312 HydrophobicContact CD2-CG1 3.81Å; F310-V312 HydrophobicContact CE2-CG1 3.69Å; F310-C344 HydrophobicContact CD1-CB 4.06Å; F310-C344 HydrophobicContact CD2-CB 3.92Å; F310-C344 HydrophobicContact CE1-CB 3.63Å; F310-C344 HydrophobicContact CE2-CB 3.49Å; F310-C344 VanDerWaalsContact CE2-CB 3.49Å; F310-C344 HydrophobicContact CG-CB 4.19Å; F310-C344 HydrophobicContact CZ-CB 3.34Å; F310-C344 PolarHBondContact N-O 2.91Å; F310-C344 PolarHBondContact O-N 2.92Å; F310-I358 HydrophobicContact CE1-CD1 3.75Å; F310-I358 HydrophobicContact CE1-CG2 4Å; F310-I358 HydrophobicContact CZ-CD1 3.97Å; F310-I358 HydrophobicContact CZ-CG2 3.91Å
311	I	87.7	Confident	71.6	Confident	30 Å²	30	66.3 Å²	66.3	15%	0.154	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	138.2	-179.9	-61.6	170.2	0	0	0	108.6	D294 K295 V297 K341 L342	D294-I311 HydrophobicContact CB-CB 4.29Å; D294-I311 HydrophobicContact CB-CG2 4.04Å; D294-I311 WeakPolarHBondContact CB-O 3.31Å; D294-I311 PolarHBondContact N-O 3.32Å; K295-I311 PolarHBondContact N-O 3.33Å; K295-I311 PolarHBondContact O-N 3.45Å; V297-I311 HydrophobicContact CG2-CD1 3.81Å; V297-I311 HydrophobicContact CG2-CG1 3.72Å; I311-K341 HydrophobicContact CG2-CB 4.23Å; I311-K341 HydrophobicContact CG2-CD 4.14Å; I311-L342 WeakPolarHBondContact CA-O 3.49Å
312	V	88.1	Confident	69.1	Low	0 Å²	0	64.7 Å²	64.7	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	150.1	171.1	-58.9	0	0	0	0	110.8	I279 I284 V286 A291 H292 F310 L342	I279-V312 HydrophobicContact CD1-CG1 3.77Å; I279-V312 HydrophobicContact CG1-CG1 4.26Å; I284-V312 HydrophobicContact CG2-CG2 4.24Å; V286-V312 HydrophobicContact CG2-CG2 4.1Å; A291-V312 HydrophobicContact CB-CB 3.84Å; A291-V312 HydrophobicContact CB-CG1 4.43Å; A291-V312 HydrophobicContact CB-CG2 3.83Å; H292-V312 CarbonylContact O-C 3.53Å; H292-V312 VanDerWaalsContact O-CA 3.26Å; H292-V312 WeakPolarHBondContact O-CA 3.09Å; H292-V312 WeakPolarHBondContact O-CB 3.08Å; F310-V312 HydrophobicContact CD2-CG1 3.81Å; F310-V312 HydrophobicContact CE2-CG1 3.69Å; V312-L342 HydrophobicContact CG2-CB 3.69Å; V312-L342 HydrophobicContact CG2-CD1 4.12Å; V312-L342 HydrophobicContact CG2-CG 4.34Å; V312-L342 PolarHBondContact N-O 2.87Å; V312-L342 PolarHBondContact O-N 3.4Å
313	R	86	Confident	66.9	Low	60 Å²	60	69.3 Å²	69.3	23%	0.226	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	163.8	-175.7	68.3	179.6	-173.6	-169.7	19.6	112.3	H292 D294 D318	H292-R313 HydrophobicContact CB-CG 4.4Å; H292-R313 PolarHBondContact N-O 3.22Å; H292-R313 PolarHBondContact O-N 3.21Å; D294-R313 HydrophobicContact CB-CB 4.31Å; D294-R313 HydrophobicContact CB-CG 4.03Å; D294-R313 WeakPolarHBondContact OD1-CD 3.26Å; D294-R313 IonicContact OD1-CZ 3.88Å; D294-R313 IonicContact OD1-NE 3.73Å; D294-R313 IonicContact OD1-NH1 2.86Å; D294-R313 PolarHBondContact OD1-NH1 2.84Å; R313-D318 IonicContact CZ-OD1 2.8Å; R313-D318 IonicContact CZ-OD2 3.53Å; R313-D318 IonicContact NE-OD2 3.66Å; R313-D318 IonicContact NH2-OD1 3.38Å; R313-D318 PolarHBondContact NH2-OD1 2.83Å; R313-D318 IonicContact NH2-OD2 2.81Å; R313-D318 PolarHBondContact NH2-OD2 2.93Å
314	D	78.6	Confident	65	Low	17 Å²	17	65.1 Å²	65.1	9%	0.091	40%	0.396	C	S	.	.			trans	-67.4	125.4	171.8	-167.5	-35.4	0	0	0	110.7	V286 N287 R316 A317	V286-D314 HydrophobicContact CG1-CB 3.95Å; N287-D314 PolarHBondContact ND2-OD2 2.83Å; N287-D314 VanDerWaalsContact ND2-OD2 3.1Å; D314-R316 PolarHBondContact O-N 3.08Å; D314-R316 VanDerWaalsContact O-N 3.16Å; D314-R316 WeakPolarHBondContact OD1-CB 3.37Å; D314-R316 PolarHBondContact OD1-N 3.39Å; D314-A317 WeakPolarHBondContact O-CB 3.43Å; D314-A317 PolarHBondContact O-N 2.75Å
315	P	69.6	Low	63.1	Low	48 Å²	48	66.9 Å²	66.9	31%	0.312	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-63.2	-15.2	178.1	24.2	-33	0	0	0	114.2	Q289 P290 H292 A317	Q289-P315 HydrophobicContact CB-CG 4.31Å; P290-P315 WeakPolarHBondContact O-CD 3.38Å; H292-P315 HydrophobicContact CB-CB 4.37Å; P315-A317 VanDerWaalsContact C-N 3.25Å; P315-A317 PolarHBondContact O-N 3.45Å
316	R	65.1	Low	60.7	Low	166 Å²	166	72.3 Å²	72.3	63%	0.626	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-77.2	-9.3	176.7	-63.3	179.5	-175.7	-169.5	2.1	113.7	Q289 D314 D318	Q289-R316 VanDerWaalsContact OE1-NH2 3.1Å; D314-R316 PolarHBondContact O-N 3.08Å; D314-R316 VanDerWaalsContact O-N 3.16Å; D314-R316 WeakPolarHBondContact OD1-CB 3.37Å; D314-R316 PolarHBondContact OD1-N 3.39Å; R316-D318 PolarHBondContact O-N 2.83Å
317	A	55.3	Low	58.2	Low	35 Å²	35	77.5 Å²	77.5	29%	0.289	48%	0.479	S	S	.	.	G	3₁₀ helix	trans	-68.9	-14.3	179.8	0	0	0	0	0	114.3	D314 P315 T339	D314-A317 WeakPolarHBondContact O-CB 3.43Å; D314-A317 PolarHBondContact O-N 2.75Å; P315-A317 VanDerWaalsContact C-N 3.25Å; P315-A317 PolarHBondContact O-N 3.45Å; A317-T339 HydrophobicContact CB-CG2 3.59Å
318	D	49.7	Very low	55.5	Low	97 Å²	97	79.6 Å²	79.6	52%	0.519	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-90.6	6.5	-175.2	-72.7	-41.6	0	0	0	114.2	R313 R316	R313-D318 IonicContact CZ-OD1 2.8Å; R313-D318 IonicContact CZ-OD2 3.53Å; R313-D318 IonicContact NE-OD2 3.66Å; R313-D318 IonicContact NH2-OD1 3.38Å; R313-D318 PolarHBondContact NH2-OD1 2.83Å; R313-D318 IonicContact NH2-OD2 2.81Å; R313-D318 PolarHBondContact NH2-OD2 2.93Å; R316-D318 PolarHBondContact O-N 2.83Å
319	N	43	Very low	52.8	Low	140 Å²	140	85 Å²	85	75%	0.749	53%	0.529	S	S	*	.			trans	-113.5	50.9	-174.4	-77.7	-21.5	0	0	0	115.1
320	T	35.6	Very low	49.9	Very low	140 Å²	140	89.3 Å²	89.3	86%	0.859	56%	0.561	S	S	*	*			trans	-134.5	83.2	168.2	30.7	0	0	0	0	111.7
321	G	28.3	Very low	46.9	Very low	81 Å²	81	93 Å²	93	84%	0.835	60%	0.599	S	S	*	*			trans	-119.2	93.6	167.4	0	0	0	0	0	110.9
322	G	27.1	Very low	43.9	Very low	70 Å²	70	96.9 Å²	96.9	72%	0.722	63%	0.628	S	S	*	*			trans	78.4	115.9	152.8	0	0	0	0	0	119.1
323	T	29	Very low	40.9	Very low	139 Å²	139	103.7 Å²	103.7	85%	0.853	66%	0.664	S	S	*	*				-171.8	128.1	125.2	23	0	0	0	0	112.1
324	S	30.8	Very low	38	Very low	109 Å²	109	106.3 Å²	106.3	76%	0.762	69%	0.687	S	S	*	*			trans	25.5	135.6	149.7	58.1	0	0	0	0	123.5
325	S	29.3	Very low	35.5	Very low	116 Å²	116	111.7 Å²	111.7	81%	0.811	72%	0.72	S	S	*	*			trans	-36.9	139.7	159.6	53.3	0	0	0	0	118.2
326	S	30.2	Very low	33.5	Very low	114 Å²	114	117.2 Å²	117.2	80%	0.797	75%	0.746	S	S	*	*				-164.2	142.8	121.9	62	0	0	0	0	110.6
327	V	31.6	Very low	31.9	Very low	133 Å²	133	112.8 Å²	112.8	81%	0.806	75%	0.752	S	S	*	*			trans	-83.2	135.4	177.6	174.9	0	0	0	0	108.6
328	D	28.9	Very low	31.2	Very low	147 Å²	147	117.5 Å²	117.5	79%	0.786	77%	0.771	S	S	*	*			trans	-139.6	140.7	154.4	-96.3	-34.9	0	0	0	110.5
329	P	33.6	Very low	31.3	Very low	114 Å²	114	117 Å²	117	74%	0.74	77%	0.772	S	S	*	*			trans	-107.9	97.7	-173.5	36.2	-22.3	0	0	0	110.5
330	S	29.5	Very low	32.4	Very low	120 Å²	120	114.6 Å²	114.6	84%	0.839	75%	0.754	S	S	*	*			trans	-168.3	136.6	159.5	38.4	0	0	0	0	109.9
331	G	28.4	Very low	34.5	Very low	77 Å²	77	112.1 Å²	112.1	79%	0.794	73%	0.732	S	S	*	*			trans	-73.4	165.9	-161	0	0	0	0	0	116.1
332	S	24.7	Very low	37.2	Very low	111 Å²	111	109.5 Å²	109.5	78%	0.776	70%	0.698	S	S	*	*			trans	95.9	133.8	163.9	-157.2	0	0	0	0	117
333	L	23.7	Very low	40.1	Very low	144 Å²	144	108.1 Å²	108.1	75%	0.754	67%	0.674	S	S	*	*			trans	91.5	95.5	164.1	-77.8	129.7	0	0	0	120.7
334	T	25.4	Very low	43	Very low	115 Å²	115	101.5 Å²	101.5	71%	0.706	63%	0.634	S	S	*	*				79.7	115	120.3	47.1	0	0	0	0	122.5
335	V	27.7	Very low	45.9	Very low	129 Å²	129	101.9 Å²	101.9	78%	0.782	62%	0.622	S	S	*	*			trans	80.7	82.7	142.5	-170.1	0	0	0	0	116.5	G337	V335-G337 PolarHBondContact O-N 3.33Å
336	L	27.3	Very low	48.7	Very low	164 Å²	164	97.2 Å²	97.2	86%	0.859	59%	0.591	S	S	*	*			trans	-56.4	117.1	151.4	-78.8	157.3	0	0	0	108.7	I338	L336-I338 PolarHBondContact O-N 3.22Å
337	G	30.7	Very low	51.2	Low	73 Å²	73	94.3 Å²	94.3	75%	0.753	57%	0.569	S	S	*	*			trans	-67.5	91.7	-179	0	0	0	0	0	112.3	V335 T339	V335-G337 PolarHBondContact O-N 3.33Å; G337-T339 PolarHBondContact O-N 3.42Å
338	I	40.2	Very low	53.6	Low	135 Å²	135	88.1 Å²	88.1	69%	0.692	53%	0.531	S	S	*	.			trans	-76	113.6	172.6	-47.6	176.3	0	0	0	107.7	L336 K340	L336-I338 PolarHBondContact O-N 3.22Å; I338-K340 PolarHBondContact O-N 2.93Å; I338-K340 VanDerWaalsContact O-N 3.1Å
339	T	53.2	Low	55.9	Low	86 Å²	86	82.6 Å²	82.6	53%	0.528	50%	0.504	S	S	.	.			trans	-73.8	99.9	178.1	31.6	0	0	0	0	109.9	A317 G337 K341	A317-T339 HydrophobicContact CB-CG2 3.59Å; G337-T339 PolarHBondContact O-N 3.42Å; T339-K341 PolarHBondContact O-N 3.06Å
340	K	65.8	Low	57.3	Low	90 Å²	90	81.5 Å²	81.5	39%	0.391	49%	0.491	S	S	.	.			trans	-63.6	130.4	176.8	-78.2	171.2	168.1	-137.6	0	111.2	V286 N287 I338 E362	V286-K340 HydrophobicContact CG1-CB 4.09Å; V286-K340 WeakPolarHBondContact CG1-O 3.07Å; N287-K340 WeakPolarHBondContact OD1-CD 3.43Å; I338-K340 PolarHBondContact O-N 2.93Å; I338-K340 VanDerWaalsContact O-N 3.1Å; K340-E362 VanDerWaalsContact CD-OE1 3.26Å; K340-E362 WeakPolarHBondContact CD-OE1 3.23Å; K340-E362 WeakPolarHBondContact CE-OE1 3.46Å; K340-E362 IonicContact NZ-OE1 2.71Å; K340-E362 PolarHBondContact NZ-OE1 2.91Å
341	K	79.7	Confident	58.5	Low	87 Å²	87	79.8 Å²	79.8	38%	0.378	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	140.8	172	-65.1	-169.2	179.6	-150	0	109.6	D294 I311 T339 I363	D294-K341 IonicContact OD2-NZ 3.96Å; D294-K341 PolarHBondContact OD2-NZ 3.13Å; I311-K341 HydrophobicContact CG2-CB 4.23Å; I311-K341 HydrophobicContact CG2-CD 4.14Å; T339-K341 PolarHBondContact O-N 3.06Å; K341-I363 HydrophobicContact CB-CD1 3.88Å; K341-I363 PolarHBondContact O-N 2.87Å
342	L	84.3	Confident	59.5	Low	26 Å²	26	82.2 Å²	82.2	14%	0.136	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	138.2	171.4	-58.2	170.8	0	0	0	109.2	V286 I311 V312 C360 E361 E362	V286-L342 HydrophobicContact CG2-CD1 3.68Å; V286-L342 HydrophobicContact CG2-CG 4.05Å; I311-L342 WeakPolarHBondContact CA-O 3.49Å; V312-L342 HydrophobicContact CG2-CB 3.69Å; V312-L342 HydrophobicContact CG2-CD1 4.12Å; V312-L342 HydrophobicContact CG2-CG 4.34Å; V312-L342 PolarHBondContact N-O 2.87Å; V312-L342 PolarHBondContact O-N 3.4Å; L342-C360 HydrophobicContact CB-CB 4.33Å; L342-C360 HydrophobicContact CD1-CB 4.41Å; L342-E361 CarbonylContact C-O 3.55Å; L342-E361 VanDerWaalsContact CA-O 3.28Å; L342-E361 WeakPolarHBondContact CA-O 3.26Å; L342-E362 HydrophobicContact CD2-CB 4.02Å; L342-E362 HydrophobicContact CD2-CG 4.23Å
343	I	88.5	Confident	60.7	Low	42 Å²	42	81 Å²	81	22%	0.215	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	124.5	166.5	-169.5	167.1	0	0	0	108.7	V309 C360 E361 I363	V309-I343 HydrophobicContact CG1-CD1 4Å; V309-I343 HydrophobicContact CG1-CG1 4.03Å; I343-C360 CarbonylContact O-C 3.45Å; I343-C360 VanDerWaalsContact O-CA 3.3Å; I343-C360 WeakPolarHBondContact O-CA 3.43Å; I343-E361 HydrophobicContact CG2-CB 4.34Å; I343-E361 PolarHBondContact N-O 3.35Å; I343-E361 PolarHBondContact O-N 2.8Å; I343-I363 HydrophobicContact CB-CD1 4.21Å; I343-I363 HydrophobicContact CB-CG1 4.03Å; I343-I363 HydrophobicContact CG2-CG1 4.19Å
344	C	89.9	Confident	62.6	Low	0 Å²	0	77.9 Å²	77.9	0%	0	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	130.3	-179.7	-61.3	0	0	0	0	109.9	V309 F310 I358 K359 C360	V309-C344 WeakPolarHBondContact CA-O 3.34Å; F310-C344 HydrophobicContact CD1-CB 4.06Å; F310-C344 HydrophobicContact CD2-CB 3.92Å; F310-C344 HydrophobicContact CE1-CB 3.63Å; F310-C344 HydrophobicContact CE2-CB 3.49Å; F310-C344 VanDerWaalsContact CE2-CB 3.49Å; F310-C344 HydrophobicContact CG-CB 4.19Å; F310-C344 HydrophobicContact CZ-CB 3.34Å; F310-C344 PolarHBondContact N-O 2.91Å; F310-C344 PolarHBondContact O-N 2.92Å; C344-I358 HydrophobicContact CB-CG2 3.95Å; C344-K359 CarbonylContact C-O 3.53Å; C344-K359 VanDerWaalsContact CA-O 3.31Å; C344-K359 WeakPolarHBondContact CA-O 3.46Å; C344-C360 HydrophobicContact CB-CB 4.15Å; C344-C360 WeakPolarHBondContact CB-SG 3.23Å; C344-C360 WeakPolarHBondContact SG-CB 3.33Å; C344-C360 CovalentContact SG-SG 2.05Å; C344-C360 PolarHBondContact SG-SG 3.15Å
345	K	90.9	Very high	64.3	Low	117 Å²	117	83.6 Å²	83.6	51%	0.509	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	137.4	179.9	-63.8	-178.6	-179.8	171.6	0	109.5	V308 V309 K359	V308-K345 WeakPolarHBondContact O-CA 3.42Å; V309-K345 HydrophobicContact CG1-CG 4.02Å; V309-K345 HydrophobicContact CG2-CG 4.06Å; K345-K359 PolarHBondContact N-O 2.91Å; K345-K359 PolarHBondContact O-N 3.49Å
346	G	87.8	Confident	66.7	Low	17 Å²	17	79.8 Å²	79.8	18%	0.175	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.2	-173.7	-178.4	0	0	0	0	0	115.9	V308 N357	V308-G346 PolarHBondContact N-O 2.97Å; V308-G346 PolarHBondContact O-N 3.08Å; V308-G346 VanDerWaalsContact O-N 3.1Å; G346-N357 CarbonylContact C-O 3.5Å; G346-N357 WeakPolarHBondContact CA-O 3.12Å
347	T	83.4	Confident	69.1	Low	54 Å²	54	76.9 Å²	76.9	33%	0.331	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	127.8	175.4	24.8	0	0	0	0	110.5	F306 E307 N357	F306-T347 CarbonylContact O-C 3.54Å; F306-T347 WeakPolarHBondContact O-CA 3.4Å; E307-T347 HydrophobicContact CG-CG2 4.49Å; T347-N357 PolarHBondContact N-O 2.96Å; T347-N357 PolarHBondContact O-N 3.36Å; T347-N357 VanDerWaalsContact O-N 3.08Å
348	L	82.4	Confident	71.7	Confident	2 Å²	2	74.1 Å²	74.1	1%	0.01	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	119.9	171.5	-63.5	170.1	0	0	0	108.6	V271 I275 V278 G305 F306 V308 D356 I358	V271-L348 HydrophobicContact CG1-CD1 4.32Å; I275-L348 HydrophobicContact CG1-CD1 3.85Å; V278-L348 HydrophobicContact CB-CD2 4.46Å; V278-L348 HydrophobicContact CG2-CD2 3.54Å; G305-L348 CarbonylContact C-O 3.56Å; G305-L348 WeakPolarHBondContact CA-O 3.45Å; F306-L348 HydrophobicContact CB-CB 4.27Å; F306-L348 PolarHBondContact N-O 2.74Å; F306-L348 PolarHBondContact O-N 3.42Å; V308-L348 HydrophobicContact CB-CD1 4.42Å; V308-L348 HydrophobicContact CG1-CD1 3.71Å; V308-L348 HydrophobicContact CG1-CG 4.36Å; V308-L348 HydrophobicContact CG2-CD1 3.89Å; V308-L348 HydrophobicContact CG2-CG 3.87Å; L348-D356 WeakPolarHBondContact CA-OD1 3.48Å; L348-I358 HydrophobicContact CD2-CD1 3.79Å
349	S	76	Confident	74	Confident	31 Å²	31	75 Å²	75	22%	0.217	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	136.8	179.6	-161.1	0	0	0	0	111.9	S304 V351 V354 D356	S304-S349 PolarHBondContact O-OG 3.16Å; S349-V351 VanDerWaalsContact C-N 3.27Å; S349-V351 PolarHBondContact OG-N 3.04Å; S349-V354 WeakPolarHBondContact OG-CB 3.47Å; S349-V354 WeakPolarHBondContact OG-CG1 3.26Å; S349-D356 PolarHBondContact N-OD1 2.81Å
350	I	63.9	Low	75.6	Confident	92 Å²	92	73 Å²	73	47%	0.472	39%	0.394	S	S	.	.	S	Bend	trans	-80.1	-17.4	173.2	-63.6	157.5	0	0	0	110.4	F306 P352	F306-I350 HydrophobicContact CD2-CD1 4.07Å; F306-I350 HydrophobicContact CD2-CG1 3.86Å; F306-I350 HydrophobicContact CE2-CD1 3.7Å; F306-I350 HydrophobicContact CE2-CG1 3.56Å; F306-I350 HydrophobicContact CZ-CD1 4.18Å; F306-I350 HydrophobicContact CZ-CG1 4.46Å; I350-P352 WeakPolarHBondContact O-CD 3.38Å
351	V	55	Low	76.6	Confident	83 Å²	83	74.9 Å²	74.9	50%	0.503	40%	0.404	S	S	.	.	S	Bend	trans	-87.6	115.9	-176.2	-175.7	0	0	0	0	109.7	S349 G353 V354	S349-V351 VanDerWaalsContact C-N 3.27Å; S349-V351 PolarHBondContact OG-N 3.04Å; V351-G353 PolarHBondContact O-N 2.86Å; V351-V354 HydrophobicContact CB-CB 4.34Å; V351-V354 HydrophobicContact CB-CG2 3.74Å; V351-V354 HydrophobicContact CG1-CG2 3.83Å; V351-V354 PolarHBondContact O-N 2.91Å; V351-V354 VanDerWaalsContact O-N 3.16Å
352	P	49	Very low	76.6	Confident	128 Å²	128	75.5 Å²	75.5	83%	0.831	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	123.8	174.1	-21.8	32.7	0	0	0	110.7	I350	I350-P352 WeakPolarHBondContact O-CD 3.38Å
353	G	49.7	Very low	75.9	Confident	85 Å²	85	77.6 Å²	77.6	88%	0.876	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	101.3	-11.5	179.8	0	0	0	0	0	115.5	V351	V351-G353 PolarHBondContact O-N 2.86Å
354	V	62.8	Low	74.2	Confident	79 Å²	79	84.2 Å²	84.2	48%	0.479	45%	0.446	S	S	.	.	S	Bend	trans	-84.4	131.1	169.7	178.4	0	0	0	0	108.8	S349 V351 D356	S349-V354 WeakPolarHBondContact OG-CB 3.47Å; S349-V354 WeakPolarHBondContact OG-CG1 3.26Å; V351-V354 HydrophobicContact CB-CB 4.34Å; V351-V354 HydrophobicContact CB-CG2 3.74Å; V351-V354 HydrophobicContact CG1-CG2 3.83Å; V351-V354 PolarHBondContact O-N 2.91Å; V351-V354 VanDerWaalsContact O-N 3.16Å; V354-D356 PolarHBondContact O-N 3.42Å
355	R	62.3	Low	71.6	Confident	235 Å²	235	91 Å²	91	89%	0.887	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-70.6	130.6	-178.1	-70.6	-173.5	-169.7	-174.8	3.7	111
356	D	77.2	Confident	68.7	Low	50 Å²	50	90.3 Å²	90.3	27%	0.267	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-65.7	137.3	165.7	-58.9	-44.5	0	0	0	110	V278 Q282 L348 S349 V354	V278-D356 HydrophobicContact CG2-CB 4Å; V278-D356 VanDerWaalsContact CG2-OD2 3.25Å; V278-D356 WeakPolarHBondContact CG2-OD2 3.23Å; Q282-D356 PolarHBondContact NE2-O 2.83Å; Q282-D356 VanDerWaalsContact NE2-O 3.12Å; L348-D356 WeakPolarHBondContact CA-OD1 3.48Å; S349-D356 PolarHBondContact N-OD1 2.81Å; V354-D356 PolarHBondContact O-N 3.42Å
357	N	78.5	Confident	65.9	Low	103 Å²	103	96.4 Å²	96.4	55%	0.551	53%	0.526	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.7	98.7	179.5	-173.2	12.1	0	0	0	109.1	G346 T347	G346-N357 CarbonylContact C-O 3.5Å; G346-N357 WeakPolarHBondContact CA-O 3.12Å; T347-N357 PolarHBondContact N-O 2.96Å; T347-N357 PolarHBondContact O-N 3.36Å; T347-N357 VanDerWaalsContact O-N 3.08Å
358	I	85.2	Confident	63.2	Low	15 Å²	15	101.2 Å²	101.2	8%	0.077	54%	0.544	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	133.2	-179	-52.9	-157.4	0	0	0	109.2	V278 Q282 F310 C344 L348	V278-I358 HydrophobicContact CB-CD1 4.11Å; V278-I358 HydrophobicContact CG1-CB 4.36Å; V278-I358 HydrophobicContact CG1-CD1 3.5Å; V278-I358 HydrophobicContact CG1-CG1 3.93Å; V278-I358 HydrophobicContact CG2-CD1 4.31Å; Q282-I358 PolarHBondContact OE1-O 3.48Å; F310-I358 HydrophobicContact CE1-CD1 3.75Å; F310-I358 HydrophobicContact CE1-CG2 4Å; F310-I358 HydrophobicContact CZ-CD1 3.97Å; F310-I358 HydrophobicContact CZ-CG2 3.91Å; C344-I358 HydrophobicContact CB-CG2 3.95Å; L348-I358 HydrophobicContact CD2-CD1 3.79Å
359	K	87.5	Confident	60.7	Low	153 Å²	153	110 Å²	110	67%	0.665	59%	0.586	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-119.3	137.4	171.5	-70	-176	178.3	-178.4	0	109.4	C344 K345	C344-K359 CarbonylContact C-O 3.53Å; C344-K359 VanDerWaalsContact CA-O 3.31Å; C344-K359 WeakPolarHBondContact CA-O 3.46Å; K345-K359 PolarHBondContact N-O 2.91Å; K345-K359 PolarHBondContact O-N 3.49Å
360	C	87.9	Confident	58.3	Low	44 Å²	44	118.7 Å²	118.7	30%	0.297	61%	0.613	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118	136.8	178.4	-58.8	0	0	0	0	110.8	L342 I343 C344	L342-C360 HydrophobicContact CB-CB 4.33Å; L342-C360 HydrophobicContact CD1-CB 4.41Å; I343-C360 CarbonylContact O-C 3.45Å; I343-C360 VanDerWaalsContact O-CA 3.3Å; I343-C360 WeakPolarHBondContact O-CA 3.43Å; C344-C360 HydrophobicContact CB-CB 4.15Å; C344-C360 WeakPolarHBondContact CB-SG 3.23Å; C344-C360 WeakPolarHBondContact SG-CB 3.33Å; C344-C360 CovalentContact SG-SG 2.05Å; C344-C360 PolarHBondContact SG-SG 3.15Å
361	E	87.1	Confident	56.8	Low	130 Å²	130	119.3 Å²	119.3	61%	0.607	62%	0.624	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-127.8	148.5	-179.3	-69	174.5	179.9	0	0	110.3	L342 I343	L342-E361 CarbonylContact C-O 3.55Å; L342-E361 VanDerWaalsContact CA-O 3.28Å; L342-E361 WeakPolarHBondContact CA-O 3.26Å; I343-E361 HydrophobicContact CG2-CB 4.34Å; I343-E361 PolarHBondContact N-O 3.35Å; I343-E361 PolarHBondContact O-N 2.8Å
362	E	78.9	Confident	55.5	Low	99 Å²	99	124.9 Å²	124.9	46%	0.463	64%	0.641	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-75.4	129.8	179.7	-156.7	171.4	-151	0	0	110.4	K340 L342 K364	K340-E362 VanDerWaalsContact CD-OE1 3.26Å; K340-E362 WeakPolarHBondContact CD-OE1 3.23Å; K340-E362 WeakPolarHBondContact CE-OE1 3.46Å; K340-E362 IonicContact NZ-OE1 2.71Å; K340-E362 PolarHBondContact NZ-OE1 2.91Å; L342-E362 HydrophobicContact CD2-CB 4.02Å; L342-E362 HydrophobicContact CD2-CG 4.23Å; E362-K364 PolarHBondContact O-N 2.83Å; E362-K364 VanDerWaalsContact O-N 3.12Å
363	I	70.7	Confident	54.6	Low	71 Å²	71	123.9 Å²	123.9	36%	0.364	64%	0.635	S	S	.	*			trans	-74.8	104.6	178.1	-56.2	178.3	0	0	0	107.4	K341 I343	K341-I363 HydrophobicContact CB-CD1 3.88Å; K341-I363 PolarHBondContact O-N 2.87Å; I343-I363 HydrophobicContact CB-CD1 4.21Å; I343-I363 HydrophobicContact CB-CG1 4.03Å; I343-I363 HydrophobicContact CG2-CG1 4.19Å
364	K	51.8	Low	53.7	Low	180 Å²	180	126.4 Å²	126.4	78%	0.783	63%	0.628	S	S	*	*			trans	-77.9	123.7	169.9	-69.6	-177.5	179.3	179.2	0	108.6	E362 S366	E362-K364 PolarHBondContact O-N 2.83Å; E362-K364 VanDerWaalsContact O-N 3.12Å; K364-S366 PolarHBondContact O-N 2.82Å
365	D	36.5	Very low	52.1	Low	144 Å²	144	128.3 Å²	128.3	77%	0.77	64%	0.635	S	S	*	*	S	Bend	trans	-62.6	91	177.1	-70.6	-40.5	0	0	0	110.6
366	S	28	Very low	50.6	Low	101 Å²	101	122.3 Å²	122.3	71%	0.706	63%	0.626	S	S	*	*			trans	-177.4	129.4	159.9	13.1	0	0	0	0	111.4	K364	K364-S366 PolarHBondContact O-N 2.82Å
367	V	29.2	Very low	48.4	Very low	145 Å²	145	122.2 Å²	122.2	88%	0.879	64%	0.638	S	S	*	*			trans	79.2	122.1	160.9	-170.3	0	0	0	0	118.3
368	E	28.5	Very low	46	Very low	155 Å²	155	120.5 Å²	120.5	72%	0.724	64%	0.644	S	S	*	*			trans	-53.1	126.9	169.6	-176.7	176.7	167.7	0	0	113.7
369	E	28.1	Very low	43.2	Very low	188 Å²	188	122.2 Å²	122.2	88%	0.879	67%	0.665	S	S	*	*			trans	-135.1	113.5	162.2	-147.4	180	-164.1	0	0	109.3
370	R	26.1	Very low	40.4	Very low	212 Å²	212	124.5 Å²	124.5	80%	0.8	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-68.2	131.3	-173.3	-67.5	-176.3	-172	-164.3	3.7	112
371	P	32.1	Very low	37.7	Very low	106 Å²	106	127.8 Å²	127.8	69%	0.688	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-80.5	133	167.4	-8	25.2	0	0	0	111.9
372	K	29.3	Very low	35	Very low	199 Å²	199	124.1 Å²	124.1	87%	0.865	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-53.1	139.5	168.4	-85.1	171.7	173.9	168	0	111.8
373	P	29.8	Very low	32.9	Very low	108 Å²	108	125.7 Å²	125.7	70%	0.701	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-82.5	124.6	179.7	30.6	-29.4	0	0	0	111.8
374	N	30	Very low	31.6	Very low	137 Å²	137	129.7 Å²	129.7	73%	0.733	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-88.9	134.2	162.5	-72.7	-30.2	0	0	0	109.1
375	L	29.9	Very low	31.5	Very low	119 Å²	119	124.2 Å²	124.2	62%	0.623	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-68.8	145.5	-178.5	-87.8	73.9	0	0	0	113.2	V390	L375-V390 HydrophobicContact CD1-CG1 4.4Å; L375-V390 HydrophobicContact CD2-CB 4.49Å; L375-V390 HydrophobicContact CD2-CG1 4.28Å; L375-V390 HydrophobicContact CD2-CG2 3.73Å
376	P	30.6	Very low	32.2	Very low	109 Å²	109	119.9 Å²	119.9	71%	0.708	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-101.7	131.2	161.4	33.7	-23.2	0	0	0	112.1
377	G	30	Very low	33.8	Very low	49 Å²	49	118 Å²	118	51%	0.505	65%	0.651	S	S	.	*	P	Polyproline II helix	trans	-95.4	158	158.5	0	0	0	0	0	109.6
378	G	28.3	Very low	35.6	Very low	66 Å²	66	113.3 Å²	113.3	68%	0.68	62%	0.62	S	S	*	*			cis	-166.7	143	-4.9	0	0	0	0	0	107.6
379	G	26.6	Very low	37.6	Very low	51 Å²	51	109.1 Å²	109.1	53%	0.526	60%	0.602	S	S	.	*	S	Bend	trans	-141	104.2	168.3	0	0	0	0	0	107.6	L381	G379-L381 PolarHBondContact O-N 3Å
380	H	28.6	Very low	39.7	Very low	202 Å²	202	102.4 Å²	102.4	94%	0.935	57%	0.574	S	S	*	*	S	Bend	trans	36.9	60.2	165.5	-88.6	-69.9	0	0	0	118.3
381	L	31.3	Very low	42.1	Very low	113 Å²	113	98.1 Å²	98.1	59%	0.592	56%	0.561	S	S	*	*	S	Bend	trans	-131	146.7	139	-77.1	163.6	0	0	0	104.4	G379 L383 I386	G379-L381 PolarHBondContact O-N 3Å; L381-L383 PolarHBondContact O-N 3.02Å; L381-I386 HydrophobicContact CB-CD1 4.44Å; L381-I386 HydrophobicContact CB-CG1 4.36Å
382	A	31.3	Very low	44.4	Very low	52 Å²	52	93 Å²	93	43%	0.43	53%	0.528	S	S	.	.			trans	-52.9	134.2	-177.9	0	0	0	0	0	108.6	E384 D385	A382-E384 HydrophobicContact CB-CB 4.4Å; A382-E384 PolarHBondContact O-N 2.96Å; A382-D385 PolarHBondContact N-OD2 2.94Å; A382-D385 WeakPolarHBondContact O-CB 3.47Å; A382-D385 PolarHBondContact O-N 3.32Å
383	L	35.4	Very low	46.8	Very low	132 Å²	132	84.9 Å²	84.9	69%	0.691	50%	0.495	S	S	*	.	H	α-helix	trans	-52.1	-24	179.1	-171.7	71.2	0	0	0	111.6	L381 T387	L381-L383 PolarHBondContact O-N 3.02Å; L383-T387 WeakPolarHBondContact O-CB 3.43Å; L383-T387 PolarHBondContact O-N 2.9Å; L383-T387 PolarHBondContact O-OG1 2.75Å
384	E	41.7	Very low	49.1	Very low	155 Å²	155	82.7 Å²	82.7	72%	0.724	48%	0.479	S	S	*	.	H	α-helix	trans	-62.7	-45	172	-64.5	176.3	173.3	0	0	112.6	A382 T387 E388	A382-E384 HydrophobicContact CB-CB 4.4Å; A382-E384 PolarHBondContact O-N 2.96Å; E384-T387 PolarHBondContact O-N 3.02Å; E384-E388 WeakPolarHBondContact O-CB 3.35Å; E384-E388 PolarHBondContact O-N 3.45Å
385	D	50.1	Low	51.5	Low	65 Å²	65	77.6 Å²	77.6	35%	0.348	45%	0.454	S	S	.	.	H	α-helix	trans	-68.3	-41.7	-178.1	-58.7	-29.8	0	0	0	112.3	A382 E388 I389	A382-D385 PolarHBondContact N-OD2 2.94Å; A382-D385 WeakPolarHBondContact O-CB 3.47Å; A382-D385 PolarHBondContact O-N 3.32Å; D385-E388 PolarHBondContact O-N 2.9Å; D385-I389 VanDerWaalsContact O-CG1 3.31Å; D385-I389 WeakPolarHBondContact O-CG1 3.48Å; D385-I389 PolarHBondContact O-N 3.26Å
386	I	51.6	Low	54.1	Low	53 Å²	53	71.9 Å²	71.9	27%	0.272	43%	0.425	S	S	.	.	H	α-helix	trans	-68.6	-40.4	179.1	-61.4	175.3	0	0	0	110.1	L381 E388 V390	L381-I386 HydrophobicContact CB-CD1 4.44Å; L381-I386 HydrophobicContact CB-CG1 4.36Å; I386-E388 VanDerWaalsContact C-N 3.33Å; I386-V390 WeakPolarHBondContact O-CB 3.31Å; I386-V390 WeakPolarHBondContact O-CG2 3.4Å; I386-V390 PolarHBondContact O-N 2.85Å; I386-V390 VanDerWaalsContact O-N 3.09Å
387	T	62.4	Low	56.6	Low	61 Å²	61	72 Å²	72	37%	0.374	41%	0.414	S	S	.	.	H	α-helix	trans	-66.1	-37.8	176.3	-56.5	0	0	0	0	111.1	L383 E384 K391	L383-T387 WeakPolarHBondContact O-CB 3.43Å; L383-T387 PolarHBondContact O-N 2.9Å; L383-T387 PolarHBondContact O-OG1 2.75Å; E384-T387 PolarHBondContact O-N 3.02Å; T387-K391 HydrophobicContact CG2-CD 4.3Å; T387-K391 WeakPolarHBondContact O-CB 3.38Å; T387-K391 VanDerWaalsContact O-CG 3.26Å; T387-K391 WeakPolarHBondContact O-CG 3.26Å; T387-K391 PolarHBondContact O-N 3.34Å
388	E	66.8	Low	59	Low	48 Å²	48	77.7 Å²	77.7	22%	0.224	42%	0.42	C	S	.	.	H	α-helix	trans	-65.8	-47.6	176.2	-173.5	164.1	-156.8	0	0	112	E384 D385 I386 V390 K391 I392	E384-E388 WeakPolarHBondContact O-CB 3.35Å; E384-E388 PolarHBondContact O-N 3.45Å; D385-E388 PolarHBondContact O-N 2.9Å; I386-E388 VanDerWaalsContact C-N 3.33Å; E388-V390 VanDerWaalsContact C-N 3.31Å; E388-V390 PolarHBondContact O-N 3.08Å; E388-K391 WeakPolarHBondContact O-CB 3.41Å; E388-K391 PolarHBondContact O-N 2.89Å; E388-K391 VanDerWaalsContact O-N 3.15Å; E388-I392 HydrophobicContact CG-CD1 3.85Å; E388-I392 HydrophobicContact CG-CG1 4.45Å; E388-I392 VanDerWaalsContact O-CG1 3.27Å; E388-I392 WeakPolarHBondContact O-CG1 3.38Å; E388-I392 PolarHBondContact O-N 2.05Å
389	I	69.8	Low	61.6	Low	66 Å²	66	75 Å²	75	34%	0.338	39%	0.39	S	S	.	.	H	α-helix	trans	-61.2	-39.2	176.9	-68.2	167	0	0	0	111.6	D385 I392 T393	D385-I389 VanDerWaalsContact O-CG1 3.31Å; D385-I389 WeakPolarHBondContact O-CG1 3.48Å; D385-I389 PolarHBondContact O-N 3.26Å; I389-I392 PolarHBondContact O-N 3.5Å; I389-T393 HydrophobicContact CG2-CG2 4.48Å; I389-T393 WeakPolarHBondContact O-CB 3.48Å; I389-T393 WeakPolarHBondContact O-CG2 3.45Å; I389-T393 PolarHBondContact O-N 3.42Å; I389-T393 PolarHBondContact O-OG1 2.81Å
390	V	72.8	Confident	64.2	Low	48 Å²	48	72.9 Å²	72.9	29%	0.291	37%	0.367	S	S	.	.	H	α-helix	trans	-67.7	-38.6	177	171.9	0	0	0	0	111.2	L375 I386 E388 T393 T394	L375-V390 HydrophobicContact CD1-CG1 4.4Å; L375-V390 HydrophobicContact CD2-CB 4.49Å; L375-V390 HydrophobicContact CD2-CG1 4.28Å; L375-V390 HydrophobicContact CD2-CG2 3.73Å; I386-V390 WeakPolarHBondContact O-CB 3.31Å; I386-V390 WeakPolarHBondContact O-CG2 3.4Å; I386-V390 PolarHBondContact O-N 2.85Å; I386-V390 VanDerWaalsContact O-N 3.09Å; E388-V390 VanDerWaalsContact C-N 3.31Å; E388-V390 PolarHBondContact O-N 3.08Å; V390-T393 WeakPolarHBondContact CA-OG1 3.33Å; V390-T393 PolarHBondContact O-OG1 3.27Å; V390-T394 VanDerWaalsContact O-CB 3.27Å; V390-T394 WeakPolarHBondContact O-CB 3.23Å; V390-T394 PolarHBondContact O-N 3.24Å; V390-T394 PolarHBondContact O-OG1 2.8Å
391	K	76	Confident	66.7	Low	121 Å²	121	67.8 Å²	67.8	53%	0.526	35%	0.35	S	S	.	.	H	α-helix	trans	-64.4	-47.5	172.7	-75.9	171.2	178.8	176	0	111.3	T387 E388 T394 S395	T387-K391 HydrophobicContact CG2-CD 4.3Å; T387-K391 WeakPolarHBondContact O-CB 3.38Å; T387-K391 VanDerWaalsContact O-CG 3.26Å; T387-K391 WeakPolarHBondContact O-CG 3.26Å; T387-K391 PolarHBondContact O-N 3.34Å; E388-K391 WeakPolarHBondContact O-CB 3.41Å; E388-K391 PolarHBondContact O-N 2.89Å; E388-K391 VanDerWaalsContact O-N 3.15Å; K391-T394 PolarHBondContact O-N 2.89Å; K391-S395 WeakPolarHBondContact O-CB 3.46Å; K391-S395 PolarHBondContact O-N 3.48Å; K391-S395 PolarHBondContact O-OG 3.48Å
392	I	81	Confident	68.8	Low	0 Å²	0	68.1 Å²	68.1	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-58.8	-52	178.4	-68.9	165.1	0	0	0	110.3	E388 I389 T394 S395 I396 L417 H420 I427 I429 L469	E388-I392 HydrophobicContact CG-CD1 3.85Å; E388-I392 HydrophobicContact CG-CG1 4.45Å; E388-I392 VanDerWaalsContact O-CG1 3.27Å; E388-I392 WeakPolarHBondContact O-CG1 3.38Å; E388-I392 PolarHBondContact O-N 2.05Å; I389-I392 PolarHBondContact O-N 3.5Å; I392-T394 PolarHBondContact O-N 2.83Å; I392-S395 WeakPolarHBondContact O-CB 3.2Å; I392-S395 PolarHBondContact O-N 2.9Å; I392-S395 VanDerWaalsContact O-N 3.16Å; I392-I396 HydrophobicContact CG2-CD1 3.71Å; I392-I396 HydrophobicContact CG2-CG1 4.35Å; I392-I396 WeakPolarHBondContact O-CG1 3.4Å; I392-I396 PolarHBondContact O-N 3.25Å; I392-L417 HydrophobicContact CG2-CD1 4.13Å; I392-L417 HydrophobicContact CG2-CD2 3.95Å; I392-H420 HydrophobicContact CD1-CB 4Å; I392-I427 HydrophobicContact CD1-CD1 4.23Å; I392-I427 HydrophobicContact CD1-CG2 3.96Å; I392-I427 HydrophobicContact CG1-CD1 3.95Å; I392-I427 HydrophobicContact CG1-CG2 4.35Å; I392-I429 HydrophobicContact CG2-CG2 3.94Å; I392-L469 HydrophobicContact CG2-CD2 4.27Å
393	T	79.2	Confident	71	Confident	28 Å²	28	70.5 Å²	70.5	17%	0.172	36%	0.357	C	S	.	.	H	α-helix	trans	-64.5	-36.8	-179.4	47.2	0	0	0	0	113	I389 V390 K397 F414	I389-T393 HydrophobicContact CG2-CG2 4.48Å; I389-T393 WeakPolarHBondContact O-CB 3.48Å; I389-T393 WeakPolarHBondContact O-CG2 3.45Å; I389-T393 PolarHBondContact O-N 3.42Å; I389-T393 PolarHBondContact O-OG1 2.81Å; V390-T393 WeakPolarHBondContact CA-OG1 3.33Å; V390-T393 PolarHBondContact O-OG1 3.27Å; T393-K397 WeakPolarHBondContact O-CG 3.33Å; T393-K397 PolarHBondContact O-N 3.34Å; T393-F414 HydrophobicContact CG2-CE1 3.96Å; T393-F414 HydrophobicContact CG2-CZ 3.66Å
394	T	77.7	Confident	73.1	Confident	61 Å²	61	65.9 Å²	65.9	37%	0.374	34%	0.342	S	S	.	.	H	α-helix	trans	-65.2	-40.8	173.3	-57.7	0	0	0	0	111.5	V390 K391 I392 R398	V390-T394 VanDerWaalsContact O-CB 3.27Å; V390-T394 WeakPolarHBondContact O-CB 3.23Å; V390-T394 PolarHBondContact O-N 3.24Å; V390-T394 PolarHBondContact O-OG1 2.8Å; K391-T394 PolarHBondContact O-N 2.89Å; I392-T394 PolarHBondContact O-N 2.83Å; T394-R398 WeakPolarHBondContact O-CG 3.27Å; T394-R398 PolarHBondContact O-N 3.16Å; T394-R398 VanDerWaalsContact O-N 3.11Å
395	S	81.3	Confident	74.7	Confident	30 Å²	30	59.8 Å²	59.8	21%	0.21	31%	0.314	C	S	.	.	H	α-helix	trans	-68	-40	176.6	-67.6	0	0	0	0	112.6	K391 I392 R398 L399	K391-S395 WeakPolarHBondContact O-CB 3.46Å; K391-S395 PolarHBondContact O-N 3.48Å; K391-S395 PolarHBondContact O-OG 3.48Å; I392-S395 WeakPolarHBondContact O-CB 3.2Å; I392-S395 PolarHBondContact O-N 2.9Å; I392-S395 VanDerWaalsContact O-N 3.16Å; S395-R398 PolarHBondContact O-N 2.78Å; S395-L399 WeakPolarHBondContact O-CB 3.28Å; S395-L399 PolarHBondContact O-N 3.37Å
396	I	83.9	Confident	76	Confident	0 Å²	0	65 Å²	65	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-61.4	-46.7	174.1	-68.7	167.2	0	0	0	110.6	I392 R398 L399 L400 F414 L417 I429 F431	I392-I396 HydrophobicContact CG2-CD1 3.71Å; I392-I396 HydrophobicContact CG2-CG1 4.35Å; I392-I396 WeakPolarHBondContact O-CG1 3.4Å; I392-I396 PolarHBondContact O-N 3.25Å; I396-R398 VanDerWaalsContact C-N 3.31Å; I396-R398 PolarHBondContact O-N 3.27Å; I396-L399 PolarHBondContact O-N 3.01Å; I396-L399 VanDerWaalsContact O-N 3.09Å; I396-L400 HydrophobicContact CG2-CD1 4.19Å; I396-L400 HydrophobicContact CG2-CG 4.4Å; I396-L400 WeakPolarHBondContact O-CG 3.23Å; I396-L400 PolarHBondContact O-N 2.93Å; I396-F414 HydrophobicContact CB-CD2 4.38Å; I396-F414 HydrophobicContact CD1-CE2 4.14Å; I396-F414 HydrophobicContact CG2-CD2 3.53Å; I396-F414 HydrophobicContact CG2-CE2 3.99Å; I396-F414 HydrophobicContact CG2-CG 4.44Å; I396-L417 HydrophobicContact CD1-CD1 3.8Å; I396-I429 HydrophobicContact CD1-CD1 3.86Å; I396-I429 HydrophobicContact CG1-CD1 3.68Å; I396-F431 HydrophobicContact CD1-CB 4.48Å; I396-F431 HydrophobicContact CD1-CD1 4.11Å; I396-F431 HydrophobicContact CD1-CG 4.23Å; I396-F431 HydrophobicContact CG2-CD2 3.8Å; I396-F431 HydrophobicContact CG2-CE1 4.34Å; I396-F431 HydrophobicContact CG2-CE2 3.58Å; I396-F431 HydrophobicContact CG2-CG 4.25Å; I396-F431 HydrophobicContact CG2-CZ 3.87Å
397	K	83.2	Confident	77	Confident	110 Å²	110	62.7 Å²	62.7	48%	0.478	32%	0.317	S	S	.	.	H	α-helix	trans	-59	-40.8	176.9	-74.6	176.2	-179.9	-179.6	0	112.3	T393 V401 F414	T393-K397 WeakPolarHBondContact O-CG 3.33Å; T393-K397 PolarHBondContact O-N 3.34Å; K397-V401 WeakPolarHBondContact O-CG2 3.23Å; K397-V401 PolarHBondContact O-N 3Å; K397-F414 HydrophobicContact CG-CB 4.01Å; K397-F414 HydrophobicContact CG-CG 4.36Å
398	R	81.1	Confident	77.3	Confident	170 Å²	170	64.9 Å²	64.9	64%	0.642	33%	0.327	S	S	*	.	H	α-helix	trans	-64.9	-43.2	173.3	-74.4	179.9	-177.3	171.6	1	111.6	T394 S395 I396 L400 V401 T402	T394-R398 WeakPolarHBondContact O-CG 3.27Å; T394-R398 PolarHBondContact O-N 3.16Å; T394-R398 VanDerWaalsContact O-N 3.11Å; S395-R398 PolarHBondContact O-N 2.78Å; I396-R398 VanDerWaalsContact C-N 3.31Å; I396-R398 PolarHBondContact O-N 3.27Å; R398-L400 PolarHBondContact O-N 2.8Å; R398-V401 WeakPolarHBondContact O-CB 3.07Å; R398-V401 PolarHBondContact O-N 2.83Å; R398-T402 PolarHBondContact O-N 2.89Å; R398-T402 PolarHBondContact O-OG1 2.77Å
399	L	81	Confident	77.5	Confident	10 Å²	10	65 Å²	65	5%	0.052	34%	0.341	C	S	.	.	H	α-helix	trans	-65	-39.6	-178.4	-172.6	149.8	0	0	0	112.7	S395 I396 V401 T402 K403 I405 L469 N477 I479	S395-L399 WeakPolarHBondContact O-CB 3.28Å; S395-L399 PolarHBondContact O-N 3.37Å; I396-L399 PolarHBondContact O-N 3.01Å; I396-L399 VanDerWaalsContact O-N 3.09Å; L399-V401 VanDerWaalsContact C-N 3.26Å; L399-V401 PolarHBondContact O-N 3.21Å; L399-T402 PolarHBondContact O-N 2.86Å; L399-K403 HydrophobicContact CD2-CB 4.36Å; L399-K403 HydrophobicContact CD2-CG 3.92Å; L399-K403 HydrophobicContact CG-CG 4.16Å; L399-K403 WeakPolarHBondContact O-CB 3.32Å; L399-K403 PolarHBondContact O-N 2.91Å; L399-I405 HydrophobicContact CD2-CD1 4.25Å; L399-L469 HydrophobicContact CD1-CD1 3.95Å; L399-N477 HydrophobicContact CD1-CB 3.39Å; L399-I479 HydrophobicContact CD1-CD1 3.49Å; L399-I479 VanDerWaalsContact CD1-CD1 3.49Å; L399-I479 HydrophobicContact CD1-CG1 3.93Å; L399-I479 HydrophobicContact CD2-CB 4.2Å; L399-I479 HydrophobicContact CD2-CD1 3.4Å; L399-I479 HydrophobicContact CD2-CG1 3.83Å; L399-I479 HydrophobicContact CG-CD1 4.05Å
400	L	82.1	Confident	77.7	Confident	5 Å²	5	64.3 Å²	64.3	3%	0.026	34%	0.336	C	S	.	.	H	α-helix	trans	-57.1	-41.7	173.3	-71.2	169.9	0	0	0	111.6	I396 R398 G404 I405 A412 F414 F431 V433	I396-L400 HydrophobicContact CG2-CD1 4.19Å; I396-L400 HydrophobicContact CG2-CG 4.4Å; I396-L400 WeakPolarHBondContact O-CG 3.23Å; I396-L400 PolarHBondContact O-N 2.93Å; R398-L400 PolarHBondContact O-N 2.8Å; L400-G404 PolarHBondContact O-N 3.37Å; L400-I405 HydrophobicContact CD2-CB 3.92Å; L400-I405 HydrophobicContact CD2-CD1 3.74Å; L400-I405 HydrophobicContact CD2-CG1 4.36Å; L400-I405 HydrophobicContact CD2-CG2 4.12Å; L400-I405 PolarHBondContact O-N 2.88Å; L400-A412 HydrophobicContact CD2-CB 4.35Å; L400-F414 HydrophobicContact CD1-CB 3.78Å; L400-F431 HydrophobicContact CD2-CE2 4.24Å; L400-V433 HydrophobicContact CD1-CG1 3.98Å; L400-V433 HydrophobicContact CD2-CG1 3.8Å
401	V	80.5	Confident	78	Confident	96 Å²	96	66 Å²	66	58%	0.582	34%	0.343	S	S	*	.	H	α-helix	trans	-67.5	-45.4	175.1	179	0	0	0	0	111	K397 R398 L399 L411	K397-V401 WeakPolarHBondContact O-CG2 3.23Å; K397-V401 PolarHBondContact O-N 3Å; R398-V401 WeakPolarHBondContact O-CB 3.07Å; R398-V401 PolarHBondContact O-N 2.83Å; L399-V401 VanDerWaalsContact C-N 3.26Å; L399-V401 PolarHBondContact O-N 3.21Å; V401-L411 HydrophobicContact CG2-CD2 4.1Å
402	T	76.4	Confident	78.2	Confident	119 Å²	119	60.5 Å²	60.5	73%	0.73	32%	0.32	S	S	*	.	H	α-helix	trans	-72.9	-40.3	-175.1	-53.9	0	0	0	0	113.8	R398 L399 G404	R398-T402 PolarHBondContact O-N 2.89Å; R398-T402 PolarHBondContact O-OG1 2.77Å; L399-T402 PolarHBondContact O-N 2.86Å; T402-G404 VanDerWaalsContact C-N 3.3Å
403	K	76.4	Confident	78.3	Confident	102 Å²	102	65.4 Å²	65.4	44%	0.443	34%	0.343	S	S	.	.	H	α-helix	trans	-82.3	-8.9	177.6	-72.6	-80.8	-174	163.6	0	112.7	L399 I405 N477	L399-K403 HydrophobicContact CD2-CB 4.36Å; L399-K403 HydrophobicContact CD2-CG 3.92Å; L399-K403 HydrophobicContact CG-CG 4.16Å; L399-K403 WeakPolarHBondContact O-CB 3.32Å; L399-K403 PolarHBondContact O-N 2.91Å; K403-I405 VanDerWaalsContact C-N 3.33Å; K403-I405 HydrophobicContact CB-CD1 4.33Å; K403-I405 HydrophobicContact CB-CG1 4.11Å; K403-I405 PolarHBondContact O-N 2.9Å; K403-N477 WeakPolarHBondContact CE-O 3.3Å; K403-N477 PolarHBondContact NZ-O 3.06Å
404	G	79.4	Confident	78.5	Confident	36 Å²	36	65.3 Å²	65.3	37%	0.371	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.1	38.4	179.1	0	0	0	0	0	113.2	L400 T402 R406	L400-G404 PolarHBondContact O-N 3.37Å; T402-G404 VanDerWaalsContact C-N 3.3Å; G404-R406 PolarHBondContact O-N 3.28Å
405	I	77.2	Confident	78.6	Confident	27 Å²	27	65.2 Å²	65.2	14%	0.138	34%	0.335	C	S	.	.			trans	-65.6	125.2	179.3	-65.6	169.9	0	0	0	108.5	L399 L400 K403 A412 I479	L399-I405 HydrophobicContact CD2-CD1 4.25Å; L400-I405 HydrophobicContact CD2-CB 3.92Å; L400-I405 HydrophobicContact CD2-CD1 3.74Å; L400-I405 HydrophobicContact CD2-CG1 4.36Å; L400-I405 HydrophobicContact CD2-CG2 4.12Å; L400-I405 PolarHBondContact O-N 2.88Å; K403-I405 VanDerWaalsContact C-N 3.33Å; K403-I405 HydrophobicContact CB-CD1 4.33Å; K403-I405 HydrophobicContact CB-CG1 4.11Å; K403-I405 PolarHBondContact O-N 2.9Å; I405-A412 HydrophobicContact CB-CB 4.47Å; I405-A412 HydrophobicContact CG2-CB 3.9Å; I405-A412 WeakPolarHBondContact O-CB 3.24Å; I405-A412 PolarHBondContact O-N 3.48Å; I405-I479 HydrophobicContact CD1-CG2 4.49Å
406	R	77.4	Confident	78.5	Confident	174 Å²	174	67.1 Å²	67.1	66%	0.657	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.5	138.7	-177.6	-64.8	-176.3	-174.6	-154.2	7.1	112.2	G404 G409 Q410	G404-R406 PolarHBondContact O-N 3.28Å; R406-G409 PolarHBondContact NH1-O 3.37Å; R406-Q410 CarbonylContact C-O 3.52Å; R406-Q410 WeakPolarHBondContact CA-O 3.33Å; R406-Q410 WeakPolarHBondContact CB-O 3.1Å
407	V	71	Confident	78.4	Confident	5 Å²	5	68.7 Å²	68.7	3%	0.03	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	124.1	167	-179.4	0	0	0	0	106.4	G409 Q410 A412 V433 D435 L463	V407-G409 PolarHBondContact O-N 3.07Å; V407-G409 VanDerWaalsContact O-N 3.1Å; V407-Q410 PolarHBondContact N-O 3.44Å; V407-Q410 PolarHBondContact O-N 3.04Å; V407-A412 HydrophobicContact CG2-CB 3.7Å; V407-V433 HydrophobicContact CG2-CG2 4.08Å; V407-D435 HydrophobicContact CG1-CB 3.97Å; V407-L463 HydrophobicContact CG2-CD1 3.67Å; V407-L463 HydrophobicContact CG2-CG 4.14Å
408	N	69.1	Low	78	Confident	107 Å²	107	67.2 Å²	67.2	57%	0.572	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.6	36.9	-176.9	-59.8	-27.6	0	0	0	114.5	Q410 D435 T461	N408-Q410 PolarHBondContact O-N 2.87Å; N408-D435 WeakPolarHBondContact CB-OD2 3.2Å; N408-D435 PolarHBondContact ND2-OD2 2.82Å; N408-T461 PolarHBondContact ND2-OG1 3.43Å
409	G	72.1	Confident	77.7	Confident	51 Å²	51	62.7 Å²	62.7	53%	0.526	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.1	-5.5	-179.5	0	0	0	0	0	115.5	R406 V407	R406-G409 PolarHBondContact NH1-O 3.37Å; V407-G409 PolarHBondContact O-N 3.07Å; V407-G409 VanDerWaalsContact O-N 3.1Å
410	Q	73.3	Confident	77.7	Confident	50 Å²	50	65.7 Å²	65.7	23%	0.234	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	153	172.9	-63.9	-152	-17.1	0	0	112.2	R406 V407 N408 A412 D435 P436	R406-Q410 CarbonylContact C-O 3.52Å; R406-Q410 WeakPolarHBondContact CA-O 3.33Å; R406-Q410 WeakPolarHBondContact CB-O 3.1Å; V407-Q410 PolarHBondContact N-O 3.44Å; V407-Q410 PolarHBondContact O-N 3.04Å; N408-Q410 PolarHBondContact O-N 2.87Å; Q410-A412 PolarHBondContact O-N 3.28Å; Q410-D435 PolarHBondContact OE1-OD1 3.34Å; Q410-P436 HydrophobicContact CB-CG 4.37Å
411	L	79	Confident	77.3	Confident	83 Å²	83	71.8 Å²	71.8	44%	0.435	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	123.9	173.9	-169.6	73.2	0	0	0	109.6	V401 P436	V401-L411 HydrophobicContact CG2-CD2 4.1Å; L411-P436 VanDerWaalsContact O-CG 3.24Å; L411-P436 WeakPolarHBondContact O-CG 3.1Å
412	A	80.8	Confident	77	Confident	6 Å²	6	74.8 Å²	74.8	5%	0.05	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-62.5	136	-174.3	0	0	0	0	0	111.7	L400 I405 V407 Q410 V433	L400-A412 HydrophobicContact CD2-CB 4.35Å; I405-A412 HydrophobicContact CB-CB 4.47Å; I405-A412 HydrophobicContact CG2-CB 3.9Å; I405-A412 WeakPolarHBondContact O-CB 3.24Å; I405-A412 PolarHBondContact O-N 3.48Å; V407-A412 HydrophobicContact CG2-CB 3.7Å; Q410-A412 PolarHBondContact O-N 3.28Å; A412-V433 HydrophobicContact CB-CB 3.97Å; A412-V433 HydrophobicContact CB-CG2 3.95Å
413	H	81.9	Confident	76.8	Confident	103 Å²	103	71.3 Å²	71.3	48%	0.477	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	130.9	174.5	-164.3	68.7	0	0	0	110.3	E415 V433 T434 P436	H413-E415 PolarHBondContact O-N 3.48Å; H413-V433 CarbonylContact O-C 3.59Å; H413-V433 WeakPolarHBondContact O-CA 3.23Å; H413-V433 WeakPolarHBondContact O-CB 3.12Å; H413-T434 PolarHBondContact N-O 2.69Å; H413-T434 PolarHBondContact O-N 2.97Å; H413-P436 HydrophobicContact CB-CG 4.43Å
414	F	84.3	Confident	76.4	Confident	26 Å²	26	76.6 Å²	76.6	11%	0.114	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	120.6	171.6	171.7	-96.9	0	0	0	110	T393 I396 K397 L400 L417 F431	T393-F414 HydrophobicContact CG2-CE1 3.96Å; T393-F414 HydrophobicContact CG2-CZ 3.66Å; I396-F414 HydrophobicContact CB-CD2 4.38Å; I396-F414 HydrophobicContact CD1-CE2 4.14Å; I396-F414 HydrophobicContact CG2-CD2 3.53Å; I396-F414 HydrophobicContact CG2-CE2 3.99Å; I396-F414 HydrophobicContact CG2-CG 4.44Å; K397-F414 HydrophobicContact CG-CB 4.01Å; K397-F414 HydrophobicContact CG-CG 4.36Å; L400-F414 HydrophobicContact CD1-CB 3.78Å; F414-L417 HydrophobicContact CE2-CB 4.48Å; F414-L417 HydrophobicContact CZ-CB 4.12Å; F414-F431 HydrophobicContact CD2-CD2 4.15Å; F414-F431 HydrophobicContact CE2-CB 4.08Å; F414-F431 HydrophobicContact CE2-CD2 4.36Å; F414-F431 HydrophobicContact CE2-CG 4.5Å
415	E	79.4	Confident	75.9	Confident	59 Å²	59	78.9 Å²	78.9	28%	0.276	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	-62.7	179.8	178.5	-176.7	-145.7	0	0	111	H413 T432 T434 R462	H413-E415 PolarHBondContact O-N 3.48Å; E415-T432 WeakPolarHBondContact CB-OG1 3.29Å; E415-T432 PolarHBondContact N-O 3.09Å; E415-T432 WeakPolarHBondContact OE2-CB 3.35Å; E415-T432 PolarHBondContact OE2-OG1 2.75Å; E415-T434 HydrophobicContact CB-CG2 4.07Å; E415-T434 VanDerWaalsContact CD-CG2 3.49Å; E415-T434 HydrophobicContact CG-CG2 4.22Å; E415-T434 WeakPolarHBondContact OE2-CG2 3.33Å; E415-R462 IonicContact OE1-CZ 2.91Å; E415-R462 IonicContact OE1-NE 2.93Å; E415-R462 PolarHBondContact OE1-NE 2.87Å; E415-R462 IonicContact OE1-NH2 2.88Å; E415-R462 PolarHBondContact OE1-NH2 2.77Å; E415-R462 IonicContact OE2-CZ 3.8Å; E415-R462 IonicContact OE2-NE 2.75Å; E415-R462 PolarHBondContact OE2-NE 3.27Å
416	T	78.9	Confident	75.8	Confident	71 Å²	71	78.4 Å²	78.4	44%	0.436	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	152.6	178.8	-163.8	0	0	0	0	114	I418 F431 T432	T416-I418 HydrophobicContact CG2-CG1 4.47Å; T416-F431 CarbonylContact O-C 3.54Å; T416-F431 VanDerWaalsContact O-CA 3.23Å; T416-F431 WeakPolarHBondContact O-CA 3.35Å; T416-F431 WeakPolarHBondContact O-CB 3.29Å; T416-T432 HydrophobicContact CG2-CG2 4.44Å; T416-T432 WeakPolarHBondContact CG2-OG1 3.48Å; T416-T432 PolarHBondContact O-N 2.71Å
417	L	81.1	Confident	76	Confident	33 Å²	33	70.5 Å²	70.5	17%	0.173	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	119.9	168.9	-179	69.7	0	0	0	108.2	I392 I396 F414 T419 H420 I429 F431	I392-L417 HydrophobicContact CG2-CD1 4.13Å; I392-L417 HydrophobicContact CG2-CD2 3.95Å; I396-L417 HydrophobicContact CD1-CD1 3.8Å; F414-L417 HydrophobicContact CE2-CB 4.48Å; F414-L417 HydrophobicContact CZ-CB 4.12Å; L417-T419 WeakPolarHBondContact CD1-O 2.94Å; L417-H420 HydrophobicContact CD2-CB 4.43Å; L417-I429 HydrophobicContact CD1-CB 4.36Å; L417-I429 HydrophobicContact CD1-CG2 4.39Å; L417-F431 HydrophobicContact CD1-CB 4.26Å
418	I	75	Confident	76.5	Confident	79 Å²	79	73.9 Å²	73.9	41%	0.405	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	-52.7	-178.7	-56.6	166.9	0	0	0	110.4	T416 L430 T432	T416-I418 HydrophobicContact CG2-CG1 4.47Å; I418-L430 WeakPolarHBondContact CA-O 3.38Å; I418-L430 HydrophobicContact CB-CB 4.24Å; I418-L430 HydrophobicContact CB-CD2 4.05Å; I418-L430 HydrophobicContact CB-CG 4Å; I418-L430 WeakPolarHBondContact CB-O 3.29Å; I418-L430 HydrophobicContact CD1-CD2 4.14Å; I418-L430 HydrophobicContact CD1-CG 3.85Å; I418-L430 HydrophobicContact CG1-CG 4.47Å; I418-L430 HydrophobicContact CG2-CD2 3.87Å; I418-L430 HydrophobicContact CG2-CG 4.38Å; I418-L430 PolarHBondContact N-O 3.46Å; I418-T432 HydrophobicContact CD1-CG2 3.59Å; I418-T432 HydrophobicContact CG1-CG2 4.14Å
419	T	75.4	Confident	77.3	Confident	75 Å²	75	68.9 Å²	68.9	46%	0.46	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	158.1	177	64.5	0	0	0	0	111.5	L417 L430	L417-T419 WeakPolarHBondContact CD1-O 2.94Å; T419-L430 PolarHBondContact N-O 2.85Å; T419-L430 PolarHBondContact O-N 3.23Å; T419-L430 VanDerWaalsContact O-N 3.09Å; T419-L430 WeakPolarHBondContact OG1-CB 3.5Å
420	H	80.6	Confident	77.7	Confident	73 Å²	73	68.4 Å²	68.4	34%	0.338	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	143.6	165.3	66	-74.1	0	0	0	110.2	I392 L417 I427 E428 I429	I392-H420 HydrophobicContact CD1-CB 4Å; L417-H420 HydrophobicContact CD2-CB 4.43Å; H420-I427 HydrophobicContact CB-CG2 4.18Å; H420-E428 CarbonylContact C-O 3.45Å; H420-E428 VanDerWaalsContact CA-O 3.23Å; H420-E428 WeakPolarHBondContact CA-O 3.33Å; H420-I429 HydrophobicContact CB-CG2 4.26Å
421	K	74.7	Confident	78.4	Confident	132 Å²	132	66 Å²	66	57%	0.574	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.4	127.3	175.8	-177.5	-177.6	174.5	-168.5	0	109.6	I427 E428	K421-I427 CarbonylContact O-C 3.57Å; K421-E428 HydrophobicContact CB-CB 4.35Å; K421-E428 PolarHBondContact N-O 3.24Å; K421-E428 PolarHBondContact O-N 2.88Å
422	K	73.6	Confident	78.5	Confident	160 Å²	160	62.9 Å²	62.9	70%	0.696	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.1	126.3	174.9	-164.8	171.3	-176.7	172.8	0	109.5
423	T	71.4	Confident	78.6	Confident	46 Å²	46	62.6 Å²	62.6	28%	0.282	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	171	177.9	65.6	0	0	0	0	110.1	S425 G426 E428	T423-S425 PolarHBondContact O-N 3.39Å; T423-S425 PolarHBondContact OG1-N 3.39Å; T423-S425 PolarHBondContact OG1-OG 3.21Å; T423-S425 VanDerWaalsContact OG1-OG 3.07Å; T423-G426 PolarHBondContact N-O 2.87Å; T423-G426 PolarHBondContact O-N 2.83Å; T423-G426 VanDerWaalsContact O-O 3.13Å; T423-G426 PolarHBondContact OG1-N 3.43Å; T423-G426 PolarHBondContact OG1-O 3.35Å; T423-G426 VanDerWaalsContact OG1-O 3.11Å; T423-E428 HydrophobicContact CG2-CB 4.18Å
424	E	69.8	Low	78.6	Confident	213 Å²	213	58.1 Å²	58.1	100%	0.995	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-25.3	173.6	-66.3	-177.6	168.7	0	0	112.7
425	S	67.7	Low	78.1	Confident	83 Å²	83	57.9 Å²	57.9	58%	0.58	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-8.8	-176.9	51.4	0	0	0	0	114.7	T423	T423-S425 PolarHBondContact O-N 3.39Å; T423-S425 PolarHBondContact OG1-N 3.39Å; T423-S425 PolarHBondContact OG1-OG 3.21Å; T423-S425 VanDerWaalsContact OG1-OG 3.07Å
426	G	76.1	Confident	77.4	Confident	17 Å²	17	57.9 Å²	57.9	18%	0.175	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	149.9	-148.1	-177.7	0	0	0	0	0	112.9	T423	T423-G426 PolarHBondContact N-O 2.87Å; T423-G426 PolarHBondContact O-N 2.83Å; T423-G426 VanDerWaalsContact O-O 3.13Å; T423-G426 PolarHBondContact OG1-N 3.43Å; T423-G426 PolarHBondContact OG1-O 3.35Å; T423-G426 VanDerWaalsContact OG1-O 3.11Å
427	I	81.3	Confident	76.4	Confident	8 Å²	8	63.4 Å²	63.4	4%	0.041	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	109.8	174.6	-53	176.3	0	0	0	108.1	I392 H420 K421 I429 L469 L471	I392-I427 HydrophobicContact CD1-CD1 4.23Å; I392-I427 HydrophobicContact CD1-CG2 3.96Å; I392-I427 HydrophobicContact CG1-CD1 3.95Å; I392-I427 HydrophobicContact CG1-CG2 4.35Å; H420-I427 HydrophobicContact CB-CG2 4.18Å; K421-I427 CarbonylContact O-C 3.57Å; I427-I429 HydrophobicContact CG2-CG2 3.81Å; I427-I429 PolarHBondContact O-N 3.43Å; I427-L469 HydrophobicContact CB-CB 4.36Å; I427-L469 PolarHBondContact N-O 2.72Å; I427-L469 WeakPolarHBondContact O-CB 3.35Å; I427-L469 PolarHBondContact O-N 2.79Å; I427-L471 HydrophobicContact CD1-CD1 3.61Å; I427-L471 HydrophobicContact CD1-CD2 4.49Å; I427-L471 HydrophobicContact CD1-CG 3.92Å
428	E	81	Confident	75.1	Confident	77 Å²	77	64 Å²	64	36%	0.36	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	123.9	171.5	-174	176.7	-151	0	0	108.7	H420 K421 T423	H420-E428 CarbonylContact C-O 3.45Å; H420-E428 VanDerWaalsContact CA-O 3.23Å; H420-E428 WeakPolarHBondContact CA-O 3.33Å; K421-E428 HydrophobicContact CB-CB 4.35Å; K421-E428 PolarHBondContact N-O 3.24Å; K421-E428 PolarHBondContact O-N 2.88Å; T423-E428 HydrophobicContact CG2-CB 4.18Å
429	I	85.2	Confident	73.7	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.005	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	141.5	-173.4	54.1	166.3	0	0	0	112	I392 I396 L417 H420 I427 F431 E466 G467 L469 I479	I392-I429 HydrophobicContact CG2-CG2 3.94Å; I396-I429 HydrophobicContact CD1-CD1 3.86Å; I396-I429 HydrophobicContact CG1-CD1 3.68Å; L417-I429 HydrophobicContact CD1-CB 4.36Å; L417-I429 HydrophobicContact CD1-CG2 4.39Å; H420-I429 HydrophobicContact CB-CG2 4.26Å; I427-I429 HydrophobicContact CG2-CG2 3.81Å; I427-I429 PolarHBondContact O-N 3.43Å; I429-F431 HydrophobicContact CD1-CD1 3.97Å; I429-F431 HydrophobicContact CD1-CE1 3.73Å; I429-F431 HydrophobicContact CG1-CD1 4.35Å; I429-F431 HydrophobicContact CG1-CE1 4.32Å; I429-E466 WeakPolarHBondContact O-CA 2.66Å; I429-G467 VanDerWaalsContact CG1-O 3.31Å; I429-G467 WeakPolarHBondContact CG1-O 3.25Å; I429-G467 PolarHBondContact N-O 2.9Å; I429-G467 PolarHBondContact O-N 2.73Å; I429-G467 VanDerWaalsContact O-N 3.1Å; I429-L469 HydrophobicContact CD1-CB 3.87Å; I429-L469 HydrophobicContact CD1-CD1 4.27Å; I429-L469 HydrophobicContact CD1-CD2 4.48Å; I429-L469 HydrophobicContact CD1-CG 4.44Å; I429-L469 HydrophobicContact CG1-CB 4.22Å; I429-L469 HydrophobicContact CG2-CB 4.44Å; I429-I479 HydrophobicContact CD1-CD1 3.92Å
430	L	82.1	Confident	71.9	Confident	42 Å²	42	66.3 Å²	66.3	22%	0.22	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	127.3	170.6	-174.9	67.5	0	0	0	108.7	I418 T419 I464 C465 E466	I418-L430 WeakPolarHBondContact CA-O 3.38Å; I418-L430 HydrophobicContact CB-CB 4.24Å; I418-L430 HydrophobicContact CB-CD2 4.05Å; I418-L430 HydrophobicContact CB-CG 4Å; I418-L430 WeakPolarHBondContact CB-O 3.29Å; I418-L430 HydrophobicContact CD1-CD2 4.14Å; I418-L430 HydrophobicContact CD1-CG 3.85Å; I418-L430 HydrophobicContact CG1-CG 4.47Å; I418-L430 HydrophobicContact CG2-CD2 3.87Å; I418-L430 HydrophobicContact CG2-CG 4.38Å; I418-L430 PolarHBondContact N-O 3.46Å; T419-L430 PolarHBondContact N-O 2.85Å; T419-L430 PolarHBondContact O-N 3.23Å; T419-L430 VanDerWaalsContact O-N 3.09Å; T419-L430 WeakPolarHBondContact OG1-CB 3.5Å; L430-I464 HydrophobicContact CD1-CG2 3.68Å; L430-C465 WeakPolarHBondContact CA-O 3.41Å; L430-E466 HydrophobicContact CD1-CB 3.94Å; L430-E466 HydrophobicContact CD1-CG 4.3Å
431	F	87	Confident	69.8	Low	0 Å²	0	69.3 Å²	69.3	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	161.4	-175.4	63.4	-82.6	0	0	0	112.5	I396 L400 F414 T416 L417 I429 V433 C465 I479	I396-F431 HydrophobicContact CD1-CB 4.48Å; I396-F431 HydrophobicContact CD1-CD1 4.11Å; I396-F431 HydrophobicContact CD1-CG 4.23Å; I396-F431 HydrophobicContact CG2-CD2 3.8Å; I396-F431 HydrophobicContact CG2-CE1 4.34Å; I396-F431 HydrophobicContact CG2-CE2 3.58Å; I396-F431 HydrophobicContact CG2-CG 4.25Å; I396-F431 HydrophobicContact CG2-CZ 3.87Å; L400-F431 HydrophobicContact CD2-CE2 4.24Å; F414-F431 HydrophobicContact CD2-CD2 4.15Å; F414-F431 HydrophobicContact CE2-CB 4.08Å; F414-F431 HydrophobicContact CE2-CD2 4.36Å; F414-F431 HydrophobicContact CE2-CG 4.5Å; T416-F431 CarbonylContact O-C 3.54Å; T416-F431 VanDerWaalsContact O-CA 3.23Å; T416-F431 WeakPolarHBondContact O-CA 3.35Å; T416-F431 WeakPolarHBondContact O-CB 3.29Å; L417-F431 HydrophobicContact CD1-CB 4.26Å; I429-F431 HydrophobicContact CD1-CD1 3.97Å; I429-F431 HydrophobicContact CD1-CE1 3.73Å; I429-F431 HydrophobicContact CG1-CD1 4.35Å; I429-F431 HydrophobicContact CG1-CE1 4.32Å; F431-V433 HydrophobicContact CD2-CG1 3.87Å; F431-V433 HydrophobicContact CE2-CG1 3.7Å; F431-C465 HydrophobicContact CD1-CB 4.05Å; F431-C465 WeakPolarHBondContact CD1-O 3.3Å; F431-C465 HydrophobicContact CD2-CB 3.92Å; F431-C465 HydrophobicContact CE1-CB 3.6Å; F431-C465 HydrophobicContact CE2-CB 3.46Å; F431-C465 VanDerWaalsContact CE2-CB 3.46Å; F431-C465 HydrophobicContact CG-CB 4.2Å; F431-C465 HydrophobicContact CZ-CB 3.29Å; F431-C465 PolarHBondContact N-O 2.79Å; F431-C465 PolarHBondContact O-N 3.43Å; F431-I479 HydrophobicContact CE1-CD1 3.91Å; F431-I479 HydrophobicContact CE1-CG2 4.09Å; F431-I479 HydrophobicContact CZ-CD1 4.04Å; F431-I479 HydrophobicContact CZ-CG2 3.92Å
432	T	81.1	Confident	67.9	Low	17 Å²	17	66.4 Å²	66.4	10%	0.104	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	149.7	175.7	67.7	0	0	0	0	112.3	E415 T416 I418 L463 I464	E415-T432 WeakPolarHBondContact CB-OG1 3.29Å; E415-T432 PolarHBondContact N-O 3.09Å; E415-T432 WeakPolarHBondContact OE2-CB 3.35Å; E415-T432 PolarHBondContact OE2-OG1 2.75Å; T416-T432 HydrophobicContact CG2-CG2 4.44Å; T416-T432 WeakPolarHBondContact CG2-OG1 3.48Å; T416-T432 PolarHBondContact O-N 2.71Å; I418-T432 HydrophobicContact CD1-CG2 3.59Å; I418-T432 HydrophobicContact CG1-CG2 4.14Å; T432-L463 WeakPolarHBondContact CA-O 3.31Å; T432-I464 HydrophobicContact CG2-CG1 4.4Å
433	V	83.2	Confident	65.8	Low	0 Å²	0	66.4 Å²	66.4	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	149.3	173.8	-58.3	0	0	0	0	111.8	L400 V407 A412 H413 F431 L463	L400-V433 HydrophobicContact CD1-CG1 3.98Å; L400-V433 HydrophobicContact CD2-CG1 3.8Å; V407-V433 HydrophobicContact CG2-CG2 4.08Å; A412-V433 HydrophobicContact CB-CB 3.97Å; A412-V433 HydrophobicContact CB-CG2 3.95Å; H413-V433 CarbonylContact O-C 3.59Å; H413-V433 WeakPolarHBondContact O-CA 3.23Å; H413-V433 WeakPolarHBondContact O-CB 3.12Å; F431-V433 HydrophobicContact CD2-CG1 3.87Å; F431-V433 HydrophobicContact CE2-CG1 3.7Å; V433-L463 HydrophobicContact CG2-CB 3.7Å; V433-L463 HydrophobicContact CG2-CD1 4.35Å; V433-L463 HydrophobicContact CG2-CG 4.49Å; V433-L463 PolarHBondContact N-O 3.48Å; V433-L463 PolarHBondContact O-N 2.94Å
434	T	81	Confident	64	Low	9 Å²	9	70.3 Å²	70.3	6%	0.055	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	164.8	-175.9	51.7	0	0	0	0	112.8	H413 E415 R462	H413-T434 PolarHBondContact N-O 2.69Å; H413-T434 PolarHBondContact O-N 2.97Å; E415-T434 HydrophobicContact CB-CG2 4.07Å; E415-T434 VanDerWaalsContact CD-CG2 3.49Å; E415-T434 HydrophobicContact CG-CG2 4.22Å; E415-T434 WeakPolarHBondContact OE2-CG2 3.33Å; T434-R462 HydrophobicContact CG2-CG 3.69Å
435	D	74.6	Confident	62.2	Low	20 Å²	20	65.9 Å²	65.9	11%	0.107	41%	0.405	C	S	.	.			trans	-71.4	126	168.4	-171.9	-28	0	0	0	110.4	V407 N408 Q410 R437 S438	V407-D435 HydrophobicContact CG1-CB 3.97Å; N408-D435 WeakPolarHBondContact CB-OD2 3.2Å; N408-D435 PolarHBondContact ND2-OD2 2.82Å; Q410-D435 PolarHBondContact OE1-OD1 3.34Å; D435-R437 PolarHBondContact O-N 3.3Å; D435-R437 WeakPolarHBondContact OD1-CB 3.13Å; D435-R437 PolarHBondContact OD1-N 3.03Å; D435-S438 WeakPolarHBondContact O-CB 3.48Å; D435-S438 PolarHBondContact O-N 2.97Å; D435-S438 PolarHBondContact O-OG 3.45Å
436	P	64.1	Low	60.5	Low	60 Å²	60	67.9 Å²	67.9	39%	0.39	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-55.3	-21.2	175.9	-21.2	29.1	0	0	0	115	Q410 L411 H413	Q410-P436 HydrophobicContact CB-CG 4.37Å; L411-P436 VanDerWaalsContact O-CG 3.24Å; L411-P436 WeakPolarHBondContact O-CG 3.1Å; H413-P436 HydrophobicContact CB-CG 4.43Å
437	R	59.6	Low	58.4	Low	186 Å²	186	70.8 Å²	70.8	70%	0.702	45%	0.449	S	S	*	.	G	3₁₀ helix	trans	-84	-6.2	179.1	-74.8	179.4	167.7	160.2	2.1	114.5	D435 D439	D435-R437 PolarHBondContact O-N 3.3Å; D435-R437 WeakPolarHBondContact OD1-CB 3.13Å; D435-R437 PolarHBondContact OD1-N 3.03Å; R437-D439 PolarHBondContact O-N 3.01Å
438	S	53.3	Low	56	Low	46 Å²	46	77.4 Å²	77.4	32%	0.322	49%	0.489	S	S	.	.	G	3₁₀ helix	trans	-73.5	-8.2	-177.9	60.5	0	0	0	0	115.3	D435	D435-S438 WeakPolarHBondContact O-CB 3.48Å; D435-S438 PolarHBondContact O-N 2.97Å; D435-S438 PolarHBondContact O-OG 3.45Å
439	D	44.3	Very low	53.9	Low	127 Å²	127	80.4 Å²	80.4	68%	0.679	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-96.7	10.6	-179.8	-72.8	-35.7	0	0	0	114.5	R437	R437-D439 PolarHBondContact O-N 3.01Å
440	A	38.9	Very low	51.4	Low	76 Å²	76	86.7 Å²	86.7	63%	0.628	55%	0.549	S	S	*	.			trans	-88.1	126.9	178.6	0	0	0	0	0	112.1	G442	A440-G442 PolarHBondContact O-N 2.7Å
441	P	36.1	Very low	49.5	Very low	136 Å²	136	89.1 Å²	89.1	88%	0.883	57%	0.569	S	S	*	*			trans	-72.9	99.7	172	28.9	-29	0	0	0	109
442	G	35.2	Very low	46.9	Very low	71 Å²	71	92.9 Å²	92.9	73%	0.732	61%	0.608	S	S	*	*			trans	-86.6	139.8	177.1	0	0	0	0	0	113	A440	A440-G442 PolarHBondContact O-N 2.7Å
443	D	29.3	Very low	44.5	Very low	159 Å²	159	97.3 Å²	97.3	85%	0.85	64%	0.635	S	S	*	*			trans	-54.7	142.3	-177.9	-77.3	-47.5	0	0	0	114.5	S445	D443-S445 PolarHBondContact O-N 3.01Å
444	P	33	Very low	41.8	Very low	129 Å²	129	107.1 Å²	107.1	84%	0.838	68%	0.678	S	S	*	*			trans	-84.6	101.9	179	32.3	-29.3	0	0	0	111
445	S	33.2	Very low	39.2	Very low	119 Å²	119	112.3 Å²	112.3	83%	0.832	71%	0.71	S	S	*	*			trans	-81	129	166.6	67.4	0	0	0	0	111.1	D443	D443-S445 PolarHBondContact O-N 3.01Å
446	S	30.5	Very low	36.9	Very low	126 Å²	126	117.8 Å²	117.8	88%	0.881	75%	0.745	S	S	*	*			trans	-67.9	135.3	-173	53.3	0	0	0	0	115.5
447	G	31.7	Very low	35.2	Very low	77 Å²	77	120.7 Å²	120.7	79%	0.794	76%	0.761	S	S	*	*			trans	-159.2	127.1	162.1	0	0	0	0	0	110.1
448	V	30.8	Very low	33.9	Very low	148 Å²	148	118 Å²	118	90%	0.897	77%	0.765	S	S	*	*			trans	-101.7	128.6	-173.5	176.4	0	0	0	0	109.7
449	D	37.4	Very low	33.1	Very low	139 Å²	139	124.8 Å²	124.8	74%	0.743	79%	0.792	S	S	*	*			trans	-120.2	151.8	169.1	-110.8	-19.5	0	0	0	110.9	S451	D449-S451 VanDerWaalsContact C-N 3.3Å; D449-S451 PolarHBondContact O-N 3.16Å
450	P	33.6	Very low	33.4	Very low	133 Å²	133	121.9 Å²	121.9	86%	0.864	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	21.3	-157.3	31.5	-35	0	0	0	116.6
451	S	42.2	Very low	34.3	Very low	93 Å²	93	121.3 Å²	121.3	65%	0.65	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.6	7.1	-174.9	66	0	0	0	0	115.8	D449 T453	D449-S451 VanDerWaalsContact C-N 3.3Å; D449-S451 PolarHBondContact O-N 3.16Å; S451-T453 PolarHBondContact O-N 2.74Å; S451-T453 PolarHBondContact O-OG1 2.9Å; S451-T453 VanDerWaalsContact O-OG1 3.1Å
452	G	31.8	Very low	35.9	Very low	80 Å²	80	118.5 Å²	118.5	83%	0.825	74%	0.739	S	S	*	*			trans	64	13.3	164.6	0	0	0	0	0	117
453	T	30.7	Very low	37.9	Very low	109 Å²	109	116.2 Å²	116.2	67%	0.669	71%	0.71	S	S	*	*			trans	-118	110.9	-178	-38.8	0	0	0	0	110.5	S451 T455	S451-T453 PolarHBondContact O-N 2.74Å; S451-T453 PolarHBondContact O-OG1 2.9Å; S451-T453 VanDerWaalsContact O-OG1 3.1Å; T453-T455 PolarHBondContact O-N 3.42Å
454	F	26.2	Very low	40.4	Very low	207 Å²	207	110.6 Å²	110.6	91%	0.908	68%	0.68	S	S	*	*			trans	-72.9	111.2	174.1	-96.4	-92.2	0	0	0	110.3
455	T	26.5	Very low	42.8	Very low	117 Å²	117	104.5 Å²	104.5	72%	0.718	64%	0.64	S	S	*	*			trans	-127.5	109.9	163.2	45	0	0	0	0	109.7	T453	T453-T455 PolarHBondContact O-N 3.42Å
456	T	27.2	Very low	45.3	Very low	136 Å²	136	104.3 Å²	104.3	83%	0.834	63%	0.626	S	S	*	*			trans	-87.4	116.6	168.7	37.4	0	0	0	0	109.3
457	V	27.6	Very low	47.9	Very low	121 Å²	121	99 Å²	99	73%	0.733	59%	0.591	S	S	*	*			trans	-114.2	107.6	173.7	179.9	0	0	0	0	108.4
458	T	32	Very low	50.2	Low	129 Å²	129	98.9 Å²	98.9	79%	0.791	57%	0.571	S	S	*	*			trans	-89.5	109.9	166.4	40.9	0	0	0	0	109	T460	T458-T460 PolarHBondContact O-N 3.02Å
459	Q	37.4	Very low	52.4	Low	188 Å²	188	91.9 Å²	91.9	88%	0.879	53%	0.529	S	S	*	.			trans	-72.4	111	175	-76.6	-178.9	-13.5	0	0	110.5
460	T	50.1	Low	53.9	Low	66 Å²	66	86.4 Å²	86.4	41%	0.405	50%	0.502	S	S	.	.			trans	-95.8	115.2	173.7	2	0	0	0	0	109	T458 R462	T458-T460 PolarHBondContact O-N 3.02Å; T460-R462 PolarHBondContact O-N 3.02Å
461	T	58.9	Low	55.2	Low	65 Å²	65	84.6 Å²	84.6	40%	0.399	48%	0.484	S	S	.	.			trans	-72.7	117.1	175.5	-17.6	0	0	0	0	109.5	N408	N408-T461 PolarHBondContact ND2-OG1 3.43Å
462	R	67.7	Low	55.9	Low	76 Å²	76	84.8 Å²	84.8	29%	0.287	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	134.3	-179.9	-79.7	173	170	173.2	0.1	109.3	E415 T434 T460 P484	E415-R462 IonicContact OE1-CZ 2.91Å; E415-R462 IonicContact OE1-NE 2.93Å; E415-R462 PolarHBondContact OE1-NE 2.87Å; E415-R462 IonicContact OE1-NH2 2.88Å; E415-R462 PolarHBondContact OE1-NH2 2.77Å; E415-R462 IonicContact OE2-CZ 3.8Å; E415-R462 IonicContact OE2-NE 2.75Å; E415-R462 PolarHBondContact OE2-NE 3.27Å; T434-R462 HydrophobicContact CG2-CG 3.69Å; T460-R462 PolarHBondContact O-N 3.02Å; R462-P484 WeakPolarHBondContact O-CD 3.47Å
463	L	78.6	Confident	56.6	Low	23 Å²	23	89.2 Å²	89.2	12%	0.12	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	146.2	168	-64.3	174.8	0	0	0	109.8	V407 T432 V433 C481 D483	V407-L463 HydrophobicContact CG2-CD1 3.67Å; V407-L463 HydrophobicContact CG2-CG 4.14Å; T432-L463 WeakPolarHBondContact CA-O 3.31Å; V433-L463 HydrophobicContact CG2-CB 3.7Å; V433-L463 HydrophobicContact CG2-CD1 4.35Å; V433-L463 HydrophobicContact CG2-CG 4.49Å; V433-L463 PolarHBondContact N-O 3.48Å; V433-L463 PolarHBondContact O-N 2.94Å; L463-C481 HydrophobicContact CB-CB 4.44Å; L463-C481 HydrophobicContact CD1-CB 4.38Å; L463-D483 WeakPolarHBondContact CD2-OD1 3.46Å
464	I	80.5	Confident	57.4	Low	42 Å²	42	88 Å²	88	22%	0.215	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	126.9	170.9	-63.2	175.4	0	0	0	107.9	L430 T432 C481 E482 P484 F488	L430-I464 HydrophobicContact CD1-CG2 3.68Å; T432-I464 HydrophobicContact CG2-CG1 4.4Å; I464-C481 CarbonylContact O-C 3.53Å; I464-C481 VanDerWaalsContact O-CA 3.24Å; I464-C481 WeakPolarHBondContact O-CA 3.34Å; I464-E482 PolarHBondContact N-O 2.97Å; I464-E482 PolarHBondContact O-N 3.09Å; I464-P484 HydrophobicContact CD1-CB 4.2Å; I464-F488 HydrophobicContact CD1-CE1 4.19Å; I464-F488 HydrophobicContact CD1-CE2 3.96Å; I464-F488 HydrophobicContact CD1-CZ 3.31Å
465	C	84.5	Confident	58.9	Low	0 Å²	0	81.8 Å²	81.8	0%	0	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	132.4	-179	-60.9	0	0	0	0	110.9	L430 F431 I479 K480 C481	L430-C465 WeakPolarHBondContact CA-O 3.41Å; F431-C465 HydrophobicContact CD1-CB 4.05Å; F431-C465 WeakPolarHBondContact CD1-O 3.3Å; F431-C465 HydrophobicContact CD2-CB 3.92Å; F431-C465 HydrophobicContact CE1-CB 3.6Å; F431-C465 HydrophobicContact CE2-CB 3.46Å; F431-C465 VanDerWaalsContact CE2-CB 3.46Å; F431-C465 HydrophobicContact CG-CB 4.2Å; F431-C465 HydrophobicContact CZ-CB 3.29Å; F431-C465 PolarHBondContact N-O 2.79Å; F431-C465 PolarHBondContact O-N 3.43Å; C465-I479 HydrophobicContact CB-CG2 4.03Å; C465-K480 CarbonylContact C-O 3.53Å; C465-K480 VanDerWaalsContact CA-O 3.26Å; C465-K480 WeakPolarHBondContact CA-O 3.31Å; C465-C481 HydrophobicContact CB-CB 4.13Å; C465-C481 WeakPolarHBondContact CB-SG 3.42Å; C465-C481 WeakPolarHBondContact SG-CB 3.12Å; C465-C481 CovalentContact SG-SG 2.05Å; C465-C481 PolarHBondContact SG-SG 2.89Å
466	E	86.2	Confident	60.2	Low	116 Å²	116	82.8 Å²	82.8	54%	0.542	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	143.1	178.6	-174.2	-179.3	175.1	0	0	110	I429 L430 I479 K480	I429-E466 WeakPolarHBondContact O-CA 2.66Å; L430-E466 HydrophobicContact CD1-CB 3.94Å; L430-E466 HydrophobicContact CD1-CG 4.3Å; E466-I479 WeakPolarHBondContact O-CA 3.34Å; E466-K480 PolarHBondContact N-O 2.85Å; E466-K480 PolarHBondContact O-N 3.21Å
467	G	83.4	Confident	61.9	Low	13 Å²	13	77.6 Å²	77.6	13%	0.134	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.9	-178.8	175.4	0	0	0	0	0	114.9	I429 D478	I429-G467 VanDerWaalsContact CG1-O 3.31Å; I429-G467 WeakPolarHBondContact CG1-O 3.25Å; I429-G467 PolarHBondContact N-O 2.9Å; I429-G467 PolarHBondContact O-N 2.73Å; I429-G467 VanDerWaalsContact O-N 3.1Å; G467-D478 WeakPolarHBondContact CA-O 2.96Å
468	I	80.6	Confident	63.8	Low	75 Å²	75	77.6 Å²	77.6	39%	0.385	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	122.1	176	-56.9	175.9	0	0	0	109	D478	I468-D478 PolarHBondContact N-O 3.04Å
469	L	77.4	Confident	65.9	Low	2 Å²	2	72.7 Å²	72.7	1%	0.01	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	109.4	178.8	-171.3	81.2	0	0	0	110.1	I392 L399 I427 I429 L471	I392-L469 HydrophobicContact CG2-CD2 4.27Å; L399-L469 HydrophobicContact CD1-CD1 3.95Å; I427-L469 HydrophobicContact CB-CB 4.36Å; I427-L469 PolarHBondContact N-O 2.72Å; I427-L469 WeakPolarHBondContact O-CB 3.35Å; I427-L469 PolarHBondContact O-N 2.79Å; I429-L469 HydrophobicContact CD1-CB 3.87Å; I429-L469 HydrophobicContact CD1-CD1 4.27Å; I429-L469 HydrophobicContact CD1-CD2 4.48Å; I429-L469 HydrophobicContact CD1-CG 4.44Å; I429-L469 HydrophobicContact CG1-CB 4.22Å; I429-L469 HydrophobicContact CG2-CB 4.44Å; L469-L471 HydrophobicContact CD2-CD2 4.44Å
470	S	69.4	Low	68	Low	24 Å²	24	71.5 Å²	71.5	17%	0.168	40%	0.398	C	S	.	.			trans	-85.5	127.9	168	-169.6	0	0	0	0	110.3	V472 N477	S470-V472 PolarHBondContact O-N 2.92Å; S470-V472 PolarHBondContact OG-N 3.16Å; S470-N477 WeakPolarHBondContact CB-OD1 3.2Å; S470-N477 PolarHBondContact N-OD1 2.83Å
471	L	60.2	Low	69.6	Low	95 Å²	95	70.3 Å²	70.3	50%	0.497	39%	0.392	S	S	.	.			trans	-82.4	-0.7	175.1	-68	175.9	0	0	0	112.7	I427 L469	I427-L471 HydrophobicContact CD1-CD1 3.61Å; I427-L471 HydrophobicContact CD1-CD2 4.49Å; I427-L471 HydrophobicContact CD1-CG 3.92Å; L469-L471 HydrophobicContact CD2-CD2 4.44Å
472	V	57.3	Low	70.6	Confident	96 Å²	96	73.5 Å²	73.5	58%	0.582	40%	0.402	S	S	*	.	S	Bend	trans	-82.7	123	176.7	-176.8	0	0	0	0	109.3	S470 G474 V475	S470-V472 PolarHBondContact O-N 2.92Å; S470-V472 PolarHBondContact OG-N 3.16Å; V472-G474 PolarHBondContact O-N 3.11Å; V472-V475 HydrophobicContact CB-CG2 3.8Å; V472-V475 HydrophobicContact CG1-CG2 3.95Å; V472-V475 PolarHBondContact O-N 3.41Å
473	L	46.4	Very low	70.5	Confident	174 Å²	174	74.5 Å²	74.5	91%	0.911	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	123.1	175.7	-81.9	160	0	0	0	110.4
474	G	46.6	Very low	69.5	Low	84 Å²	84	76.4 Å²	76.4	87%	0.866	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	101	-1.2	175.7	0	0	0	0	0	116	V472	V472-G474 PolarHBondContact O-N 3.11Å
475	V	57.4	Low	67.8	Low	75 Å²	75	82.4 Å²	82.4	46%	0.455	45%	0.451	S	S	.	.			trans	-88.1	131.2	175.2	-174.2	0	0	0	0	110	V472 N477	V472-V475 HydrophobicContact CB-CG2 3.8Å; V472-V475 HydrophobicContact CG1-CG2 3.95Å; V472-V475 PolarHBondContact O-N 3.41Å; V475-N477 PolarHBondContact O-N 3.38Å
476	N	55.9	Low	65.4	Low	139 Å²	139	89.9 Å²	89.9	74%	0.743	49%	0.491	S	S	*	.			trans	-67.9	114.1	174.5	-86.6	-25.3	0	0	0	109.7
477	N	62.7	Low	62.9	Low	27 Å²	27	92 Å²	92	14%	0.144	51%	0.506	C	S	.	.			trans	-84.2	124.9	172.2	-65.7	-28.5	0	0	0	108.9	L399 K403 S470 V475	L399-N477 HydrophobicContact CD1-CB 3.39Å; K403-N477 WeakPolarHBondContact CE-O 3.3Å; K403-N477 PolarHBondContact NZ-O 3.06Å; S470-N477 WeakPolarHBondContact CB-OD1 3.2Å; S470-N477 PolarHBondContact N-OD1 2.83Å; V475-N477 PolarHBondContact O-N 3.38Å
478	D	67.1	Low	60.6	Low	120 Å²	120	96.4 Å²	96.4	64%	0.642	52%	0.522	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.6	112.1	176.5	-75	-26.9	0	0	0	109.4	G467 I468	G467-D478 WeakPolarHBondContact CA-O 2.96Å; I468-D478 PolarHBondContact N-O 3.04Å
479	I	75.7	Confident	58.5	Low	27 Å²	27	102.2 Å²	102.2	14%	0.138	55%	0.547	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	128.9	178.1	-56.3	-151.6	0	0	0	108.3	L399 I405 I429 F431 C465 E466	L399-I479 HydrophobicContact CD1-CD1 3.49Å; L399-I479 VanDerWaalsContact CD1-CD1 3.49Å; L399-I479 HydrophobicContact CD1-CG1 3.93Å; L399-I479 HydrophobicContact CD2-CB 4.2Å; L399-I479 HydrophobicContact CD2-CD1 3.4Å; L399-I479 HydrophobicContact CD2-CG1 3.83Å; L399-I479 HydrophobicContact CG-CD1 4.05Å; I405-I479 HydrophobicContact CD1-CG2 4.49Å; I429-I479 HydrophobicContact CD1-CD1 3.92Å; F431-I479 HydrophobicContact CE1-CD1 3.91Å; F431-I479 HydrophobicContact CE1-CG2 4.09Å; F431-I479 HydrophobicContact CZ-CD1 4.04Å; F431-I479 HydrophobicContact CZ-CG2 3.92Å; C465-I479 HydrophobicContact CB-CG2 4.03Å; E466-I479 WeakPolarHBondContact O-CA 3.34Å
480	K	82.5	Confident	56.6	Low	163 Å²	163	110.9 Å²	110.9	71%	0.709	59%	0.585	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-111.1	137	172.9	-67.4	-179.8	-178.8	176.8	0	108.7	C465 E466	C465-K480 CarbonylContact C-O 3.53Å; C465-K480 VanDerWaalsContact CA-O 3.26Å; C465-K480 WeakPolarHBondContact CA-O 3.31Å; E466-K480 PolarHBondContact N-O 2.85Å; E466-K480 PolarHBondContact O-N 3.21Å
481	C	82.6	Confident	54.7	Low	41 Å²	41	117.8 Å²	117.8	28%	0.277	61%	0.609	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-121.7	131.3	175.6	-58.6	0	0	0	0	109.2	L463 I464 C465	L463-C481 HydrophobicContact CB-CB 4.44Å; L463-C481 HydrophobicContact CD1-CB 4.38Å; I464-C481 CarbonylContact O-C 3.53Å; I464-C481 VanDerWaalsContact O-CA 3.24Å; I464-C481 WeakPolarHBondContact O-CA 3.34Å; C465-C481 HydrophobicContact CB-CB 4.13Å; C465-C481 WeakPolarHBondContact CB-SG 3.42Å; C465-C481 WeakPolarHBondContact SG-CB 3.12Å; C465-C481 CovalentContact SG-SG 2.05Å; C465-C481 PolarHBondContact SG-SG 2.89Å
482	E	79.1	Confident	53.5	Low	132 Å²	132	118.1 Å²	118.1	62%	0.617	62%	0.616	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-128.9	150.4	-178.7	-65.5	-174.6	-178.9	0	0	111	I464	I464-E482 PolarHBondContact N-O 2.97Å; I464-E482 PolarHBondContact O-N 3.09Å
483	D	65.6	Low	52.2	Low	96 Å²	96	119.4 Å²	119.4	51%	0.513	62%	0.619	S	S	.	*			trans	-63.6	140.6	168	-69.9	-51.6	0	0	0	109.2	L463 K485	L463-D483 WeakPolarHBondContact CD2-OD1 3.46Å; D483-K485 VanDerWaalsContact C-N 3.27Å; D483-K485 PolarHBondContact O-N 3.36Å
484	P	57.9	Low	51.5	Low	64 Å²	64	116.3 Å²	116.3	42%	0.416	61%	0.609	S	S	.	*			trans	-66.5	86.9	175.2	26	-31.9	0	0	0	109.6	R462 I464 F488	R462-P484 WeakPolarHBondContact O-CD 3.47Å; I464-P484 HydrophobicContact CD1-CB 4.2Å; P484-F488 HydrophobicContact CB-CE2 3.92Å
485	K	44.4	Very low	50.6	Low	168 Å²	168	116.4 Å²	116.4	73%	0.73	60%	0.597	S	S	*	*			trans	-73	139.8	176.6	-74.5	-179.2	179.1	173.8	0	110.7	D483 N487	D483-K485 VanDerWaalsContact C-N 3.27Å; D483-K485 PolarHBondContact O-N 3.36Å; K485-N487 PolarHBondContact O-N 3.49Å
486	D	35.1	Very low	49.3	Very low	157 Å²	157	121.7 Å²	121.7	84%	0.84	61%	0.614	S	S	*	*	S	Bend	trans	-40.5	101.7	178.7	-67.8	-45.7	0	0	0	113
487	N	34.3	Very low	47.9	Very low	159 Å²	159	118.1 Å²	118.1	85%	0.85	60%	0.603	S	S	*	*			trans	170.2	42.7	155.8	-85.6	-21.8	0	0	0	112.1	K485 E489	K485-N487 PolarHBondContact O-N 3.49Å; N487-E489 VanDerWaalsContact C-N 3.27Å; N487-E489 PolarHBondContact O-N 2.87Å
488	F	35.3	Very low	46.4	Very low	106 Å²	106	121.8 Å²	121.8	47%	0.465	63%	0.627	S	S	.	*			trans	-80.9	61.5	-179.4	-97.3	-88.3	0	0	0	112.9	I464 P484	I464-F488 HydrophobicContact CD1-CE1 4.19Å; I464-F488 HydrophobicContact CD1-CE2 3.96Å; I464-F488 HydrophobicContact CD1-CZ 3.31Å; P484-F488 HydrophobicContact CB-CE2 3.92Å
489	E	35.5	Very low	44.5	Very low	197 Å²	197	120.4 Å²	120.4	92%	0.921	62%	0.624	S	S	*	*			trans	-99.4	4.3	174.7	-146.7	167.9	-161.5	0	0	113.1	N487	N487-E489 VanDerWaalsContact C-N 3.27Å; N487-E489 PolarHBondContact O-N 2.87Å
490	K	37.2	Very low	42.5	Very low	184 Å²	184	126 Å²	126	80%	0.8	65%	0.654	S	S	*	*	S	Bend	trans	-114.4	-4.7	-176.1	-127.4	175.6	-175.5	178.2	0	116.7
491	Y	30.5	Very low	40.3	Very low	170 Å²	170	125 Å²	125	67%	0.667	65%	0.646	S	S	*	*	S	Bend	trans	-149.7	126.4	178.1	-66.7	-79.6	0	0	0	111.5	I493	Y491-I493 PolarHBondContact O-N 2.98Å
492	P	34.4	Very low	38.5	Very low	101 Å²	101	125.4 Å²	125.4	66%	0.656	65%	0.65	S	S	*	*			trans	-77.3	123.4	178.9	27.1	-25.7	0	0	0	111.2	T540	P492-T540 HydrophobicContact CG-CG2 3.96Å
493	I	30.2	Very low	36.7	Very low	123 Å²	123	125 Å²	125	63%	0.631	65%	0.651	S	S	*	*			trans	-64.2	125.6	174.8	-58.6	167.2	0	0	0	109.7	Y491 S495	Y491-I493 PolarHBondContact O-N 2.98Å; I493-S495 PolarHBondContact O-N 2.88Å
494	P	32.2	Very low	36	Very low	109 Å²	109	126.1 Å²	126.1	71%	0.708	65%	0.648	S	S	*	*			trans	-74.7	115	168.1	-7.1	23.6	0	0	0	109.4
495	S	27.8	Very low	35.9	Very low	87 Å²	87	129.8 Å²	129.8	61%	0.608	66%	0.659	S	S	*	*			trans	-66.9	146.8	162.8	54.3	0	0	0	0	110.3	I493	I493-S495 PolarHBondContact O-N 2.88Å
496	F	30.1	Very low	36.4	Very low	185 Å²	185	123.7 Å²	123.7	81%	0.811	64%	0.64	S	S	*	*			trans	96.6	101.1	171.3	-53.4	-71.5	0	0	0	117
497	A	26.2	Very low	37.7	Very low	64 Å²	64	119.1 Å²	119.1	53%	0.529	62%	0.618	S	S	.	*			trans	-58	136.2	151.1	0	0	0	0	0	109.7
498	T	30.6	Very low	39.4	Very low	105 Å²	105	113.9 Å²	113.9	64%	0.644	59%	0.588	S	S	*	*			trans	179.9	151.1	152.3	23	0	0	0	0	110.8
499	P	27.4	Very low	41.1	Very low	90 Å²	90	112 Å²	112	58%	0.584	58%	0.581	S	S	*	*			trans	-66.2	171.3	-164.1	28.7	-35.8	0	0	0	113.2	Y501 S502	P499-Y501 HydrophobicContact CG-CD2 4.39Å; P499-Y501 WeakPolarHBondContact O-CA 3.43Å; P499-Y501 PolarHBondContact O-N 3.19Å; P499-S502 PolarHBondContact O-N 3.31Å
500	I	34.2	Very low	43	Very low	146 Å²	146	105.8 Å²	105.8	75%	0.749	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-36.4	-14.8	-178.5	-61.3	168.6	0	0	0	116.4
501	Y	35.2	Very low	44.7	Very low	141 Å²	141	101.5 Å²	101.5	55%	0.553	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-26.7	171.7	-72.1	-92.5	0	0	0	115.4	H257 P499	H257-Y501 AromaticContact CE1-CE1 3.19Å; H257-Y501 WeakPolarHBondContact CE1-CE1 3.39Å; H257-Y501 AromaticContact CE1-CZ 3.55Å; H257-Y501 PolarHBondContact CE1-OH 3.3Å; H257-Y501 VanDerWaalsContact CE1-OH 3.27Å; H257-Y501 AromaticContact NE2-CE1 3.22Å; H257-Y501 WeakPolarHBondContact NE2-CE1 3.46Å; H257-Y501 AromaticContact NE2-CZ 3.59Å; H257-Y501 PolarHBondContact NE2-OH 3.23Å; H257-Y501 VanDerWaalsContact NE2-OH 3.08Å; P499-Y501 HydrophobicContact CG-CD2 4.39Å; P499-Y501 WeakPolarHBondContact O-CA 3.43Å; P499-Y501 PolarHBondContact O-N 3.19Å
502	S	45.5	Very low	46.9	Very low	50 Å²	50	100 Å²	100	35%	0.35	53%	0.532	S	S	.	.	H	α-helix	trans	-80.1	-21.6	-179.4	73	0	0	0	0	114	P499 R504 E505 A506	P499-S502 PolarHBondContact O-N 3.31Å; S502-R504 PolarHBondContact O-N 3.36Å; S502-E505 PolarHBondContact O-N 2.81Å; S502-A506 WeakPolarHBondContact O-CB 3.28Å; S502-A506 PolarHBondContact O-N 3.17Å
503	L	42.2	Very low	49.1	Very low	124 Å²	124	95.3 Å²	95.3	65%	0.649	50%	0.501	S	S	*	.	H	α-helix	trans	-60.7	-35.5	-178	-156.5	92	0	0	0	111.3	A506 V507	L503-A506 PolarHBondContact O-N 3.34Å; L503-V507 VanDerWaalsContact O-CB 3.31Å; L503-V507 WeakPolarHBondContact O-CB 3.43Å; L503-V507 WeakPolarHBondContact O-CG2 3.23Å; L503-V507 PolarHBondContact O-N 2.94Å
504	R	49.7	Very low	51.6	Low	119 Å²	119	90.7 Å²	90.7	45%	0.449	48%	0.479	S	S	.	.	H	α-helix	trans	-66.1	-45.7	177.7	-169.8	174.8	-161.9	-106.9	-2.2	112	S502 V507 E508	S502-R504 PolarHBondContact O-N 3.36Å; R504-V507 PolarHBondContact O-N 3.43Å; R504-E508 IonicContact CZ-OE1 3.48Å; R504-E508 IonicContact NE-OE1 3.65Å; R504-E508 IonicContact NH1-OE1 2.9Å; R504-E508 PolarHBondContact NH1-OE1 3.16Å; R504-E508 IonicContact NH2-OE1 3.66Å; R504-E508 WeakPolarHBondContact O-CB 3.26Å; R504-E508 WeakPolarHBondContact O-CG 3.42Å; R504-E508 PolarHBondContact O-N 3.33Å
505	E	55.1	Low	53.8	Low	140 Å²	140	87.6 Å²	87.6	65%	0.654	46%	0.462	S	S	*	.	H	α-helix	trans	-67.4	-39.1	177.3	-67.5	-173.1	166.5	0	0	111.5	S502 E508 Q509	S502-E505 PolarHBondContact O-N 2.81Å; E505-E508 PolarHBondContact O-N 3.43Å; E505-Q509 WeakPolarHBondContact O-CB 3.27Å; E505-Q509 PolarHBondContact O-N 3.1Å
506	A	56.5	Low	56.5	Low	40 Å²	40	85.8 Å²	85.8	33%	0.331	45%	0.449	S	S	.	.	H	α-helix	trans	-63.7	-43.3	175	0	0	0	0	0	111.7	S502 L503 Q509 I510	S502-A506 WeakPolarHBondContact O-CB 3.28Å; S502-A506 PolarHBondContact O-N 3.17Å; L503-A506 PolarHBondContact O-N 3.34Å; A506-Q509 PolarHBondContact O-N 3.03Å; A506-I510 WeakPolarHBondContact O-CB 3.41Å; A506-I510 VanDerWaalsContact O-CG1 3.23Å; A506-I510 WeakPolarHBondContact O-CG1 3.26Å; A506-I510 PolarHBondContact O-N 3.05Å
507	V	62.6	Low	59.2	Low	61 Å²	61	77 Å²	77	37%	0.37	41%	0.411	S	S	.	.	H	α-helix	trans	-66.6	-45.4	176	170.4	0	0	0	0	111	L503 R504 Q509 I510 I511	L503-V507 VanDerWaalsContact O-CB 3.31Å; L503-V507 WeakPolarHBondContact O-CB 3.43Å; L503-V507 WeakPolarHBondContact O-CG2 3.23Å; L503-V507 PolarHBondContact O-N 2.94Å; R504-V507 PolarHBondContact O-N 3.43Å; V507-Q509 VanDerWaalsContact C-N 3.29Å; V507-Q509 PolarHBondContact O-N 2.96Å; V507-I510 PolarHBondContact O-N 2.8Å; V507-I511 HydrophobicContact CG1-CD1 3.76Å; V507-I511 HydrophobicContact CG1-CG1 4.36Å; V507-I511 WeakPolarHBondContact O-CB 3.46Å; V507-I511 VanDerWaalsContact O-CG1 3.23Å; V507-I511 WeakPolarHBondContact O-CG1 3.43Å; V507-I511 PolarHBondContact O-N 2.92Å
508	E	68.1	Low	62.1	Low	49 Å²	49	79.6 Å²	79.6	23%	0.229	41%	0.41	C	S	.	.	H	α-helix	trans	-61	-38.9	175	-78.2	177.7	-171	0	0	111.7	R504 E505 I511 R512	R504-E508 IonicContact CZ-OE1 3.48Å; R504-E508 IonicContact NE-OE1 3.65Å; R504-E508 IonicContact NH1-OE1 2.9Å; R504-E508 PolarHBondContact NH1-OE1 3.16Å; R504-E508 IonicContact NH2-OE1 3.66Å; R504-E508 WeakPolarHBondContact O-CB 3.26Å; R504-E508 WeakPolarHBondContact O-CG 3.42Å; R504-E508 PolarHBondContact O-N 3.33Å; E505-E508 PolarHBondContact O-N 3.43Å; E508-I511 PolarHBondContact O-N 3.06Å; E508-R512 WeakPolarHBondContact O-CB 3.44Å; E508-R512 VanDerWaalsContact O-CG 3.29Å; E508-R512 WeakPolarHBondContact O-CG 3.15Å; E508-R512 PolarHBondContact O-N 2.71Å
509	Q	72.5	Confident	64.6	Low	67 Å²	67	83.6 Å²	83.6	31%	0.313	41%	0.413	S	S	.	.	H	α-helix	trans	-64.9	-45.5	174.6	-174.7	178.1	-1.9	0	0	111.6	E505 A506 V507 I511 R512 I513	E505-Q509 WeakPolarHBondContact O-CB 3.27Å; E505-Q509 PolarHBondContact O-N 3.1Å; A506-Q509 PolarHBondContact O-N 3.03Å; V507-Q509 VanDerWaalsContact C-N 3.29Å; V507-Q509 PolarHBondContact O-N 2.96Å; Q509-I511 VanDerWaalsContact C-N 3.35Å; Q509-I511 PolarHBondContact O-N 2.94Å; Q509-R512 PolarHBondContact O-N 3.38Å; Q509-I513 HydrophobicContact CG-CD1 3.87Å; Q509-I513 HydrophobicContact CG-CG1 4.48Å; Q509-I513 WeakPolarHBondContact O-CB 3.49Å; Q509-I513 VanDerWaalsContact O-CG1 3.26Å; Q509-I513 WeakPolarHBondContact O-CG1 3.42Å; Q509-I513 PolarHBondContact O-N 2.83Å
510	I	74	Confident	67.4	Low	67 Å²	67	79.4 Å²	79.4	34%	0.344	39%	0.386	S	S	.	.	H	α-helix	trans	-63	-40.3	176.4	-70.6	165.2	0	0	0	110.9	A506 V507 I513 T514	A506-I510 WeakPolarHBondContact O-CB 3.41Å; A506-I510 VanDerWaalsContact O-CG1 3.23Å; A506-I510 WeakPolarHBondContact O-CG1 3.26Å; A506-I510 PolarHBondContact O-N 3.05Å; V507-I510 PolarHBondContact O-N 2.8Å; I510-I513 PolarHBondContact O-N 2.9Å; I510-T514 VanDerWaalsContact O-CB 3.26Å; I510-T514 WeakPolarHBondContact O-CB 3.41Å; I510-T514 PolarHBondContact O-N 2.96Å; I510-T514 PolarHBondContact O-OG1 3.38Å
511	I	73	Confident	69.8	Low	93 Å²	93	72.8 Å²	72.8	48%	0.477	35%	0.352	S	S	.	.	H	α-helix	trans	-61.8	-46.6	175.4	-69.8	166	0	0	0	110.4	V507 E508 Q509 T514 A515	V507-I511 HydrophobicContact CG1-CD1 3.76Å; V507-I511 HydrophobicContact CG1-CG1 4.36Å; V507-I511 WeakPolarHBondContact O-CB 3.46Å; V507-I511 VanDerWaalsContact O-CG1 3.23Å; V507-I511 WeakPolarHBondContact O-CG1 3.43Å; V507-I511 PolarHBondContact O-N 2.92Å; E508-I511 PolarHBondContact O-N 3.06Å; Q509-I511 VanDerWaalsContact C-N 3.35Å; Q509-I511 PolarHBondContact O-N 2.94Å; I511-T514 PolarHBondContact O-N 3.32Å; I511-A515 WeakPolarHBondContact O-CB 3.4Å; I511-A515 PolarHBondContact O-N 2.8Å
512	R	76.8	Confident	72.1	Confident	139 Å²	139	70.8 Å²	70.8	53%	0.525	35%	0.354	S	S	.	.	H	α-helix	trans	-63.8	-41.7	177.5	-72.9	174.9	-175.6	169.4	5	112.3	E175 E508 Q509 S516	E175-R512 VanDerWaalsContact CD-NH2 3.31Å; E175-R512 IonicContact OE1-CZ 2.67Å; E175-R512 IonicContact OE1-NH2 3.14Å; E175-R512 PolarHBondContact OE1-NH2 3.46Å; E175-R512 IonicContact OE2-NH2 2.85Å; E175-R512 PolarHBondContact OE2-NH2 3.2Å; E508-R512 WeakPolarHBondContact O-CB 3.44Å; E508-R512 VanDerWaalsContact O-CG 3.29Å; E508-R512 WeakPolarHBondContact O-CG 3.15Å; E508-R512 PolarHBondContact O-N 2.71Å; Q509-R512 PolarHBondContact O-N 3.38Å; R512-S516 WeakPolarHBondContact O-CB 3.48Å; R512-S516 PolarHBondContact O-N 3.4Å; R512-S516 PolarHBondContact O-OG 2.92Å
513	I	82.1	Confident	73.7	Confident	3 Å²	3	72.3 Å²	72.3	2%	0.015	37%	0.365	C	S	.	.	H	α-helix	trans	-63.9	-47.8	175.5	-69.3	167.6	0	0	0	110	Q509 I510 A515 S516 I517 L538 H541 I548 I550 L590	Q509-I513 HydrophobicContact CG-CD1 3.87Å; Q509-I513 HydrophobicContact CG-CG1 4.48Å; Q509-I513 WeakPolarHBondContact O-CB 3.49Å; Q509-I513 VanDerWaalsContact O-CG1 3.26Å; Q509-I513 WeakPolarHBondContact O-CG1 3.42Å; Q509-I513 PolarHBondContact O-N 2.83Å; I510-I513 PolarHBondContact O-N 2.9Å; I513-A515 PolarHBondContact O-N 2.67Å; I513-S516 CarbonylContact O-C 3.45Å; I513-S516 WeakPolarHBondContact O-CA 3.47Å; I513-S516 WeakPolarHBondContact O-CB 3.35Å; I513-S516 PolarHBondContact O-N 2.81Å; I513-S516 VanDerWaalsContact O-N 3.08Å; I513-I517 HydrophobicContact CG2-CD1 3.75Å; I513-I517 HydrophobicContact CG2-CG1 4.36Å; I513-I517 WeakPolarHBondContact O-CG1 3.49Å; I513-I517 PolarHBondContact O-N 3.13Å; I513-L538 HydrophobicContact CG2-CD1 4.18Å; I513-L538 HydrophobicContact CG2-CD2 3.84Å; I513-H541 HydrophobicContact CD1-CB 3.98Å; I513-I548 HydrophobicContact CD1-CD1 4.4Å; I513-I548 HydrophobicContact CD1-CG2 4.04Å; I513-I548 HydrophobicContact CG1-CD1 4.16Å; I513-I548 HydrophobicContact CG1-CG2 4.47Å; I513-I550 HydrophobicContact CG2-CG2 3.97Å; I513-L590 HydrophobicContact CG2-CD1 4.21Å
514	T	82.3	Confident	75.5	Confident	26 Å²	26	71.1 Å²	71.1	16%	0.16	36%	0.356	C	S	.	.	H	α-helix	trans	-62.3	-43	-179.7	-58.2	0	0	0	0	112	I510 I511 S516 I517 K518 F535	I510-T514 VanDerWaalsContact O-CB 3.26Å; I510-T514 WeakPolarHBondContact O-CB 3.41Å; I510-T514 PolarHBondContact O-N 2.96Å; I510-T514 PolarHBondContact O-OG1 3.38Å; I511-T514 PolarHBondContact O-N 3.32Å; T514-S516 VanDerWaalsContact C-N 3.29Å; T514-S516 PolarHBondContact O-N 3.45Å; T514-I517 PolarHBondContact O-N 2.83Å; T514-K518 WeakPolarHBondContact O-CG 3.35Å; T514-K518 PolarHBondContact O-N 3.3Å; T514-F535 HydrophobicContact CG2-CD1 4.12Å; T514-F535 HydrophobicContact CG2-CE1 3.57Å; T514-F535 HydrophobicContact CG2-CZ 3.9Å
515	A	78.8	Confident	77.1	Confident	43 Å²	43	67.5 Å²	67.5	36%	0.355	36%	0.356	S	S	.	.	H	α-helix	trans	-62.3	-37.6	174	0	0	0	0	0	111.9	I511 I513 R519	I511-A515 WeakPolarHBondContact O-CB 3.4Å; I511-A515 PolarHBondContact O-N 2.8Å; I513-A515 PolarHBondContact O-N 2.67Å; A515-R519 WeakPolarHBondContact O-CG 3.41Å; A515-R519 PolarHBondContact O-N 2.87Å; A515-R519 VanDerWaalsContact O-N 3.14Å
516	S	84	Confident	78.4	Confident	49 Å²	49	61.7 Å²	61.7	34%	0.343	33%	0.329	S	S	.	.	H	α-helix	trans	-67.8	-40.1	175.9	-57.2	0	0	0	0	111.9	R512 I513 T514 R519 L520	R512-S516 WeakPolarHBondContact O-CB 3.48Å; R512-S516 PolarHBondContact O-N 3.4Å; R512-S516 PolarHBondContact O-OG 2.92Å; I513-S516 CarbonylContact O-C 3.45Å; I513-S516 WeakPolarHBondContact O-CA 3.47Å; I513-S516 WeakPolarHBondContact O-CB 3.35Å; I513-S516 PolarHBondContact O-N 2.81Å; I513-S516 VanDerWaalsContact O-N 3.08Å; T514-S516 VanDerWaalsContact C-N 3.29Å; T514-S516 PolarHBondContact O-N 3.45Å; S516-R519 PolarHBondContact O-N 2.95Å; S516-L520 WeakPolarHBondContact O-CB 3.28Å; S516-L520 PolarHBondContact O-N 3.23Å
517	I	86.9	Confident	79.7	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-65.2	-44.9	175.4	-68.2	168.5	0	0	0	111.3	I513 T514 R519 L520 I521 F535 L538 I550 F552 L590	I513-I517 HydrophobicContact CG2-CD1 3.75Å; I513-I517 HydrophobicContact CG2-CG1 4.36Å; I513-I517 WeakPolarHBondContact O-CG1 3.49Å; I513-I517 PolarHBondContact O-N 3.13Å; T514-I517 PolarHBondContact O-N 2.83Å; I517-R519 VanDerWaalsContact C-N 3.29Å; I517-R519 PolarHBondContact O-N 3.47Å; I517-L520 WeakPolarHBondContact O-CA 3.44Å; I517-L520 WeakPolarHBondContact O-CB 3.4Å; I517-L520 PolarHBondContact O-N 2.93Å; I517-I521 HydrophobicContact CG2-CD1 4.02Å; I517-I521 HydrophobicContact CG2-CG1 4.43Å; I517-I521 WeakPolarHBondContact O-CG1 3.33Å; I517-I521 PolarHBondContact O-N 2.62Å; I517-F535 HydrophobicContact CB-CD2 4.41Å; I517-F535 HydrophobicContact CB-CE2 4.38Å; I517-F535 HydrophobicContact CD1-CE2 4.21Å; I517-F535 HydrophobicContact CG2-CD2 3.51Å; I517-F535 HydrophobicContact CG2-CE2 3.78Å; I517-L538 HydrophobicContact CD1-CD1 3.63Å; I517-I550 HydrophobicContact CD1-CD1 3.84Å; I517-I550 HydrophobicContact CG1-CD1 3.61Å; I517-F552 HydrophobicContact CD1-CB 4.34Å; I517-F552 HydrophobicContact CD1-CD1 4.07Å; I517-F552 HydrophobicContact CD1-CG 4.23Å; I517-F552 HydrophobicContact CG1-CD1 4.41Å; I517-F552 HydrophobicContact CG1-CE1 4.49Å; I517-F552 HydrophobicContact CG2-CD1 4.19Å; I517-F552 HydrophobicContact CG2-CD2 3.67Å; I517-F552 HydrophobicContact CG2-CE1 4.11Å; I517-F552 HydrophobicContact CG2-CE2 3.56Å; I517-F552 HydrophobicContact CG2-CG 3.97Å; I517-F552 HydrophobicContact CG2-CZ 3.79Å; I517-L590 HydrophobicContact CG1-CD1 4.45Å
518	K	86.4	Confident	80.5	Confident	119 Å²	119	60.5 Å²	60.5	52%	0.517	32%	0.318	S	S	.	.	H	α-helix	trans	-59.1	-40	176.3	-73.7	179.7	178.9	-178.6	0	111.9	T514 V522 F535	T514-K518 WeakPolarHBondContact O-CG 3.35Å; T514-K518 PolarHBondContact O-N 3.3Å; K518-V522 WeakPolarHBondContact O-CG2 3.42Å; K518-V522 PolarHBondContact O-N 3.47Å; K518-F535 HydrophobicContact CG-CB 4.15Å; K518-F535 HydrophobicContact CG-CG 4.43Å
519	R	83.3	Confident	80.8	Confident	190 Å²	190	62.5 Å²	62.5	72%	0.717	33%	0.33	S	S	*	.	H	α-helix	trans	-66.3	-39.3	172.8	-72.4	179.1	-172.3	168.6	2.7	112.2	A515 S516 I517 V522 S523	A515-R519 WeakPolarHBondContact O-CG 3.41Å; A515-R519 PolarHBondContact O-N 2.87Å; A515-R519 VanDerWaalsContact O-N 3.14Å; S516-R519 PolarHBondContact O-N 2.95Å; I517-R519 VanDerWaalsContact C-N 3.29Å; I517-R519 PolarHBondContact O-N 3.47Å; R519-V522 PolarHBondContact O-N 3.1Å; R519-S523 WeakPolarHBondContact O-CB 3.42Å; R519-S523 PolarHBondContact O-N 3.38Å; R519-S523 PolarHBondContact O-OG 2.88Å
520	L	85.4	Confident	81	Confident	2 Å²	2	62.4 Å²	62.4	1%	0.01	35%	0.348	C	S	.	.	H	α-helix	trans	-63.7	-42.6	178.8	-172.6	146.6	0	0	0	112.2	S516 I517 V522 S523 E524 I526 L590 N598 V600	S516-L520 WeakPolarHBondContact O-CB 3.28Å; S516-L520 PolarHBondContact O-N 3.23Å; I517-L520 WeakPolarHBondContact O-CA 3.44Å; I517-L520 WeakPolarHBondContact O-CB 3.4Å; I517-L520 PolarHBondContact O-N 2.93Å; L520-V522 VanDerWaalsContact C-N 3.26Å; L520-V522 PolarHBondContact O-N 2.84Å; L520-S523 WeakPolarHBondContact CA-OG 3.05Å; L520-S523 PolarHBondContact O-N 3.46Å; L520-S523 PolarHBondContact O-OG 3.5Å; L520-E524 HydrophobicContact CD2-CB 4.49Å; L520-E524 HydrophobicContact CD2-CG 4.03Å; L520-E524 HydrophobicContact CG-CG 3.98Å; L520-E524 WeakPolarHBondContact O-CB 3.29Å; L520-E524 PolarHBondContact O-N 2.89Å; L520-I526 HydrophobicContact CD2-CD1 3.73Å; L520-L590 HydrophobicContact CD1-CD2 3.77Å; L520-N598 HydrophobicContact CD1-CB 3.4Å; L520-V600 HydrophobicContact CD1-CB 4.48Å; L520-V600 HydrophobicContact CD1-CG2 3.51Å; L520-V600 HydrophobicContact CD2-CB 3.87Å; L520-V600 HydrophobicContact CD2-CG1 4.32Å; L520-V600 HydrophobicContact CD2-CG2 3.65Å; L520-V600 HydrophobicContact CG-CG2 4.25Å
521	I	85.5	Confident	81.1	Confident	6 Å²	6	62.1 Å²	62.1	3%	0.031	35%	0.345	C	S	.	.	H	α-helix	trans	-57	-43.1	175.3	-69.9	165.5	0	0	0	110.7	I517 G525 I526 L532 A533 F535 F552 V554	I517-I521 HydrophobicContact CG2-CD1 4.02Å; I517-I521 HydrophobicContact CG2-CG1 4.43Å; I517-I521 WeakPolarHBondContact O-CG1 3.33Å; I517-I521 PolarHBondContact O-N 2.62Å; I521-G525 PolarHBondContact O-N 3.24Å; I521-I526 HydrophobicContact CG1-CD1 4.13Å; I521-I526 HydrophobicContact CG2-CB 4.31Å; I521-I526 PolarHBondContact O-N 3.22Å; I521-I526 VanDerWaalsContact O-N 3.12Å; I521-L532 HydrophobicContact CG2-CD1 4.1Å; I521-L532 HydrophobicContact CG2-CG 4.34Å; I521-A533 VanDerWaalsContact CG2-O 3.29Å; I521-A533 WeakPolarHBondContact CG2-O 3.18Å; I521-F535 HydrophobicContact CD1-CB 3.75Å; I521-F535 HydrophobicContact CD1-CD2 4.4Å; I521-F552 HydrophobicContact CD1-CE2 4.21Å; I521-F552 HydrophobicContact CG1-CE2 4.26Å; I521-V554 HydrophobicContact CD1-CG1 3.75Å; I521-V554 HydrophobicContact CG1-CG1 4.32Å
522	V	83	Confident	81.7	Confident	99 Å²	99	61.9 Å²	61.9	60%	0.6	34%	0.344	S	S	*	.	H	α-helix	trans	-70	-42.1	177.3	179.4	0	0	0	0	111.7	K518 R519 L520 L532	K518-V522 WeakPolarHBondContact O-CG2 3.42Å; K518-V522 PolarHBondContact O-N 3.47Å; R519-V522 PolarHBondContact O-N 3.1Å; L520-V522 VanDerWaalsContact C-N 3.26Å; L520-V522 PolarHBondContact O-N 2.84Å; V522-L532 HydrophobicContact CG2-CD2 4.21Å
523	S	79.1	Confident	82.1	Confident	83 Å²	83	55.5 Å²	55.5	58%	0.58	32%	0.321	S	S	*	.	H	α-helix	trans	-76.8	-35.8	-174.9	66.8	0	0	0	0	114.2	R519 L520	R519-S523 WeakPolarHBondContact O-CB 3.42Å; R519-S523 PolarHBondContact O-N 3.38Å; R519-S523 PolarHBondContact O-OG 2.88Å; L520-S523 WeakPolarHBondContact CA-OG 3.05Å; L520-S523 PolarHBondContact O-N 3.46Å; L520-S523 PolarHBondContact O-OG 3.5Å
524	E	80.8	Confident	82.2	Confident	98 Å²	98	59.9 Å²	59.9	46%	0.458	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-3.8	178.7	-62.4	-61.8	140.2	0	0	112.4	L520 I526	L520-E524 HydrophobicContact CD2-CB 4.49Å; L520-E524 HydrophobicContact CD2-CG 4.03Å; L520-E524 HydrophobicContact CG-CG 3.98Å; L520-E524 WeakPolarHBondContact O-CB 3.29Å; L520-E524 PolarHBondContact O-N 2.89Å; E524-I526 HydrophobicContact CB-CG1 4.19Å; E524-I526 PolarHBondContact O-N 3.18Å
525	G	82.7	Confident	82.5	Confident	43 Å²	43	60.2 Å²	60.2	44%	0.443	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.1	40.6	179.1	0	0	0	0	0	113.2	I521 T527	I521-G525 PolarHBondContact O-N 3.24Å; G525-T527 PolarHBondContact O-N 2.74Å; G525-T527 VanDerWaalsContact O-N 3.15Å
526	I	83.3	Confident	82.7	Confident	19 Å²	19	61.8 Å²	61.8	10%	0.097	34%	0.337	C	S	.	.			trans	-67.9	114.7	179.4	-58.7	176.3	0	0	0	108.5	L520 I521 E524 A533 F552 V554	L520-I526 HydrophobicContact CD2-CD1 3.73Å; I521-I526 HydrophobicContact CG1-CD1 4.13Å; I521-I526 HydrophobicContact CG2-CB 4.31Å; I521-I526 PolarHBondContact O-N 3.22Å; I521-I526 VanDerWaalsContact O-N 3.12Å; E524-I526 HydrophobicContact CB-CG1 4.19Å; E524-I526 PolarHBondContact O-N 3.18Å; I526-A533 HydrophobicContact CG2-CB 4.02Å; I526-A533 WeakPolarHBondContact O-CB 3.34Å; I526-A533 PolarHBondContact O-N 2.86Å; I526-F552 HydrophobicContact CD1-CZ 4.49Å; I526-V554 HydrophobicContact CG2-CG2 4.23Å
527	T	84	Confident	82.7	Confident	72 Å²	72	62.6 Å²	62.6	44%	0.442	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	142.4	179.4	61	0	0	0	0	112.8	G525 Q531	G525-T527 PolarHBondContact O-N 2.74Å; G525-T527 VanDerWaalsContact O-N 3.15Å; T527-Q531 CarbonylContact C-O 3.52Å; T527-Q531 WeakPolarHBondContact CA-O 3.37Å; T527-Q531 VanDerWaalsContact CB-O 3.24Å; T527-Q531 WeakPolarHBondContact CB-O 3.46Å
528	V	78.7	Confident	82.6	Confident	3 Å²	3	64 Å²	64	2%	0.018	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	125.8	163.8	178.1	0	0	0	0	106.8	G530 Q531 A533 V554 D556 K582 L584	V528-G530 PolarHBondContact O-N 3.38Å; V528-G530 VanDerWaalsContact O-N 3.14Å; V528-Q531 PolarHBondContact N-O 3.29Å; V528-Q531 PolarHBondContact O-N 3.11Å; V528-A533 HydrophobicContact CB-CB 4.45Å; V528-A533 HydrophobicContact CG2-CB 3.69Å; V528-V554 HydrophobicContact CG2-CG2 4.09Å; V528-D556 HydrophobicContact CB-CB 4.42Å; V528-D556 HydrophobicContact CG1-CB 3.82Å; V528-K582 HydrophobicContact CG1-CB 3.88Å; V528-L584 HydrophobicContact CG2-CD1 3.5Å; V528-L584 HydrophobicContact CG2-CG 3.97Å
529	N	75.3	Confident	82.3	Confident	91 Å²	91	62.4 Å²	62.4	49%	0.487	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.2	36.4	-177.8	-61.5	-34.6	0	0	0	114.4	Q531 D556 K582	N529-Q531 PolarHBondContact O-N 3.18Å; N529-D556 PolarHBondContact ND2-OD2 2.74Å; N529-K582 VanDerWaalsContact OD1-CD 3.3Å; N529-K582 WeakPolarHBondContact OD1-CD 3.29Å; N529-K582 WeakPolarHBondContact OD1-CE 3.29Å
530	G	74.7	Confident	82.3	Confident	66 Å²	66	55.7 Å²	55.7	68%	0.68	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	76	2.2	-179.9	0	0	0	0	0	115.5	V528	V528-G530 PolarHBondContact O-N 3.38Å; V528-G530 VanDerWaalsContact O-N 3.14Å
531	Q	78	Confident	82.1	Confident	60 Å²	60	59 Å²	59	28%	0.28	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	146.2	170.7	-73.9	177.5	50.7	0	0	110.8	T527 V528 N529 A533 P557	T527-Q531 CarbonylContact C-O 3.52Å; T527-Q531 WeakPolarHBondContact CA-O 3.37Å; T527-Q531 VanDerWaalsContact CB-O 3.24Å; T527-Q531 WeakPolarHBondContact CB-O 3.46Å; V528-Q531 PolarHBondContact N-O 3.29Å; V528-Q531 PolarHBondContact O-N 3.11Å; N529-Q531 PolarHBondContact O-N 3.18Å; Q531-A533 PolarHBondContact O-N 3.36Å; Q531-A533 VanDerWaalsContact O-N 3.1Å; Q531-P557 HydrophobicContact CB-CG 4.07Å
532	L	84	Confident	81.8	Confident	88 Å²	88	65.2 Å²	65.2	46%	0.461	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.7	120	175.7	-173.2	70.4	0	0	0	109.6	I521 V522	I521-L532 HydrophobicContact CG2-CD1 4.1Å; I521-L532 HydrophobicContact CG2-CG 4.34Å; V522-L532 HydrophobicContact CG2-CD2 4.21Å
533	A	85.5	Confident	81.4	Confident	6 Å²	6	67.6 Å²	67.6	5%	0.05	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-64.6	144.1	-172.7	0	0	0	0	0	110.8	I521 I526 V528 Q531 V554	I521-A533 VanDerWaalsContact CG2-O 3.29Å; I521-A533 WeakPolarHBondContact CG2-O 3.18Å; I526-A533 HydrophobicContact CG2-CB 4.02Å; I526-A533 WeakPolarHBondContact O-CB 3.34Å; I526-A533 PolarHBondContact O-N 2.86Å; V528-A533 HydrophobicContact CB-CB 4.45Å; V528-A533 HydrophobicContact CG2-CB 3.69Å; Q531-A533 PolarHBondContact O-N 3.36Å; Q531-A533 VanDerWaalsContact O-N 3.1Å; A533-V554 HydrophobicContact CB-CB 3.73Å; A533-V554 HydrophobicContact CB-CG1 4.38Å; A533-V554 HydrophobicContact CB-CG2 3.67Å
534	R	85.4	Confident	81.1	Confident	94 Å²	94	65.7 Å²	65.7	36%	0.355	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	128.4	173.1	-167.8	176.4	87.5	177.3	6	109.1	E536 V554 I555 P557 D560	R534-E536 PolarHBondContact O-N 2.94Å; R534-V554 CarbonylContact O-C 3.46Å; R534-V554 VanDerWaalsContact O-CA 3.22Å; R534-V554 WeakPolarHBondContact O-CA 3.45Å; R534-V554 WeakPolarHBondContact O-CB 3.33Å; R534-I555 HydrophobicContact CB-CG1 4.21Å; R534-I555 PolarHBondContact N-O 2.85Å; R534-I555 PolarHBondContact O-N 2.94Å; R534-P557 HydrophobicContact CB-CB 4.34Å; R534-D560 IonicContact CZ-OD1 2.82Å; R534-D560 IonicContact CZ-OD2 3.66Å; R534-D560 VanDerWaalsContact NH1-CG 3.29Å; R534-D560 IonicContact NH1-OD1 3.62Å; R534-D560 IonicContact NH1-OD2 3.85Å; R534-D560 PolarHBondContact NH1-OD2 2.89Å; R534-D560 IonicContact NH2-OD1 3.53Å; R534-D560 PolarHBondContact NH2-OD1 2.96Å; R534-D560 IonicContact NH2-OD2 3.17Å; R534-D560 PolarHBondContact NH2-OD2 3.43Å
535	F	87.5	Confident	80.6	Confident	34 Å²	34	71.3 Å²	71.3	15%	0.149	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	123.1	167.9	175.5	-98.9	0	0	0	109.8	T514 I517 K518 I521 L538 F552	T514-F535 HydrophobicContact CG2-CD1 4.12Å; T514-F535 HydrophobicContact CG2-CE1 3.57Å; T514-F535 HydrophobicContact CG2-CZ 3.9Å; I517-F535 HydrophobicContact CB-CD2 4.41Å; I517-F535 HydrophobicContact CB-CE2 4.38Å; I517-F535 HydrophobicContact CD1-CE2 4.21Å; I517-F535 HydrophobicContact CG2-CD2 3.51Å; I517-F535 HydrophobicContact CG2-CE2 3.78Å; K518-F535 HydrophobicContact CG-CB 4.15Å; K518-F535 HydrophobicContact CG-CG 4.43Å; I521-F535 HydrophobicContact CD1-CB 3.75Å; I521-F535 HydrophobicContact CD1-CD2 4.4Å; F535-L538 HydrophobicContact CE2-CB 4.49Å; F535-L538 HydrophobicContact CZ-CB 4.06Å; F535-F552 HydrophobicContact CD2-CD2 4.13Å; F535-F552 HydrophobicContact CE2-CB 4.02Å; F535-F552 HydrophobicContact CE2-CD2 4.33Å; F535-F552 HydrophobicContact CE2-CG 4.45Å
536	E	83.9	Confident	79.8	Confident	75 Å²	75	72.9 Å²	72.9	35%	0.35	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	-66.8	177.9	-174.4	-170.7	179.7	0	0	110.1	R534 T553 I555 K583	R534-E536 PolarHBondContact O-N 2.94Å; E536-T553 WeakPolarHBondContact CB-O 3.16Å; E536-T553 PolarHBondContact N-O 2.99Å; E536-T553 WeakPolarHBondContact OE2-CB 3.3Å; E536-T553 PolarHBondContact OE2-OG1 2.78Å; E536-I555 HydrophobicContact CB-CD1 4.39Å; E536-I555 HydrophobicContact CB-CG1 4.2Å; E536-I555 HydrophobicContact CB-CG2 4.09Å; E536-I555 HydrophobicContact CG-CD1 4.27Å; E536-I555 HydrophobicContact CG-CG2 4.12Å; E536-I555 WeakPolarHBondContact OE2-CG2 3.37Å; E536-K583 IonicContact OE1-NZ 2.69Å; E536-K583 PolarHBondContact OE1-NZ 2.86Å; E536-K583 VanDerWaalsContact OE2-CD 3.3Å; E536-K583 WeakPolarHBondContact OE2-CD 3.38Å; E536-K583 WeakPolarHBondContact OE2-CE 3.49Å; E536-K583 IonicContact OE2-NZ 2.83Å; E536-K583 PolarHBondContact OE2-NZ 3.47Å
537	T	82.9	Confident	79.6	Confident	67 Å²	67	72 Å²	72	41%	0.411	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	152.5	-179.6	-169.9	0	0	0	0	113.3	F552 T553	T537-F552 CarbonylContact O-C 3.51Å; T537-F552 VanDerWaalsContact O-CA 3.27Å; T537-F552 WeakPolarHBondContact O-CA 3.33Å; T537-F552 VanDerWaalsContact O-CB 3.3Å; T537-F552 WeakPolarHBondContact O-CB 3.39Å; T537-T553 WeakPolarHBondContact CG2-OG1 3.43Å; T537-T553 PolarHBondContact O-N 3.42Å; T537-T553 PolarHBondContact O-OG1 2.85Å
538	L	84.3	Confident	79.5	Confident	29 Å²	29	69.5 Å²	69.5	15%	0.152	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	117	170	177.7	68.2	0	0	0	108.2	I513 I517 F535 H541 I550 F552	I513-L538 HydrophobicContact CG2-CD1 4.18Å; I513-L538 HydrophobicContact CG2-CD2 3.84Å; I517-L538 HydrophobicContact CD1-CD1 3.63Å; F535-L538 HydrophobicContact CE2-CB 4.49Å; F535-L538 HydrophobicContact CZ-CB 4.06Å; L538-H541 HydrophobicContact CD2-CB 4.45Å; L538-I550 HydrophobicContact CD1-CB 4.38Å; L538-I550 HydrophobicContact CD1-CG2 4.42Å; L538-F552 HydrophobicContact CD1-CB 4.3Å
539	I	81.9	Confident	79.8	Confident	85 Å²	85	73.8 Å²	73.8	44%	0.436	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	-52.9	-178	-63.9	165.7	0	0	0	110.7	V551 T553 I585	I539-V551 WeakPolarHBondContact CA-O 3.42Å; I539-V551 HydrophobicContact CB-CB 4.23Å; I539-V551 HydrophobicContact CB-CG1 4.04Å; I539-V551 WeakPolarHBondContact CB-O 3.38Å; I539-V551 HydrophobicContact CD1-CG1 3.9Å; I539-V551 HydrophobicContact CG2-CG1 4.35Å; I539-V551 PolarHBondContact N-O 3.48Å; I539-T553 HydrophobicContact CD1-CG2 3.58Å; I539-T553 HydrophobicContact CG1-CG2 4.41Å; I539-I585 HydrophobicContact CD1-CD1 3.94Å; I539-I585 HydrophobicContact CD1-CG1 4.14Å
540	T	82	Confident	80.4	Confident	50 Å²	50	69.5 Å²	69.5	31%	0.307	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	155.6	177.9	59.1	0	0	0	0	111.4	P492 I550 V551	P492-T540 HydrophobicContact CG-CG2 3.96Å; T540-I550 WeakPolarHBondContact O-CA 3.33Å; T540-V551 PolarHBondContact N-O 3.16Å; T540-V551 VanDerWaalsContact N-O 3.14Å; T540-V551 PolarHBondContact O-N 3.27Å; T540-V551 WeakPolarHBondContact OG1-CB 3.49Å; T540-V551 VanDerWaalsContact OG1-CG2 3.32Å; T540-V551 WeakPolarHBondContact OG1-CG2 3.29Å
541	H	82.5	Confident	81	Confident	71 Å²	71	67.5 Å²	67.5	33%	0.329	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	141.6	167.2	68.5	-79.2	0	0	0	110.4	I513 L538 I548 E549 I550	I513-H541 HydrophobicContact CD1-CB 3.98Å; L538-H541 HydrophobicContact CD2-CB 4.45Å; H541-I548 HydrophobicContact CB-CG2 4.28Å; H541-E549 CarbonylContact C-O 3.58Å; H541-E549 VanDerWaalsContact CA-O 3.23Å; H541-E549 WeakPolarHBondContact CA-O 3.49Å; H541-I550 HydrophobicContact CB-CG2 4.2Å
542	K	78.7	Confident	81.5	Confident	136 Å²	136	64.6 Å²	64.6	59%	0.591	32%	0.321	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138	122.8	176.6	-175.6	179.8	-180	-178.9	0	109.6	T544 I548 E549	K542-T544 PolarHBondContact O-N 3.2Å; K542-I548 CarbonylContact O-C 3.44Å; K542-E549 HydrophobicContact CB-CB 4.37Å; K542-E549 PolarHBondContact N-O 3.28Å; K542-E549 PolarHBondContact O-N 2.93Å
543	K	74.9	Confident	81.6	Confident	150 Å²	150	60.6 Å²	60.6	65%	0.652	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.4	123.7	173.7	-166.7	175.8	-178.3	-179.9	0	108.8
544	T	72.1	Confident	81.7	Confident	43 Å²	43	60.3 Å²	60.3	26%	0.264	30%	0.297	S	S	.	.			trans	-113.9	174.1	176.9	67.8	0	0	0	0	110.1	K542 S546 G547 E549	K542-T544 PolarHBondContact O-N 3.2Å; T544-S546 PolarHBondContact O-N 3.28Å; T544-S546 PolarHBondContact OG1-N 2.9Å; T544-S546 PolarHBondContact OG1-OG 2.98Å; T544-G547 PolarHBondContact N-O 3.3Å; T544-G547 PolarHBondContact OG1-N 2.88Å; T544-G547 VanDerWaalsContact OG1-N 3.16Å; T544-G547 PolarHBondContact OG1-O 3.09Å; T544-E549 HydrophobicContact CG2-CB 4.22Å
545	Q	69.9	Low	81.6	Confident	215 Å²	215	56.6 Å²	56.6	100%	1.005	28%	0.284	S	S	*	.	S	Bend	trans	-64.3	-26.5	173.4	-71.5	-176.5	-2.3	0	0	112.7
546	S	67	Low	81.2	Confident	77 Å²	77	55.8 Å²	55.8	54%	0.538	28%	0.281	S	S	.	.	S	Bend	trans	-97.1	-15.6	-175.3	53.4	0	0	0	0	114.5	T544	T544-S546 PolarHBondContact O-N 3.28Å; T544-S546 PolarHBondContact OG1-N 2.9Å; T544-S546 PolarHBondContact OG1-OG 2.98Å
547	G	77.9	Confident	80.6	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.28	C	S	.	.	S	Bend	trans	167.1	-151	-176.5	0	0	0	0	0	113.1	T544 L590	T544-G547 PolarHBondContact N-O 3.3Å; T544-G547 PolarHBondContact OG1-N 2.88Å; T544-G547 VanDerWaalsContact OG1-N 3.16Å; T544-G547 PolarHBondContact OG1-O 3.09Å; G547-L590 CarbonylContact C-O 3.51Å; G547-L590 VanDerWaalsContact CA-O 3.23Å; G547-L590 WeakPolarHBondContact CA-O 3.09Å
548	I	83.1	Confident	79.9	Confident	19 Å²	19	59.1 Å²	59.1	10%	0.097	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	110.6	172.4	-52.6	174.3	0	0	0	107.4	I513 H541 K542 I550 I589 L590 L592	I513-I548 HydrophobicContact CD1-CD1 4.4Å; I513-I548 HydrophobicContact CD1-CG2 4.04Å; I513-I548 HydrophobicContact CG1-CD1 4.16Å; I513-I548 HydrophobicContact CG1-CG2 4.47Å; H541-I548 HydrophobicContact CB-CG2 4.28Å; K542-I548 CarbonylContact O-C 3.44Å; I548-I550 HydrophobicContact CG2-CG2 3.93Å; I548-I589 WeakPolarHBondContact O-CA 3.31Å; I548-L590 HydrophobicContact CB-CB 4.3Å; I548-L590 PolarHBondContact N-O 3Å; I548-L590 PolarHBondContact O-N 3Å; I548-L592 HydrophobicContact CD1-CD2 4.11Å; I548-L592 HydrophobicContact CG1-CD1 4.4Å; I548-L592 HydrophobicContact CG1-CD2 4.34Å; I548-L592 HydrophobicContact CG1-CG 4.38Å
549	E	83.8	Confident	78.7	Confident	94 Å²	94	58.9 Å²	58.9	44%	0.439	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	130.8	171.4	-173.4	176.8	-164.2	0	0	108.9	H541 K542 T544 G588	H541-E549 CarbonylContact C-O 3.58Å; H541-E549 VanDerWaalsContact CA-O 3.23Å; H541-E549 WeakPolarHBondContact CA-O 3.49Å; K542-E549 HydrophobicContact CB-CB 4.37Å; K542-E549 PolarHBondContact N-O 3.28Å; K542-E549 PolarHBondContact O-N 2.93Å; T544-E549 HydrophobicContact CG2-CB 4.22Å; E549-G588 WeakPolarHBondContact CA-O 3.24Å
550	I	87.8	Confident	77	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	143.2	-173.8	54.6	162.1	0	0	0	111.7	I513 I517 L538 T540 H541 I548 F552 K587 G588 L590	I513-I550 HydrophobicContact CG2-CG2 3.97Å; I517-I550 HydrophobicContact CD1-CD1 3.84Å; I517-I550 HydrophobicContact CG1-CD1 3.61Å; L538-I550 HydrophobicContact CD1-CB 4.38Å; L538-I550 HydrophobicContact CD1-CG2 4.42Å; T540-I550 WeakPolarHBondContact O-CA 3.33Å; H541-I550 HydrophobicContact CB-CG2 4.2Å; I548-I550 HydrophobicContact CG2-CG2 3.93Å; I550-F552 HydrophobicContact CD1-CD1 3.88Å; I550-F552 HydrophobicContact CD1-CE1 3.73Å; I550-F552 HydrophobicContact CG1-CD1 4.43Å; I550-F552 HydrophobicContact CG1-CE1 4.49Å; I550-K587 WeakPolarHBondContact O-CA 3.42Å; I550-G588 WeakPolarHBondContact CG1-O 3.13Å; I550-G588 PolarHBondContact N-O 2.85Å; I550-G588 PolarHBondContact O-N 3.27Å; I550-L590 HydrophobicContact CD1-CD1 3.82Å; I550-L590 HydrophobicContact CD1-CD2 4.05Å; I550-L590 HydrophobicContact CD1-CG 3.63Å; I550-L590 HydrophobicContact CG1-CD1 4.47Å; I550-L590 HydrophobicContact CG1-CG 4.17Å; I550-L590 HydrophobicContact CG2-CD1 4Å; I550-L590 HydrophobicContact CG2-CG 4.43Å
551	V	87.3	Confident	75	Confident	24 Å²	24	62.9 Å²	62.9	15%	0.145	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	127.7	168.1	-175.5	0	0	0	0	108	I539 T540 I585 C586 K587	I539-V551 WeakPolarHBondContact CA-O 3.42Å; I539-V551 HydrophobicContact CB-CB 4.23Å; I539-V551 HydrophobicContact CB-CG1 4.04Å; I539-V551 WeakPolarHBondContact CB-O 3.38Å; I539-V551 HydrophobicContact CD1-CG1 3.9Å; I539-V551 HydrophobicContact CG2-CG1 4.35Å; I539-V551 PolarHBondContact N-O 3.48Å; T540-V551 PolarHBondContact N-O 3.16Å; T540-V551 VanDerWaalsContact N-O 3.14Å; T540-V551 PolarHBondContact O-N 3.27Å; T540-V551 WeakPolarHBondContact OG1-CB 3.49Å; T540-V551 VanDerWaalsContact OG1-CG2 3.32Å; T540-V551 WeakPolarHBondContact OG1-CG2 3.29Å; V551-I585 HydrophobicContact CG1-CD1 4.01Å; V551-I585 HydrophobicContact CG1-CG1 4.02Å; V551-C586 CarbonylContact C-O 3.42Å; V551-C586 WeakPolarHBondContact CA-O 3.42Å; V551-K587 HydrophobicContact CG1-CG 4.02Å; V551-K587 HydrophobicContact CG2-CG 4.05Å
552	F	89.7	Confident	72.7	Confident	0 Å²	0	66 Å²	66	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	165.7	-178.5	64.4	-83.6	0	0	0	111.3	I517 I521 I526 F535 T537 L538 I550 V554 C586 V600	I517-F552 HydrophobicContact CD1-CB 4.34Å; I517-F552 HydrophobicContact CD1-CD1 4.07Å; I517-F552 HydrophobicContact CD1-CG 4.23Å; I517-F552 HydrophobicContact CG1-CD1 4.41Å; I517-F552 HydrophobicContact CG1-CE1 4.49Å; I517-F552 HydrophobicContact CG2-CD1 4.19Å; I517-F552 HydrophobicContact CG2-CD2 3.67Å; I517-F552 HydrophobicContact CG2-CE1 4.11Å; I517-F552 HydrophobicContact CG2-CE2 3.56Å; I517-F552 HydrophobicContact CG2-CG 3.97Å; I517-F552 HydrophobicContact CG2-CZ 3.79Å; I521-F552 HydrophobicContact CD1-CE2 4.21Å; I521-F552 HydrophobicContact CG1-CE2 4.26Å; I526-F552 HydrophobicContact CD1-CZ 4.49Å; F535-F552 HydrophobicContact CD2-CD2 4.13Å; F535-F552 HydrophobicContact CE2-CB 4.02Å; F535-F552 HydrophobicContact CE2-CD2 4.33Å; F535-F552 HydrophobicContact CE2-CG 4.45Å; T537-F552 CarbonylContact O-C 3.51Å; T537-F552 VanDerWaalsContact O-CA 3.27Å; T537-F552 WeakPolarHBondContact O-CA 3.33Å; T537-F552 VanDerWaalsContact O-CB 3.3Å; T537-F552 WeakPolarHBondContact O-CB 3.39Å; L538-F552 HydrophobicContact CD1-CB 4.3Å; I550-F552 HydrophobicContact CD1-CD1 3.88Å; I550-F552 HydrophobicContact CD1-CE1 3.73Å; I550-F552 HydrophobicContact CG1-CD1 4.43Å; I550-F552 HydrophobicContact CG1-CE1 4.49Å; F552-V554 HydrophobicContact CD2-CG1 3.83Å; F552-V554 HydrophobicContact CE2-CG1 3.63Å; F552-C586 HydrophobicContact CD1-CB 3.97Å; F552-C586 HydrophobicContact CD2-CB 3.91Å; F552-C586 HydrophobicContact CE1-CB 3.58Å; F552-C586 HydrophobicContact CE2-CB 3.53Å; F552-C586 HydrophobicContact CG-CB 4.13Å; F552-C586 HydrophobicContact CZ-CB 3.36Å; F552-C586 PolarHBondContact N-O 3.14Å; F552-C586 PolarHBondContact O-N 3.43Å; F552-V600 HydrophobicContact CE1-CG1 3.78Å; F552-V600 HydrophobicContact CE1-CG2 4.4Å; F552-V600 HydrophobicContact CZ-CG1 3.82Å
553	T	85.6	Confident	70.5	Confident	3 Å²	3	65.1 Å²	65.1	2%	0.018	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	146.7	177	42.2	0	0	0	0	111.2	E536 T537 I539 K583 L584 I585 I605	E536-T553 WeakPolarHBondContact CB-O 3.16Å; E536-T553 PolarHBondContact N-O 2.99Å; E536-T553 WeakPolarHBondContact OE2-CB 3.3Å; E536-T553 PolarHBondContact OE2-OG1 2.78Å; T537-T553 WeakPolarHBondContact CG2-OG1 3.43Å; T537-T553 PolarHBondContact O-N 3.42Å; T537-T553 PolarHBondContact O-OG1 2.85Å; I539-T553 HydrophobicContact CD1-CG2 3.58Å; I539-T553 HydrophobicContact CG1-CG2 4.41Å; T553-K583 VanDerWaalsContact CG2-CE 3.4Å; T553-K583 HydrophobicContact CG2-CG 4.38Å; T553-L584 WeakPolarHBondContact CA-O 3.46Å; T553-I585 HydrophobicContact CG2-CB 4.5Å; T553-I585 HydrophobicContact CG2-CG1 4.49Å; T553-I605 HydrophobicContact CG2-CD1 4.5Å
554	V	86.8	Confident	68.4	Low	0 Å²	0	69 Å²	69	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	144.8	173.2	-57.2	0	0	0	0	109.7	I521 I526 V528 A533 R534 F552 L584	I521-V554 HydrophobicContact CD1-CG1 3.75Å; I521-V554 HydrophobicContact CG1-CG1 4.32Å; I526-V554 HydrophobicContact CG2-CG2 4.23Å; V528-V554 HydrophobicContact CG2-CG2 4.09Å; A533-V554 HydrophobicContact CB-CB 3.73Å; A533-V554 HydrophobicContact CB-CG1 4.38Å; A533-V554 HydrophobicContact CB-CG2 3.67Å; R534-V554 CarbonylContact O-C 3.46Å; R534-V554 VanDerWaalsContact O-CA 3.22Å; R534-V554 WeakPolarHBondContact O-CA 3.45Å; R534-V554 WeakPolarHBondContact O-CB 3.33Å; F552-V554 HydrophobicContact CD2-CG1 3.83Å; F552-V554 HydrophobicContact CE2-CG1 3.63Å; V554-L584 HydrophobicContact CG2-CB 3.69Å; V554-L584 HydrophobicContact CG2-CD1 4.04Å; V554-L584 HydrophobicContact CG2-CG 4.36Å; V554-L584 PolarHBondContact N-O 3.29Å; V554-L584 PolarHBondContact O-N 3.25Å
555	I	84.9	Confident	66.5	Low	16 Å²	16	74.3 Å²	74.3	8%	0.082	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	160.3	-178.5	57.1	176.5	0	0	0	110.6	R534 E536 K583	R534-I555 HydrophobicContact CB-CG1 4.21Å; R534-I555 PolarHBondContact N-O 2.85Å; R534-I555 PolarHBondContact O-N 2.94Å; E536-I555 HydrophobicContact CB-CD1 4.39Å; E536-I555 HydrophobicContact CB-CG1 4.2Å; E536-I555 HydrophobicContact CB-CG2 4.09Å; E536-I555 HydrophobicContact CG-CD1 4.27Å; E536-I555 HydrophobicContact CG-CG2 4.12Å; E536-I555 WeakPolarHBondContact OE2-CG2 3.37Å; I555-K583 HydrophobicContact CG2-CB 4.32Å; I555-K583 HydrophobicContact CG2-CD 4.37Å; I555-K583 HydrophobicContact CG2-CG 4.03Å
556	D	77.9	Confident	64.7	Low	17 Å²	17	73.5 Å²	73.5	9%	0.091	39%	0.385	C	S	.	.			trans	-57.1	125.9	165.9	-165.7	-41.7	0	0	0	109	V528 N529 R558 A559	V528-D556 HydrophobicContact CB-CB 4.42Å; V528-D556 HydrophobicContact CG1-CB 3.82Å; N529-D556 PolarHBondContact ND2-OD2 2.74Å; D556-R558 PolarHBondContact O-N 3.34Å; D556-R558 VanDerWaalsContact OD1-CB 3.32Å; D556-R558 WeakPolarHBondContact OD1-CB 3.4Å; D556-R558 PolarHBondContact OD1-N 3.35Å; D556-A559 HydrophobicContact CB-CB 4.44Å; D556-A559 VanDerWaalsContact O-CB 3.28Å; D556-A559 WeakPolarHBondContact O-CB 3.4Å; D556-A559 PolarHBondContact O-N 3.29Å
557	P	71.4	Confident	63	Low	48 Å²	48	75.1 Å²	75.1	31%	0.312	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-13.8	176.9	23.4	-33.8	0	0	0	113.6	Q531 R534	Q531-P557 HydrophobicContact CB-CG 4.07Å; R534-P557 HydrophobicContact CB-CB 4.34Å
558	R	67.9	Low	60.8	Low	164 Å²	164	78.2 Å²	78.2	62%	0.619	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-8.2	174.6	-63.1	-179.9	169.8	-176.5	-4.7	114.7	D556 D560	D556-R558 PolarHBondContact O-N 3.34Å; D556-R558 VanDerWaalsContact OD1-CB 3.32Å; D556-R558 WeakPolarHBondContact OD1-CB 3.4Å; D556-R558 PolarHBondContact OD1-N 3.35Å; R558-D560 PolarHBondContact O-N 3.41Å; R558-D560 VanDerWaalsContact O-N 3.16Å
559	A	59	Low	58.5	Low	25 Å²	25	86.3 Å²	86.3	21%	0.207	47%	0.468	C	S	.	.			trans	-72.7	-1.7	-173.7	0	0	0	0	0	115.5	D556 S561	D556-A559 HydrophobicContact CB-CB 4.44Å; D556-A559 VanDerWaalsContact O-CB 3.28Å; D556-A559 WeakPolarHBondContact O-CB 3.4Å; D556-A559 PolarHBondContact O-N 3.29Å; A559-S561 VanDerWaalsContact C-N 3.26Å; A559-S561 PolarHBondContact O-N 3.4Å; A559-S561 VanDerWaalsContact O-N 3.12Å
560	D	47.9	Very low	56.2	Low	117 Å²	117	88 Å²	88	63%	0.626	48%	0.479	S	S	*	.			trans	-86.2	29.5	-169.8	-127.8	25.8	0	0	0	114.7	R534 R558	R534-D560 IonicContact CZ-OD1 2.82Å; R534-D560 IonicContact CZ-OD2 3.66Å; R534-D560 VanDerWaalsContact NH1-CG 3.29Å; R534-D560 IonicContact NH1-OD1 3.62Å; R534-D560 IonicContact NH1-OD2 3.85Å; R534-D560 PolarHBondContact NH1-OD2 2.89Å; R534-D560 IonicContact NH2-OD1 3.53Å; R534-D560 PolarHBondContact NH2-OD1 2.96Å; R534-D560 IonicContact NH2-OD2 3.17Å; R534-D560 PolarHBondContact NH2-OD2 3.43Å; R558-D560 PolarHBondContact O-N 3.41Å; R558-D560 VanDerWaalsContact O-N 3.16Å
561	S	39.6	Very low	53.5	Low	101 Å²	101	93.9 Å²	93.9	71%	0.706	52%	0.518	S	S	*	.			trans	-121.5	51.3	-174	69.5	0	0	0	0	114.2	A559	A559-S561 VanDerWaalsContact C-N 3.26Å; A559-S561 PolarHBondContact O-N 3.4Å; A559-S561 VanDerWaalsContact O-N 3.12Å
562	T	34.4	Very low	51	Low	136 Å²	136	97.7 Å²	97.7	83%	0.834	54%	0.541	S	S	*	.			trans	-151.3	86	170.1	29.9	0	0	0	0	112.3
563	S	31.1	Very low	48.4	Very low	119 Å²	119	107.1 Å²	107.1	83%	0.832	58%	0.582	S	S	*	*			trans	-165.4	61.1	149.8	59	0	0	0	0	110.7
564	R	32.3	Very low	45.8	Very low	231 Å²	231	113.1 Å²	113.1	87%	0.872	62%	0.619	S	S	*	*			trans	-105.9	111.6	154.8	-76.8	-166.3	-166.7	-177	5.3	108.1	F566	R564-F566 PolarHBondContact O-N 3.09Å
565	I	32.5	Very low	43.1	Very low	155 Å²	155	118.4 Å²	118.4	80%	0.795	66%	0.656	S	S	*	*			trans	-48	107.2	163.7	-63.1	166.1	0	0	0	107.2	S567	I565-S567 PolarHBondContact O-N 3.37Å
566	F	31.3	Very low	40.4	Very low	198 Å²	198	122.4 Å²	122.4	87%	0.868	69%	0.692	S	S	*	*			trans	-80.4	96.5	165.2	-90.8	-91	0	0	0	107.1	R564	R564-F566 PolarHBondContact O-N 3.09Å
567	S	32.2	Very low	38.4	Very low	111 Å²	111	127.9 Å²	127.9	78%	0.776	73%	0.726	S	S	*	*			trans	-104.8	99.2	160.5	36.9	0	0	0	0	107.7	I565	I565-S567 PolarHBondContact O-N 3.37Å
568	G	31.4	Very low	36.4	Very low	64 Å²	64	132.7 Å²	132.7	66%	0.66	75%	0.748	S	S	*	*			trans	143.8	117.4	170.2	0	0	0	0	0	113.3
569	M	34	Very low	34.9	Very low	190 Å²	190	133 Å²	133	94%	0.936	76%	0.761	S	S	*	*			trans	97	96.1	157.5	-106.8	152.4	177.6	0	0	119.6
570	D	34.8	Very low	34.1	Very low	129 Å²	129	140.2 Å²	140.2	69%	0.69	78%	0.784	S	S	*	*			trans	67.3	108.4	131.6	-134	-28.9	0	0	0	120.5	T572	D570-T572 VanDerWaalsContact C-N 3.35Å; D570-T572 PolarHBondContact O-N 2.9Å; D570-T572 VanDerWaalsContact O-N 3.1Å
571	P	32.4	Very low	34.4	Very low	124 Å²	124	138 Å²	138	81%	0.805	78%	0.778	S	S	*	*	S	Bend	trans	-89.9	58.8	-173.7	38.7	-35.2	0	0	0	111.7
572	T	33.7	Very low	35.6	Very low	104 Å²	104	137.4 Å²	137.4	64%	0.638	76%	0.763	S	S	*	*			trans	-150.5	66.9	173.2	54.7	0	0	0	0	112.8	D570	D570-T572 VanDerWaalsContact C-N 3.35Å; D570-T572 PolarHBondContact O-N 2.9Å; D570-T572 VanDerWaalsContact O-N 3.1Å
573	K	34.8	Very low	37.6	Very low	198 Å²	198	134.4 Å²	134.4	86%	0.861	74%	0.738	S	S	*	*	S	Bend	trans	169.4	108.5	146.3	-92.7	153.4	-172.3	-180	0	113.1
574	T	32.3	Very low	40.1	Very low	128 Å²	128	129.6 Å²	129.6	79%	0.785	70%	0.703	S	S	*	*			trans	71	103.2	132.5	-34.1	0	0	0	0	120.6
575	S	29.3	Very low	42.7	Very low	111 Å²	111	120.6 Å²	120.6	78%	0.776	67%	0.672	S	S	*	*			trans	64.2	87.9	142.1	-58.4	0	0	0	0	120.2
576	A	29.2	Very low	45.4	Very low	101 Å²	101	113.2 Å²	113.2	84%	0.835	63%	0.634	S	S	*	*			trans	-87.3	111.9	162.3	0	0	0	0	0	110.9	L578	A576-L578 PolarHBondContact O-N 3.01Å
577	T	34.3	Very low	48.1	Very low	131 Å²	131	109.3 Å²	109.3	80%	0.804	62%	0.616	S	S	*	*			trans	-72	110.2	168.6	-46.6	0	0	0	0	109.2	L579	T577-L579 PolarHBondContact O-N 3.22Å
578	L	30.3	Very low	50.7	Low	150 Å²	150	104.7 Å²	104.7	79%	0.785	59%	0.586	S	S	*	*			trans	-62.3	108	171.8	-90.3	146	0	0	0	110.2	A576 Y580	A576-L578 PolarHBondContact O-N 3.01Å; L578-Y580 PolarHBondContact O-N 3.32Å; L578-Y580 VanDerWaalsContact O-N 3.15Å
579	L	36.3	Very low	53.1	Low	169 Å²	169	105.1 Å²	105.1	89%	0.885	57%	0.573	S	S	*	*			trans	-76.9	93.8	168.6	-82.2	160.3	0	0	0	109	T577 S581	T577-L579 PolarHBondContact O-N 3.22Å; L579-S581 PolarHBondContact O-N 2.85Å
580	Y	42.4	Very low	55.3	Low	178 Å²	178	96.6 Å²	96.6	70%	0.698	53%	0.53	S	S	*	.			trans	-64.4	113.6	172.6	-105.3	-95.1	0	0	0	110.8	L578 K582	L578-Y580 PolarHBondContact O-N 3.32Å; L578-Y580 VanDerWaalsContact O-N 3.15Å; Y580-K582 PolarHBondContact O-N 3.2Å
581	S	53.5	Low	57.1	Low	71 Å²	71	91.7 Å²	91.7	50%	0.497	51%	0.507	S	S	.	.			trans	-77.3	113.2	171	46.6	0	0	0	0	110.3	L579 K583	L579-S581 PolarHBondContact O-N 2.85Å; S581-K583 PolarHBondContact O-N 2.95Å
582	K	65.5	Low	58.4	Low	88 Å²	88	91.2 Å²	91.2	38%	0.383	50%	0.496	S	S	.	.			trans	-65.4	128.8	176.2	-69.1	-158.4	-177.1	-172	0	111.3	V528 N529 Y580 E604	V528-K582 HydrophobicContact CG1-CB 3.88Å; N529-K582 VanDerWaalsContact OD1-CD 3.3Å; N529-K582 WeakPolarHBondContact OD1-CD 3.29Å; N529-K582 WeakPolarHBondContact OD1-CE 3.29Å; Y580-K582 PolarHBondContact O-N 3.2Å; K582-E604 WeakPolarHBondContact CD-OE1 3.32Å; K582-E604 IonicContact NZ-OE1 2.74Å; K582-E604 PolarHBondContact NZ-OE1 2.88Å
583	K	75.9	Confident	59.5	Low	72 Å²	72	90.4 Å²	90.4	31%	0.313	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	129.2	175.8	-174.7	170.1	170.2	152.8	0	109.3	E536 T553 I555 S581 I605	E536-K583 IonicContact OE1-NZ 2.69Å; E536-K583 PolarHBondContact OE1-NZ 2.86Å; E536-K583 VanDerWaalsContact OE2-CD 3.3Å; E536-K583 WeakPolarHBondContact OE2-CD 3.38Å; E536-K583 WeakPolarHBondContact OE2-CE 3.49Å; E536-K583 IonicContact OE2-NZ 2.83Å; E536-K583 PolarHBondContact OE2-NZ 3.47Å; T553-K583 VanDerWaalsContact CG2-CE 3.4Å; T553-K583 HydrophobicContact CG2-CG 4.38Å; I555-K583 HydrophobicContact CG2-CB 4.32Å; I555-K583 HydrophobicContact CG2-CD 4.37Å; I555-K583 HydrophobicContact CG2-CG 4.03Å; S581-K583 PolarHBondContact O-N 2.95Å; K583-I605 HydrophobicContact CB-CD1 4.22Å; K583-I605 HydrophobicContact CD-CD1 3.94Å; K583-I605 HydrophobicContact CG-CD1 3.75Å; K583-I605 PolarHBondContact O-N 3.1Å
584	L	83.6	Confident	60.5	Low	19 Å²	19	93 Å²	93	10%	0.099	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	139.6	174.7	-63.6	169.9	0	0	0	109.3	V528 T553 V554 C602 E603 E604	V528-L584 HydrophobicContact CG2-CD1 3.5Å; V528-L584 HydrophobicContact CG2-CG 3.97Å; T553-L584 WeakPolarHBondContact CA-O 3.46Å; V554-L584 HydrophobicContact CG2-CB 3.69Å; V554-L584 HydrophobicContact CG2-CD1 4.04Å; V554-L584 HydrophobicContact CG2-CG 4.36Å; V554-L584 PolarHBondContact N-O 3.29Å; V554-L584 PolarHBondContact O-N 3.25Å; L584-C602 HydrophobicContact CB-CB 4.37Å; L584-C602 HydrophobicContact CD1-CB 4.43Å; L584-E603 CarbonylContact C-O 3.57Å; L584-E603 VanDerWaalsContact CA-O 3.31Å; L584-E603 WeakPolarHBondContact CA-O 3.35Å; L584-E604 HydrophobicContact CD2-CB 4.17Å; L584-E604 HydrophobicContact CD2-CG 3.44Å; L584-E604 VanDerWaalsContact CD2-CG 3.44Å
585	I	86.9	Confident	61.4	Low	42 Å²	42	91 Å²	91	22%	0.215	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	125	166.6	-169.5	166.7	0	0	0	109.2	I539 V551 T553 C602 E603 I605	I539-I585 HydrophobicContact CD1-CD1 3.94Å; I539-I585 HydrophobicContact CD1-CG1 4.14Å; V551-I585 HydrophobicContact CG1-CD1 4.01Å; V551-I585 HydrophobicContact CG1-CG1 4.02Å; T553-I585 HydrophobicContact CG2-CB 4.5Å; T553-I585 HydrophobicContact CG2-CG1 4.49Å; I585-C602 CarbonylContact O-C 3.56Å; I585-C602 VanDerWaalsContact O-CA 3.28Å; I585-C602 WeakPolarHBondContact O-CA 3.41Å; I585-E603 HydrophobicContact CG2-CB 4.28Å; I585-E603 PolarHBondContact N-O 2.8Å; I585-E603 PolarHBondContact O-N 2.03Å; I585-I605 HydrophobicContact CB-CD1 4.41Å; I585-I605 HydrophobicContact CB-CG1 4.16Å; I585-I605 HydrophobicContact CG2-CG1 4.24Å
586	C	89.1	Confident	63	Low	0 Å²	0	89.4 Å²	89.4	0%	0	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	130.1	-178.3	-62	0	0	0	0	110.5	V551 F552 V600 K601 C602	V551-C586 CarbonylContact C-O 3.42Å; V551-C586 WeakPolarHBondContact CA-O 3.42Å; F552-C586 HydrophobicContact CD1-CB 3.97Å; F552-C586 HydrophobicContact CD2-CB 3.91Å; F552-C586 HydrophobicContact CE1-CB 3.58Å; F552-C586 HydrophobicContact CE2-CB 3.53Å; F552-C586 HydrophobicContact CG-CB 4.13Å; F552-C586 HydrophobicContact CZ-CB 3.36Å; F552-C586 PolarHBondContact N-O 3.14Å; F552-C586 PolarHBondContact O-N 3.43Å; C586-V600 HydrophobicContact CB-CG1 3.83Å; C586-K601 CarbonylContact C-O 3.54Å; C586-K601 VanDerWaalsContact CA-O 3.31Å; C586-K601 WeakPolarHBondContact CA-O 3.4Å; C586-C602 HydrophobicContact CB-CB 4.12Å; C586-C602 WeakPolarHBondContact CB-SG 2.98Å; C586-C602 WeakPolarHBondContact SG-CB 3.42Å; C586-C602 CovalentContact SG-SG 2.05Å; C586-C602 PolarHBondContact SG-SG 2.88Å
587	K	89	Confident	64.5	Low	116 Å²	116	93.4 Å²	93.4	50%	0.504	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	136.2	179.6	-61.4	-176.7	178.1	170.2	0	110.2	I550 V551 V600 K601	I550-K587 WeakPolarHBondContact O-CA 3.42Å; V551-K587 HydrophobicContact CG1-CG 4.02Å; V551-K587 HydrophobicContact CG2-CG 4.05Å; K587-V600 WeakPolarHBondContact O-CA 3.45Å; K587-K601 PolarHBondContact N-O 3.48Å; K587-K601 PolarHBondContact O-N 2.95Å
588	G	85.9	Confident	66.4	Low	13 Å²	13	89.5 Å²	89.5	13%	0.134	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.3	-173.2	178.6	0	0	0	0	0	115.6	E549 I550 H599	E549-G588 WeakPolarHBondContact CA-O 3.24Å; I550-G588 WeakPolarHBondContact CG1-O 3.13Å; I550-G588 PolarHBondContact N-O 2.85Å; I550-G588 PolarHBondContact O-N 3.27Å; G588-H599 CarbonylContact C-O 3.48Å; G588-H599 WeakPolarHBondContact CA-O 3.41Å
589	I	82.3	Confident	68.3	Low	74 Å²	74	88.3 Å²	88.3	38%	0.379	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	124.4	-179.9	-55.2	174.5	0	0	0	109.4	I548 H599	I548-I589 WeakPolarHBondContact O-CA 3.31Å; I589-H599 PolarHBondContact N-O 2.92Å; I589-H599 PolarHBondContact O-N 2.72Å
590	L	79.8	Confident	70.5	Confident	10 Å²	10	81.5 Å²	81.5	5%	0.052	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	117.9	167.4	-66.2	173.6	0	0	0	109.2	I513 I517 L520 G547 I548 I550 N598	I513-L590 HydrophobicContact CG2-CD1 4.21Å; I517-L590 HydrophobicContact CG1-CD1 4.45Å; L520-L590 HydrophobicContact CD1-CD2 3.77Å; G547-L590 CarbonylContact C-O 3.51Å; G547-L590 VanDerWaalsContact CA-O 3.23Å; G547-L590 WeakPolarHBondContact CA-O 3.09Å; I548-L590 HydrophobicContact CB-CB 4.3Å; I548-L590 PolarHBondContact N-O 3Å; I548-L590 PolarHBondContact O-N 3Å; I550-L590 HydrophobicContact CD1-CD1 3.82Å; I550-L590 HydrophobicContact CD1-CD2 4.05Å; I550-L590 HydrophobicContact CD1-CG 3.63Å; I550-L590 HydrophobicContact CG1-CD1 4.47Å; I550-L590 HydrophobicContact CG1-CG 4.17Å; I550-L590 HydrophobicContact CG2-CD1 4Å; I550-L590 HydrophobicContact CG2-CG 4.43Å; L590-N598 WeakPolarHBondContact CA-OD1 3.25Å; L590-N598 HydrophobicContact CD2-CB 4.34Å
591	S	72.3	Confident	72.6	Confident	27 Å²	27	79.8 Å²	79.8	19%	0.189	41%	0.411	C	S	.	.			trans	-78.4	134.9	178.8	-165.5	0	0	0	0	111.5	V593 V596 N598	S591-V593 PolarHBondContact OG-N 3.4Å; S591-V596 WeakPolarHBondContact OG-CB 3.45Å; S591-V596 WeakPolarHBondContact OG-CG1 3.31Å; S591-N598 PolarHBondContact N-OD1 3.42Å
592	L	60.1	Low	74.2	Confident	113 Å²	113	78.5 Å²	78.5	59%	0.592	40%	0.401	S	S	*	.	S	Bend	trans	-83	-3.9	172.2	-68.9	169.2	0	0	0	112.4	I548	I548-L592 HydrophobicContact CD1-CD2 4.11Å; I548-L592 HydrophobicContact CG1-CD1 4.4Å; I548-L592 HydrophobicContact CG1-CD2 4.34Å; I548-L592 HydrophobicContact CG1-CG 4.38Å
593	V	57.2	Low	75.1	Confident	88 Å²	88	80.3 Å²	80.3	53%	0.533	41%	0.411	S	S	.	.	S	Bend	trans	-97.6	120.1	-176.2	-174.3	0	0	0	0	109.4	S591 G595 V596	S591-V593 PolarHBondContact OG-N 3.4Å; V593-G595 PolarHBondContact O-N 2.94Å; V593-V596 HydrophobicContact CB-CB 4.39Å; V593-V596 HydrophobicContact CB-CG2 3.77Å; V593-V596 HydrophobicContact CG1-CG2 3.87Å; V593-V596 PolarHBondContact O-N 2.69Å
594	R	54.9	Low	75.1	Confident	251 Å²	251	82 Å²	82	95%	0.947	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	123.4	172.4	-103.7	-177.4	177.2	166.2	-2.5	109.6
595	G	51.2	Low	74.3	Confident	86 Å²	86	84.7 Å²	84.7	89%	0.887	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.9	-8.7	177.7	0	0	0	0	0	115.4	V593	V593-G595 PolarHBondContact O-N 2.94Å
596	V	63.7	Low	72.6	Confident	79 Å²	79	91.2 Å²	91.2	48%	0.479	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-91.4	122.7	174.3	-179.6	0	0	0	0	108.9	S591 V593	S591-V596 WeakPolarHBondContact OG-CB 3.45Å; S591-V596 WeakPolarHBondContact OG-CG1 3.31Å; V593-V596 HydrophobicContact CB-CB 4.39Å; V593-V596 HydrophobicContact CB-CG2 3.77Å; V593-V596 HydrophobicContact CG1-CG2 3.87Å; V593-V596 PolarHBondContact O-N 2.69Å
597	K	61.3	Low	70.4	Confident	185 Å²	185	96.8 Å²	96.8	80%	0.804	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-61.7	136.3	175.6	-83.7	-172.7	176.4	-175.7	0	110
598	N	72.5	Confident	67.9	Low	48 Å²	48	96 Å²	96	26%	0.257	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-68.9	146.7	167.6	-59.9	-42.6	0	0	0	108.6	L520 L590 S591	L520-N598 HydrophobicContact CD1-CB 3.4Å; L590-N598 WeakPolarHBondContact CA-OD1 3.25Å; L590-N598 HydrophobicContact CD2-CB 4.34Å; S591-N598 PolarHBondContact N-OD1 3.42Å
599	H	70.6	Confident	65.4	Low	125 Å²	125	102.5 Å²	102.5	58%	0.579	53%	0.531	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.1	114.5	-179.6	-171	-75.6	0	0	0	109	G588 I589	G588-H599 CarbonylContact C-O 3.48Å; G588-H599 WeakPolarHBondContact CA-O 3.41Å; I589-H599 PolarHBondContact N-O 2.92Å; I589-H599 PolarHBondContact O-N 2.72Å
600	V	82.1	Confident	63	Low	26 Å²	26	108.8 Å²	108.8	16%	0.158	56%	0.559	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-133	133.4	-179.2	177	0	0	0	0	109.2	L520 F552 C586 K587	L520-V600 HydrophobicContact CD1-CB 4.48Å; L520-V600 HydrophobicContact CD1-CG2 3.51Å; L520-V600 HydrophobicContact CD2-CB 3.87Å; L520-V600 HydrophobicContact CD2-CG1 4.32Å; L520-V600 HydrophobicContact CD2-CG2 3.65Å; L520-V600 HydrophobicContact CG-CG2 4.25Å; F552-V600 HydrophobicContact CE1-CG1 3.78Å; F552-V600 HydrophobicContact CE1-CG2 4.4Å; F552-V600 HydrophobicContact CZ-CG1 3.82Å; C586-V600 HydrophobicContact CB-CG1 3.83Å; K587-V600 WeakPolarHBondContact O-CA 3.45Å
601	K	86.4	Confident	60.6	Low	143 Å²	143	116.3 Å²	116.3	62%	0.622	59%	0.594	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-113.9	139.3	171.8	-73.3	-178.2	171.2	179.7	0	109.2	C586 K587	C586-K601 CarbonylContact C-O 3.54Å; C586-K601 VanDerWaalsContact CA-O 3.31Å; C586-K601 WeakPolarHBondContact CA-O 3.4Å; K587-K601 PolarHBondContact N-O 3.48Å; K587-K601 PolarHBondContact O-N 2.95Å
602	C	87.1	Confident	58.7	Low	44 Å²	44	123.3 Å²	123.3	30%	0.297	63%	0.627	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.4	138.5	178.4	-57.6	0	0	0	0	110.8	L584 I585 C586	L584-C602 HydrophobicContact CB-CB 4.37Å; L584-C602 HydrophobicContact CD1-CB 4.43Å; I585-C602 CarbonylContact O-C 3.56Å; I585-C602 VanDerWaalsContact O-CA 3.28Å; I585-C602 WeakPolarHBondContact O-CA 3.41Å; C586-C602 HydrophobicContact CB-CB 4.12Å; C586-C602 WeakPolarHBondContact CB-SG 2.98Å; C586-C602 WeakPolarHBondContact SG-CB 3.42Å; C586-C602 CovalentContact SG-SG 2.05Å; C586-C602 PolarHBondContact SG-SG 2.88Å
603	E	85.4	Confident	57.3	Low	125 Å²	125	123.8 Å²	123.8	58%	0.584	63%	0.63	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-126.6	144.6	-179.4	-68.7	171.8	-176.6	0	0	109.7	L584 I585	L584-E603 CarbonylContact C-O 3.57Å; L584-E603 VanDerWaalsContact CA-O 3.31Å; L584-E603 WeakPolarHBondContact CA-O 3.35Å; I585-E603 HydrophobicContact CG2-CB 4.28Å; I585-E603 PolarHBondContact N-O 2.8Å; I585-E603 PolarHBondContact O-N 2.03Å
604	E	75.8	Confident	56.4	Low	107 Å²	107	123.9 Å²	123.9	50%	0.5	63%	0.633	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-68.4	133.1	171.9	-76.4	-175.2	164.3	0	0	110.1	K582 L584 K606	K582-E604 WeakPolarHBondContact CD-OE1 3.32Å; K582-E604 IonicContact NZ-OE1 2.74Å; K582-E604 PolarHBondContact NZ-OE1 2.88Å; L584-E604 HydrophobicContact CD2-CB 4.17Å; L584-E604 HydrophobicContact CD2-CG 3.44Å; L584-E604 VanDerWaalsContact CD2-CG 3.44Å; E604-K606 PolarHBondContact O-N 2.85Å; E604-K606 VanDerWaalsContact O-N 3.08Å
605	I	66.3	Low	55.6	Low	76 Å²	76	117 Å²	117	39%	0.39	62%	0.623	S	S	.	*			trans	-72.4	102.2	169	-56.7	178.3	0	0	0	106.3	T553 K583 I585 D607	T553-I605 HydrophobicContact CG2-CD1 4.5Å; K583-I605 HydrophobicContact CB-CD1 4.22Å; K583-I605 HydrophobicContact CD-CD1 3.94Å; K583-I605 HydrophobicContact CG-CD1 3.75Å; K583-I605 PolarHBondContact O-N 3.1Å; I585-I605 HydrophobicContact CB-CD1 4.41Å; I585-I605 HydrophobicContact CB-CG1 4.16Å; I585-I605 HydrophobicContact CG2-CG1 4.24Å; I605-D607 PolarHBondContact O-N 3.31Å
606	K	52.4	Low	54.7	Low	179 Å²	179	121.1 Å²	121.1	78%	0.778	62%	0.624	S	S	*	*			trans	-75.8	110.4	168.6	-66.7	-177	-179.9	-178.1	0	107.2	E604 S608	E604-K606 PolarHBondContact O-N 2.85Å; E604-K606 VanDerWaalsContact O-N 3.08Å; K606-S608 VanDerWaalsContact C-N 3.34Å; K606-S608 PolarHBondContact O-N 3.34Å
607	D	42.1	Very low	53.4	Low	117 Å²	117	122.4 Å²	122.4	63%	0.626	63%	0.634	S	S	*	*			trans	-62	102	163.6	-76	-24.4	0	0	0	107	I605 D609	I605-D607 PolarHBondContact O-N 3.31Å; D607-D609 PolarHBondContact O-N 2.84Å
608	S	37	Very low	52.1	Low	100 Å²	100	119.4 Å²	119.4	70%	0.699	64%	0.636	S	S	*	*			trans	-77.9	110.3	174.7	48.1	0	0	0	0	109.4	K606	K606-S608 VanDerWaalsContact C-N 3.34Å; K606-S608 PolarHBondContact O-N 3.34Å
609	D	33.1	Very low	50	Low	149 Å²	149	122.5 Å²	122.5	80%	0.797	66%	0.662	S	S	*	*			trans	57	107.2	134.3	-52.6	-42.5	0	0	0	119.5	D607	D607-D609 PolarHBondContact O-N 2.84Å
610	E	32	Very low	48.2	Very low	206 Å²	206	122 Å²	122	96%	0.963	67%	0.67	S	S	*	*				-143.2	112.9	119.4	-123.7	179	-172.9	0	0	109.9
611	Q	29.1	Very low	46	Very low	169 Å²	169	127 Å²	127	79%	0.79	71%	0.706	S	S	*	*			trans	-88.9	128.4	-178	175	-178.3	32.9	0	0	110.1
612	I	32.1	Very low	43.4	Very low	174 Å²	174	124.7 Å²	124.7	89%	0.892	71%	0.713	S	S	*	*			trans	-137.7	98.7	151.1	-55.8	-178.9	0	0	0	108.4
613	D	30.6	Very low	40.9	Very low	123 Å²	123	128.2 Å²	128.2	66%	0.658	74%	0.736	S	S	*	*			trans	-81.1	175.6	157.2	-165.4	33.3	0	0	0	107.8
614	P	38.8	Very low	38.4	Very low	89 Å²	89	134 Å²	134	58%	0.578	75%	0.752	S	S	*	*			cis	-136.1	171.4	-6.9	11.6	16.4	0	0	0	114.3
615	S	37.7	Very low	36.2	Very low	108 Å²	108	132.3 Å²	132.3	76%	0.755	76%	0.756	S	S	*	*				154.8	100.1	117.5	53.2	0	0	0	0	116.4
616	L	32.8	Very low	34.6	Very low	171 Å²	171	136 Å²	136	90%	0.895	78%	0.777	S	S	*	*				71.2	153.3	125	-91.9	92.1	0	0	0	123.8
617	P	35.9	Very low	33.5	Very low	106 Å²	106	135.1 Å²	135.1	69%	0.688	78%	0.781	S	S	*	*			trans	-129.7	176.2	-144.9	43.8	-26.4	0	0	0	114.6
618	S	35.1	Very low	33	Very low	122 Å²	122	134.8 Å²	134.8	85%	0.853	79%	0.785	S	S	*	*			trans	178.7	150.3	154.9	10.2	0	0	0	0	108.1
619	S	28.4	Very low	32.5	Very low	114 Å²	114	134.2 Å²	134.2	80%	0.797	79%	0.787	S	S	*	*			cis	-176.2	152.2	-10.9	168.1	0	0	0	0	104
620	P	33	Very low	32.5	Very low	115 Å²	115	134.2 Å²	134.2	75%	0.747	79%	0.792	S	S	*	*			trans	-99.3	156.3	-156	36	-29.5	0	0	0	115.1
621	S	34.4	Very low	32.9	Very low	131 Å²	131	129.6 Å²	129.6	92%	0.916	78%	0.778	S	S	*	*			trans	-154.4	128.8	157.7	-49.9	0	0	0	0	113.6
622	A	31.7	Very low	33.1	Very low	94 Å²	94	128.8 Å²	128.8	78%	0.777	78%	0.784	S	S	*	*			trans	-80.3	-160	-170	0	0	0	0	0	115.3
623	P	35.7	Very low	33.6	Very low	118 Å²	118	124.7 Å²	124.7	77%	0.766	77%	0.767	S	S	*	*				-134.5	153.4	-94.8	38.3	-18.9	0	0	0	115.8
624	W	32	Very low	34.7	Very low	246 Å²	246	122.8 Å²	122.8	93%	0.932	76%	0.757	S	S	*	*			trans	-175.4	143.3	160	53.1	-72.4	0	0	0	106.9
625	A	29.9	Very low	35.7	Very low	71 Å²	71	123.9 Å²	123.9	59%	0.587	76%	0.762	S	S	*	*			cis	-163.4	149	-9.6	0	0	0	0	0	106.1
626	N	31.7	Very low	37.3	Very low	153 Å²	153	123 Å²	123	82%	0.818	75%	0.752	S	S	*	*			trans	64.9	95.8	153.1	-46.8	-27.1	0	0	0	119.7
627	D	30	Very low	39	Very low	161 Å²	161	118.2 Å²	118.2	86%	0.861	73%	0.725	S	S	*	*				158	138.2	103.8	-117.4	-19.7	0	0	0	110.7
628	P	32.5	Very low	41	Very low	111 Å²	111	117.2 Å²	117.2	72%	0.721	71%	0.708	S	S	*	*			trans	-87.3	133.4	-161.5	33.5	-31.8	0	0	0	114.1
629	A	26.1	Very low	43.2	Very low	88 Å²	88	115.8 Å²	115.8	73%	0.727	69%	0.694	S	S	*	*			trans	2.5	116.9	148.9	0	0	0	0	0	118.1
630	T	33.1	Very low	45.8	Very low	148 Å²	148	116.8 Å²	116.8	91%	0.908	68%	0.684	S	S	*	*			trans	-111	103.4	145.3	-0	0	0	0	0	108
631	T	39.4	Very low	48.3	Very low	110 Å²	110	111.9 Å²	111.9	68%	0.675	65%	0.651	S	S	*	*			trans	-64.2	146.3	-177.7	31.5	0	0	0	0	112	V633	T631-V633 PolarHBondContact O-N 3.04Å
632	V	34.6	Very low	50.9	Low	151 Å²	151	107 Å²	107	92%	0.915	62%	0.615	S	S	*	*			trans	-58.1	88.2	174.2	-177.9	0	0	0	0	109.5
633	V	41.7	Very low	53.6	Low	88 Å²	88	106.2 Å²	106.2	53%	0.533	60%	0.604	S	S	.	*			trans	-106.1	108.9	177	177.2	0	0	0	0	109.1	T631	T631-V633 PolarHBondContact O-N 3.04Å
634	D	54.4	Low	56.1	Low	84 Å²	84	107.6 Å²	107.6	45%	0.449	60%	0.598	S	S	.	*			trans	32.1	87.6	164.6	-83.6	-37.4	0	0	0	117	V636 E637 Y638	D634-V636 PolarHBondContact O-N 3.33Å; D634-V636 VanDerWaalsContact O-N 3.12Å; D634-E637 HydrophobicContact CB-CB 3.59Å; D634-E637 PolarHBondContact O-N 3.35Å; D634-Y638 WeakPolarHBondContact O-CB 3.27Å; D634-Y638 PolarHBondContact O-N 2.8Å
635	T	60.1	Low	59	Low	112 Å²	112	96.1 Å²	96.1	69%	0.687	55%	0.554	S	S	*	*	H	α-helix	trans	-53.5	-31.9	170.2	44.6	0	0	0	0	112.7	V639	T635-V639 WeakPolarHBondContact O-CB 3.48Å; T635-V639 WeakPolarHBondContact O-CG2 3.24Å; T635-V639 PolarHBondContact O-N 3.36Å
636	V	70.4	Confident	61.9	Low	88 Å²	88	98 Å²	98	53%	0.533	55%	0.55	S	S	.	.	H	α-helix	trans	-71.2	-41.1	175.6	-178.1	0	0	0	0	111.7	D634 K640	D634-V636 PolarHBondContact O-N 3.33Å; D634-V636 VanDerWaalsContact O-N 3.12Å; V636-K640 HydrophobicContact CG1-CD 4.25Å; V636-K640 WeakPolarHBondContact O-CB 3.49Å; V636-K640 VanDerWaalsContact O-CG 3.29Å; V636-K640 WeakPolarHBondContact O-CG 3.36Å; V636-K640 PolarHBondContact O-N 2.88Å
637	E	69.7	Low	64.6	Low	72 Å²	72	97.6 Å²	97.6	34%	0.336	54%	0.536	S	S	.	.	H	α-helix	trans	-71.4	-41.2	177.3	-163.4	167.6	-148.6	0	0	110.5	D634 V639 K640 I641	D634-E637 HydrophobicContact CB-CB 3.59Å; D634-E637 PolarHBondContact O-N 3.35Å; E637-V639 PolarHBondContact O-N 2.99Å; E637-K640 PolarHBondContact O-N 2.82Å; E637-I641 HydrophobicContact CG-CD1 3.78Å; E637-I641 HydrophobicContact CG-CG1 4.36Å; E637-I641 WeakPolarHBondContact O-CB 3.34Å; E637-I641 VanDerWaalsContact O-CG1 3.22Å; E637-I641 WeakPolarHBondContact O-CG1 3.28Å; E637-I641 PolarHBondContact O-N 2.89Å
638	Y	77	Confident	67.4	Low	85 Å²	85	93.6 Å²	93.6	33%	0.333	52%	0.515	S	S	.	.	H	α-helix	trans	-55.8	-48	171.1	-177.4	-91	0	0	0	112	D634 I641 L642 L666	D634-Y638 WeakPolarHBondContact O-CB 3.27Å; D634-Y638 PolarHBondContact O-N 2.8Å; Y638-I641 PolarHBondContact O-N 3.26Å; Y638-L642 HydrophobicContact CE1-CD2 4.1Å; Y638-L642 WeakPolarHBondContact O-CB 3.43Å; Y638-L642 PolarHBondContact O-N 3.47Å; Y638-L666 HydrophobicContact CD2-CD1 4.06Å; Y638-L666 HydrophobicContact CE2-CB 3.78Å; Y638-L666 HydrophobicContact CE2-CD1 3.73Å; Y638-L666 HydrophobicContact CE2-CG 4.38Å
639	V	80.7	Confident	70.2	Confident	92 Å²	92	88.5 Å²	88.5	56%	0.558	48%	0.481	S	S	*	.	H	α-helix	trans	-66.7	-41.2	178.6	171.6	0	0	0	0	111.5	T635 E637 S643	T635-V639 WeakPolarHBondContact O-CB 3.48Å; T635-V639 WeakPolarHBondContact O-CG2 3.24Å; T635-V639 PolarHBondContact O-N 3.36Å; E637-V639 PolarHBondContact O-N 2.99Å; V639-S643 WeakPolarHBondContact O-CB 3.34Å; V639-S643 PolarHBondContact O-N 3.27Å
640	K	83.7	Confident	73	Confident	134 Å²	134	90.4 Å²	90.4	58%	0.583	47%	0.474	S	S	*	.	H	α-helix	trans	-62.6	-43	175.1	-77.6	175.1	-178.2	174.6	0	111.6	V636 E637 K644	V636-K640 HydrophobicContact CG1-CD 4.25Å; V636-K640 WeakPolarHBondContact O-CB 3.49Å; V636-K640 VanDerWaalsContact O-CG 3.29Å; V636-K640 WeakPolarHBondContact O-CG 3.36Å; V636-K640 PolarHBondContact O-N 2.88Å; E637-K640 PolarHBondContact O-N 2.82Å; K640-K644 WeakPolarHBondContact O-CG 3.05Å; K640-K644 PolarHBondContact O-N 3.17Å; K640-K644 VanDerWaalsContact O-N 3.07Å
641	I	85.5	Confident	75.4	Confident	12 Å²	12	87.3 Å²	87.3	6%	0.062	46%	0.455	C	S	.	.	H	α-helix	trans	-70.1	-45.9	178.9	-66.9	169.6	0	0	0	110.4	E637 Y638 S643 K644 V645 L666 L669 M676 I678	E637-I641 HydrophobicContact CG-CD1 3.78Å; E637-I641 HydrophobicContact CG-CG1 4.36Å; E637-I641 WeakPolarHBondContact O-CB 3.34Å; E637-I641 VanDerWaalsContact O-CG1 3.22Å; E637-I641 WeakPolarHBondContact O-CG1 3.28Å; E637-I641 PolarHBondContact O-N 2.89Å; Y638-I641 PolarHBondContact O-N 3.26Å; I641-S643 VanDerWaalsContact C-N 3.25Å; I641-S643 PolarHBondContact O-N 3.49Å; I641-K644 CarbonylContact O-C 3.56Å; I641-K644 WeakPolarHBondContact O-CA 3.32Å; I641-K644 WeakPolarHBondContact O-CB 3.05Å; I641-K644 PolarHBondContact O-N 3.34Å; I641-V645 HydrophobicContact CG2-CG2 4.09Å; I641-V645 WeakPolarHBondContact O-CG2 3.29Å; I641-V645 PolarHBondContact O-N 3.22Å; I641-L666 HydrophobicContact CG2-CD1 4.25Å; I641-L669 HydrophobicContact CB-CD1 4.22Å; I641-L669 HydrophobicContact CD1-CD1 3.51Å; I641-L669 HydrophobicContact CD1-CD2 3.87Å; I641-L669 HydrophobicContact CD1-CG 4.17Å; I641-L669 HydrophobicContact CG1-CD1 4.43Å; I641-L669 HydrophobicContact CG2-CD1 3.64Å; I641-M676 HydrophobicContact CD1-CE 4.17Å; I641-M676 HydrophobicContact CD1-SD 3.54Å; I641-M676 VanDerWaalsContact CD1-SD 3.54Å; I641-M676 HydrophobicContact CG1-SD 4.49Å; I641-I678 HydrophobicContact CG2-CG2 4.22Å
642	L	88.7	Confident	77.8	Confident	29 Å²	29	87.7 Å²	87.7	15%	0.152	45%	0.449	C	S	.	.	H	α-helix	trans	-57.4	-40.3	176	-174.6	65.5	0	0	0	111.5	Y638 V645 K646 V663 L666	Y638-L642 HydrophobicContact CE1-CD2 4.1Å; Y638-L642 WeakPolarHBondContact O-CB 3.43Å; Y638-L642 PolarHBondContact O-N 3.47Å; L642-V645 PolarHBondContact O-N 2.93Å; L642-K646 HydrophobicContact CG-CD 4.35Å; L642-K646 WeakPolarHBondContact O-CB 3.43Å; L642-K646 VanDerWaalsContact O-CG 3.31Å; L642-K646 WeakPolarHBondContact O-CG 3.15Å; L642-K646 PolarHBondContact O-N 3.47Å; L642-V663 HydrophobicContact CD1-CG1 3.98Å; L642-L666 HydrophobicContact CB-CD1 3.8Å; L642-L666 HydrophobicContact CD1-CD1 3.86Å; L642-L666 HydrophobicContact CD1-CG 3.93Å; L642-L666 HydrophobicContact CG-CD1 4.42Å
643	S	88	Confident	80.2	Confident	77 Å²	77	83.7 Å²	83.7	54%	0.538	42%	0.419	S	S	.	.	H	α-helix	trans	-63.6	-43.3	174.4	-175	0	0	0	0	112.2	V639 I641 R647	V639-S643 WeakPolarHBondContact O-CB 3.34Å; V639-S643 PolarHBondContact O-N 3.27Å; I641-S643 VanDerWaalsContact C-N 3.25Å; I641-S643 PolarHBondContact O-N 3.49Å; S643-R647 WeakPolarHBondContact O-CB 3.25Å; S643-R647 PolarHBondContact O-N 3.37Å
644	K	89.7	Confident	82.5	Confident	148 Å²	148	82.5 Å²	82.5	64%	0.643	41%	0.408	S	S	*	.	H	α-helix	trans	-63	-41.3	174.1	-73.2	178.2	179	-177	0	112.4	K640 I641 R647 L648	K640-K644 WeakPolarHBondContact O-CG 3.05Å; K640-K644 PolarHBondContact O-N 3.17Å; K640-K644 VanDerWaalsContact O-N 3.07Å; I641-K644 CarbonylContact O-C 3.56Å; I641-K644 WeakPolarHBondContact O-CA 3.32Å; I641-K644 WeakPolarHBondContact O-CB 3.05Å; I641-K644 PolarHBondContact O-N 3.34Å; K644-R647 PolarHBondContact O-N 3.43Å; K644-L648 WeakPolarHBondContact O-CB 3.43Å; K644-L648 PolarHBondContact O-N 3.33Å
645	V	91.2	Very high	84.2	Confident	4 Å²	4	81.9 Å²	81.9	2%	0.024	41%	0.408	C	S	.	.	H	α-helix	trans	-69.5	-42.8	178.9	177	0	0	0	0	111.3	I641 L642 R647 L648 V649 V663 L666 I678 F680	I641-V645 HydrophobicContact CG2-CG2 4.09Å; I641-V645 WeakPolarHBondContact O-CG2 3.29Å; I641-V645 PolarHBondContact O-N 3.22Å; L642-V645 PolarHBondContact O-N 2.93Å; V645-R647 VanDerWaalsContact C-N 3.29Å; V645-R647 PolarHBondContact O-N 2.81Å; V645-L648 WeakPolarHBondContact O-CB 3.37Å; V645-L648 PolarHBondContact O-N 2.66Å; V645-L648 VanDerWaalsContact O-N 3.14Å; V645-V649 WeakPolarHBondContact O-CG2 3.41Å; V645-V649 PolarHBondContact O-N 2.95Å; V645-V663 HydrophobicContact CG1-CG1 4.38Å; V645-V663 HydrophobicContact CG1-CG2 3.96Å; V645-L666 HydrophobicContact CG2-CD2 4.19Å; V645-I678 HydrophobicContact CG2-CD1 3.36Å; V645-F680 HydrophobicContact CG1-CB 4.42Å; V645-F680 HydrophobicContact CG1-CD1 3.58Å; V645-F680 HydrophobicContact CG1-CD2 3.97Å; V645-F680 HydrophobicContact CG1-CE1 3.7Å; V645-F680 HydrophobicContact CG1-CE2 4.08Å; V645-F680 HydrophobicContact CG1-CG 3.73Å; V645-F680 HydrophobicContact CG1-CZ 3.95Å
646	K	92.3	Very high	85.6	Confident	111 Å²	111	79.9 Å²	79.9	48%	0.483	40%	0.395	S	S	.	.	H	α-helix	trans	-56.6	-44.1	171.6	-78.1	176.8	177	-176.1	0	111.6	L642 F650 V663	L642-K646 HydrophobicContact CG-CD 4.35Å; L642-K646 WeakPolarHBondContact O-CB 3.43Å; L642-K646 VanDerWaalsContact O-CG 3.31Å; L642-K646 WeakPolarHBondContact O-CG 3.15Å; L642-K646 PolarHBondContact O-N 3.47Å; K646-F650 WeakPolarHBondContact O-CB 3.39Å; K646-F650 PolarHBondContact O-N 3.36Å; K646-F650 VanDerWaalsContact O-N 3.15Å; K646-V663 HydrophobicContact CG-CB 3.89Å; K646-V663 HydrophobicContact CG-CG2 4.01Å
647	R	88.2	Confident	86.4	Confident	144 Å²	144	79.3 Å²	79.3	54%	0.543	41%	0.407	S	S	.	.	H	α-helix	trans	-65.1	-40	175.6	-169.4	175.2	-179.2	175.5	1.6	112	S643 K644 V645 F650 V651	S643-R647 WeakPolarHBondContact O-CB 3.25Å; S643-R647 PolarHBondContact O-N 3.37Å; K644-R647 PolarHBondContact O-N 3.43Å; V645-R647 VanDerWaalsContact C-N 3.29Å; V645-R647 PolarHBondContact O-N 2.81Å; R647-F650 PolarHBondContact O-N 3.11Å; R647-V651 HydrophobicContact CG-CG2 4.21Å; R647-V651 WeakPolarHBondContact O-CB 3.38Å; R647-V651 WeakPolarHBondContact O-CG2 3.43Å; R647-V651 PolarHBondContact O-N 3.28Å
648	L	88.8	Confident	87.1	Confident	77 Å²	77	77.4 Å²	77.4	40%	0.403	41%	0.407	S	S	.	.	H	α-helix	trans	-62.7	-51.6	176.7	-174.8	69.4	0	0	0	111.5	K644 V645 F650 V651 E652	K644-L648 WeakPolarHBondContact O-CB 3.43Å; K644-L648 PolarHBondContact O-N 3.33Å; V645-L648 WeakPolarHBondContact O-CB 3.37Å; V645-L648 PolarHBondContact O-N 2.66Å; V645-L648 VanDerWaalsContact O-N 3.14Å; L648-F650 PolarHBondContact O-N 3.38Å; L648-V651 PolarHBondContact O-N 3.05Å; L648-E652 HydrophobicContact CD1-CG 3.94Å; L648-E652 HydrophobicContact CG-CG 4.2Å; L648-E652 VanDerWaalsContact O-CB 3.32Å; L648-E652 WeakPolarHBondContact O-CB 3.46Å; L648-E652 VanDerWaalsContact O-CG 3.31Å; L648-E652 WeakPolarHBondContact O-CG 3.15Å; L648-E652 PolarHBondContact O-N 3.5Å
649	V	90.2	Very high	87.7	Confident	4 Å²	4	78.7 Å²	78.7	2%	0.024	41%	0.412	C	S	.	.	H	α-helix	trans	-56.6	-38.6	177.6	171.8	0	0	0	0	111.8	V645 K653 M654 V661 V663 F680 I682	V645-V649 WeakPolarHBondContact O-CG2 3.41Å; V645-V649 PolarHBondContact O-N 2.95Å; V649-K653 PolarHBondContact O-N 3Å; V649-M654 HydrophobicContact CB-SD 4.24Å; V649-M654 HydrophobicContact CG1-CB 4.16Å; V649-M654 HydrophobicContact CG1-CG 4.49Å; V649-M654 HydrophobicContact CG1-SD 4.17Å; V649-M654 HydrophobicContact CG2-SD 3.79Å; V649-M654 PolarHBondContact O-N 3.39Å; V649-V661 HydrophobicContact CG1-CG2 3.62Å; V649-V663 HydrophobicContact CB-CG2 3.84Å; V649-V663 HydrophobicContact CG1-CG2 4.28Å; V649-V663 HydrophobicContact CG2-CG2 3.4Å; V649-V663 VanDerWaalsContact CG2-CG2 3.4Å; V649-F680 HydrophobicContact CG2-CD2 4.42Å; V649-F680 HydrophobicContact CG2-CE2 3.58Å; V649-F680 HydrophobicContact CG2-CZ 4.07Å; V649-I682 HydrophobicContact CG2-CG2 4.44Å
650	F	84.9	Confident	88.2	Confident	128 Å²	128	77.7 Å²	77.7	56%	0.561	40%	0.399	S	S	*	.	H	α-helix	trans	-70.1	-47.5	176.2	-178.3	-98.4	0	0	0	113.1	K646 R647 L648 K653 I826	K646-F650 WeakPolarHBondContact O-CB 3.39Å; K646-F650 PolarHBondContact O-N 3.36Å; K646-F650 VanDerWaalsContact O-N 3.15Å; R647-F650 PolarHBondContact O-N 3.11Å; L648-F650 PolarHBondContact O-N 3.38Å; F650-K653 PolarHBondContact O-N 3.39Å; F650-I826 HydrophobicContact CE1-CD1 4.29Å; F650-I826 HydrophobicContact CZ-CD1 4.13Å
651	V	84.9	Confident	88.6	Confident	84 Å²	84	72 Å²	72	51%	0.509	38%	0.375	S	S	.	.	H	α-helix	trans	-65.6	-39.5	-179.1	168.7	0	0	0	0	111.6	R647 L648 K653	R647-V651 HydrophobicContact CG-CG2 4.21Å; R647-V651 WeakPolarHBondContact O-CB 3.38Å; R647-V651 WeakPolarHBondContact O-CG2 3.43Å; R647-V651 PolarHBondContact O-N 3.28Å; L648-V651 PolarHBondContact O-N 3.05Å; V651-K653 PolarHBondContact O-N 3.07Å
652	E	88.5	Confident	89	Confident	118 Å²	118	79 Å²	79	55%	0.551	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-5.5	177.5	-67.7	-61.7	150.6	0	0	113.3	L648 M654	L648-E652 HydrophobicContact CD1-CG 3.94Å; L648-E652 HydrophobicContact CG-CG 4.2Å; L648-E652 VanDerWaalsContact O-CB 3.32Å; L648-E652 WeakPolarHBondContact O-CB 3.46Å; L648-E652 VanDerWaalsContact O-CG 3.31Å; L648-E652 WeakPolarHBondContact O-CG 3.15Å; L648-E652 PolarHBondContact O-N 3.5Å; E652-M654 HydrophobicContact CB-CE 4.23Å; E652-M654 HydrophobicContact CB-CG 4.04Å; E652-M654 HydrophobicContact CG-CE 4.48Å; E652-M654 PolarHBondContact O-N 3.28Å
653	K	86.3	Confident	89.2	Confident	67 Å²	67	78.4 Å²	78.4	29%	0.291	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	43.1	-179.9	-50.6	179.6	86.3	174.9	0	112.2	V649 F650 V651 T655 Y660 I826	V649-K653 PolarHBondContact O-N 3Å; F650-K653 PolarHBondContact O-N 3.39Å; V651-K653 PolarHBondContact O-N 3.07Å; K653-T655 WeakPolarHBondContact O-CG2 3.4Å; K653-T655 PolarHBondContact O-N 3.07Å; K653-Y660 HydrophobicContact CB-CE1 4.12Å; K653-I826 HydrophobicContact CD-CB 3.81Å; K653-I826 HydrophobicContact CD-CD1 4.42Å; K653-I826 HydrophobicContact CD-CG2 3.4Å; K653-I826 VanDerWaalsContact CD-CG2 3.4Å; K653-I826 HydrophobicContact CG-CB 4.21Å; K653-I826 HydrophobicContact CG-CD1 4Å; K653-I826 HydrophobicContact CG-CG2 3.62Å; K653-I826 PolarHBondContact NZ-O 3.49Å
654	M	89.8	Confident	89.3	Confident	63 Å²	63	78.6 Å²	78.6	31%	0.31	39%	0.393	S	S	.	.			trans	-61	138.6	-177.5	-69	-174.7	176.1	0	0	111	V649 E652 V661	V649-M654 HydrophobicContact CB-SD 4.24Å; V649-M654 HydrophobicContact CG1-CB 4.16Å; V649-M654 HydrophobicContact CG1-CG 4.49Å; V649-M654 HydrophobicContact CG1-SD 4.17Å; V649-M654 HydrophobicContact CG2-SD 3.79Å; V649-M654 PolarHBondContact O-N 3.39Å; E652-M654 HydrophobicContact CB-CE 4.23Å; E652-M654 HydrophobicContact CB-CG 4.04Å; E652-M654 HydrophobicContact CG-CE 4.48Å; E652-M654 PolarHBondContact O-N 3.28Å; M654-V661 HydrophobicContact CB-CG2 3.47Å; M654-V661 VanDerWaalsContact CB-CG2 3.47Å; M654-V661 WeakPolarHBondContact O-CG2 3.41Å; M654-V661 PolarHBondContact O-N 3.11Å
655	T	90.7	Very high	89.2	Confident	71 Å²	71	77.1 Å²	77.1	44%	0.436	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	146.8	-175.1	59.6	0	0	0	0	111.5	K653 Y659 Y660 T689	K653-T655 WeakPolarHBondContact O-CG2 3.4Å; K653-T655 PolarHBondContact O-N 3.07Å; T655-Y659 CarbonylContact C-O 3.55Å; T655-Y659 WeakPolarHBondContact CA-O 3.43Å; T655-Y659 VanDerWaalsContact CB-O 3.24Å; T655-Y659 WeakPolarHBondContact CB-O 3.48Å; T655-Y660 HydrophobicContact CG2-CD1 4.07Å; T655-Y660 HydrophobicContact CG2-CE1 4.4Å; T655-T689 HydrophobicContact CG2-CG2 3.13Å
656	V	88.3	Confident	89	Confident	69 Å²	69	77.7 Å²	77.7	42%	0.418	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	124.7	173.1	169.6	0	0	0	0	107	G658 Y659 V661 I682 P684	V656-G658 PolarHBondContact O-N 2.84Å; V656-Y659 PolarHBondContact N-O 3.24Å; V656-Y659 PolarHBondContact O-N 3.01Å; V656-Y659 VanDerWaalsContact O-N 3.09Å; V656-V661 HydrophobicContact CB-CG1 3.79Å; V656-V661 HydrophobicContact CG2-CG1 3.6Å; V656-I682 HydrophobicContact CG2-CD1 4.01Å; V656-P684 HydrophobicContact CB-CB 4.37Å
657	G	87.4	Confident	88.7	Confident	76 Å²	76	76.3 Å²	76.3	78%	0.784	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	25.1	-179.3	0	0	0	0	0	114.8	Y659	G657-Y659 VanDerWaalsContact C-N 3.3Å; G657-Y659 WeakPolarHBondContact O-CD2 3.49Å; G657-Y659 PolarHBondContact O-N 3.37Å
658	G	85	Confident	88.5	Confident	33 Å²	33	74.2 Å²	74.2	34%	0.34	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	82	3.3	-177.2	0	0	0	0	0	114.9	V656 T689	V656-G658 PolarHBondContact O-N 2.84Å; G658-T689 WeakPolarHBondContact O-CB 3.4Å; G658-T689 WeakPolarHBondContact O-CG2 3.1Å; G658-T689 PolarHBondContact O-N 3.41Å; G658-T689 PolarHBondContact O-OG1 2.63Å
659	Y	89.2	Confident	88.2	Confident	112 Å²	112	73.4 Å²	73.4	44%	0.439	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	145.2	172.4	-62.8	-91.3	0	0	0	110.6	T655 V656 G657 T685 C687 A688	T655-Y659 CarbonylContact C-O 3.55Å; T655-Y659 WeakPolarHBondContact CA-O 3.43Å; T655-Y659 VanDerWaalsContact CB-O 3.24Å; T655-Y659 WeakPolarHBondContact CB-O 3.48Å; V656-Y659 PolarHBondContact N-O 3.24Å; V656-Y659 PolarHBondContact O-N 3.01Å; V656-Y659 VanDerWaalsContact O-N 3.09Å; G657-Y659 VanDerWaalsContact C-N 3.3Å; G657-Y659 WeakPolarHBondContact O-CD2 3.49Å; G657-Y659 PolarHBondContact O-N 3.37Å; Y659-T685 VanDerWaalsContact CB-O 3.24Å; Y659-T685 WeakPolarHBondContact CB-O 3.29Å; Y659-T685 WeakPolarHBondContact CD1-O 3.43Å; Y659-C687 CarbonylContact C-O 3.6Å; Y659-C687 VanDerWaalsContact CA-O 3.28Å; Y659-C687 WeakPolarHBondContact CA-O 3.3Å; Y659-A688 HydrophobicContact CD1-CB 4.38Å; Y659-A688 HydrophobicContact CE1-CB 4.24Å
660	Y	90.4	Very high	87.8	Confident	71 Å²	71	77.2 Å²	77.2	28%	0.278	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	157.2	170.7	-73	-76.5	0	0	0	110.6	K653 T655 P684 T685 C687 T689	K653-Y660 HydrophobicContact CB-CE1 4.12Å; T655-Y660 HydrophobicContact CG2-CD1 4.07Å; T655-Y660 HydrophobicContact CG2-CE1 4.4Å; Y660-P684 CarbonylContact O-C 3.53Å; Y660-T685 PolarHBondContact O-N 3.33Å; Y660-T685 PolarHBondContact O-OG1 3.01Å; Y660-C687 HydrophobicContact CD2-CB 3.9Å; Y660-C687 WeakPolarHBondContact CD2-O 3.26Å; Y660-C687 PolarHBondContact N-O 2.74Å; Y660-T689 HydrophobicContact CD2-CG2 4.34Å; Y660-T689 HydrophobicContact CE1-CG2 4.46Å; Y660-T689 HydrophobicContact CE2-CG2 4.15Å
661	V	93.6	Very high	87.4	Confident	14 Å²	14	79.4 Å²	79.4	9%	0.085	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	156.6	177.2	-51.6	0	0	0	0	112	V649 M654 V656 I682 I683	V649-V661 HydrophobicContact CG1-CG2 3.62Å; M654-V661 HydrophobicContact CB-CG2 3.47Å; M654-V661 VanDerWaalsContact CB-CG2 3.47Å; M654-V661 WeakPolarHBondContact O-CG2 3.41Å; M654-V661 PolarHBondContact O-N 3.11Å; V656-V661 HydrophobicContact CB-CG1 3.79Å; V656-V661 HydrophobicContact CG2-CG1 3.6Å; V661-I682 HydrophobicContact CB-CB 4.11Å; V661-I682 HydrophobicContact CB-CD1 4.28Å; V661-I682 HydrophobicContact CG1-CD1 4.2Å; V661-I682 HydrophobicContact CG2-CB 4Å; V661-I682 HydrophobicContact CG2-CD1 3.92Å; V661-I682 HydrophobicContact CG2-CG1 4.5Å; V661-I682 HydrophobicContact CG2-CG2 4.12Å; V661-I683 WeakPolarHBondContact CA-O 3.49Å
662	R	92.1	Very high	87.4	Confident	160 Å²	160	77.7 Å²	77.7	60%	0.604	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.1	151.4	169.5	64.7	-179.5	-177.5	-178.3	1.1	110.4	D664 I682 I683 T685	R662-D664 PolarHBondContact O-N 3.47Å; R662-I682 CarbonylContact O-C 3.59Å; R662-I682 VanDerWaalsContact O-CA 3.25Å; R662-I682 WeakPolarHBondContact O-CA 3.36Å; R662-I683 PolarHBondContact N-O 2.05Å; R662-I683 PolarHBondContact O-N 2.86Å; R662-T685 HydrophobicContact CB-CG2 4.15Å; R662-T685 HydrophobicContact CG-CG2 4.19Å
663	V	92.9	Very high	86.9	Confident	15 Å²	15	79.8 Å²	79.8	9%	0.091	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	125.4	172	-178.4	0	0	0	0	109	L642 V645 K646 V649 F680	L642-V663 HydrophobicContact CD1-CG1 3.98Å; V645-V663 HydrophobicContact CG1-CG1 4.38Å; V645-V663 HydrophobicContact CG1-CG2 3.96Å; K646-V663 HydrophobicContact CG-CB 3.89Å; K646-V663 HydrophobicContact CG-CG2 4.01Å; V649-V663 HydrophobicContact CB-CG2 3.84Å; V649-V663 HydrophobicContact CG1-CG2 4.28Å; V649-V663 HydrophobicContact CG2-CG2 3.4Å; V649-V663 VanDerWaalsContact CG2-CG2 3.4Å; V663-F680 HydrophobicContact CG1-CB 4.39Å; V663-F680 HydrophobicContact CG1-CD2 4.45Å; V663-F680 HydrophobicContact CG2-CD2 4.43Å
664	D	91.4	Very high	86.5	Confident	82 Å²	82	83.4 Å²	83.4	44%	0.439	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	-66.5	175.4	172.3	46.9	0	0	0	110.2	R662 T681 I683	R662-D664 PolarHBondContact O-N 3.47Å; D664-T681 WeakPolarHBondContact CB-OG1 3.12Å; D664-T681 PolarHBondContact N-O 3.13Å; D664-T681 PolarHBondContact OD2-OG1 3.37Å; D664-I683 HydrophobicContact CB-CD1 3.6Å; D664-I683 HydrophobicContact CB-CG1 3.85Å; D664-I683 WeakPolarHBondContact OD1-CD1 3.28Å
665	K	87.5	Confident	86	Confident	116 Å²	116	82.1 Å²	82.1	50%	0.504	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	159.6	175.1	60.7	-179.2	176.1	-176.5	0	112.3	T667 F680 T681	K665-T667 HydrophobicContact CG-CG2 4.45Å; K665-F680 CarbonylContact O-C 3.54Å; K665-F680 WeakPolarHBondContact O-CA 3.47Å; K665-F680 VanDerWaalsContact O-CB 3.26Å; K665-F680 WeakPolarHBondContact O-CB 3.43Å; K665-T681 VanDerWaalsContact CG-OG1 3.32Å; K665-T681 WeakPolarHBondContact CG-OG1 3.43Å; K665-T681 PolarHBondContact N-OG1 2.9Å; K665-T681 PolarHBondContact O-N 3.3Å; K665-T681 PolarHBondContact O-OG1 2.91Å
666	L	87	Confident	85.6	Confident	16 Å²	16	83 Å²	83	8%	0.084	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	127.5	165.4	-74.7	158.7	0	0	0	108.5	Y638 I641 L642 V645 A679 F680	Y638-L666 HydrophobicContact CD2-CD1 4.06Å; Y638-L666 HydrophobicContact CE2-CB 3.78Å; Y638-L666 HydrophobicContact CE2-CD1 3.73Å; Y638-L666 HydrophobicContact CE2-CG 4.38Å; I641-L666 HydrophobicContact CG2-CD1 4.25Å; L642-L666 HydrophobicContact CB-CD1 3.8Å; L642-L666 HydrophobicContact CD1-CD1 3.86Å; L642-L666 HydrophobicContact CD1-CG 3.93Å; L642-L666 HydrophobicContact CG-CD1 4.42Å; V645-L666 HydrophobicContact CG2-CD2 4.19Å; L666-A679 CarbonylContact C-O 3.57Å; L666-A679 WeakPolarHBondContact CA-O 3.26Å; L666-F680 HydrophobicContact CD2-CB 4.06Å
667	T	86.3	Confident	85.3	Confident	82 Å²	82	83.5 Å²	83.5	50%	0.503	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	-24.5	178.1	50.5	0	0	0	0	113	K665 A679 F680 T681	K665-T667 HydrophobicContact CG-CG2 4.45Å; T667-A679 PolarHBondContact N-O 3Å; T667-A679 VanDerWaalsContact OG1-CB 3.32Å; T667-A679 WeakPolarHBondContact OG1-CB 3.46Å; T667-A679 PolarHBondContact OG1-O 2.62Å; T667-F680 PolarHBondContact OG1-N 3.39Å; T667-T681 HydrophobicContact CG2-CG2 3.79Å
668	K	84.2	Confident	85.4	Confident	100 Å²	100	82.4 Å²	82.4	44%	0.435	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	135.8	175.1	-165.4	177.5	177.5	-171.5	0	110.2	E670 I678 A679	K668-E670 WeakPolarHBondContact CE-OE2 3.47Å; K668-E670 IonicContact NZ-OE2 2.68Å; K668-E670 PolarHBondContact NZ-OE2 3.35Å; K668-I678 CarbonylContact O-C 3.55Å; K668-I678 VanDerWaalsContact O-CA 3.31Å; K668-I678 WeakPolarHBondContact O-CA 3.39Å; K668-A679 HydrophobicContact CB-CB 3.58Å; K668-A679 PolarHBondContact N-O 3.4Å; K668-A679 VanDerWaalsContact N-O 3.09Å; K668-A679 PolarHBondContact O-N 3.44Å
669	L	82.7	Confident	85.5	Confident	60 Å²	60	82.6 Å²	82.6	31%	0.314	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	105.6	171.2	-165.5	85.7	0	0	0	107.9	I641 I678	I641-L669 HydrophobicContact CB-CD1 4.22Å; I641-L669 HydrophobicContact CD1-CD1 3.51Å; I641-L669 HydrophobicContact CD1-CD2 3.87Å; I641-L669 HydrophobicContact CD1-CG 4.17Å; I641-L669 HydrophobicContact CG1-CD1 4.43Å; I641-L669 HydrophobicContact CG2-CD1 3.64Å; L669-I678 HydrophobicContact CD1-CG2 3.57Å
670	E	81.8	Confident	85.6	Confident	84 Å²	84	80 Å²	80	39%	0.393	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	124.3	-176.6	-178.3	179.4	-164.9	0	0	110.1	K668 V672 M676 N677	K668-E670 WeakPolarHBondContact CE-OE2 3.47Å; K668-E670 IonicContact NZ-OE2 2.68Å; K668-E670 PolarHBondContact NZ-OE2 3.35Å; E670-V672 HydrophobicContact CG-CG1 4.27Å; E670-V672 PolarHBondContact O-N 3.13Å; E670-M676 CarbonylContact O-C 3.57Å; E670-M676 WeakPolarHBondContact O-CA 3.47Å; E670-N677 HydrophobicContact CB-CB 4.39Å; E670-N677 PolarHBondContact N-O 3.26Å; E670-N677 PolarHBondContact O-N 2.89Å
671	K	76.2	Confident	85.7	Confident	174 Å²	174	78.9 Å²	78.9	76%	0.757	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.7	120.5	175	-164.5	173.2	-177.3	174.2	0	108.9	M676	K671-M676 HydrophobicContact CB-CG 4.48Å; K671-M676 HydrophobicContact CG-CG 4.27Å
672	V	84.3	Confident	85.7	Confident	49 Å²	49	81.3 Å²	81.3	30%	0.297	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	164	178.2	-64.6	0	0	0	0	109.8	E670 T674 G675 N677	E670-V672 HydrophobicContact CG-CG1 4.27Å; E670-V672 PolarHBondContact O-N 3.13Å; V672-T674 PolarHBondContact O-N 3.04Å; V672-T674 VanDerWaalsContact O-N 3.07Å; V672-G675 CarbonylContact C-O 3.58Å; V672-G675 PolarHBondContact N-O 2.92Å; V672-G675 CarbonylContact O-C 3.56Å; V672-G675 PolarHBondContact O-N 2.79Å; V672-N677 HydrophobicContact CG1-CB 3.99Å; V672-N677 HydrophobicContact CG2-CB 4.33Å
673	V	77.7	Confident	85.7	Confident	162 Å²	162	76.7 Å²	76.7	98%	0.982	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-30.3	-175.1	-151.4	0	0	0	0	112.7
674	T	78.4	Confident	85.6	Confident	142 Å²	142	79.2 Å²	79.2	87%	0.871	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-5.4	180	54.7	0	0	0	0	114.5	V672	V672-T674 PolarHBondContact O-N 3.04Å; V672-T674 VanDerWaalsContact O-N 3.07Å
675	G	78.3	Confident	85.5	Confident	36 Å²	36	77.2 Å²	77.2	37%	0.371	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	151.9	-135.7	-175.6	0	0	0	0	0	113.7	V672	V672-G675 CarbonylContact C-O 3.58Å; V672-G675 PolarHBondContact N-O 2.92Å; V672-G675 CarbonylContact O-C 3.56Å; V672-G675 PolarHBondContact O-N 2.79Å
676	M	82.7	Confident	85.5	Confident	89 Å²	89	77.9 Å²	77.9	44%	0.438	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	123.6	175.4	-74.6	178.2	-75.1	0	0	108.9	I641 E670 K671 I678	I641-M676 HydrophobicContact CD1-CE 4.17Å; I641-M676 HydrophobicContact CD1-SD 3.54Å; I641-M676 VanDerWaalsContact CD1-SD 3.54Å; I641-M676 HydrophobicContact CG1-SD 4.49Å; E670-M676 CarbonylContact O-C 3.57Å; E670-M676 WeakPolarHBondContact O-CA 3.47Å; K671-M676 HydrophobicContact CB-CG 4.48Å; K671-M676 HydrophobicContact CG-CG 4.27Å; M676-I678 HydrophobicContact CB-CG2 4.45Å
677	N	82.7	Confident	85.3	Confident	80 Å²	80	80.5 Å²	80.5	43%	0.428	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	122.4	169.9	-163.7	-6.5	0	0	0	108.6	E670 V672	E670-N677 HydrophobicContact CB-CB 4.39Å; E670-N677 PolarHBondContact N-O 3.26Å; E670-N677 PolarHBondContact O-N 2.89Å; V672-N677 HydrophobicContact CG1-CB 3.99Å; V672-N677 HydrophobicContact CG2-CB 4.33Å
678	I	88.3	Confident	85.1	Confident	53 Å²	53	79.1 Å²	79.1	27%	0.272	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	137.5	-175.8	56.9	165.2	0	0	0	109.9	I641 V645 K668 L669 M676 F680	I641-I678 HydrophobicContact CG2-CG2 4.22Å; V645-I678 HydrophobicContact CG2-CD1 3.36Å; K668-I678 CarbonylContact O-C 3.55Å; K668-I678 VanDerWaalsContact O-CA 3.31Å; K668-I678 WeakPolarHBondContact O-CA 3.39Å; L669-I678 HydrophobicContact CD1-CG2 3.57Å; M676-I678 HydrophobicContact CB-CG2 4.45Å; I678-F680 HydrophobicContact CD1-CD1 4.49Å; I678-F680 HydrophobicContact CD1-CE1 4.37Å
679	A	87.3	Confident	84.8	Confident	37 Å²	37	77.1 Å²	77.1	31%	0.306	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	143.6	167.8	0	0	0	0	0	109.1	L666 T667 K668	L666-A679 CarbonylContact C-O 3.57Å; L666-A679 WeakPolarHBondContact CA-O 3.26Å; T667-A679 PolarHBondContact N-O 3Å; T667-A679 VanDerWaalsContact OG1-CB 3.32Å; T667-A679 WeakPolarHBondContact OG1-CB 3.46Å; T667-A679 PolarHBondContact OG1-O 2.62Å; K668-A679 HydrophobicContact CB-CB 3.58Å; K668-A679 PolarHBondContact N-O 3.4Å; K668-A679 VanDerWaalsContact N-O 3.09Å; K668-A679 PolarHBondContact O-N 3.44Å
680	F	92.7	Very high	84.2	Confident	57 Å²	57	82.4 Å²	82.4	25%	0.25	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	155	-179.7	54.2	-86.1	0	0	0	110.9	V645 V649 V663 K665 L666 T667 I678 I682	V645-F680 HydrophobicContact CG1-CB 4.42Å; V645-F680 HydrophobicContact CG1-CD1 3.58Å; V645-F680 HydrophobicContact CG1-CD2 3.97Å; V645-F680 HydrophobicContact CG1-CE1 3.7Å; V645-F680 HydrophobicContact CG1-CE2 4.08Å; V645-F680 HydrophobicContact CG1-CG 3.73Å; V645-F680 HydrophobicContact CG1-CZ 3.95Å; V649-F680 HydrophobicContact CG2-CD2 4.42Å; V649-F680 HydrophobicContact CG2-CE2 3.58Å; V649-F680 HydrophobicContact CG2-CZ 4.07Å; V663-F680 HydrophobicContact CG1-CB 4.39Å; V663-F680 HydrophobicContact CG1-CD2 4.45Å; V663-F680 HydrophobicContact CG2-CD2 4.43Å; K665-F680 CarbonylContact O-C 3.54Å; K665-F680 WeakPolarHBondContact O-CA 3.47Å; K665-F680 VanDerWaalsContact O-CB 3.26Å; K665-F680 WeakPolarHBondContact O-CB 3.43Å; L666-F680 HydrophobicContact CD2-CB 4.06Å; T667-F680 PolarHBondContact OG1-N 3.39Å; I678-F680 HydrophobicContact CD1-CD1 4.49Å; I678-F680 HydrophobicContact CD1-CE1 4.37Å; F680-I682 HydrophobicContact CD2-CG2 3.86Å; F680-I682 HydrophobicContact CE2-CG2 3.81Å
681	T	91.9	Very high	82.7	Confident	49 Å²	49	85.1 Å²	85.1	30%	0.301	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	148.7	172	48.8	0	0	0	0	110.5	D664 K665 T667	D664-T681 WeakPolarHBondContact CB-OG1 3.12Å; D664-T681 PolarHBondContact N-O 3.13Å; D664-T681 PolarHBondContact OD2-OG1 3.37Å; K665-T681 VanDerWaalsContact CG-OG1 3.32Å; K665-T681 WeakPolarHBondContact CG-OG1 3.43Å; K665-T681 PolarHBondContact N-OG1 2.9Å; K665-T681 PolarHBondContact O-N 3.3Å; K665-T681 PolarHBondContact O-OG1 2.91Å; T667-T681 HydrophobicContact CG2-CG2 3.79Å
682	I	93	Very high	81.3	Confident	65 Å²	65	81.5 Å²	81.5	33%	0.333	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	147.9	176.2	55.9	173.5	0	0	0	109.7	V649 V656 V661 R662 F680	V649-I682 HydrophobicContact CG2-CG2 4.44Å; V656-I682 HydrophobicContact CG2-CD1 4.01Å; V661-I682 HydrophobicContact CB-CB 4.11Å; V661-I682 HydrophobicContact CB-CD1 4.28Å; V661-I682 HydrophobicContact CG1-CD1 4.2Å; V661-I682 HydrophobicContact CG2-CB 4Å; V661-I682 HydrophobicContact CG2-CD1 3.92Å; V661-I682 HydrophobicContact CG2-CG1 4.5Å; V661-I682 HydrophobicContact CG2-CG2 4.12Å; R662-I682 CarbonylContact O-C 3.59Å; R662-I682 VanDerWaalsContact O-CA 3.25Å; R662-I682 WeakPolarHBondContact O-CA 3.36Å; F680-I682 HydrophobicContact CD2-CG2 3.86Å; F680-I682 HydrophobicContact CE2-CG2 3.81Å
683	I	92.1	Very high	78.9	Confident	63 Å²	63	85 Å²	85	32%	0.323	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	131.7	175.5	-63.6	166.5	0	0	0	108.2	V661 R662 D664	V661-I683 WeakPolarHBondContact CA-O 3.49Å; R662-I683 PolarHBondContact N-O 2.05Å; R662-I683 PolarHBondContact O-N 2.86Å; D664-I683 HydrophobicContact CB-CD1 3.6Å; D664-I683 HydrophobicContact CB-CG1 3.85Å; D664-I683 WeakPolarHBondContact OD1-CD1 3.28Å
684	P	90.8	Very high	77	Confident	67 Å²	67	84.8 Å²	84.8	44%	0.435	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	138.1	172.7	24.8	-31.8	0	0	0	110.9	V656 Y660	V656-P684 HydrophobicContact CB-CB 4.37Å; Y660-P684 CarbonylContact O-C 3.53Å
685	T	89.7	Confident	75.1	Confident	40 Å²	40	81.2 Å²	81.2	25%	0.245	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	175.5	173.1	74.1	0	0	0	0	109.5	Y659 Y660 R662 C687	Y659-T685 VanDerWaalsContact CB-O 3.24Å; Y659-T685 WeakPolarHBondContact CB-O 3.29Å; Y659-T685 WeakPolarHBondContact CD1-O 3.43Å; Y660-T685 PolarHBondContact O-N 3.33Å; Y660-T685 PolarHBondContact O-OG1 3.01Å; R662-T685 HydrophobicContact CB-CG2 4.15Å; R662-T685 HydrophobicContact CG-CG2 4.19Å; T685-C687 PolarHBondContact O-N 3.28Å; T685-C687 PolarHBondContact OG1-N 3.27Å
686	T	87	Confident	73	Confident	131 Å²	131	85.9 Å²	85.9	80%	0.804	51%	0.514	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.1	-3.7	173.6	50.8	0	0	0	0	112.9	A688	T686-A688 PolarHBondContact O-N 2.02Å
687	C	82.6	Confident	70.7	Confident	71 Å²	71	90.9 Å²	90.9	48%	0.48	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	109.6	-175.6	-56.5	0	0	0	0	111.2	Y659 Y660 T685	Y659-C687 CarbonylContact C-O 3.6Å; Y659-C687 VanDerWaalsContact CA-O 3.28Å; Y659-C687 WeakPolarHBondContact CA-O 3.3Å; Y660-C687 HydrophobicContact CD2-CB 3.9Å; Y660-C687 WeakPolarHBondContact CD2-O 3.26Å; Y660-C687 PolarHBondContact N-O 2.74Å; T685-C687 PolarHBondContact O-N 3.28Å; T685-C687 PolarHBondContact OG1-N 3.27Å
688	A	83.1	Confident	68.6	Low	53 Å²	53	92 Å²	92	44%	0.438	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	147.3	174.9	0	0	0	0	0	112.5	Y659 T686	Y659-A688 HydrophobicContact CD1-CB 4.38Å; Y659-A688 HydrophobicContact CE1-CB 4.24Å; T686-A688 PolarHBondContact O-N 2.02Å
689	T	77.8	Confident	66	Low	57 Å²	57	94.9 Å²	94.9	35%	0.35	57%	0.572	S	S	.	*	S	Bend	trans	-80.1	-20.1	-179.7	51.2	0	0	0	0	114.1	T655 G658 Y660	T655-T689 HydrophobicContact CG2-CG2 3.13Å; G658-T689 WeakPolarHBondContact O-CB 3.4Å; G658-T689 WeakPolarHBondContact O-CG2 3.1Å; G658-T689 PolarHBondContact O-N 3.41Å; G658-T689 PolarHBondContact O-OG1 2.63Å; Y660-T689 HydrophobicContact CD2-CG2 4.34Å; Y660-T689 HydrophobicContact CE1-CG2 4.46Å; Y660-T689 HydrophobicContact CE2-CG2 4.15Å
690	K	68.9	Low	63.4	Low	171 Å²	171	100.6 Å²	100.6	74%	0.743	60%	0.598	S	S	*	*			trans	-112.6	112.3	177	-71.1	-177	179.3	178.8	0	109.2	T692	K690-T692 PolarHBondContact O-N 2.88Å
691	V	51.1	Low	60.7	Low	141 Å²	141	102.5 Å²	102.5	86%	0.855	62%	0.616	S	S	*	*			trans	-77.3	98.9	165.2	-172.6	0	0	0	0	106.4	P693	V691-P693 WeakPolarHBondContact O-CD 3.23Å
692	T	46.4	Very low	58.1	Low	98 Å²	98	105.8 Å²	105.8	60%	0.601	64%	0.641	S	S	*	*			trans	-76.3	120.2	168.8	-50.1	0	0	0	0	107.1	K690 L694	K690-T692 PolarHBondContact O-N 2.88Å; T692-L694 HydrophobicContact CG2-CG 4.34Å; T692-L694 PolarHBondContact O-N 3.17Å
693	P	35.3	Very low	55.2	Low	124 Å²	124	110.3 Å²	110.3	81%	0.805	67%	0.666	S	S	*	*			trans	-74.9	97.9	176.9	28.8	-29.7	0	0	0	108.6	V691	V691-P693 WeakPolarHBondContact O-CD 3.23Å
694	L	37.3	Very low	52.7	Low	156 Å²	156	113.2 Å²	113.2	82%	0.817	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-101.4	123.8	170.4	-81.4	161	0	0	0	108.8	T692	T692-L694 HydrophobicContact CG2-CG 4.34Å; T692-L694 PolarHBondContact O-N 3.17Å
695	G	37.9	Very low	50.1	Low	68 Å²	68	116.4 Å²	116.4	70%	0.701	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-65.5	173.5	177.9	0	0	0	0	0	113.8
696	P	35.3	Very low	47.8	Very low	134 Å²	134	121 Å²	121	87%	0.87	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-85.9	135.1	-155.8	32.6	-32.9	0	0	0	113.3
697	Q	33.9	Very low	45.5	Very low	194 Å²	194	119.8 Å²	119.8	91%	0.907	72%	0.718	S	S	*	*			trans	-134.7	151.9	152	-107.6	-158.7	-76.6	0	0	110.1
698	P	37.3	Very low	44	Very low	104 Å²	104	121 Å²	121	68%	0.675	72%	0.716	S	S	*	*			trans	-105.9	163.6	-153.2	14.3	8.1	0	0	0	114.7
699	S	35.7	Very low	43.2	Very low	112 Å²	112	121.9 Å²	121.9	78%	0.783	72%	0.716	S	S	*	*			trans	70.5	102.4	157.9	49	0	0	0	0	120
700	D	31.1	Very low	43.2	Very low	158 Å²	158	124.4 Å²	124.4	85%	0.845	73%	0.732	S	S	*	*				79.9	152.3	127.2	-138.2	28.3	0	0	0	119.4
701	P	37	Very low	43.8	Very low	97 Å²	97	119 Å²	119	63%	0.63	71%	0.709	S	S	*	*			cis	-124.1	120	-41.9	19.7	0.1	0	0	0	110.7
702	S	37.7	Very low	45.3	Very low	117 Å²	117	115 Å²	115	82%	0.818	68%	0.682	S	S	*	*			trans	176.9	76.3	160.6	23.8	0	0	0	0	111.1	P704	S702-P704 WeakPolarHBondContact O-CD 3.09Å
703	D	30.9	Very low	47.2	Very low	161 Å²	161	111.6 Å²	111.6	86%	0.861	66%	0.664	S	S	*	*			trans	-77.7	122.5	166.4	-95.7	-35.6	0	0	0	109.1	E705	D703-E705 PolarHBondContact O-N 2.73Å
704	P	39.6	Very low	49.7	Very low	124 Å²	124	111.2 Å²	111.2	81%	0.805	65%	0.652	S	S	*	*			trans	-72.7	90.1	160.6	30.3	-27.8	0	0	0	107.2	S702 V706	S702-P704 WeakPolarHBondContact O-CD 3.09Å; P704-V706 PolarHBondContact O-N 3.06Å
705	E	36.8	Very low	52.2	Low	134 Å²	134	104.1 Å²	104.1	63%	0.626	62%	0.615	S	S	*	*			trans	-36.5	122	167.7	-163	174.1	-171	0	0	110.5	D703 V707	D703-E705 PolarHBondContact O-N 2.73Å; E705-V707 PolarHBondContact O-N 3.06Å
706	V	42	Very low	54.8	Low	137 Å²	137	101.7 Å²	101.7	83%	0.83	59%	0.586	S	S	*	*			trans	-55.3	100	148.2	171.9	0	0	0	0	103.2	P704 E708	P704-V706 PolarHBondContact O-N 3.06Å; V706-E708 PolarHBondContact O-N 2.89Å
707	V	37.3	Very low	57.4	Low	105 Å²	105	98.9 Å²	98.9	64%	0.636	57%	0.567	S	S	*	*			trans	-59	91.5	-175.7	-178.7	0	0	0	0	107.1	E705 T709	E705-V707 PolarHBondContact O-N 3.06Å; V707-T709 PolarHBondContact O-N 3.38Å
708	E	50.8	Low	60	Low	96 Å²	96	92.3 Å²	92.3	45%	0.449	54%	0.536	S	S	.	.			trans	-51.3	104.6	145.2	-78.5	-167.9	162.2	0	0	102.2	V706 T710 A713	V706-E708 PolarHBondContact O-N 2.89Å; E708-T710 PolarHBondContact O-N 3.14Å; E708-T710 VanDerWaalsContact O-N 3.14Å; E708-A713 HydrophobicContact CB-CB 4.22Å; E708-A713 WeakPolarHBondContact OE2-CB 3.39Å
709	T	66.7	Low	62.6	Low	71 Å²	71	87.3 Å²	87.3	44%	0.436	50%	0.504	S	S	.	.			trans	-46.9	132.1	168.2	46.7	0	0	0	0	105.7	V707 E711 I712 A713	V707-T709 PolarHBondContact O-N 3.38Å; T709-E711 CarbonylContact O-C 3.54Å; T709-E711 PolarHBondContact O-N 3.41Å; T709-I712 PolarHBondContact O-N 3.27Å; T709-I712 WeakPolarHBondContact OG1-CD1 3.32Å; T709-I712 WeakPolarHBondContact OG1-CG1 3.05Å; T709-A713 PolarHBondContact O-N 3.06Å
710	T	79.5	Confident	65.3	Low	110 Å²	110	85.2 Å²	85.2	68%	0.675	48%	0.481	S	S	*	.	H	α-helix	trans	-43.8	-34	-176.5	45.3	0	0	0	0	112.2	E708 A713 E714	E708-T710 PolarHBondContact O-N 3.14Å; E708-T710 VanDerWaalsContact O-N 3.14Å; T710-A713 PolarHBondContact O-N 3.46Å; T710-E714 WeakPolarHBondContact O-CB 3.44Å; T710-E714 VanDerWaalsContact O-CG 3.22Å; T710-E714 WeakPolarHBondContact O-CG 3.29Å; T710-E714 PolarHBondContact O-N 3.47Å
711	E	80.4	Confident	68	Low	58 Å²	58	80.9 Å²	80.9	27%	0.271	46%	0.46	S	S	.	.	H	α-helix	trans	-55	-47.9	170.3	-178.6	162.6	-170.2	0	0	115.4	T709 E714 I715 K745	T709-E711 CarbonylContact O-C 3.54Å; T709-E711 PolarHBondContact O-N 3.41Å; E711-E714 PolarHBondContact O-N 3.46Å; E711-I715 HydrophobicContact CG-CD1 3.7Å; E711-I715 WeakPolarHBondContact O-CB 3.29Å; E711-I715 WeakPolarHBondContact O-CD1 3.42Å; E711-I715 WeakPolarHBondContact O-CG1 3.48Å; E711-I715 PolarHBondContact O-N 3.07Å; E711-K745 WeakPolarHBondContact OE1-CD 3.36Å; E711-K745 WeakPolarHBondContact OE1-CE 3.2Å; E711-K745 IonicContact OE1-NZ 3.74Å; E711-K745 PolarHBondContact OE1-NZ 3.21Å; E711-K745 IonicContact OE2-NZ 3.21Å; E711-K745 PolarHBondContact OE2-NZ 3.35Å
712	I	83.5	Confident	70.5	Confident	56 Å²	56	77 Å²	77	29%	0.287	43%	0.434	S	S	.	.	H	α-helix	trans	-69.7	-39	179.2	-65.5	172.6	0	0	0	111	T709 I715 T716	T709-I712 PolarHBondContact O-N 3.27Å; T709-I712 WeakPolarHBondContact OG1-CD1 3.32Å; T709-I712 WeakPolarHBondContact OG1-CG1 3.05Å; I712-I715 PolarHBondContact O-N 3.18Å; I712-T716 HydrophobicContact CG2-CG2 4.21Å; I712-T716 WeakPolarHBondContact O-CB 3.01Å; I712-T716 VanDerWaalsContact O-CG2 3.26Å; I712-T716 WeakPolarHBondContact O-CG2 3.37Å; I712-T716 PolarHBondContact O-N 2.87Å; I712-T716 PolarHBondContact O-OG1 2.93Å
713	A	86.4	Confident	73	Confident	27 Å²	27	71.5 Å²	71.5	22%	0.223	40%	0.396	C	S	.	.	H	α-helix	trans	-64	-42.5	175.7	0	0	0	0	0	111.5	E708 T709 T710 T716 T717	E708-A713 HydrophobicContact CB-CB 4.22Å; E708-A713 WeakPolarHBondContact OE2-CB 3.39Å; T709-A713 PolarHBondContact O-N 3.06Å; T710-A713 PolarHBondContact O-N 3.46Å; A713-T716 PolarHBondContact O-OG1 3.19Å; A713-T717 VanDerWaalsContact O-CB 3.28Å; A713-T717 WeakPolarHBondContact O-CB 3.12Å; A713-T717 PolarHBondContact O-N 3Å; A713-T717 PolarHBondContact O-OG1 2.83Å
714	E	87.8	Confident	75.7	Confident	117 Å²	117	65.9 Å²	65.9	55%	0.547	37%	0.365	S	S	.	.	H	α-helix	trans	-62.9	-47.9	174.1	-75.9	171.6	-167.4	0	0	111.6	T710 E711 T717 Q718	T710-E714 WeakPolarHBondContact O-CB 3.44Å; T710-E714 VanDerWaalsContact O-CG 3.22Å; T710-E714 WeakPolarHBondContact O-CG 3.29Å; T710-E714 PolarHBondContact O-N 3.47Å; E711-E714 PolarHBondContact O-N 3.46Å; E714-T717 PolarHBondContact O-N 3.48Å; E714-Q718 VanDerWaalsContact O-CG 3.32Å; E714-Q718 WeakPolarHBondContact O-CG 3.43Å; E714-Q718 PolarHBondContact O-N 2.87Å
715	I	89.3	Confident	77.8	Confident	6 Å²	6	65.1 Å²	65.1	3%	0.031	36%	0.358	C	S	.	.	H	α-helix	trans	-62.6	-47	179.6	-69.3	164.1	0	0	0	110.8	E711 I712 T717 Q718 I719 L740 H743 V750 V752	E711-I715 HydrophobicContact CG-CD1 3.7Å; E711-I715 WeakPolarHBondContact O-CB 3.29Å; E711-I715 WeakPolarHBondContact O-CD1 3.42Å; E711-I715 WeakPolarHBondContact O-CG1 3.48Å; E711-I715 PolarHBondContact O-N 3.07Å; I712-I715 PolarHBondContact O-N 3.18Å; I715-T717 VanDerWaalsContact C-N 3.32Å; I715-T717 PolarHBondContact O-N 2.92Å; I715-Q718 PolarHBondContact O-N 3.15Å; I715-I719 HydrophobicContact CG2-CD1 3.78Å; I715-I719 HydrophobicContact CG2-CG1 4.42Å; I715-I719 VanDerWaalsContact O-CG1 3.26Å; I715-I719 WeakPolarHBondContact O-CG1 3.31Å; I715-I719 PolarHBondContact O-N 3.33Å; I715-L740 HydrophobicContact CG2-CD2 3.95Å; I715-H743 HydrophobicContact CD1-CB 4.12Å; I715-V750 HydrophobicContact CD1-CG1 3.94Å; I715-V750 HydrophobicContact CG1-CG1 4.11Å; I715-V750 HydrophobicContact CG1-CG2 4.47Å; I715-V752 HydrophobicContact CG2-CG1 3.89Å
716	T	91.4	Very high	80.1	Confident	17 Å²	17	62.9 Å²	62.9	10%	0.104	35%	0.347	C	S	.	.	H	α-helix	trans	-64.4	-38.4	178.8	55.7	0	0	0	0	111.4	I712 A713 I719 K720 L740	I712-T716 HydrophobicContact CG2-CG2 4.21Å; I712-T716 WeakPolarHBondContact O-CB 3.01Å; I712-T716 VanDerWaalsContact O-CG2 3.26Å; I712-T716 WeakPolarHBondContact O-CG2 3.37Å; I712-T716 PolarHBondContact O-N 2.87Å; I712-T716 PolarHBondContact O-OG1 2.93Å; A713-T716 PolarHBondContact O-OG1 3.19Å; T716-I719 PolarHBondContact O-N 2.82Å; T716-K720 WeakPolarHBondContact O-CB 3.23Å; T716-K720 VanDerWaalsContact O-CG 3.23Å; T716-K720 WeakPolarHBondContact O-CG 3.29Å; T716-K720 PolarHBondContact O-N 3.36Å; T716-L740 HydrophobicContact CG2-CD2 4.29Å
717	T	90.2	Very high	82.2	Confident	75 Å²	75	62.3 Å²	62.3	46%	0.46	33%	0.329	S	S	.	.	H	α-helix	trans	-62.1	-43.3	174.2	-61.1	0	0	0	0	111.7	A713 E714 I715 K720 T721	A713-T717 VanDerWaalsContact O-CB 3.28Å; A713-T717 WeakPolarHBondContact O-CB 3.12Å; A713-T717 PolarHBondContact O-N 3Å; A713-T717 PolarHBondContact O-OG1 2.83Å; E714-T717 PolarHBondContact O-N 3.48Å; I715-T717 VanDerWaalsContact C-N 3.32Å; I715-T717 PolarHBondContact O-N 2.92Å; T717-K720 PolarHBondContact O-N 2.71Å; T717-T721 WeakPolarHBondContact O-CB 3.32Å; T717-T721 PolarHBondContact O-N 2.89Å; T717-T721 PolarHBondContact O-OG1 2.85Å
718	Q	88.8	Confident	84.7	Confident	56 Å²	56	58.9 Å²	58.9	26%	0.262	31%	0.306	S	S	.	.	H	α-helix	trans	-64.6	-39.6	175	-68.3	176.6	41.3	0	0	112.1	E714 I715 T721 T722 I792	E714-Q718 VanDerWaalsContact O-CG 3.32Å; E714-Q718 WeakPolarHBondContact O-CG 3.43Å; E714-Q718 PolarHBondContact O-N 2.87Å; I715-Q718 PolarHBondContact O-N 3.15Å; Q718-T721 PolarHBondContact O-N 3.42Å; Q718-T722 WeakPolarHBondContact O-CB 3.5Å; Q718-T722 PolarHBondContact O-N 3.06Å; Q718-T722 PolarHBondContact O-OG1 3.29Å; Q718-I792 HydrophobicContact CB-CG2 3.81Å; Q718-I792 VanDerWaalsContact OE1-CG2 3.28Å
719	I	91.9	Very high	86.5	Confident	0 Å²	0	58 Å²	58	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-61.7	-52.1	174.5	-67.8	161.9	0	0	0	110.6	I715 T716 T721 T722 I723 L737 L740 V752 F754 I792	I715-I719 HydrophobicContact CG2-CD1 3.78Å; I715-I719 HydrophobicContact CG2-CG1 4.42Å; I715-I719 VanDerWaalsContact O-CG1 3.26Å; I715-I719 WeakPolarHBondContact O-CG1 3.31Å; I715-I719 PolarHBondContact O-N 3.33Å; T716-I719 PolarHBondContact O-N 2.82Å; I719-T721 VanDerWaalsContact C-N 3.27Å; I719-T721 PolarHBondContact O-N 3.43Å; I719-T722 WeakPolarHBondContact O-CB 3.44Å; I719-T722 PolarHBondContact O-N 3.06Å; I719-T722 VanDerWaalsContact O-N 3.09Å; I719-I723 HydrophobicContact CG2-CD1 3.91Å; I719-I723 HydrophobicContact CG2-CG1 4.43Å; I719-I723 WeakPolarHBondContact O-CG1 3.37Å; I719-I723 PolarHBondContact O-N 3.28Å; I719-L737 HydrophobicContact CB-CD2 4.34Å; I719-L737 HydrophobicContact CG2-CD1 3.73Å; I719-L737 HydrophobicContact CG2-CD2 3.96Å; I719-L737 HydrophobicContact CG2-CG 4.34Å; I719-L740 HydrophobicContact CD1-CD1 3.63Å; I719-V752 HydrophobicContact CD1-CG1 4.37Å; I719-F754 HydrophobicContact CD1-CD1 4.25Å; I719-F754 HydrophobicContact CD1-CG 4.47Å; I719-F754 HydrophobicContact CG1-CD1 4.38Å; I719-F754 HydrophobicContact CG1-CE1 4.44Å; I719-F754 HydrophobicContact CG2-CD1 4.23Å; I719-F754 HydrophobicContact CG2-CD2 3.82Å; I719-F754 HydrophobicContact CG2-CE1 4.14Å; I719-F754 HydrophobicContact CG2-CE2 3.71Å; I719-F754 HydrophobicContact CG2-CG 4.07Å; I719-F754 HydrophobicContact CG2-CZ 3.88Å; I719-I792 HydrophobicContact CB-CD1 4.12Å; I719-I792 HydrophobicContact CD1-CD1 4.31Å; I719-I792 HydrophobicContact CG1-CD1 3.19Å
720	K	92.4	Very high	87.5	Confident	68 Å²	68	55 Å²	55	30%	0.296	29%	0.285	S	S	.	.	H	α-helix	trans	-58.9	-41.2	-179.1	-67.3	177.6	178.3	169.5	0	111.1	T716 T717 I723 I724 L737 M769 Y773	T716-K720 WeakPolarHBondContact O-CB 3.23Å; T716-K720 VanDerWaalsContact O-CG 3.23Å; T716-K720 WeakPolarHBondContact O-CG 3.29Å; T716-K720 PolarHBondContact O-N 3.36Å; T717-K720 PolarHBondContact O-N 2.71Å; K720-I723 PolarHBondContact O-N 3.39Å; K720-I724 PolarHBondContact O-N 2.93Å; K720-L737 HydrophobicContact CG-CB 4.31Å; K720-L737 HydrophobicContact CG-CD2 3.89Å; K720-M769 HydrophobicContact CB-CE 3.24Å; K720-M769 HydrophobicContact CB-SD 3.72Å; K720-M769 HydrophobicContact CD-CE 4.25Å; K720-M769 HydrophobicContact CD-SD 4.47Å; K720-M769 HydrophobicContact CG-CE 4.37Å; K720-Y773 HydrophobicContact CB-CE2 4.03Å; K720-Y773 HydrophobicContact CD-CE1 4.23Å; K720-Y773 HydrophobicContact CD-CE2 4.13Å; K720-Y773 HydrophobicContact CG-CE1 4.21Å; K720-Y773 HydrophobicContact CG-CE2 4Å; K720-Y773 WeakPolarHBondContact CG-OH 3.39Å
721	T	88.7	Confident	87.6	Confident	66 Å²	66	55.5 Å²	55.5	41%	0.405	28%	0.283	S	S	.	.	H	α-helix	trans	-62.2	-45.6	175.7	-56.6	0	0	0	0	110.5	T717 Q718 I719 I723 I724 T725	T717-T721 WeakPolarHBondContact O-CB 3.32Å; T717-T721 PolarHBondContact O-N 2.89Å; T717-T721 PolarHBondContact O-OG1 2.85Å; Q718-T721 PolarHBondContact O-N 3.42Å; I719-T721 VanDerWaalsContact C-N 3.27Å; I719-T721 PolarHBondContact O-N 3.43Å; T721-I723 PolarHBondContact O-N 2.79Å; T721-I724 PolarHBondContact O-N 3.28Å; T721-T725 WeakPolarHBondContact O-CB 3.41Å; T721-T725 PolarHBondContact O-N 3.25Å; T721-T725 PolarHBondContact O-OG1 3.48Å
722	T	89	Confident	87.8	Confident	16 Å²	16	54.6 Å²	54.6	10%	0.098	29%	0.29	C	S	.	.	H	α-helix	trans	-60.5	-42.4	178.7	-57.6	0	0	0	0	112.4	Q718 I719 I724 T725 K726 P800 I802	Q718-T722 WeakPolarHBondContact O-CB 3.5Å; Q718-T722 PolarHBondContact O-N 3.06Å; Q718-T722 PolarHBondContact O-OG1 3.29Å; I719-T722 WeakPolarHBondContact O-CB 3.44Å; I719-T722 PolarHBondContact O-N 3.06Å; I719-T722 VanDerWaalsContact O-N 3.09Å; T722-I724 VanDerWaalsContact C-N 3.3Å; T722-I724 PolarHBondContact O-N 3.44Å; T722-T725 PolarHBondContact O-N 3.09Å; T722-K726 HydrophobicContact CG2-CG 4.05Å; T722-K726 VanDerWaalsContact O-CB 3.27Å; T722-K726 WeakPolarHBondContact O-CB 3.22Å; T722-K726 PolarHBondContact O-N 3.27Å; T722-P800 HydrophobicContact CG2-CB 4.11Å; T722-P800 HydrophobicContact CG2-CG 3.65Å; T722-I802 HydrophobicContact CG2-CD1 3.56Å
723	I	89.8	Confident	88.1	Confident	2 Å²	2	54.1 Å²	54.1	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-57	-43.2	177.6	-71.1	169.3	0	0	0	111.2	I719 K720 T721 R727 F728 A735 L737 F754 I756	I719-I723 HydrophobicContact CG2-CD1 3.91Å; I719-I723 HydrophobicContact CG2-CG1 4.43Å; I719-I723 WeakPolarHBondContact O-CG1 3.37Å; I719-I723 PolarHBondContact O-N 3.28Å; K720-I723 PolarHBondContact O-N 3.39Å; T721-I723 PolarHBondContact O-N 2.79Å; I723-R727 PolarHBondContact O-N 3.09Å; I723-F728 HydrophobicContact CG1-CD2 4.01Å; I723-F728 HydrophobicContact CG1-CE2 4.46Å; I723-F728 HydrophobicContact CG2-CB 4.26Å; I723-F728 PolarHBondContact O-N 3.37Å; I723-A735 WeakPolarHBondContact CG2-O 3.17Å; I723-L737 HydrophobicContact CD1-CB 3.78Å; I723-F754 HydrophobicContact CD1-CE2 4.21Å; I723-F754 HydrophobicContact CG1-CE2 4.41Å; I723-I756 HydrophobicContact CD1-CG2 3.8Å; I723-I756 HydrophobicContact CG1-CG2 4.38Å
724	I	87.5	Confident	88.2	Confident	42 Å²	42	53.5 Å²	53.5	22%	0.215	28%	0.279	C	S	.	.	H	α-helix	trans	-74.1	-49.2	179.9	-64.6	177	0	0	0	110.9	K720 T721 T722 K726 R727 M769 L772	K720-I724 PolarHBondContact O-N 2.93Å; T721-I724 PolarHBondContact O-N 3.28Å; T722-I724 VanDerWaalsContact C-N 3.3Å; T722-I724 PolarHBondContact O-N 3.44Å; I724-K726 VanDerWaalsContact C-N 3.34Å; I724-K726 PolarHBondContact O-N 3.1Å; I724-R727 PolarHBondContact O-N 3.29Å; I724-R727 VanDerWaalsContact O-N 3.14Å; I724-M769 VanDerWaalsContact CD1-CA 3.43Å; I724-M769 HydrophobicContact CD1-CB 3.75Å; I724-M769 HydrophobicContact CD1-CE 4.45Å; I724-M769 HydrophobicContact CD1-CG 4.14Å; I724-M769 HydrophobicContact CD1-SD 3.32Å; I724-M769 WeakPolarHBondContact CD1-SD 3.27Å; I724-M769 HydrophobicContact CG1-SD 4.45Å; I724-L772 HydrophobicContact CD1-CD2 3.98Å; I724-L772 HydrophobicContact CG1-CD2 3.64Å
725	T	84.4	Confident	88.4	Confident	108 Å²	108	48 Å²	48	66%	0.663	25%	0.253	S	S	*	.	H	α-helix	trans	-64.2	-38.2	-177.1	-54.6	0	0	0	0	112.2	T721 T722 R727	T721-T725 WeakPolarHBondContact O-CB 3.41Å; T721-T725 PolarHBondContact O-N 3.25Å; T721-T725 PolarHBondContact O-OG1 3.48Å; T722-T725 PolarHBondContact O-N 3.09Å; T725-R727 VanDerWaalsContact C-N 3.34Å
726	K	84.8	Confident	88.5	Confident	88 Å²	88	50.1 Å²	50.1	38%	0.383	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-3.2	176.8	-68.6	-71.9	-171.3	174.7	0	113.7	T722 I724 F728	T722-K726 HydrophobicContact CG2-CG 4.05Å; T722-K726 VanDerWaalsContact O-CB 3.27Å; T722-K726 WeakPolarHBondContact O-CB 3.22Å; T722-K726 PolarHBondContact O-N 3.27Å; I724-K726 VanDerWaalsContact C-N 3.34Å; I724-K726 PolarHBondContact O-N 3.1Å; K726-F728 HydrophobicContact CB-CD1 3.75Å; K726-F728 HydrophobicContact CB-CE1 3.46Å; K726-F728 VanDerWaalsContact CB-CE1 3.46Å; K726-F728 HydrophobicContact CB-CZ 4.41Å; K726-F728 HydrophobicContact CG-CE1 4.24Å
727	R	86.8	Confident	88.6	Confident	124 Å²	124	50.3 Å²	50.3	47%	0.468	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	48	63.5	-176.3	-59.9	-172.6	-167.9	-175.9	4.5	112.5	I723 I724 T725 I729 H766	I723-R727 PolarHBondContact O-N 3.09Å; I724-R727 PolarHBondContact O-N 3.29Å; I724-R727 VanDerWaalsContact O-N 3.14Å; T725-R727 VanDerWaalsContact C-N 3.34Å; R727-I729 PolarHBondContact O-N 2.02Å; R727-H766 PolarHBondContact NH2-CE1 2.98Å; R727-H766 PolarHBondContact NH2-NE2 3.39Å
728	F	89.6	Confident	88.6	Confident	34 Å²	34	49.5 Å²	49.5	15%	0.149	25%	0.254	C	S	.	.			trans	-67.7	121.2	173.6	-73.5	5.3	0	0	0	109.6	I723 K726 A735 F754 I756 I802	I723-F728 HydrophobicContact CG1-CD2 4.01Å; I723-F728 HydrophobicContact CG1-CE2 4.46Å; I723-F728 HydrophobicContact CG2-CB 4.26Å; I723-F728 PolarHBondContact O-N 3.37Å; K726-F728 HydrophobicContact CB-CD1 3.75Å; K726-F728 HydrophobicContact CB-CE1 3.46Å; K726-F728 VanDerWaalsContact CB-CE1 3.46Å; K726-F728 HydrophobicContact CB-CZ 4.41Å; K726-F728 HydrophobicContact CG-CE1 4.24Å; F728-A735 HydrophobicContact CB-CB 3.94Å; F728-A735 WeakPolarHBondContact O-CB 3.3Å; F728-A735 PolarHBondContact O-N 2.85Å; F728-F754 HydrophobicContact CE2-CZ 4.48Å; F728-I756 HydrophobicContact CB-CD1 4.43Å; F728-I756 HydrophobicContact CD2-CD1 4.05Å; F728-I802 HydrophobicContact CE2-CG2 3.96Å; F728-I802 HydrophobicContact CZ-CB 4.05Å; F728-I802 HydrophobicContact CZ-CG2 3.89Å
729	I	88.4	Confident	88.6	Confident	76 Å²	76	51.8 Å²	51.8	39%	0.39	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	133.9	-175.4	-67.8	169.1	0	0	0	109.1	R727 Q733	R727-I729 PolarHBondContact O-N 2.02Å; I729-Q733 CarbonylContact C-O 3.51Å; I729-Q733 VanDerWaalsContact CA-O 3.27Å; I729-Q733 WeakPolarHBondContact CA-O 3.45Å; I729-Q733 WeakPolarHBondContact CG2-O 3.18Å
730	I	86.9	Confident	88.6	Confident	10 Å²	10	53.2 Å²	53.2	5%	0.051	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	120.9	171.7	-58.6	168.9	0	0	0	106.8	G732 Q733 A735 I756 E758 L786	I730-G732 PolarHBondContact O-N 2.8Å; I730-G732 VanDerWaalsContact O-N 3.15Å; I730-Q733 PolarHBondContact N-O 2.82Å; I730-Q733 PolarHBondContact O-N 2.98Å; I730-A735 HydrophobicContact CD1-CB 3.92Å; I730-A735 HydrophobicContact CG1-CB 4.13Å; I730-I756 HydrophobicContact CD1-CD1 4.1Å; I730-I756 HydrophobicContact CD1-CG1 4.05Å; I730-I756 HydrophobicContact CG1-CD1 4.49Å; I730-E758 HydrophobicContact CB-CB 4Å; I730-E758 HydrophobicContact CB-CG 4.11Å; I730-E758 HydrophobicContact CD1-CB 4.44Å; I730-E758 HydrophobicContact CG2-CB 3.94Å; I730-E758 HydrophobicContact CG2-CG 4.16Å; I730-L786 HydrophobicContact CD1-CD1 4.08Å; I730-L786 HydrophobicContact CD1-CG 4.15Å; I730-L786 HydrophobicContact CG1-CD1 3.79Å; I730-L786 HydrophobicContact CG1-CG 4.35Å
731	N	81.7	Confident	88.5	Confident	119 Å²	119	53.2 Å²	53.2	64%	0.636	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	37.3	-179.8	-58.2	-36.1	0	0	0	114.7	Q733 E758	N731-Q733 VanDerWaalsContact C-N 3.27Å; N731-Q733 PolarHBondContact O-N 3.21Å; N731-E758 PolarHBondContact ND2-OE2 3.16Å
732	G	84.7	Confident	88.6	Confident	40 Å²	40	52.7 Å²	52.7	41%	0.412	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.5	1.1	-178.9	0	0	0	0	0	115.3	I730 G763	I730-G732 PolarHBondContact O-N 2.8Å; I730-G732 VanDerWaalsContact O-N 3.15Å; G732-G763 WeakPolarHBondContact O-CA 3.46Å; G732-G763 PolarHBondContact O-N 2.96Å
733	Q	88.9	Confident	88.7	Confident	46 Å²	46	55.4 Å²	55.4	22%	0.215	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	152.7	174.1	-80.5	151	85.6	0	0	111.2	I729 I730 N731 E758 T759 C761	I729-Q733 CarbonylContact C-O 3.51Å; I729-Q733 VanDerWaalsContact CA-O 3.27Å; I729-Q733 WeakPolarHBondContact CA-O 3.45Å; I729-Q733 WeakPolarHBondContact CG2-O 3.18Å; I730-Q733 PolarHBondContact N-O 2.82Å; I730-Q733 PolarHBondContact O-N 2.98Å; N731-Q733 VanDerWaalsContact C-N 3.27Å; N731-Q733 PolarHBondContact O-N 3.21Å; Q733-E758 HydrophobicContact CB-CG 3.82Å; Q733-E758 PolarHBondContact NE2-OE1 2.72Å; Q733-E758 PolarHBondContact OE1-OE1 3.47Å; Q733-T759 WeakPolarHBondContact CB-O 3.22Å; Q733-T759 VanDerWaalsContact CD-O 3.28Å; Q733-T759 WeakPolarHBondContact CG-O 3.19Å; Q733-T759 PolarHBondContact OE1-O 3.15Å; Q733-C761 CarbonylContact C-O 3.46Å; Q733-C761 WeakPolarHBondContact CA-O 3.43Å; Q733-C761 WeakPolarHBondContact CB-O 3.5Å
734	H	90.3	Very high	88.7	Confident	14 Å²	14	61.8 Å²	61.8	7%	0.065	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	145.8	173.8	-79.8	-83.2	0	0	0	111.1	T759 C761 D762 V765 V767 L772	H734-T759 WeakPolarHBondContact CB-OG1 3.4Å; H734-T759 VanDerWaalsContact O-CB 3.28Å; H734-T759 WeakPolarHBondContact O-CB 3.29Å; H734-T759 WeakPolarHBondContact O-CG2 3.29Å; H734-T759 PolarHBondContact O-N 3Å; H734-T759 PolarHBondContact O-OG1 3.25Å; H734-C761 HydrophobicContact CB-CB 4.48Å; H734-C761 PolarHBondContact N-O 2.96Å; H734-D762 PolarHBondContact CD2-O 3.48Å; H734-D762 PolarHBondContact NE2-O 2.9Å; H734-D762 VanDerWaalsContact NE2-O 3.16Å; H734-V765 PolarHBondContact CE1-O 2.78Å; H734-V765 PolarHBondContact NE2-O 3.19Å; H734-V767 WeakPolarHBondContact NE2-CG2 3.47Å; H734-L772 HydrophobicContact CB-CD1 3.57Å
735	A	91.4	Very high	88.6	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	148.5	170.3	0	0	0	0	0	110.9	I723 F728 I730 I756 M757	I723-A735 WeakPolarHBondContact CG2-O 3.17Å; F728-A735 HydrophobicContact CB-CB 3.94Å; F728-A735 WeakPolarHBondContact O-CB 3.3Å; F728-A735 PolarHBondContact O-N 2.85Å; I730-A735 HydrophobicContact CD1-CB 3.92Å; I730-A735 HydrophobicContact CG1-CB 4.13Å; A735-I756 HydrophobicContact CB-CB 4.24Å; A735-I756 HydrophobicContact CB-CD1 3.93Å; A735-I756 HydrophobicContact CB-CG1 4.48Å; A735-M757 WeakPolarHBondContact CA-O 3.14Å
736	R	91.1	Very high	88.6	Confident	51 Å²	51	63.3 Å²	63.3	19%	0.192	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	152	168.9	67.9	177.6	-174.7	-177.4	3.8	110.9	D738 I756 M757 T759 Y773	R736-D738 PolarHBondContact O-N 3.07Å; R736-I756 CarbonylContact O-C 3.5Å; R736-I756 VanDerWaalsContact O-CA 3.24Å; R736-I756 WeakPolarHBondContact O-CA 3.42Å; R736-M757 HydrophobicContact CG-CG 3.48Å; R736-M757 VanDerWaalsContact CG-CG 3.48Å; R736-M757 HydrophobicContact CG-SD 4.3Å; R736-M757 PolarHBondContact N-O 2.87Å; R736-M757 PolarHBondContact NE-SD 3.47Å; R736-M757 PolarHBondContact NH2-SD 2.95Å; R736-M757 PolarHBondContact O-N 3.49Å; R736-T759 HydrophobicContact CB-CG2 3.62Å; R736-T759 HydrophobicContact CG-CG2 3.66Å; R736-Y773 HydrophobicContact CB-CE1 4.13Å
737	L	93	Very high	88.4	Confident	22 Å²	22	67.3 Å²	67.3	12%	0.115	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	125	170.3	-179	60.5	0	0	0	109.4	I719 K720 I723 F754 Y773	I719-L737 HydrophobicContact CB-CD2 4.34Å; I719-L737 HydrophobicContact CG2-CD1 3.73Å; I719-L737 HydrophobicContact CG2-CD2 3.96Å; I719-L737 HydrophobicContact CG2-CG 4.34Å; K720-L737 HydrophobicContact CG-CB 4.31Å; K720-L737 HydrophobicContact CG-CD2 3.89Å; I723-L737 HydrophobicContact CD1-CB 3.78Å; L737-F754 HydrophobicContact CD1-CB 3.9Å; L737-F754 HydrophobicContact CD1-CD2 3.64Å; L737-F754 HydrophobicContact CD1-CG 4.08Å; L737-Y773 HydrophobicContact CB-CE1 4.15Å; L737-Y773 VanDerWaalsContact CB-OH 3.28Å; L737-Y773 WeakPolarHBondContact CB-OH 3.39Å; L737-Y773 PolarHBondContact N-OH 2.78Å
738	D	89.9	Confident	88.1	Confident	57 Å²	57	66.1 Å²	66.1	31%	0.305	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	-54.8	174.3	169.8	73.2	0	0	0	110.4	R736 T755 M757 K785	R736-D738 PolarHBondContact O-N 3.07Å; D738-T755 WeakPolarHBondContact CB-O 3.35Å; D738-T755 WeakPolarHBondContact CB-OG1 3.43Å; D738-T755 PolarHBondContact N-O 2.67Å; D738-T755 PolarHBondContact OD2-OG1 2.8Å; D738-M757 HydrophobicContact CB-CB 4.36Å; D738-M757 HydrophobicContact CB-CG 4.13Å; D738-M757 HydrophobicContact CB-SD 4.01Å; D738-K785 IonicContact OD1-NZ 2.81Å; D738-K785 PolarHBondContact OD1-NZ 2.93Å; D738-K785 WeakPolarHBondContact OD2-CD 3.5Å; D738-K785 WeakPolarHBondContact OD2-CE 3.38Å; D738-K785 IonicContact OD2-NZ 2.8Å; D738-K785 PolarHBondContact OD2-NZ 3.04Å
739	K	90.2	Very high	87.9	Confident	104 Å²	104	64.9 Å²	64.9	45%	0.452	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	142.2	179.2	-174.6	173.3	178.9	177.8	0	112.9	F754 T755 S821	K739-F754 CarbonylContact O-C 3.47Å; K739-F754 WeakPolarHBondContact O-CA 3.18Å; K739-F754 VanDerWaalsContact O-CB 3.3Å; K739-F754 WeakPolarHBondContact O-CB 3.34Å; K739-T755 PolarHBondContact N-O 3.14Å; K739-T755 PolarHBondContact N-OG1 3.07Å; K739-T755 VanDerWaalsContact N-OG1 3.11Å; K739-T755 PolarHBondContact O-N 2.99Å; K739-T755 PolarHBondContact O-OG1 3.24Å; K739-S821 PolarHBondContact NZ-OG 3.15Å
740	L	91.8	Very high	88	Confident	30 Å²	30	61.9 Å²	61.9	16%	0.157	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	119.3	163.9	-178	60	0	0	0	109.6	I715 T716 I719 S742 V752 F754	I715-L740 HydrophobicContact CG2-CD2 3.95Å; T716-L740 HydrophobicContact CG2-CD2 4.29Å; I719-L740 HydrophobicContact CD1-CD1 3.63Å; L740-S742 WeakPolarHBondContact CD1-O 3.01Å; L740-V752 HydrophobicContact CD1-CB 4.29Å; L740-V752 HydrophobicContact CD1-CG1 4.42Å; L740-F754 HydrophobicContact CD1-CB 4.19Å
741	I	90.1	Very high	88.1	Confident	69 Å²	69	66 Å²	66	35%	0.354	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-51.6	179.2	-62.3	-179.3	0	0	0	110.5	E753 T755 I787	I741-E753 WeakPolarHBondContact CA-O 3.43Å; I741-E753 HydrophobicContact CB-CB 4.19Å; I741-E753 HydrophobicContact CB-CG 3.9Å; I741-E753 VanDerWaalsContact CB-O 3.3Å; I741-E753 WeakPolarHBondContact CB-O 3.03Å; I741-E753 HydrophobicContact CD1-CG 4.02Å; I741-E753 HydrophobicContact CG1-CG 4.44Å; I741-E753 HydrophobicContact CG2-CG 4.1Å; I741-E753 PolarHBondContact N-O 2.87Å; I741-T755 HydrophobicContact CD1-CG2 3.8Å; I741-T755 HydrophobicContact CG1-CG2 4.34Å; I741-I787 HydrophobicContact CD1-CD1 3.67Å; I741-I787 HydrophobicContact CD1-CG1 3.98Å
742	S	90.8	Very high	88.6	Confident	54 Å²	54	60.4 Å²	60.4	38%	0.378	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	154.8	-179.7	72.1	0	0	0	0	111.5	L740 V752 E753	L740-S742 WeakPolarHBondContact CD1-O 3.01Å; S742-V752 WeakPolarHBondContact O-CA 3.5Å; S742-E753 PolarHBondContact N-O 2.71Å; S742-E753 PolarHBondContact O-N 3.37Å; S742-E753 WeakPolarHBondContact OG-CB 3.38Å; S742-E753 PolarHBondContact OG-OE2 3.06Å
743	H	90.9	Very high	89	Confident	74 Å²	74	60.4 Å²	60.4	34%	0.343	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	147.6	171.3	65.8	-85.5	0	0	0	110.6	I715 V750 Q751 V752	I715-H743 HydrophobicContact CD1-CB 4.12Å; H743-V750 HydrophobicContact CB-CG1 4.17Å; H743-Q751 CarbonylContact C-O 3.53Å; H743-Q751 VanDerWaalsContact CA-O 3.23Å; H743-Q751 WeakPolarHBondContact CA-O 3.48Å; H743-V752 HydrophobicContact CB-CG1 4.27Å
744	K	89.6	Confident	89.3	Confident	136 Å²	136	58.2 Å²	58.2	59%	0.591	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.8	125.4	175	-177.2	-178.3	177.7	-175.4	0	109.4	V746 Q751	K744-V746 PolarHBondContact O-N 2.88Å; K744-Q751 HydrophobicContact CB-CB 4.45Å; K744-Q751 PolarHBondContact N-O 2.67Å; K744-Q751 WeakPolarHBondContact O-CB 3.48Å; K744-Q751 PolarHBondContact O-N 3.28Å
745	K	85.6	Confident	89.4	Confident	134 Å²	134	58 Å²	58	58%	0.583	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.7	130.5	170.2	-76.3	171.3	168.8	152.1	0	109.8	E711	E711-K745 WeakPolarHBondContact OE1-CD 3.36Å; E711-K745 WeakPolarHBondContact OE1-CE 3.2Å; E711-K745 IonicContact OE1-NZ 3.74Å; E711-K745 PolarHBondContact OE1-NZ 3.21Å; E711-K745 IonicContact OE2-NZ 3.21Å; E711-K745 PolarHBondContact OE2-NZ 3.35Å
746	V	84.9	Confident	89.4	Confident	47 Å²	47	58.1 Å²	58.1	29%	0.285	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	162.7	175.8	-64.8	0	0	0	0	108.9	K744 N748 G749 Q751 I791	K744-V746 PolarHBondContact O-N 2.88Å; V746-N748 PolarHBondContact O-N 3.44Å; V746-G749 CarbonylContact C-O 3.59Å; V746-G749 VanDerWaalsContact CG2-O 3.23Å; V746-G749 WeakPolarHBondContact CG2-O 3.44Å; V746-G749 PolarHBondContact N-O 3.08Å; V746-G749 PolarHBondContact O-N 2.87Å; V746-G749 VanDerWaalsContact O-N 3.08Å; V746-Q751 HydrophobicContact CG1-CB 4.13Å; V746-Q751 HydrophobicContact CG2-CB 4.37Å; V746-I791 HydrophobicContact CG2-CD1 4.36Å; V746-I791 HydrophobicContact CG2-CG2 4.21Å
747	D	80.6	Confident	89.3	Confident	173 Å²	173	56.7 Å²	56.7	93%	0.925	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-30.9	-174.1	-58.3	-27	0	0	0	113.7
748	N	80.5	Confident	89.1	Confident	99 Å²	99	55.8 Å²	55.8	53%	0.529	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	7.9	-175.7	-63	-0.2	0	0	0	114.3	V746 T793 M798	V746-N748 PolarHBondContact O-N 3.44Å; N748-T793 WeakPolarHBondContact O-CG2 3.49Å; N748-M798 HydrophobicContact CB-CE 4.02Å
749	G	85.2	Confident	89.1	Confident	8 Å²	8	53.1 Å²	53.1	8%	0.082	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	146	-152.7	-179.5	0	0	0	0	0	114.1	V746 I792	V746-G749 CarbonylContact C-O 3.59Å; V746-G749 VanDerWaalsContact CG2-O 3.23Å; V746-G749 WeakPolarHBondContact CG2-O 3.44Å; V746-G749 PolarHBondContact N-O 3.08Å; V746-G749 PolarHBondContact O-N 2.87Å; V746-G749 VanDerWaalsContact O-N 3.08Å; G749-I792 CarbonylContact C-O 3.54Å; G749-I792 WeakPolarHBondContact CA-O 3.4Å
750	V	89.1	Confident	89	Confident	13 Å²	13	51.4 Å²	51.4	8%	0.079	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	113.7	175.7	-171.4	0	0	0	0	109.2	I715 H743 V752 I791 I792	I715-V750 HydrophobicContact CD1-CG1 3.94Å; I715-V750 HydrophobicContact CG1-CG1 4.11Å; I715-V750 HydrophobicContact CG1-CG2 4.47Å; H743-V750 HydrophobicContact CB-CG1 4.17Å; V750-V752 HydrophobicContact CB-CG1 4.4Å; V750-V752 HydrophobicContact CG1-CG1 3.81Å; V750-V752 PolarHBondContact O-N 2.96Å; V750-I791 WeakPolarHBondContact O-CA 3.38Å; V750-I792 PolarHBondContact N-O 3.27Å; V750-I792 PolarHBondContact O-N 3.24Å
751	Q	89.8	Confident	88.9	Confident	95 Å²	95	51 Å²	51	44%	0.444	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	124	170.5	-173.9	175.5	29.8	0	0	108.6	H743 K744 V746 G790 I791	H743-Q751 CarbonylContact C-O 3.53Å; H743-Q751 VanDerWaalsContact CA-O 3.23Å; H743-Q751 WeakPolarHBondContact CA-O 3.48Å; K744-Q751 HydrophobicContact CB-CB 4.45Å; K744-Q751 PolarHBondContact N-O 2.67Å; K744-Q751 WeakPolarHBondContact O-CB 3.48Å; K744-Q751 PolarHBondContact O-N 3.28Å; V746-Q751 HydrophobicContact CG1-CB 4.13Å; V746-Q751 HydrophobicContact CG2-CB 4.37Å; Q751-G790 CarbonylContact C-O 3.5Å; Q751-G790 WeakPolarHBondContact CA-O 3.35Å; Q751-I791 HydrophobicContact CB-CG1 4.35Å; Q751-I791 HydrophobicContact CG-CG1 4.48Å
752	V	93.2	Very high	88.8	Confident	3 Å²	3	51.4 Å²	51.4	2%	0.018	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	147.1	-175.1	-64.1	0	0	0	0	111.8	I715 I719 L740 S742 H743 V750 F754 K789 G790 I792	I715-V752 HydrophobicContact CG2-CG1 3.89Å; I719-V752 HydrophobicContact CD1-CG1 4.37Å; L740-V752 HydrophobicContact CD1-CB 4.29Å; L740-V752 HydrophobicContact CD1-CG1 4.42Å; S742-V752 WeakPolarHBondContact O-CA 3.5Å; H743-V752 HydrophobicContact CB-CG1 4.27Å; V750-V752 HydrophobicContact CB-CG1 4.4Å; V750-V752 HydrophobicContact CG1-CG1 3.81Å; V750-V752 PolarHBondContact O-N 2.96Å; V752-F754 HydrophobicContact CB-CD1 4.19Å; V752-F754 HydrophobicContact CG2-CD1 3.74Å; V752-F754 HydrophobicContact CG2-CE1 3.69Å; V752-K789 WeakPolarHBondContact O-CA 3.39Å; V752-G790 PolarHBondContact N-O 3.13Å; V752-G790 PolarHBondContact O-N 3.15Å; V752-I792 HydrophobicContact CG1-CD1 4.19Å; V752-I792 HydrophobicContact CG2-CD1 3.63Å; V752-I792 HydrophobicContact CG2-CG1 3.78Å
753	E	93.2	Very high	88.5	Confident	40 Å²	40	49 Å²	49	19%	0.187	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	125.2	165.8	-178.2	176.1	-157.7	0	0	107.7	I741 S742 I787 C788 K789	I741-E753 WeakPolarHBondContact CA-O 3.43Å; I741-E753 HydrophobicContact CB-CB 4.19Å; I741-E753 HydrophobicContact CB-CG 3.9Å; I741-E753 VanDerWaalsContact CB-O 3.3Å; I741-E753 WeakPolarHBondContact CB-O 3.03Å; I741-E753 HydrophobicContact CD1-CG 4.02Å; I741-E753 HydrophobicContact CG1-CG 4.44Å; I741-E753 HydrophobicContact CG2-CG 4.1Å; I741-E753 PolarHBondContact N-O 2.87Å; S742-E753 PolarHBondContact N-O 2.71Å; S742-E753 PolarHBondContact O-N 3.37Å; S742-E753 WeakPolarHBondContact OG-CB 3.38Å; S742-E753 PolarHBondContact OG-OE2 3.06Å; E753-I787 HydrophobicContact CG-CD1 4.18Å; E753-I787 HydrophobicContact CG-CG1 4.16Å; E753-I787 VanDerWaalsContact OE1-CD1 3.25Å; E753-I787 WeakPolarHBondContact OE1-CD1 3.31Å; E753-C788 CarbonylContact C-O 3.41Å; E753-C788 VanDerWaalsContact CA-O 3.31Å; E753-C788 WeakPolarHBondContact CA-O 3.31Å; E753-K789 HydrophobicContact CB-CG 4.35Å; E753-K789 HydrophobicContact CG-CD 4.48Å; E753-K789 HydrophobicContact CG-CG 3.94Å; E753-K789 WeakPolarHBondContact OE1-CE 3.4Å; E753-K789 IonicContact OE1-NZ 3.07Å; E753-K789 PolarHBondContact OE1-NZ 3.48Å
754	F	94	Very high	88.2	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	159.6	-176.5	60.6	-87.1	0	0	0	111.5	I719 I723 F728 L737 K739 L740 V752 I756 C788 I802	I719-F754 HydrophobicContact CD1-CD1 4.25Å; I719-F754 HydrophobicContact CD1-CG 4.47Å; I719-F754 HydrophobicContact CG1-CD1 4.38Å; I719-F754 HydrophobicContact CG1-CE1 4.44Å; I719-F754 HydrophobicContact CG2-CD1 4.23Å; I719-F754 HydrophobicContact CG2-CD2 3.82Å; I719-F754 HydrophobicContact CG2-CE1 4.14Å; I719-F754 HydrophobicContact CG2-CE2 3.71Å; I719-F754 HydrophobicContact CG2-CG 4.07Å; I719-F754 HydrophobicContact CG2-CZ 3.88Å; I723-F754 HydrophobicContact CD1-CE2 4.21Å; I723-F754 HydrophobicContact CG1-CE2 4.41Å; F728-F754 HydrophobicContact CE2-CZ 4.48Å; L737-F754 HydrophobicContact CD1-CB 3.9Å; L737-F754 HydrophobicContact CD1-CD2 3.64Å; L737-F754 HydrophobicContact CD1-CG 4.08Å; K739-F754 CarbonylContact O-C 3.47Å; K739-F754 WeakPolarHBondContact O-CA 3.18Å; K739-F754 VanDerWaalsContact O-CB 3.3Å; K739-F754 WeakPolarHBondContact O-CB 3.34Å; L740-F754 HydrophobicContact CD1-CB 4.19Å; V752-F754 HydrophobicContact CB-CD1 4.19Å; V752-F754 HydrophobicContact CG2-CD1 3.74Å; V752-F754 HydrophobicContact CG2-CE1 3.69Å; F754-I756 HydrophobicContact CD2-CG2 3.82Å; F754-I756 HydrophobicContact CE2-CG2 3.63Å; F754-C788 HydrophobicContact CD1-CB 4.29Å; F754-C788 HydrophobicContact CD2-CB 3.95Å; F754-C788 HydrophobicContact CE1-CB 3.95Å; F754-C788 HydrophobicContact CE2-CB 3.59Å; F754-C788 HydrophobicContact CG-CB 4.3Å; F754-C788 HydrophobicContact CZ-CB 3.59Å; F754-C788 PolarHBondContact N-O 3.37Å; F754-C788 PolarHBondContact O-N 3.1Å; F754-I802 HydrophobicContact CE1-CD1 4.19Å; F754-I802 HydrophobicContact CE1-CG2 4.17Å; F754-I802 HydrophobicContact CZ-CD1 4.07Å; F754-I802 HydrophobicContact CZ-CG2 3.9Å
755	T	92.4	Very high	88	Confident	9 Å²	9	49.2 Å²	49.2	6%	0.055	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	142.1	174.7	51	0	0	0	0	111.1	D738 K739 I741 L786	D738-T755 WeakPolarHBondContact CB-O 3.35Å; D738-T755 WeakPolarHBondContact CB-OG1 3.43Å; D738-T755 PolarHBondContact N-O 2.67Å; D738-T755 PolarHBondContact OD2-OG1 2.8Å; K739-T755 PolarHBondContact N-O 3.14Å; K739-T755 PolarHBondContact N-OG1 3.07Å; K739-T755 VanDerWaalsContact N-OG1 3.11Å; K739-T755 PolarHBondContact O-N 2.99Å; K739-T755 PolarHBondContact O-OG1 3.24Å; I741-T755 HydrophobicContact CD1-CG2 3.8Å; I741-T755 HydrophobicContact CG1-CG2 4.34Å; T755-L786 VanDerWaalsContact CA-O 3.31Å; T755-L786 WeakPolarHBondContact CA-O 3.27Å
756	I	91.5	Very high	88	Confident	3 Å²	3	49.6 Å²	49.6	2%	0.015	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	152.5	170.2	60.4	172	0	0	0	110.3	I723 F728 I730 A735 R736 F754 K785 L786 C788	I723-I756 HydrophobicContact CD1-CG2 3.8Å; I723-I756 HydrophobicContact CG1-CG2 4.38Å; F728-I756 HydrophobicContact CB-CD1 4.43Å; F728-I756 HydrophobicContact CD2-CD1 4.05Å; I730-I756 HydrophobicContact CD1-CD1 4.1Å; I730-I756 HydrophobicContact CD1-CG1 4.05Å; I730-I756 HydrophobicContact CG1-CD1 4.49Å; A735-I756 HydrophobicContact CB-CB 4.24Å; A735-I756 HydrophobicContact CB-CD1 3.93Å; A735-I756 HydrophobicContact CB-CG1 4.48Å; R736-I756 CarbonylContact O-C 3.5Å; R736-I756 VanDerWaalsContact O-CA 3.24Å; R736-I756 WeakPolarHBondContact O-CA 3.42Å; F754-I756 HydrophobicContact CD2-CG2 3.82Å; F754-I756 HydrophobicContact CE2-CG2 3.63Å; I756-K785 WeakPolarHBondContact O-CA 2.92Å; I756-L786 HydrophobicContact CD1-CB 4.19Å; I756-L786 HydrophobicContact CD1-CD1 4.22Å; I756-L786 HydrophobicContact CG1-CB 3.78Å; I756-L786 HydrophobicContact CG1-CG 4.5Å; I756-L786 PolarHBondContact N-O 3.24Å; I756-L786 PolarHBondContact O-N 2.97Å; I756-C788 VanDerWaalsContact CD1-SG 3.53Å
757	M	89.2	Confident	88	Confident	20 Å²	20	48.3 Å²	48.3	10%	0.099	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	151	178.8	67.5	-173.9	-54	0	0	112	A735 R736 D738	A735-M757 WeakPolarHBondContact CA-O 3.14Å; R736-M757 HydrophobicContact CG-CG 3.48Å; R736-M757 VanDerWaalsContact CG-CG 3.48Å; R736-M757 HydrophobicContact CG-SD 4.3Å; R736-M757 PolarHBondContact N-O 2.87Å; R736-M757 PolarHBondContact NE-SD 3.47Å; R736-M757 PolarHBondContact NH2-SD 2.95Å; R736-M757 PolarHBondContact O-N 3.49Å; D738-M757 HydrophobicContact CB-CB 4.36Å; D738-M757 HydrophobicContact CB-CG 4.13Å; D738-M757 HydrophobicContact CB-SD 4.01Å
758	E	88.8	Confident	88.3	Confident	4 Å²	4	43.3 Å²	43.3	2%	0.019	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	131.8	179.3	-168.2	179.4	153.3	0	0	111.2	I730 N731 Q733 R779	I730-E758 HydrophobicContact CB-CB 4Å; I730-E758 HydrophobicContact CB-CG 4.11Å; I730-E758 HydrophobicContact CD1-CB 4.44Å; I730-E758 HydrophobicContact CG2-CB 3.94Å; I730-E758 HydrophobicContact CG2-CG 4.16Å; N731-E758 PolarHBondContact ND2-OE2 3.16Å; Q733-E758 HydrophobicContact CB-CG 3.82Å; Q733-E758 PolarHBondContact NE2-OE1 2.72Å; Q733-E758 PolarHBondContact OE1-OE1 3.47Å; E758-R779 VanDerWaalsContact CD-CZ 3.43Å; E758-R779 WeakPolarHBondContact O-CB 3.09Å; E758-R779 IonicContact OE1-CZ 3.14Å; E758-R779 IonicContact OE1-NH1 3.77Å; E758-R779 PolarHBondContact OE1-NH1 3.35Å; E758-R779 VanDerWaalsContact OE1-NH1 3.14Å; E758-R779 IonicContact OE1-NH2 3.3Å; E758-R779 PolarHBondContact OE1-NH2 2.84Å; E758-R779 IonicContact OE2-CZ 3.95Å; E758-R779 IonicContact OE2-NH1 2.97Å; E758-R779 PolarHBondContact OE2-NH1 2.77Å; E758-R779 IonicContact OE2-NH2 2.69Å
759	T	89.9	Confident	88.5	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	175.2	173.1	70.3	0	0	0	0	111.2	Q733 H734 R736 C761 L772 C777	Q733-T759 WeakPolarHBondContact CB-O 3.22Å; Q733-T759 VanDerWaalsContact CD-O 3.28Å; Q733-T759 WeakPolarHBondContact CG-O 3.19Å; Q733-T759 PolarHBondContact OE1-O 3.15Å; H734-T759 WeakPolarHBondContact CB-OG1 3.4Å; H734-T759 VanDerWaalsContact O-CB 3.28Å; H734-T759 WeakPolarHBondContact O-CB 3.29Å; H734-T759 WeakPolarHBondContact O-CG2 3.29Å; H734-T759 PolarHBondContact O-N 3Å; H734-T759 PolarHBondContact O-OG1 3.25Å; R736-T759 HydrophobicContact CB-CG2 3.62Å; R736-T759 HydrophobicContact CG-CG2 3.66Å; T759-C761 VanDerWaalsContact C-N 3.34Å; T759-C761 PolarHBondContact OG1-N 3.42Å; T759-L772 HydrophobicContact CG2-CD1 3.81Å; T759-C777 WeakPolarHBondContact CA-O 3.43Å; T759-C777 WeakPolarHBondContact CB-O 3.49Å; T759-C777 HydrophobicContact CG2-CB 4.5Å
760	T	88.4	Confident	88.5	Confident	68 Å²	68	49.1 Å²	49.1	42%	0.417	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	-6.9	173.5	45.5	0	0	0	0	114.2	S776 C777 I778 R779	T760-S776 PolarHBondContact OG1-O 2.93Å; T760-C777 PolarHBondContact N-O 2.98Å; T760-C777 VanDerWaalsContact N-O 3.13Å; T760-C777 VanDerWaalsContact OG1-CA 3.29Å; T760-C777 WeakPolarHBondContact OG1-CA 3.22Å; T760-C777 PolarHBondContact OG1-O 3.39Å; T760-I778 WeakPolarHBondContact CG2-O 3.36Å; T760-R779 HydrophobicContact CG2-CB 3.96Å; T760-R779 HydrophobicContact CG2-CG 4.03Å
761	C	89.4	Confident	88.4	Confident	22 Å²	22	53 Å²	53	15%	0.149	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	131.3	-173.5	-75.8	0	0	0	0	111.4	Q733 H734 T759 G763 V767 C777	Q733-C761 CarbonylContact C-O 3.46Å; Q733-C761 WeakPolarHBondContact CA-O 3.43Å; Q733-C761 WeakPolarHBondContact CB-O 3.5Å; H734-C761 HydrophobicContact CB-CB 4.48Å; H734-C761 PolarHBondContact N-O 2.96Å; T759-C761 VanDerWaalsContact C-N 3.34Å; T759-C761 PolarHBondContact OG1-N 3.42Å; C761-G763 PolarHBondContact O-N 3.22Å; C761-V767 HydrophobicContact CB-CG2 4.14Å; C761-C777 HydrophobicContact CB-CB 3.89Å; C761-C777 WeakPolarHBondContact CB-SG 3.35Å; C761-C777 WeakPolarHBondContact SG-CA 3.3Å; C761-C777 WeakPolarHBondContact SG-CB 3.36Å; C761-C777 CovalentContact SG-SG 2.02Å; C761-C777 PolarHBondContact SG-SG 2.86Å
762	D	86.9	Confident	88.3	Confident	77 Å²	77	48.5 Å²	48.5	41%	0.412	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	125.7	178.8	-176.1	-18.4	0	0	0	110.8	H734 N764 V765	H734-D762 PolarHBondContact CD2-O 3.48Å; H734-D762 PolarHBondContact NE2-O 2.9Å; H734-D762 VanDerWaalsContact NE2-O 3.16Å; D762-N764 PolarHBondContact O-N 2.74Å; D762-N764 VanDerWaalsContact O-N 3.15Å; D762-N764 WeakPolarHBondContact OD1-CB 3.18Å; D762-N764 PolarHBondContact OD1-N 2.84Å; D762-N764 PolarHBondContact OD1-ND2 2.85Å; D762-V765 HydrophobicContact CB-CG2 3.97Å; D762-V765 PolarHBondContact O-N 2.75Å
763	G	86.4	Confident	88	Confident	3 Å²	3	51.7 Å²	51.7	3%	0.031	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-16.9	-179.5	0	0	0	0	0	114.1	G732 C761	G732-G763 WeakPolarHBondContact O-CA 3.46Å; G732-G763 PolarHBondContact O-N 2.96Å; C761-G763 PolarHBondContact O-N 3.22Å
764	N	83.3	Confident	87.6	Confident	132 Å²	132	50.9 Å²	50.9	71%	0.706	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-17.6	174.4	-58.9	-57.4	0	0	0	113.2	D762	D762-N764 PolarHBondContact O-N 2.74Å; D762-N764 VanDerWaalsContact O-N 3.15Å; D762-N764 WeakPolarHBondContact OD1-CB 3.18Å; D762-N764 PolarHBondContact OD1-N 2.84Å; D762-N764 PolarHBondContact OD1-ND2 2.85Å
765	V	86.3	Confident	86.9	Confident	83 Å²	83	58.3 Å²	58.3	50%	0.503	31%	0.308	S	S	.	.	S	Bend	trans	-88.4	136.4	179.7	178.4	0	0	0	0	109.3	H734 D762 V767	H734-V765 PolarHBondContact CE1-O 2.78Å; H734-V765 PolarHBondContact NE2-O 3.19Å; D762-V765 HydrophobicContact CB-CG2 3.97Å; D762-V765 PolarHBondContact O-N 2.75Å; V765-V767 HydrophobicContact CG1-CG2 4.47Å; V765-V767 PolarHBondContact O-N 3.27Å
766	H	84.1	Confident	86.4	Confident	143 Å²	143	62.4 Å²	62.4	66%	0.662	34%	0.337	S	S	*	.			trans	-71.7	122	170.6	-86.5	-84.8	0	0	0	110.2	R727	R727-H766 PolarHBondContact NH2-CE1 2.98Å; R727-H766 PolarHBondContact NH2-NE2 3.39Å
767	V	84.9	Confident	86.1	Confident	19 Å²	19	62.3 Å²	62.3	12%	0.115	34%	0.336	C	S	.	.			trans	-119.1	134.4	-178.9	-175.4	0	0	0	0	108.4	H734 C761 V765 Q771 L772	H734-V767 WeakPolarHBondContact NE2-CG2 3.47Å; C761-V767 HydrophobicContact CB-CG2 4.14Å; V765-V767 HydrophobicContact CG1-CG2 4.47Å; V765-V767 PolarHBondContact O-N 3.27Å; V767-Q771 HydrophobicContact CG1-CB 3.44Å; V767-Q771 VanDerWaalsContact CG1-CB 3.44Å; V767-L772 HydrophobicContact CG1-CB 3.85Å
768	T	88.6	Confident	85.6	Confident	68 Å²	68	63.5 Å²	63.5	42%	0.417	34%	0.342	S	S	.	.			trans	-76.6	163.3	174.5	68.8	0	0	0	0	111	E770 Q771 L772	T768-E770 PolarHBondContact O-N 2.98Å; T768-Q771 PolarHBondContact O-N 2.99Å; T768-Q771 VanDerWaalsContact O-N 3.16Å; T768-Q771 VanDerWaalsContact OG1-CG 3.29Å; T768-Q771 WeakPolarHBondContact OG1-CG 3.49Å; T768-Q771 PolarHBondContact OG1-N 3.39Å; T768-L772 WeakPolarHBondContact O-CB 3.14Å; T768-L772 PolarHBondContact O-N 2.9Å
769	M	84.6	Confident	84.8	Confident	64 Å²	64	67 Å²	67	32%	0.315	36%	0.356	S	S	.	.	H	α-helix	trans	-54.4	-43.5	175.4	-174.8	76.1	109.2	0	0	112	K720 I724 Q771 L772 Y773	K720-M769 HydrophobicContact CB-CE 3.24Å; K720-M769 HydrophobicContact CB-SD 3.72Å; K720-M769 HydrophobicContact CD-CE 4.25Å; K720-M769 HydrophobicContact CD-SD 4.47Å; K720-M769 HydrophobicContact CG-CE 4.37Å; I724-M769 VanDerWaalsContact CD1-CA 3.43Å; I724-M769 HydrophobicContact CD1-CB 3.75Å; I724-M769 HydrophobicContact CD1-CE 4.45Å; I724-M769 HydrophobicContact CD1-CG 4.14Å; I724-M769 HydrophobicContact CD1-SD 3.32Å; I724-M769 WeakPolarHBondContact CD1-SD 3.27Å; I724-M769 HydrophobicContact CG1-SD 4.45Å; M769-Q771 PolarHBondContact O-N 3.47Å; M769-L772 PolarHBondContact O-N 3.22Å; M769-Y773 HydrophobicContact CG-CD2 4.18Å; M769-Y773 WeakPolarHBondContact O-CD2 3.28Å; M769-Y773 PolarHBondContact O-N 2.93Å; M769-Y773 VanDerWaalsContact O-N 3.09Å; M769-Y773 HydrophobicContact SD-CD2 3.59Å; M769-Y773 VanDerWaalsContact SD-CD2 3.59Å; M769-Y773 HydrophobicContact SD-CE2 3.45Å; M769-Y773 WeakPolarHBondContact SD-CE2 3.42Å
770	E	85.3	Confident	83.4	Confident	165 Å²	165	75.4 Å²	75.4	77%	0.771	40%	0.395	S	S	*	.	H	α-helix	trans	-64.5	-38.5	179.3	-66.6	156.8	-171.8	0	0	112.3	T768 G774	T768-E770 PolarHBondContact O-N 2.98Å; E770-G774 VanDerWaalsContact O-CA 3.25Å; E770-G774 WeakPolarHBondContact O-CA 3.34Å; E770-G774 PolarHBondContact O-N 3.43Å
771	Q	85.4	Confident	81.9	Confident	94 Å²	94	74.8 Å²	74.8	44%	0.439	40%	0.401	S	S	.	.	H	α-helix	trans	-72.3	-41.6	177.7	-71.6	170.2	-18.9	0	0	111.8	V767 T768 M769 G774 C777	V767-Q771 HydrophobicContact CG1-CB 3.44Å; V767-Q771 VanDerWaalsContact CG1-CB 3.44Å; T768-Q771 PolarHBondContact O-N 2.99Å; T768-Q771 VanDerWaalsContact O-N 3.16Å; T768-Q771 VanDerWaalsContact OG1-CG 3.29Å; T768-Q771 WeakPolarHBondContact OG1-CG 3.49Å; T768-Q771 PolarHBondContact OG1-N 3.39Å; M769-Q771 PolarHBondContact O-N 3.47Å; Q771-G774 PolarHBondContact O-N 2.98Å; Q771-C777 PolarHBondContact O-SG 3.08Å
772	L	88.1	Confident	80.3	Confident	2 Å²	2	83.8 Å²	83.8	1%	0.01	43%	0.434	C	S	.	.	H	α-helix	trans	-66.8	-40.8	-177.6	-176.8	64.4	0	0	0	112.5	I724 H734 T759 V767 T768 M769 C777	I724-L772 HydrophobicContact CD1-CD2 3.98Å; I724-L772 HydrophobicContact CG1-CD2 3.64Å; H734-L772 HydrophobicContact CB-CD1 3.57Å; T759-L772 HydrophobicContact CG2-CD1 3.81Å; V767-L772 HydrophobicContact CG1-CB 3.85Å; T768-L772 WeakPolarHBondContact O-CB 3.14Å; T768-L772 PolarHBondContact O-N 2.9Å; M769-L772 PolarHBondContact O-N 3.22Å; L772-C777 HydrophobicContact CD1-CB 4.37Å
773	Y	86.6	Confident	79.2	Confident	70 Å²	70	80.9 Å²	80.9	28%	0.275	42%	0.419	S	S	.	.	S	Bend	trans	-92	-1.6	175.8	-69.4	-85.6	0	0	0	113	K720 R736 L737 M769	K720-Y773 HydrophobicContact CB-CE2 4.03Å; K720-Y773 HydrophobicContact CD-CE1 4.23Å; K720-Y773 HydrophobicContact CD-CE2 4.13Å; K720-Y773 HydrophobicContact CG-CE1 4.21Å; K720-Y773 HydrophobicContact CG-CE2 4Å; K720-Y773 WeakPolarHBondContact CG-OH 3.39Å; R736-Y773 HydrophobicContact CB-CE1 4.13Å; L737-Y773 HydrophobicContact CB-CE1 4.15Å; L737-Y773 VanDerWaalsContact CB-OH 3.28Å; L737-Y773 WeakPolarHBondContact CB-OH 3.39Å; L737-Y773 PolarHBondContact N-OH 2.78Å; M769-Y773 HydrophobicContact CG-CD2 4.18Å; M769-Y773 WeakPolarHBondContact O-CD2 3.28Å; M769-Y773 PolarHBondContact O-N 2.93Å; M769-Y773 VanDerWaalsContact O-N 3.09Å; M769-Y773 HydrophobicContact SD-CD2 3.59Å; M769-Y773 VanDerWaalsContact SD-CD2 3.59Å; M769-Y773 HydrophobicContact SD-CE2 3.45Å; M769-Y773 WeakPolarHBondContact SD-CE2 3.42Å
774	G	84.8	Confident	78.2	Confident	23 Å²	23	86.8 Å²	86.8	24%	0.237	44%	0.444	C	S	.	.	S	Bend	trans	-83.9	177	174.1	0	0	0	0	0	113.4	E770 Q771 S776 I778	E770-G774 VanDerWaalsContact O-CA 3.25Å; E770-G774 WeakPolarHBondContact O-CA 3.34Å; E770-G774 PolarHBondContact O-N 3.43Å; Q771-G774 PolarHBondContact O-N 2.98Å; G774-S776 PolarHBondContact O-N 3.45Å; G774-I778 WeakPolarHBondContact O-CG1 3.19Å
775	L	80.8	Confident	78.2	Confident	155 Å²	155	85.3 Å²	85.3	81%	0.812	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-62.5	-25	-177.3	-65.6	175.4	0	0	0	113.5	C777 I778	L775-C777 VanDerWaalsContact C-N 3.34Å; L775-C777 PolarHBondContact O-N 3.13Å; L775-I778 HydrophobicContact CD2-CD1 3.58Å; L775-I778 PolarHBondContact O-N 3.47Å
776	S	80.4	Confident	78.2	Confident	95 Å²	95	82.7 Å²	82.7	66%	0.664	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-67.3	-29	-175.1	-51.5	0	0	0	0	114.4	T760 G774	T760-S776 PolarHBondContact OG1-O 2.93Å; G774-S776 PolarHBondContact O-N 3.45Å
777	C	85.3	Confident	78.5	Confident	1 Å²	1	76.7 Å²	76.7	1%	0.007	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-104.4	11.1	-178.9	-61.4	0	0	0	0	113	T759 T760 C761 Q771 L772 L775 R779	T759-C777 WeakPolarHBondContact CA-O 3.43Å; T759-C777 WeakPolarHBondContact CB-O 3.49Å; T759-C777 HydrophobicContact CG2-CB 4.5Å; T760-C777 PolarHBondContact N-O 2.98Å; T760-C777 VanDerWaalsContact N-O 3.13Å; T760-C777 VanDerWaalsContact OG1-CA 3.29Å; T760-C777 WeakPolarHBondContact OG1-CA 3.22Å; T760-C777 PolarHBondContact OG1-O 3.39Å; C761-C777 HydrophobicContact CB-CB 3.89Å; C761-C777 WeakPolarHBondContact CB-SG 3.35Å; C761-C777 WeakPolarHBondContact SG-CA 3.3Å; C761-C777 WeakPolarHBondContact SG-CB 3.36Å; C761-C777 CovalentContact SG-SG 2.02Å; C761-C777 PolarHBondContact SG-SG 2.86Å; Q771-C777 PolarHBondContact O-SG 3.08Å; L772-C777 HydrophobicContact CD1-CB 4.37Å; L775-C777 VanDerWaalsContact C-N 3.34Å; L775-C777 PolarHBondContact O-N 3.13Å; C777-R779 PolarHBondContact O-N 2.87Å
778	I	79.9	Confident	78.9	Confident	45 Å²	45	75.8 Å²	75.8	23%	0.231	38%	0.381	C	S	.	.			trans	-75.8	119.9	-178.1	-61	-175.7	0	0	0	110.9	T760 G774 L775	T760-I778 WeakPolarHBondContact CG2-O 3.36Å; G774-I778 WeakPolarHBondContact O-CG1 3.19Å; L775-I778 HydrophobicContact CD2-CD1 3.58Å; L775-I778 PolarHBondContact O-N 3.47Å
779	R	71.1	Confident	79.1	Confident	79 Å²	79	77.9 Å²	77.9	30%	0.298	39%	0.385	S	S	.	.			trans	-88.9	115.9	167.1	-159.3	175.2	-171	-162.6	18.6	110.4	E758 T760 C777 G781	E758-R779 VanDerWaalsContact CD-CZ 3.43Å; E758-R779 WeakPolarHBondContact O-CB 3.09Å; E758-R779 IonicContact OE1-CZ 3.14Å; E758-R779 IonicContact OE1-NH1 3.77Å; E758-R779 PolarHBondContact OE1-NH1 3.35Å; E758-R779 VanDerWaalsContact OE1-NH1 3.14Å; E758-R779 IonicContact OE1-NH2 3.3Å; E758-R779 PolarHBondContact OE1-NH2 2.84Å; E758-R779 IonicContact OE2-CZ 3.95Å; E758-R779 IonicContact OE2-NH1 2.97Å; E758-R779 PolarHBondContact OE2-NH1 2.77Å; E758-R779 IonicContact OE2-NH2 2.69Å; T760-R779 HydrophobicContact CG2-CB 3.96Å; T760-R779 HydrophobicContact CG2-CG 4.03Å; C777-R779 PolarHBondContact O-N 2.87Å; R779-G781 PolarHBondContact O-N 3.2Å
780	H	60.1	Low	79.4	Confident	176 Å²	176	75.4 Å²	75.4	82%	0.815	38%	0.376	S	S	*	.			trans	-85.6	103.4	171.1	-67	-81.5	0	0	0	109.4
781	G	57.5	Low	79.6	Confident	54 Å²	54	70.3 Å²	70.3	56%	0.557	35%	0.353	S	S	*	.	S	Bend	trans	154.5	174.5	175.9	0	0	0	0	0	114.4	R779 S783	R779-G781 PolarHBondContact O-N 3.2Å; G781-S783 PolarHBondContact O-N 3.5Å; G781-S783 VanDerWaalsContact O-N 3.11Å
782	Y	56.5	Low	79.6	Confident	212 Å²	212	66 Å²	66	83%	0.831	33%	0.334	S	S	*	.			trans	-74	94.9	172.3	-67.8	-85.3	0	0	0	109.3
783	S	63.4	Low	79.4	Confident	15 Å²	15	67 Å²	67	11%	0.105	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-92.6	140.8	168.1	51.2	0	0	0	0	110.4	G781 K785	G781-S783 PolarHBondContact O-N 3.5Å; G781-S783 VanDerWaalsContact O-N 3.11Å; S783-K785 PolarHBondContact O-N 2.78Å
784	K	65.3	Low	78.5	Confident	128 Å²	128	68.1 Å²	68.1	56%	0.557	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-54.9	131.5	170.2	-73.5	-175.4	167.5	-163.4	0	108.8	E806	K784-E806 IonicContact NZ-OE2 2.72Å; K784-E806 PolarHBondContact NZ-OE2 3.06Å
785	K	82.8	Confident	77.8	Confident	100 Å²	100	70.9 Å²	70.9	44%	0.435	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	133.9	175.1	-62.5	-175.4	175.5	-161.9	0	108.8	D738 I756 S783	D738-K785 IonicContact OD1-NZ 2.81Å; D738-K785 PolarHBondContact OD1-NZ 2.93Å; D738-K785 WeakPolarHBondContact OD2-CD 3.5Å; D738-K785 WeakPolarHBondContact OD2-CE 3.38Å; D738-K785 IonicContact OD2-NZ 2.8Å; D738-K785 PolarHBondContact OD2-NZ 3.04Å; I756-K785 WeakPolarHBondContact O-CA 2.92Å; S783-K785 PolarHBondContact O-N 2.78Å
786	L	88	Confident	77.2	Confident	28 Å²	28	69.4 Å²	69.4	15%	0.147	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	141.8	169.1	-55.8	-177.9	0	0	0	108.9	I730 T755 I756 C804 S805 E806	I730-L786 HydrophobicContact CD1-CD1 4.08Å; I730-L786 HydrophobicContact CD1-CG 4.15Å; I730-L786 HydrophobicContact CG1-CD1 3.79Å; I730-L786 HydrophobicContact CG1-CG 4.35Å; T755-L786 VanDerWaalsContact CA-O 3.31Å; T755-L786 WeakPolarHBondContact CA-O 3.27Å; I756-L786 HydrophobicContact CD1-CB 4.19Å; I756-L786 HydrophobicContact CD1-CD1 4.22Å; I756-L786 HydrophobicContact CG1-CB 3.78Å; I756-L786 HydrophobicContact CG1-CG 4.5Å; I756-L786 PolarHBondContact N-O 3.24Å; I756-L786 PolarHBondContact O-N 2.97Å; L786-C804 HydrophobicContact CB-CB 4.34Å; L786-C804 HydrophobicContact CD1-CB 4.48Å; L786-S805 WeakPolarHBondContact CA-O 3.37Å; L786-E806 HydrophobicContact CD2-CB 4.13Å; L786-E806 HydrophobicContact CD2-CG 3.28Å
787	I	90.4	Very high	76.5	Confident	17 Å²	17	68.8 Å²	68.8	9%	0.087	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	125.2	170.1	-165	165.1	0	0	0	108.4	I741 E753 C804 S805 R807	I741-I787 HydrophobicContact CD1-CD1 3.67Å; I741-I787 HydrophobicContact CD1-CG1 3.98Å; E753-I787 HydrophobicContact CG-CD1 4.18Å; E753-I787 HydrophobicContact CG-CG1 4.16Å; E753-I787 VanDerWaalsContact OE1-CD1 3.25Å; E753-I787 WeakPolarHBondContact OE1-CD1 3.31Å; I787-C804 CarbonylContact O-C 3.55Å; I787-C804 VanDerWaalsContact O-CA 3.23Å; I787-C804 WeakPolarHBondContact O-CA 3.37Å; I787-S805 WeakPolarHBondContact CG2-OG 3.37Å; I787-S805 PolarHBondContact N-O 3.45Å; I787-S805 PolarHBondContact O-N 3.3Å; I787-R807 HydrophobicContact CG2-CG 4.45Å
788	C	92.9	Very high	75.7	Confident	0 Å²	0	73 Å²	73	0%	0	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	133.2	-179.6	-61.8	0	0	0	0	109.6	E753 F754 I756 I802 E803 C804	E753-C788 CarbonylContact C-O 3.41Å; E753-C788 VanDerWaalsContact CA-O 3.31Å; E753-C788 WeakPolarHBondContact CA-O 3.31Å; F754-C788 HydrophobicContact CD1-CB 4.29Å; F754-C788 HydrophobicContact CD2-CB 3.95Å; F754-C788 HydrophobicContact CE1-CB 3.95Å; F754-C788 HydrophobicContact CE2-CB 3.59Å; F754-C788 HydrophobicContact CG-CB 4.3Å; F754-C788 HydrophobicContact CZ-CB 3.59Å; F754-C788 PolarHBondContact N-O 3.37Å; F754-C788 PolarHBondContact O-N 3.1Å; I756-C788 VanDerWaalsContact CD1-SG 3.53Å; C788-I802 HydrophobicContact CB-CG2 3.89Å; C788-E803 CarbonylContact C-O 3.55Å; C788-E803 VanDerWaalsContact CA-O 3.31Å; C788-E803 WeakPolarHBondContact CA-O 3.43Å; C788-C804 HydrophobicContact CB-CB 4.13Å; C788-C804 WeakPolarHBondContact CB-SG 3.44Å; C788-C804 WeakPolarHBondContact SG-CB 3.06Å; C788-C804 CovalentContact SG-SG 2.05Å; C788-C804 PolarHBondContact SG-SG 2.73Å
789	K	92.7	Very high	75	Confident	112 Å²	112	77.8 Å²	77.8	49%	0.487	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	136.7	177	-62.6	-174.7	-170.6	-140.3	0	109	V752 E753 I802 E803	V752-K789 WeakPolarHBondContact O-CA 3.39Å; E753-K789 HydrophobicContact CB-CG 4.35Å; E753-K789 HydrophobicContact CG-CD 4.48Å; E753-K789 HydrophobicContact CG-CG 3.94Å; E753-K789 WeakPolarHBondContact OE1-CE 3.4Å; E753-K789 IonicContact OE1-NZ 3.07Å; E753-K789 PolarHBondContact OE1-NZ 3.48Å; K789-I802 WeakPolarHBondContact O-CA 3.35Å; K789-E803 PolarHBondContact N-O 3.39Å; K789-E803 PolarHBondContact O-N 3.2Å
790	G	90.7	Very high	75.1	Confident	13 Å²	13	75.5 Å²	75.5	13%	0.134	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.9	-176.3	178.7	0	0	0	0	0	114.5	Q751 V752 N801	Q751-G790 CarbonylContact C-O 3.5Å; Q751-G790 WeakPolarHBondContact CA-O 3.35Å; V752-G790 PolarHBondContact N-O 3.13Å; V752-G790 PolarHBondContact O-N 3.15Å; G790-N801 WeakPolarHBondContact CA-O 3.3Å
791	I	89.1	Confident	75.9	Confident	57 Å²	57	72.1 Å²	72.1	29%	0.292	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	124.1	172.6	-58.8	173.1	0	0	0	108.1	V746 V750 Q751 N801	V746-I791 HydrophobicContact CG2-CD1 4.36Å; V746-I791 HydrophobicContact CG2-CG2 4.21Å; V750-I791 WeakPolarHBondContact O-CA 3.38Å; Q751-I791 HydrophobicContact CB-CG1 4.35Å; Q751-I791 HydrophobicContact CG-CG1 4.48Å; I791-N801 PolarHBondContact N-O 3.12Å
792	I	86.3	Confident	77.4	Confident	5 Å²	5	70.7 Å²	70.7	3%	0.026	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	108.3	171.3	-64.6	178.7	0	0	0	107.4	Q718 I719 G749 V750 V752 I802	Q718-I792 HydrophobicContact CB-CG2 3.81Å; Q718-I792 VanDerWaalsContact OE1-CG2 3.28Å; I719-I792 HydrophobicContact CB-CD1 4.12Å; I719-I792 HydrophobicContact CD1-CD1 4.31Å; I719-I792 HydrophobicContact CG1-CD1 3.19Å; G749-I792 CarbonylContact C-O 3.54Å; G749-I792 WeakPolarHBondContact CA-O 3.4Å; V750-I792 PolarHBondContact N-O 3.27Å; V750-I792 PolarHBondContact O-N 3.24Å; V752-I792 HydrophobicContact CG1-CD1 4.19Å; V752-I792 HydrophobicContact CG2-CD1 3.63Å; V752-I792 HydrophobicContact CG2-CG1 3.78Å; I792-I802 HydrophobicContact CG1-CD1 4.16Å
793	T	82	Confident	78.8	Confident	21 Å²	21	66.2 Å²	66.2	13%	0.129	37%	0.365	C	S	.	.			trans	-84.9	130.2	-175.9	-48.4	0	0	0	0	110.6	N748 V795 M798	N748-T793 WeakPolarHBondContact O-CG2 3.49Å; T793-V795 VanDerWaalsContact C-N 3.34Å; T793-V795 HydrophobicContact CG2-CB 3.58Å; T793-V795 HydrophobicContact CG2-CG2 3.81Å; T793-M798 HydrophobicContact CG2-CB 3.72Å; T793-M798 HydrophobicContact CG2-CE 3.66Å; T793-M798 HydrophobicContact CG2-CG 3.89Å; T793-M798 HydrophobicContact CG2-SD 3.86Å; T793-M798 VanDerWaalsContact OG1-CE 3.28Å; T793-M798 WeakPolarHBondContact OG1-CE 3.29Å
794	T	68.7	Low	80.1	Confident	94 Å²	94	67.9 Å²	67.9	58%	0.577	38%	0.376	S	S	*	.			trans	-84.5	-10.6	171.4	48.5	0	0	0	0	112.8	P796	T794-P796 WeakPolarHBondContact O-CD 3.39Å
795	V	71	Confident	81.1	Confident	81 Å²	81	65 Å²	65	49%	0.491	37%	0.372	S	S	.	.	S	Bend	trans	-76	116.4	177.8	-170.4	0	0	0	0	110.4	T793 G797 M798	T793-V795 VanDerWaalsContact C-N 3.34Å; T793-V795 HydrophobicContact CG2-CB 3.58Å; T793-V795 HydrophobicContact CG2-CG2 3.81Å; V795-G797 PolarHBondContact O-N 2.97Å; V795-M798 HydrophobicContact CB-CB 4.48Å; V795-M798 PolarHBondContact O-N 2.89Å
796	P	66.5	Low	80.8	Confident	125 Å²	125	65 Å²	65	81%	0.812	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	134.2	175	-22.4	33.3	0	0	0	111.5	T794	T794-P796 WeakPolarHBondContact O-CD 3.39Å
797	G	66	Low	79.6	Confident	81 Å²	81	71 Å²	71	84%	0.835	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.6	-11.5	179.1	0	0	0	0	0	115.4	V795	V795-G797 PolarHBondContact O-N 2.97Å
798	M	68.2	Low	77.5	Confident	89 Å²	89	76.9 Å²	76.9	44%	0.438	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-96.3	121.9	174.3	-171.5	164.8	129.1	0	0	110.1	N748 T793 V795	N748-M798 HydrophobicContact CB-CE 4.02Å; T793-M798 HydrophobicContact CG2-CB 3.72Å; T793-M798 HydrophobicContact CG2-CE 3.66Å; T793-M798 HydrophobicContact CG2-CG 3.89Å; T793-M798 HydrophobicContact CG2-SD 3.86Å; T793-M798 VanDerWaalsContact OG1-CE 3.28Å; T793-M798 WeakPolarHBondContact OG1-CE 3.29Å; V795-M798 HydrophobicContact CB-CB 4.48Å; V795-M798 PolarHBondContact O-N 2.89Å
799	H	66.9	Low	74.9	Confident	146 Å²	146	83.9 Å²	83.9	68%	0.676	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-73.7	136.7	-177.8	-66.4	-47.8	0	0	0	111.5	N801	H799-N801 PolarHBondContact O-N 3.06Å
800	P	71.6	Confident	72.4	Confident	32 Å²	32	84.4 Å²	84.4	21%	0.208	48%	0.476	C	S	.	.	P	Polyproline II helix	trans	-64.7	128.4	173	25.3	-31.5	0	0	0	109.2	T722 I802	T722-P800 HydrophobicContact CG2-CB 4.11Å; T722-P800 HydrophobicContact CG2-CG 3.65Å; P800-I802 HydrophobicContact CB-CD1 4.25Å; P800-I802 HydrophobicContact CB-CG1 4.3Å
801	N	77.3	Confident	70	Confident	104 Å²	104	90 Å²	90	56%	0.556	50%	0.503	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.8	93.9	177.2	-169.8	5.2	0	0	0	108.2	G790 I791 H799	G790-N801 WeakPolarHBondContact CA-O 3.3Å; I791-N801 PolarHBondContact N-O 3.12Å; H799-N801 PolarHBondContact O-N 3.06Å
802	I	88.4	Confident	67.6	Low	25 Å²	25	96.3 Å²	96.3	13%	0.128	53%	0.531	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	116.9	-177.1	-59.1	177.3	0	0	0	108.4	T722 F728 F754 C788 K789 I792 P800	T722-I802 HydrophobicContact CG2-CD1 3.56Å; F728-I802 HydrophobicContact CE2-CG2 3.96Å; F728-I802 HydrophobicContact CZ-CB 4.05Å; F728-I802 HydrophobicContact CZ-CG2 3.89Å; F754-I802 HydrophobicContact CE1-CD1 4.19Å; F754-I802 HydrophobicContact CE1-CG2 4.17Å; F754-I802 HydrophobicContact CZ-CD1 4.07Å; F754-I802 HydrophobicContact CZ-CG2 3.9Å; C788-I802 HydrophobicContact CB-CG2 3.89Å; K789-I802 WeakPolarHBondContact O-CA 3.35Å; I792-I802 HydrophobicContact CG1-CD1 4.16Å; P800-I802 HydrophobicContact CB-CD1 4.25Å; P800-I802 HydrophobicContact CB-CG1 4.3Å
803	E	87.6	Confident	65.1	Low	117 Å²	117	101.7 Å²	101.7	55%	0.547	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.2	132	172.7	-67.8	-172.3	166.5	0	0	109.1	K301 C788 K789	K301-E803 IonicContact NZ-OE1 2.81Å; K301-E803 PolarHBondContact NZ-OE1 3.02Å; K301-E803 VanDerWaalsContact NZ-OE1 3.17Å; K301-E803 IonicContact NZ-OE2 3.62Å; C788-E803 CarbonylContact C-O 3.55Å; C788-E803 VanDerWaalsContact CA-O 3.31Å; C788-E803 WeakPolarHBondContact CA-O 3.43Å; K789-E803 PolarHBondContact N-O 3.39Å; K789-E803 PolarHBondContact O-N 3.2Å
804	C	90.8	Very high	63	Low	50 Å²	50	104.5 Å²	104.5	34%	0.338	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-116	135.7	175.9	-56.7	0	0	0	0	110.5	L786 I787 C788	L786-C804 HydrophobicContact CB-CB 4.34Å; L786-C804 HydrophobicContact CD1-CB 4.48Å; I787-C804 CarbonylContact O-C 3.55Å; I787-C804 VanDerWaalsContact O-CA 3.23Å; I787-C804 WeakPolarHBondContact O-CA 3.37Å; C788-C804 HydrophobicContact CB-CB 4.13Å; C788-C804 WeakPolarHBondContact CB-SG 3.44Å; C788-C804 WeakPolarHBondContact SG-CB 3.06Å; C788-C804 CovalentContact SG-SG 2.05Å; C788-C804 PolarHBondContact SG-SG 2.73Å
805	S	84.9	Confident	61.7	Low	67 Å²	67	105.6 Å²	105.6	47%	0.469	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-129.7	151	177.5	63.5	0	0	0	0	111.6	L786 I787	L786-S805 WeakPolarHBondContact CA-O 3.37Å; I787-S805 WeakPolarHBondContact CG2-OG 3.37Å; I787-S805 PolarHBondContact N-O 3.45Å; I787-S805 PolarHBondContact O-N 3.3Å
806	E	77.1	Confident	60.2	Low	101 Å²	101	106.2 Å²	106.2	47%	0.472	59%	0.585	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-63.9	142.1	165.2	-75.5	-175.4	-149.1	0	0	108.5	K784 L786 D808	K784-E806 IonicContact NZ-OE2 2.72Å; K784-E806 PolarHBondContact NZ-OE2 3.06Å; L786-E806 HydrophobicContact CD2-CB 4.13Å; L786-E806 HydrophobicContact CD2-CG 3.28Å; E806-D808 PolarHBondContact O-N 2.89Å
807	R	62.5	Low	59	Low	153 Å²	153	106.6 Å²	106.6	58%	0.577	58%	0.58	S	S	*	*			trans	-71.5	112.7	164	-78.7	-171.4	176.3	-179.3	-2	106.7	I787 D809	I787-R807 HydrophobicContact CG2-CG 4.45Å; R807-D809 PolarHBondContact O-N 2.66Å
808	D	45.8	Very low	57.5	Low	141 Å²	141	106.3 Å²	106.3	75%	0.754	56%	0.563	S	S	*	*			trans	-68.3	110.9	158.9	-70.5	-35.9	0	0	0	105.6	E806 V810	E806-D808 PolarHBondContact O-N 2.89Å; D808-V810 HydrophobicContact CB-CG2 4.31Å; D808-V810 PolarHBondContact O-N 3.3Å
809	D	39.7	Very low	55.6	Low	148 Å²	148	108.2 Å²	108.2	79%	0.791	59%	0.585	S	S	*	*			trans	-68.4	65.3	175.5	-68.5	-40.9	0	0	0	110.2	R807	R807-D809 PolarHBondContact O-N 2.66Å
810	V	39.7	Very low	54.1	Low	122 Å²	122	106.1 Å²	106.1	74%	0.739	58%	0.583	S	S	*	*			trans	-106.1	91.6	162.1	-157.7	0	0	0	0	105.6	D808 E812	D808-V810 HydrophobicContact CB-CG2 4.31Å; D808-V810 PolarHBondContact O-N 3.3Å; V810-E812 VanDerWaalsContact C-N 3.3Å; V810-E812 PolarHBondContact O-N 3.15Å
811	D	39.3	Very low	52.3	Low	132 Å²	132	108.1 Å²	108.1	71%	0.706	60%	0.598	S	S	*	*			trans	-56.3	96.6	165.9	-74.4	-41.3	0	0	0	108.3	F813	D811-F813 HydrophobicContact CB-CD2 4.11Å; D811-F813 HydrophobicContact CB-CE2 4.22Å; D811-F813 PolarHBondContact O-N 3.37Å
812	E	39.9	Very low	50.6	Low	188 Å²	188	108.8 Å²	108.8	88%	0.879	60%	0.597	S	S	*	*			trans	-65.4	95.9	157.2	-171.9	171.6	-175.5	0	0	106.1	V810 D814	V810-E812 VanDerWaalsContact C-N 3.3Å; V810-E812 PolarHBondContact O-N 3.15Å; E812-D814 VanDerWaalsContact C-N 3.35Å; E812-D814 PolarHBondContact O-N 2.81Å
813	F	32.6	Very low	47.8	Very low	119 Å²	119	112.9 Å²	112.9	52%	0.522	63%	0.628	S	S	.	*			trans	-59.9	93.6	177.5	-113.5	-92.2	0	0	0	109.4	D811 P815	D811-F813 HydrophobicContact CB-CD2 4.11Å; D811-F813 HydrophobicContact CB-CE2 4.22Å; D811-F813 PolarHBondContact O-N 3.37Å; F813-P815 VanDerWaalsContact O-CD 3.29Å; F813-P815 WeakPolarHBondContact O-CD 3.3Å
814	D	39.3	Very low	45	Very low	79 Å²	79	113 Å²	113	42%	0.422	63%	0.632	S	S	.	*			trans	-83.1	106.2	152.1	-178.3	3.6	0	0	0	107.7	E812 S816 L817	E812-D814 VanDerWaalsContact C-N 3.35Å; E812-D814 PolarHBondContact O-N 2.81Å; D814-S816 PolarHBondContact O-N 2.99Å; D814-S816 WeakPolarHBondContact OD1-CB 3.35Å; D814-S816 PolarHBondContact OD1-N 2.86Å; D814-S816 PolarHBondContact OD1-OG 3.4Å; D814-L817 WeakPolarHBondContact OD2-CD1 3.44Å
815	P	41.3	Very low	42.2	Very low	118 Å²	118	115.1 Å²	115.1	77%	0.766	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	1.1	178.7	-13.6	30.5	0	0	0	113.3	F813	F813-P815 VanDerWaalsContact O-CD 3.29Å; F813-P815 WeakPolarHBondContact O-CD 3.3Å
816	S	38.4	Very low	39.6	Very low	94 Å²	94	114.1 Å²	114.1	66%	0.657	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.4	-8.6	-172.9	-24.7	0	0	0	0	114.6	D814	D814-S816 PolarHBondContact O-N 2.99Å; D814-S816 WeakPolarHBondContact OD1-CB 3.35Å; D814-S816 PolarHBondContact OD1-N 2.86Å; D814-S816 PolarHBondContact OD1-OG 3.4Å
817	L	41.5	Very low	37.5	Very low	132 Å²	132	112.7 Å²	112.7	69%	0.691	63%	0.627	S	S	*	*			trans	-111.2	115.6	-174.1	-115.1	80.1	0	0	0	112.8	D814 S819	D814-L817 WeakPolarHBondContact OD2-CD1 3.44Å; L817-S819 PolarHBondContact O-N 2.8Å
818	P	33.9	Very low	35.9	Very low	75 Å²	75	109.1 Å²	109.1	49%	0.487	62%	0.62	S	S	.	*			trans	-77.3	118.1	170.5	27.6	-27.3	0	0	0	110.2	T820	P818-T820 PolarHBondContact O-N 2.85Å; P818-T820 VanDerWaalsContact O-N 3.08Å
819	S	30.2	Very low	35.3	Very low	129 Å²	129	106.8 Å²	106.8	90%	0.902	62%	0.62	S	S	*	*			trans	-70.7	96.6	174.1	36.3	0	0	0	0	111.4	L817	L817-S819 PolarHBondContact O-N 2.8Å
820	T	35.3	Very low	35.5	Very low	102 Å²	102	105.7 Å²	105.7	63%	0.626	62%	0.619	S	S	*	*			trans	-105.9	110.3	169.2	42.1	0	0	0	0	111	P818	P818-T820 PolarHBondContact O-N 2.85Å; P818-T820 VanDerWaalsContact O-N 3.08Å
821	S	32.7	Very low	35.9	Very low	75 Å²	75	103.5 Å²	103.5	52%	0.524	61%	0.606	S	S	.	*				-179.2	98	114.4	77.7	0	0	0	0	107.2	K739	K739-S821 PolarHBondContact NZ-OG 3.15Å
822	H	41.3	Very low	36.9	Very low	117 Å²	117	99.6 Å²	99.6	54%	0.542	59%	0.587	S	S	.	*				71.2	99.8	83.5	-81.6	-113.7	0	0	0	112.1
823	S	30.2	Very low	38.3	Very low	111 Å²	111	91.7 Å²	91.7	78%	0.776	55%	0.552	S	S	*	*	S	Bend		-106.9	104.9	110.3	57.9	0	0	0	0	108.1
824	D	29.4	Very low	40.5	Very low	119 Å²	119	89 Å²	89	64%	0.636	55%	0.548	S	S	*	.	S	Bend	trans	67.6	138.7	138.5	-48.6	-34.4	0	0	0	122.3
825	V	32.1	Very low	42.5	Very low	95 Å²	95	92.4 Å²	92.4	58%	0.576	56%	0.562	S	S	*	*			trans	77.4	84.9	168.6	-156.8	0	0	0	0	113.6	I827 K836	V825-I827 HydrophobicContact CG1-CD1 4.31Å; V825-I827 HydrophobicContact CG1-CG1 4.03Å; V825-I827 PolarHBondContact O-N 2.9Å; V825-K836 PolarHBondContact O-NZ 2.88Å; V825-K836 VanDerWaalsContact O-NZ 3.09Å
826	I	28.9	Very low	44.5	Very low	46 Å²	46	91.7 Å²	91.7	24%	0.236	55%	0.546	C	S	.	.			trans	-42.3	121.1	154.5	-48	167.2	0	0	0	107.8	F650 K653	F650-I826 HydrophobicContact CE1-CD1 4.29Å; F650-I826 HydrophobicContact CZ-CD1 4.13Å; K653-I826 HydrophobicContact CD-CB 3.81Å; K653-I826 HydrophobicContact CD-CD1 4.42Å; K653-I826 HydrophobicContact CD-CG2 3.4Å; K653-I826 VanDerWaalsContact CD-CG2 3.4Å; K653-I826 HydrophobicContact CG-CB 4.21Å; K653-I826 HydrophobicContact CG-CD1 4Å; K653-I826 HydrophobicContact CG-CG2 3.62Å; K653-I826 PolarHBondContact NZ-O 3.49Å
827	I	33.1	Very low	46.9	Very low	71 Å²	71	87.5 Å²	87.5	36%	0.364	52%	0.517	S	S	.	.			trans	-135.1	108.1	163	-57.1	177.6	0	0	0	105	V825	V825-I827 HydrophobicContact CG1-CD1 4.31Å; V825-I827 HydrophobicContact CG1-CG1 4.03Å; V825-I827 PolarHBondContact O-N 2.9Å
828	D	29.9	Very low	49.2	Very low	78 Å²	78	82.9 Å²	82.9	42%	0.417	49%	0.494	S	S	.	.			trans	15.5	109.1	151.2	177.9	20.8	0	0	0	115.3	T830 T831	D828-T830 PolarHBondContact O-N 3.27Å; D828-T830 VanDerWaalsContact OD1-CB 3.27Å; D828-T830 WeakPolarHBondContact OD1-CB 3.45Å; D828-T830 PolarHBondContact OD1-N 2.98Å; D828-T830 PolarHBondContact OD1-OG1 2.81Å; D828-T831 WeakPolarHBondContact CB-OG1 3.34Å; D828-T831 PolarHBondContact O-N 3.42Å; D828-T831 WeakPolarHBondContact OD2-CG2 3.49Å; D828-T831 PolarHBondContact OD2-OG1 3.32Å
829	A	33.4	Very low	51.8	Low	93 Å²	93	83.1 Å²	83.1	77%	0.769	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	3.6	176.1	0	0	0	0	0	113.8
830	T	42.5	Very low	54.6	Low	125 Å²	125	79.6 Å²	79.6	77%	0.767	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	-9.8	170.9	-15	0	0	0	0	113.9	D828	D828-T830 PolarHBondContact O-N 3.27Å; D828-T830 VanDerWaalsContact OD1-CB 3.27Å; D828-T830 WeakPolarHBondContact OD1-CB 3.45Å; D828-T830 PolarHBondContact OD1-N 2.98Å; D828-T830 PolarHBondContact OD1-OG1 2.81Å
831	T	49.4	Very low	57.3	Low	76 Å²	76	74.8 Å²	74.8	47%	0.466	44%	0.436	S	S	.	.			trans	-129.2	104.5	178.5	51	0	0	0	0	111	D828 S833	D828-T831 WeakPolarHBondContact CB-OG1 3.34Å; D828-T831 PolarHBondContact O-N 3.42Å; D828-T831 WeakPolarHBondContact OD2-CG2 3.49Å; D828-T831 PolarHBondContact OD2-OG1 3.32Å; T831-S833 PolarHBondContact O-N 3.42Å
832	V	59.8	Low	60.1	Low	50 Å²	50	72.8 Å²	72.8	30%	0.303	42%	0.419	S	S	.	.			trans	-61	103.3	164.9	176.3	0	0	0	0	106.7	S834 V837 V865 K867 V872	V832-S834 PolarHBondContact O-N 2.83Å; V832-V837 HydrophobicContact CG1-CG2 3.24Å; V832-V865 HydrophobicContact CB-CG1 4.08Å; V832-V865 HydrophobicContact CG1-CG1 3.67Å; V832-K867 HydrophobicContact CG2-CB 3.79Å; V832-K867 HydrophobicContact CG2-CD 3.84Å; V832-K867 HydrophobicContact CG2-CG 4.02Å; V832-V872 HydrophobicContact CG1-CG1 4.1Å; V832-V872 HydrophobicContact CG1-CG2 4.31Å
833	S	69.5	Low	62.4	Low	21 Å²	21	72.2 Å²	72.2	15%	0.147	42%	0.415	C	S	.	.			trans	-53.2	111.1	179.4	163.2	0	0	0	0	109.8	T831 Q835 K836 V837	T831-S833 PolarHBondContact O-N 3.42Å; S833-Q835 PolarHBondContact O-N 3.24Å; S833-Q835 VanDerWaalsContact O-N 3.13Å; S833-K836 PolarHBondContact O-N 3.39Å; S833-K836 PolarHBondContact OG-N 2.91Å; S833-V837 PolarHBondContact O-N 2.9Å; S833-V837 VanDerWaalsContact O-N 3.1Å
834	S	79.1	Confident	65.2	Low	63 Å²	63	68 Å²	68	44%	0.441	38%	0.383	S	S	.	.	H	α-helix	trans	-53.9	-34.8	178.9	-173	0	0	0	0	111.3	V832 V837 T838 L862	V832-S834 PolarHBondContact O-N 2.83Å; S834-V837 PolarHBondContact O-N 2.81Å; S834-T838 WeakPolarHBondContact O-CB 3.47Å; S834-T838 PolarHBondContact O-N 3.09Å; S834-T838 PolarHBondContact O-OG1 2.86Å; S834-L862 WeakPolarHBondContact OG-CD2 3.39Å
835	Q	81.8	Confident	68	Low	150 Å²	150	62.6 Å²	62.6	70%	0.701	35%	0.354	S	S	*	.	H	α-helix	trans	-65.5	-44.5	177.5	-70.7	176.8	-20.1	0	0	112.7	S833 V837 T838 I839	S833-Q835 PolarHBondContact O-N 3.24Å; S833-Q835 VanDerWaalsContact O-N 3.13Å; Q835-V837 VanDerWaalsContact C-N 3.29Å; Q835-V837 PolarHBondContact O-N 3.37Å; Q835-T838 PolarHBondContact O-N 3.1Å; Q835-I839 WeakPolarHBondContact O-CG1 3.39Å; Q835-I839 PolarHBondContact O-N 2.8Å
836	K	83.1	Confident	70.6	Confident	103 Å²	103	60.3 Å²	60.3	45%	0.448	34%	0.339	S	S	.	.	H	α-helix	trans	-62.2	-40.7	175.8	-73.6	-173.3	178.1	-179.3	0	110.7	V825 S833 S840	V825-K836 PolarHBondContact O-NZ 2.88Å; V825-K836 VanDerWaalsContact O-NZ 3.09Å; S833-K836 PolarHBondContact O-N 3.39Å; S833-K836 PolarHBondContact OG-N 2.91Å; K836-S840 PolarHBondContact O-N 3.48Å; K836-S840 PolarHBondContact O-OG 2.94Å; K836-S840 VanDerWaalsContact O-OG 3.07Å
837	V	88.3	Confident	73.3	Confident	7 Å²	7	62.1 Å²	62.1	4%	0.042	36%	0.355	C	S	.	.	H	α-helix	trans	-64.7	-45.7	175.3	-179.6	0	0	0	0	111.2	V832 S833 S834 Q835 I839 S840 V841 L862 V865 V872 V874	V832-V837 HydrophobicContact CG1-CG2 3.24Å; S833-V837 PolarHBondContact O-N 2.9Å; S833-V837 VanDerWaalsContact O-N 3.1Å; S834-V837 PolarHBondContact O-N 2.81Å; Q835-V837 VanDerWaalsContact C-N 3.29Å; Q835-V837 PolarHBondContact O-N 3.37Å; V837-I839 PolarHBondContact O-N 3.27Å; V837-S840 PolarHBondContact O-N 3.22Å; V837-V841 HydrophobicContact CG1-CG2 4.22Å; V837-V841 VanDerWaalsContact O-CG2 3.29Å; V837-V841 WeakPolarHBondContact O-CG2 3.09Å; V837-V841 PolarHBondContact O-N 2.91Å; V837-L862 HydrophobicContact CB-CD2 4.01Å; V837-L862 HydrophobicContact CG1-CD1 4.05Å; V837-L862 HydrophobicContact CG1-CD2 3.8Å; V837-V865 HydrophobicContact CG1-CG2 4.32Å; V837-V865 HydrophobicContact CG2-CG1 4.08Å; V837-V872 HydrophobicContact CG2-CG1 4.2Å; V837-V874 HydrophobicContact CG1-CG1 3.42Å; V837-V874 VanDerWaalsContact CG1-CG1 3.42Å
838	T	89.9	Confident	75.7	Confident	34 Å²	34	62.4 Å²	62.4	21%	0.209	36%	0.355	C	S	.	.	H	α-helix	trans	-56.3	-52.1	176	-62.2	0	0	0	0	110.4	S834 Q835 S840 V841 Q842	S834-T838 WeakPolarHBondContact O-CB 3.47Å; S834-T838 PolarHBondContact O-N 3.09Å; S834-T838 PolarHBondContact O-OG1 2.86Å; Q835-T838 PolarHBondContact O-N 3.1Å; T838-S840 VanDerWaalsContact C-N 3.3Å; T838-S840 PolarHBondContact O-N 2.78Å; T838-V841 PolarHBondContact O-N 2.86Å; T838-V841 VanDerWaalsContact O-N 3.13Å; T838-Q842 HydrophobicContact CG2-CG 4.07Å; T838-Q842 WeakPolarHBondContact O-CB 3.33Å; T838-Q842 WeakPolarHBondContact O-CG 3.42Å; T838-Q842 PolarHBondContact O-N 2.76Å
839	I	87.9	Confident	78.2	Confident	81 Å²	81	62 Å²	62	42%	0.415	36%	0.359	S	S	.	.	H	α-helix	trans	-58.5	-41.8	179.2	-66.9	165.9	0	0	0	111.4	Q835 V837 Q842 K843	Q835-I839 WeakPolarHBondContact O-CG1 3.39Å; Q835-I839 PolarHBondContact O-N 2.8Å; V837-I839 PolarHBondContact O-N 3.27Å; I839-Q842 PolarHBondContact O-N 2.85Å; I839-K843 HydrophobicContact CG2-CD 4.22Å; I839-K843 WeakPolarHBondContact O-CB 3.37Å; I839-K843 WeakPolarHBondContact O-CG 3.45Å; I839-K843 PolarHBondContact O-N 2.98Å
840	S	89	Confident	80.7	Confident	55 Å²	55	57.7 Å²	57.7	39%	0.385	32%	0.322	S	S	.	.	H	α-helix	trans	-65.4	-41.1	177.3	-63.3	0	0	0	0	112.5	K836 V837 T838 K843 L844	K836-S840 PolarHBondContact O-N 3.48Å; K836-S840 PolarHBondContact O-OG 2.94Å; K836-S840 VanDerWaalsContact O-OG 3.07Å; V837-S840 PolarHBondContact O-N 3.22Å; T838-S840 VanDerWaalsContact C-N 3.3Å; T838-S840 PolarHBondContact O-N 2.78Å; S840-K843 PolarHBondContact O-N 3.33Å; S840-L844 WeakPolarHBondContact O-CB 3.36Å; S840-L844 PolarHBondContact O-N 2.92Å
841	V	91.3	Very high	82.9	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-64.9	-43.8	174.7	172.7	0	0	0	0	110.7	V837 T838 K843 L844 M845 V859 L862 V874 F876 L914	V837-V841 HydrophobicContact CG1-CG2 4.22Å; V837-V841 VanDerWaalsContact O-CG2 3.29Å; V837-V841 WeakPolarHBondContact O-CG2 3.09Å; V837-V841 PolarHBondContact O-N 2.91Å; T838-V841 PolarHBondContact O-N 2.86Å; T838-V841 VanDerWaalsContact O-N 3.13Å; V841-K843 PolarHBondContact O-N 3.48Å; V841-L844 WeakPolarHBondContact O-CB 3.48Å; V841-L844 PolarHBondContact O-N 3.32Å; V841-L844 VanDerWaalsContact O-N 3.17Å; V841-M845 HydrophobicContact CG1-CE 4.43Å; V841-M845 WeakPolarHBondContact O-CG 3.36Å; V841-M845 PolarHBondContact O-N 3Å; V841-V859 HydrophobicContact CG1-CG1 4.35Å; V841-V859 HydrophobicContact CG1-CG2 3.92Å; V841-L862 HydrophobicContact CG2-CD1 4.22Å; V841-V874 HydrophobicContact CG2-CG2 4.28Å; V841-F876 HydrophobicContact CG1-CD1 3.85Å; V841-F876 HydrophobicContact CG1-CD2 3.64Å; V841-F876 HydrophobicContact CG1-CE1 3.63Å; V841-F876 HydrophobicContact CG1-CE2 3.38Å; V841-F876 HydrophobicContact CG1-CG 3.86Å; V841-F876 HydrophobicContact CG1-CZ 3.38Å; V841-F876 HydrophobicContact CG2-CD1 4.4Å; V841-F876 HydrophobicContact CG2-CE1 4.33Å; V841-L914 HydrophobicContact CG2-CD1 4.15Å
842	Q	92.2	Very high	84.8	Confident	33 Å²	33	49.3 Å²	49.3	15%	0.154	27%	0.271	C	S	.	.	H	α-helix	trans	-60.2	-44.9	177	-68.3	-179.2	-23.9	0	0	111.7	T838 I839 L844 M845 L846 V859 L891 Y895	T838-Q842 HydrophobicContact CG2-CG 4.07Å; T838-Q842 WeakPolarHBondContact O-CB 3.33Å; T838-Q842 WeakPolarHBondContact O-CG 3.42Å; T838-Q842 PolarHBondContact O-N 2.76Å; I839-Q842 PolarHBondContact O-N 2.85Å; Q842-L844 VanDerWaalsContact C-N 3.32Å; Q842-M845 PolarHBondContact O-N 2.71Å; Q842-L846 PolarHBondContact O-N 3.26Å; Q842-V859 HydrophobicContact CG-CB 4.01Å; Q842-V859 HydrophobicContact CG-CG2 3.98Å; Q842-L891 HydrophobicContact CB-CD1 4.01Å; Q842-L891 HydrophobicContact CB-CD2 4.24Å; Q842-L891 WeakPolarHBondContact O-CD1 3.31Å; Q842-Y895 HydrophobicContact CB-CE2 4.29Å; Q842-Y895 HydrophobicContact CG-CE1 4.18Å; Q842-Y895 HydrophobicContact CG-CE2 4.27Å; Q842-Y895 VanDerWaalsContact CG-OH 3.3Å; Q842-Y895 WeakPolarHBondContact CG-OH 3.47Å
843	K	89	Confident	86	Confident	105 Å²	105	53.6 Å²	53.6	46%	0.457	29%	0.286	S	S	.	.	H	α-helix	trans	-62.2	-40.1	174.1	-75.6	178.9	178.7	-175.2	0	111.9	I839 S840 V841 L846 S847 L891	I839-K843 HydrophobicContact CG2-CD 4.22Å; I839-K843 WeakPolarHBondContact O-CB 3.37Å; I839-K843 WeakPolarHBondContact O-CG 3.45Å; I839-K843 PolarHBondContact O-N 2.98Å; S840-K843 PolarHBondContact O-N 3.33Å; V841-K843 PolarHBondContact O-N 3.48Å; K843-L846 PolarHBondContact O-N 2.95Å; K843-S847 WeakPolarHBondContact O-CB 3.35Å; K843-S847 PolarHBondContact O-N 3.21Å; K843-S847 PolarHBondContact O-OG 3.02Å; K843-L891 HydrophobicContact CG-CD2 4.17Å
844	L	88.7	Confident	86.8	Confident	23 Å²	23	54.2 Å²	54.2	12%	0.12	30%	0.295	C	S	.	.	H	α-helix	trans	-65.4	-44.4	179.1	-176.6	68.6	0	0	0	112.2	S840 V841 Q842 L846 S847 E848 L914 H922 I924	S840-L844 WeakPolarHBondContact O-CB 3.36Å; S840-L844 PolarHBondContact O-N 2.92Å; V841-L844 WeakPolarHBondContact O-CB 3.48Å; V841-L844 PolarHBondContact O-N 3.32Å; V841-L844 VanDerWaalsContact O-N 3.17Å; Q842-L844 VanDerWaalsContact C-N 3.32Å; L844-L846 PolarHBondContact O-N 3.44Å; L844-S847 WeakPolarHBondContact CA-OG 3.48Å; L844-S847 PolarHBondContact O-N 3.48Å; L844-S847 PolarHBondContact O-OG 3.34Å; L844-S847 VanDerWaalsContact O-OG 3.09Å; L844-E848 HydrophobicContact CD1-CG 3.72Å; L844-E848 HydrophobicContact CG-CG 4.31Å; L844-E848 WeakPolarHBondContact O-CB 3.42Å; L844-E848 PolarHBondContact O-N 3.49Å; L844-L914 HydrophobicContact CD2-CD1 3.92Å; L844-H922 WeakPolarHBondContact CD1-CD2 3.48Å; L844-H922 HydrophobicContact CD2-CB 4.13Å; L844-I924 HydrophobicContact CD2-CD1 3.4Å; L844-I924 VanDerWaalsContact CD2-CD1 3.4Å; L844-I924 HydrophobicContact CD2-CG1 4.37Å
845	M	89.1	Confident	87.3	Confident	5 Å²	5	54.2 Å²	54.2	3%	0.025	29%	0.288	C	S	.	.	H	α-helix	trans	-58	-35.7	175.7	-64.3	-53.7	95.8	0	0	111.5	V841 Q842 S849 M850 V857 V859 F876 I878 L932	V841-M845 HydrophobicContact CG1-CE 4.43Å; V841-M845 WeakPolarHBondContact O-CG 3.36Å; V841-M845 PolarHBondContact O-N 3Å; Q842-M845 PolarHBondContact O-N 2.71Å; M845-S849 PolarHBondContact O-N 3.37Å; M845-M850 HydrophobicContact CB-CB 4.3Å; M845-M850 WeakPolarHBondContact O-CB 3.39Å; M845-M850 PolarHBondContact O-N 3.25Å; M845-M850 HydrophobicContact SD-CB 4.19Å; M845-M850 HydrophobicContact SD-CG 4.09Å; M845-V857 HydrophobicContact CB-CG2 3.99Å; M845-V857 HydrophobicContact CG-CG2 4.28Å; M845-V859 HydrophobicContact CG-CG2 3.75Å; M845-F876 HydrophobicContact CE-CE2 4.02Å; M845-F876 HydrophobicContact CE-CZ 3.61Å; M845-F876 HydrophobicContact CG-CE2 4.4Å; M845-F876 HydrophobicContact SD-CE2 3.81Å; M845-F876 HydrophobicContact SD-CZ 4.01Å; M845-I878 HydrophobicContact CG-CG2 4.42Å; M845-I878 HydrophobicContact SD-CG2 4.22Å; M845-L932 HydrophobicContact CE-CD1 3.38Å; M845-L932 HydrophobicContact SD-CD1 3.81Å
846	L	87.6	Confident	87.8	Confident	47 Å²	47	47.6 Å²	47.6	25%	0.246	26%	0.257	C	S	.	.	H	α-helix	trans	-75.8	-45.3	176.9	-178.1	54.5	0	0	0	112.8	Q842 K843 L844 E848 S849 L891 I894	Q842-L846 PolarHBondContact O-N 3.26Å; K843-L846 PolarHBondContact O-N 2.95Å; L844-L846 PolarHBondContact O-N 3.44Å; L846-E848 VanDerWaalsContact C-N 3.33Å; L846-E848 PolarHBondContact O-N 3.46Å; L846-S849 PolarHBondContact O-N 3.02Å; L846-L891 HydrophobicContact CB-CD1 4.22Å; L846-L891 HydrophobicContact CD2-CB 4.05Å; L846-L891 HydrophobicContact CD2-CD1 4Å; L846-I894 HydrophobicContact CD1-CD1 3.37Å; L846-I894 HydrophobicContact CD2-CD1 4.37Å; L846-I894 HydrophobicContact CG-CD1 4.34Å
847	S	84.4	Confident	88.2	Confident	84 Å²	84	43 Å²	43	59%	0.587	24%	0.238	S	C	*	.	H	α-helix	trans	-64.9	-38.8	-176	59.2	0	0	0	0	112.3	K843 L844 S849	K843-S847 WeakPolarHBondContact O-CB 3.35Å; K843-S847 PolarHBondContact O-N 3.21Å; K843-S847 PolarHBondContact O-OG 3.02Å; L844-S847 WeakPolarHBondContact CA-OG 3.48Å; L844-S847 PolarHBondContact O-N 3.48Å; L844-S847 PolarHBondContact O-OG 3.34Å; L844-S847 VanDerWaalsContact O-OG 3.09Å; S847-S849 VanDerWaalsContact C-N 3.28Å; S847-S849 PolarHBondContact O-N 3.22Å
848	E	82.9	Confident	88.4	Confident	77 Å²	77	45.6 Å²	45.6	36%	0.36	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	6.7	-179.7	-63.7	-78.8	158.4	0	0	112.6	L844 L846 M850 H922 L932	L844-E848 HydrophobicContact CD1-CG 3.72Å; L844-E848 HydrophobicContact CG-CG 4.31Å; L844-E848 WeakPolarHBondContact O-CB 3.42Å; L844-E848 PolarHBondContact O-N 3.49Å; L846-E848 VanDerWaalsContact C-N 3.33Å; L846-E848 PolarHBondContact O-N 3.46Å; E848-M850 PolarHBondContact O-N 2.93Å; E848-H922 IonicContact OE1-NE2 3.97Å; E848-L932 HydrophobicContact CB-CD2 2.92Å; E848-L932 HydrophobicContact CB-CG 4.39Å; E848-L932 HydrophobicContact CG-CD2 3.71Å
849	S	83.7	Confident	88.5	Confident	70 Å²	70	44.5 Å²	44.5	49%	0.49	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	45.3	175.8	-54.2	0	0	0	0	114.4	M845 L846 S847 T851	M845-S849 PolarHBondContact O-N 3.37Å; L846-S849 PolarHBondContact O-N 3.02Å; S847-S849 VanDerWaalsContact C-N 3.28Å; S847-S849 PolarHBondContact O-N 3.22Å; S849-T851 PolarHBondContact O-N 2.76Å
850	M	86.2	Confident	88.5	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.01	25%	0.247	C	C	.	.			trans	-64.3	128.7	178.1	-176.8	57.9	167.1	0	0	111.5	M845 E848 V857 I878 C926 G929 K931 L932	M845-M850 HydrophobicContact CB-CB 4.3Å; M845-M850 WeakPolarHBondContact O-CB 3.39Å; M845-M850 PolarHBondContact O-N 3.25Å; M845-M850 HydrophobicContact SD-CB 4.19Å; M845-M850 HydrophobicContact SD-CG 4.09Å; E848-M850 PolarHBondContact O-N 2.93Å; M850-V857 HydrophobicContact CB-CG2 3.79Å; M850-V857 HydrophobicContact CG-CB 4.47Å; M850-V857 HydrophobicContact CG-CG1 4.07Å; M850-V857 HydrophobicContact CG-CG2 3.61Å; M850-I878 HydrophobicContact CE-CD1 3.33Å; M850-I878 HydrophobicContact CG-CD1 4.07Å; M850-C926 HydrophobicContact CE-CB 3.5Å; M850-C926 VanDerWaalsContact CE-SG 3.56Å; M850-G929 VanDerWaalsContact CE-CA 3.46Å; M850-K931 WeakPolarHBondContact CA-O 3.33Å; M850-K931 VanDerWaalsContact SD-C 3.6Å; M850-L932 HydrophobicContact CB-CD1 4.39Å; M850-L932 HydrophobicContact CB-CD2 3.94Å; M850-L932 HydrophobicContact CB-CG 4Å; M850-L932 HydrophobicContact CG-CD1 4.38Å; M850-L932 HydrophobicContact CG-CG 4.17Å; M850-L932 HydrophobicContact SD-CD1 4.34Å; M850-L932 HydrophobicContact SD-CG 3.79Å
851	T	88.8	Confident	88.5	Confident	21 Å²	21	50.4 Å²	50.4	13%	0.129	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	153.5	179.4	57.4	0	0	0	0	111.7	S849 H855 D930	S849-T851 PolarHBondContact O-N 2.76Å; T851-H855 CarbonylContact C-O 3.59Å; T851-H855 WeakPolarHBondContact CA-O 3.32Å; T851-H855 WeakPolarHBondContact CB-O 3.37Å; T851-D930 PolarHBondContact O-N 3.33Å
852	I	87.7	Confident	88.4	Confident	4 Å²	4	51.6 Å²	51.6	2%	0.021	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	120.6	166.6	-67.8	166.8	0	0	0	105.7	G854 H855 V857 I878 E880 I908	I852-G854 PolarHBondContact O-N 3.19Å; I852-G854 VanDerWaalsContact O-N 3.13Å; I852-H855 PolarHBondContact N-O 3.1Å; I852-H855 PolarHBondContact O-N 3.16Å; I852-V857 HydrophobicContact CB-CG1 4.18Å; I852-V857 HydrophobicContact CD1-CG1 3.73Å; I852-V857 HydrophobicContact CG1-CG1 3.59Å; I852-I878 HydrophobicContact CD1-CD1 4.07Å; I852-I878 HydrophobicContact CD1-CG1 4.1Å; I852-E880 HydrophobicContact CB-CB 4.06Å; I852-E880 HydrophobicContact CB-CG 4.09Å; I852-E880 HydrophobicContact CG2-CB 3.99Å; I852-E880 HydrophobicContact CG2-CG 4.1Å; I852-I908 HydrophobicContact CD1-CB 4.42Å; I852-I908 HydrophobicContact CD1-CD1 3.55Å; I852-I908 HydrophobicContact CD1-CG1 3.87Å; I852-I908 HydrophobicContact CG1-CD1 3.64Å; I852-I908 HydrophobicContact CG1-CG1 4.5Å; I852-I908 HydrophobicContact CG2-CD1 4.27Å
853	K	85.2	Confident	88.3	Confident	141 Å²	141	53.3 Å²	53.3	61%	0.613	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	34.1	-177.9	-57.5	174.1	-174	164	0	112.8	H855 D930	K853-H855 VanDerWaalsContact C-N 3.32Å; K853-H855 PolarHBondContact O-N 2.83Å; K853-H855 PolarHBondContact O-ND1 2.92Å; K853-D930 WeakPolarHBondContact CA-OD2 3.42Å; K853-D930 PolarHBondContact N-OD2 3.21Å
854	G	86.2	Confident	88.4	Confident	34 Å²	34	53.3 Å²	53.3	35%	0.351	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.5	9.1	-178.9	0	0	0	0	0	116	I852 G885	I852-G854 PolarHBondContact O-N 3.19Å; I852-G854 VanDerWaalsContact O-N 3.13Å; G854-G885 WeakPolarHBondContact O-CA 3.38Å; G854-G885 PolarHBondContact O-N 3.5Å
855	H	90.7	Very high	88.4	Confident	62 Å²	62	54.6 Å²	54.6	29%	0.287	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	150.7	171.9	-59.2	99.7	0	0	0	111.8	T851 I852 K853 E880 T881 C883	T851-H855 CarbonylContact C-O 3.59Å; T851-H855 WeakPolarHBondContact CA-O 3.32Å; T851-H855 WeakPolarHBondContact CB-O 3.37Å; I852-H855 PolarHBondContact N-O 3.1Å; I852-H855 PolarHBondContact O-N 3.16Å; K853-H855 VanDerWaalsContact C-N 3.32Å; K853-H855 PolarHBondContact O-N 2.83Å; K853-H855 PolarHBondContact O-ND1 2.92Å; H855-E880 HydrophobicContact CB-CG 3.79Å; H855-E880 IonicContact CE1-OE1 3.47Å; H855-E880 IonicContact CG-OE1 3.54Å; H855-E880 IonicContact ND1-OE1 2.72Å; H855-E880 PolarHBondContact ND1-OE1 3.5Å; H855-T881 WeakPolarHBondContact CB-O 3.49Å; H855-C883 CarbonylContact C-O 3.53Å; H855-C883 VanDerWaalsContact CA-O 3.27Å; H855-C883 WeakPolarHBondContact CA-O 3.4Å; H855-C883 WeakPolarHBondContact CB-O 3.18Å
856	H	91.2	Very high	88.2	Confident	12 Å²	12	58.9 Å²	58.9	6%	0.056	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	151	175.3	-79.6	-72.9	0	0	0	111.1	T881 C883 S884 L887 I894	H856-T881 WeakPolarHBondContact CB-OG1 3.35Å; H856-T881 WeakPolarHBondContact O-CB 3.43Å; H856-T881 WeakPolarHBondContact O-CG2 3.45Å; H856-T881 PolarHBondContact O-N 2.73Å; H856-T881 PolarHBondContact O-OG1 2.92Å; H856-C883 HydrophobicContact CB-CB 4.44Å; H856-C883 PolarHBondContact N-O 3.37Å; H856-S884 PolarHBondContact CD2-O 2.9Å; H856-S884 PolarHBondContact NE2-O 3.47Å; H856-L887 PolarHBondContact CE1-O 3.26Å; H856-L887 PolarHBondContact NE2-O 2.9Å; H856-I894 HydrophobicContact CB-CD1 4.36Å; H856-I894 HydrophobicContact CB-CG1 4.44Å
857	V	92.1	Very high	88	Confident	6 Å²	6	63.3 Å²	63.3	4%	0.036	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	152	178.9	-55	0	0	0	0	112.1	M845 M850 I852 I878 S879	M845-V857 HydrophobicContact CB-CG2 3.99Å; M845-V857 HydrophobicContact CG-CG2 4.28Å; M850-V857 HydrophobicContact CB-CG2 3.79Å; M850-V857 HydrophobicContact CG-CB 4.47Å; M850-V857 HydrophobicContact CG-CG1 4.07Å; M850-V857 HydrophobicContact CG-CG2 3.61Å; I852-V857 HydrophobicContact CB-CG1 4.18Å; I852-V857 HydrophobicContact CD1-CG1 3.73Å; I852-V857 HydrophobicContact CG1-CG1 3.59Å; V857-I878 HydrophobicContact CB-CB 4.3Å; V857-I878 HydrophobicContact CB-CD1 4.3Å; V857-I878 HydrophobicContact CG1-CD1 4.2Å; V857-I878 HydrophobicContact CG2-CD1 4.32Å; V857-S879 WeakPolarHBondContact CA-O 3.4Å
858	R	91.8	Very high	87.7	Confident	62 Å²	62	62 Å²	62	23%	0.234	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	129.9	173.4	-158.4	172.4	-179.7	151.2	-6	109.3	E860 I878 S879 T881 I894 Y895 S896 C899 V901	R858-E860 PolarHBondContact O-N 2.72Å; R858-I878 CarbonylContact O-C 3.46Å; R858-I878 VanDerWaalsContact O-CA 3.25Å; R858-I878 WeakPolarHBondContact O-CA 3.1Å; R858-S879 PolarHBondContact N-O 2.94Å; R858-S879 PolarHBondContact O-N 2.85Å; R858-T881 HydrophobicContact CB-CG2 3.79Å; R858-I894 PolarHBondContact NH1-O 3.5Å; R858-Y895 HydrophobicContact CG-CD1 3.66Å; R858-Y895 HydrophobicContact CG-CE1 3.3Å; R858-Y895 HydrophobicContact CG-CE2 4.33Å; R858-Y895 HydrophobicContact CG-CG 4.28Å; R858-Y895 PolarHBondContact NH2-O 2.92Å; R858-S896 PolarHBondContact NH1-O 3.08Å; R858-C899 PolarHBondContact NH1-O 3.31Å; R858-V901 HydrophobicContact CB-CG2 4.34Å
859	V	91.9	Very high	87.3	Confident	10 Å²	10	64 Å²	64	6%	0.061	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	118.6	173.2	-179.4	0	0	0	0	107.5	V841 Q842 M845 F876 I878 Y895	V841-V859 HydrophobicContact CG1-CG1 4.35Å; V841-V859 HydrophobicContact CG1-CG2 3.92Å; Q842-V859 HydrophobicContact CG-CB 4.01Å; Q842-V859 HydrophobicContact CG-CG2 3.98Å; M845-V859 HydrophobicContact CG-CG2 3.75Å; V859-F876 HydrophobicContact CG1-CD2 4.08Å; V859-F876 HydrophobicContact CG2-CD2 4.44Å; V859-F876 HydrophobicContact CG2-CE2 4.46Å; V859-I878 HydrophobicContact CG2-CG2 4.13Å; V859-Y895 WeakPolarHBondContact CB-OH 3.49Å; V859-Y895 WeakPolarHBondContact CG2-OH 3.37Å; V859-Y895 PolarHBondContact N-OH 2.69Å
860	E	88.5	Confident	86.7	Confident	121 Å²	121	64.4 Å²	64.4	57%	0.565	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.1	-54.2	-174.3	-173.5	173.7	-178.9	0	0	110.6	R858 T877 S879	R858-E860 PolarHBondContact O-N 2.72Å; E860-T877 PolarHBondContact N-O 3.17Å; E860-S879 PolarHBondContact OE2-OG 3.3Å
861	K	89.1	Confident	86.5	Confident	140 Å²	140	64.3 Å²	64.3	61%	0.609	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.7	139.8	-179.7	-170.8	174.5	179.3	179.7	0	112.2	F876 T877	K861-F876 CarbonylContact O-C 3.46Å; K861-F876 WeakPolarHBondContact O-CA 3.33Å; K861-F876 VanDerWaalsContact O-CB 3.29Å; K861-F876 WeakPolarHBondContact O-CB 3.38Å; K861-T877 PolarHBondContact N-OG1 2.89Å; K861-T877 PolarHBondContact O-N 3.45Å; K861-T877 PolarHBondContact O-OG1 3.13Å
862	L	90.2	Very high	86.4	Confident	25 Å²	25	64 Å²	64	13%	0.131	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	112.4	167.7	-150.1	81.2	0	0	0	107.8	S834 V837 V841 V865 F876	S834-L862 WeakPolarHBondContact OG-CD2 3.39Å; V837-L862 HydrophobicContact CB-CD2 4.01Å; V837-L862 HydrophobicContact CG1-CD1 4.05Å; V837-L862 HydrophobicContact CG1-CD2 3.8Å; V841-L862 HydrophobicContact CG2-CD1 4.22Å; L862-V865 HydrophobicContact CD2-CG2 3.09Å; L862-V865 HydrophobicContact CG-CG2 3.8Å; L862-F876 HydrophobicContact CD1-CB 3.92Å
863	T	89.7	Confident	86.5	Confident	69 Å²	69	66.7 Å²	66.7	42%	0.423	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-31.6	-174.9	56.3	0	0	0	0	112.5	E875 T877	T863-E875 PolarHBondContact N-O 3.18Å; T863-E875 WeakPolarHBondContact OG1-CB 3.48Å; T863-E875 VanDerWaalsContact OG1-CG 3.29Å; T863-E875 WeakPolarHBondContact OG1-CG 3.26Å; T863-E875 PolarHBondContact OG1-O 2.83Å; T863-T877 HydrophobicContact CG2-CG2 4.28Å
864	K	90.1	Very high	86.9	Confident	104 Å²	104	60.1 Å²	60.1	45%	0.452	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	139	178	-164	177.2	177.8	177.3	0	111.6	V874 E875	K864-V874 CarbonylContact O-C 3.47Å; K864-V874 WeakPolarHBondContact O-CA 3Å; K864-E875 HydrophobicContact CB-CB 3.55Å; K864-E875 PolarHBondContact N-O 2.88Å; K864-E875 PolarHBondContact O-N 2.93Å
865	V	89.2	Confident	87.2	Confident	51 Å²	51	61.8 Å²	61.8	31%	0.309	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	125	171	-175.7	0	0	0	0	108.4	V832 V837 L862 V872 L873	V832-V865 HydrophobicContact CB-CG1 4.08Å; V832-V865 HydrophobicContact CG1-CG1 3.67Å; V837-V865 HydrophobicContact CG1-CG2 4.32Å; V837-V865 HydrophobicContact CG2-CG1 4.08Å; L862-V865 HydrophobicContact CD2-CG2 3.09Å; L862-V865 HydrophobicContact CG-CG2 3.8Å; V865-V872 HydrophobicContact CG1-CG1 3.55Å; V865-L873 CarbonylContact C-O 3.53Å; V865-L873 WeakPolarHBondContact CA-O 3.38Å
866	Q	85.5	Confident	87.3	Confident	94 Å²	94	58.8 Å²	58.8	44%	0.439	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	120.1	178	-178.2	176.1	25.4	0	0	109.9	V868 V872 L873	Q866-V868 HydrophobicContact CG-CG1 4.43Å; Q866-V872 CarbonylContact O-C 3.58Å; Q866-L873 HydrophobicContact CB-CB 4.28Å; Q866-L873 PolarHBondContact N-O 3.33Å; Q866-L873 PolarHBondContact O-N 3.42Å
867	K	81.8	Confident	87.4	Confident	141 Å²	141	59.1 Å²	59.1	61%	0.613	30%	0.297	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.6	129.5	174.3	-161.8	176.3	-179.8	178.4	0	109.7	V832	V832-K867 HydrophobicContact CG2-CB 3.79Å; V832-K867 HydrophobicContact CG2-CD 3.84Å; V832-K867 HydrophobicContact CG2-CG 4.02Å
868	V	79.7	Confident	87.4	Confident	56 Å²	56	58.9 Å²	58.9	34%	0.339	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	169.8	171.7	-62	0	0	0	0	108.8	Q866 S870 G871 L913	Q866-V868 HydrophobicContact CG-CG1 4.43Å; V868-S870 VanDerWaalsContact C-N 3.29Å; V868-S870 PolarHBondContact O-N 3.48Å; V868-G871 CarbonylContact C-O 3.52Å; V868-G871 WeakPolarHBondContact CG2-O 3.3Å; V868-G871 PolarHBondContact N-O 3.06Å; V868-G871 PolarHBondContact O-N 3.11Å; V868-L913 HydrophobicContact CG2-CD1 3.33Å
869	I	73.9	Confident	87.4	Confident	120 Å²	120	56 Å²	56	62%	0.615	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-33.6	-174.7	-69.3	167.2	0	0	0	112.3	V102 P103 G871	V102-I869 HydrophobicContact CG1-CD1 4.27Å; P103-I869 HydrophobicContact CB-CD1 3.98Å; P103-I869 WeakPolarHBondContact O-CD1 3.41Å; I869-G871 VanDerWaalsContact C-N 3.31Å
870	S	71.6	Confident	87.4	Confident	77 Å²	77	56.2 Å²	56.2	54%	0.538	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-12.8	177.7	50.7	0	0	0	0	113.8	V868 L913	V868-S870 VanDerWaalsContact C-N 3.29Å; V868-S870 PolarHBondContact O-N 3.48Å; S870-L913 WeakPolarHBondContact OG-CD1 3.41Å
871	G	80.7	Confident	87.6	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	156.9	-147.7	-178.4	0	0	0	0	0	114.3	V868 I869	V868-G871 CarbonylContact C-O 3.52Å; V868-G871 WeakPolarHBondContact CG2-O 3.3Å; V868-G871 PolarHBondContact N-O 3.06Å; V868-G871 PolarHBondContact O-N 3.11Å; I869-G871 VanDerWaalsContact C-N 3.31Å
872	V	88.6	Confident	87.8	Confident	14 Å²	14	47.2 Å²	47.2	9%	0.085	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	112.3	176.5	-174.6	0	0	0	0	108.5	V832 V837 V865 Q866 V874 L914 V916	V832-V872 HydrophobicContact CG1-CG1 4.1Å; V832-V872 HydrophobicContact CG1-CG2 4.31Å; V837-V872 HydrophobicContact CG2-CG1 4.2Å; V865-V872 HydrophobicContact CG1-CG1 3.55Å; Q866-V872 CarbonylContact O-C 3.58Å; V872-V874 HydrophobicContact CG1-CG1 3.86Å; V872-V874 PolarHBondContact O-N 3.27Å; V872-L914 HydrophobicContact CB-CB 4.5Å; V872-L914 PolarHBondContact N-O 2.92Å; V872-L914 WeakPolarHBondContact O-CB 3.3Å; V872-L914 PolarHBondContact O-N 3.49Å; V872-V916 HydrophobicContact CG2-CG2 4.24Å
873	L	88.8	Confident	87.9	Confident	61 Å²	61	46.7 Å²	46.7	32%	0.319	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	122.9	171.2	-171.8	77.3	0	0	0	108.6	V865 Q866 G912	V865-L873 CarbonylContact C-O 3.53Å; V865-L873 WeakPolarHBondContact CA-O 3.38Å; Q866-L873 HydrophobicContact CB-CB 4.28Å; Q866-L873 PolarHBondContact N-O 3.33Å; Q866-L873 PolarHBondContact O-N 3.42Å; L873-G912 WeakPolarHBondContact CA-O 3.48Å
874	V	92.8	Very high	87.9	Confident	3 Å²	3	45.4 Å²	45.4	2%	0.018	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	146.2	-176	-63	0	0	0	0	111.3	V837 V841 K864 V872 F876 K911 G912 L914 I924	V837-V874 HydrophobicContact CG1-CG1 3.42Å; V837-V874 VanDerWaalsContact CG1-CG1 3.42Å; V841-V874 HydrophobicContact CG2-CG2 4.28Å; K864-V874 CarbonylContact O-C 3.47Å; K864-V874 WeakPolarHBondContact O-CA 3Å; V872-V874 HydrophobicContact CG1-CG1 3.86Å; V872-V874 PolarHBondContact O-N 3.27Å; V874-F876 HydrophobicContact CB-CD1 4.36Å; V874-F876 HydrophobicContact CG2-CD1 4.02Å; V874-F876 HydrophobicContact CG2-CE1 3.95Å; V874-K911 WeakPolarHBondContact O-CA 3.18Å; V874-G912 WeakPolarHBondContact CG2-O 3.14Å; V874-G912 PolarHBondContact N-O 3.2Å; V874-G912 PolarHBondContact O-N 3.36Å; V874-L914 HydrophobicContact CG1-CB 4.44Å; V874-L914 HydrophobicContact CG2-CB 4.38Å; V874-I924 HydrophobicContact CG2-CD1 3.89Å; V874-I924 HydrophobicContact CG2-CG1 4.3Å
875	E	93.4	Very high	87.7	Confident	68 Å²	68	41.6 Å²	41.6	32%	0.318	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	133.7	165.8	-163.4	-179.2	140.5	0	0	107.4	T863 K864 V909 C910 K911	T863-E875 PolarHBondContact N-O 3.18Å; T863-E875 WeakPolarHBondContact OG1-CB 3.48Å; T863-E875 VanDerWaalsContact OG1-CG 3.29Å; T863-E875 WeakPolarHBondContact OG1-CG 3.26Å; T863-E875 PolarHBondContact OG1-O 2.83Å; K864-E875 HydrophobicContact CB-CB 3.55Å; K864-E875 PolarHBondContact N-O 2.88Å; K864-E875 PolarHBondContact O-N 2.93Å; E875-V909 HydrophobicContact CG-CG1 4.06Å; E875-C910 CarbonylContact C-O 3.57Å; E875-C910 WeakPolarHBondContact CA-O 3.37Å; E875-K911 HydrophobicContact CG-CB 4.14Å
876	F	93.5	Very high	87.4	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	163.1	-174.9	62.2	-84.9	0	0	0	111.9	V841 M845 V859 K861 L862 V874 I878 C910 I924	V841-F876 HydrophobicContact CG1-CD1 3.85Å; V841-F876 HydrophobicContact CG1-CD2 3.64Å; V841-F876 HydrophobicContact CG1-CE1 3.63Å; V841-F876 HydrophobicContact CG1-CE2 3.38Å; V841-F876 HydrophobicContact CG1-CG 3.86Å; V841-F876 HydrophobicContact CG1-CZ 3.38Å; V841-F876 HydrophobicContact CG2-CD1 4.4Å; V841-F876 HydrophobicContact CG2-CE1 4.33Å; M845-F876 HydrophobicContact CE-CE2 4.02Å; M845-F876 HydrophobicContact CE-CZ 3.61Å; M845-F876 HydrophobicContact CG-CE2 4.4Å; M845-F876 HydrophobicContact SD-CE2 3.81Å; M845-F876 HydrophobicContact SD-CZ 4.01Å; V859-F876 HydrophobicContact CG1-CD2 4.08Å; V859-F876 HydrophobicContact CG2-CD2 4.44Å; V859-F876 HydrophobicContact CG2-CE2 4.46Å; K861-F876 CarbonylContact O-C 3.46Å; K861-F876 WeakPolarHBondContact O-CA 3.33Å; K861-F876 VanDerWaalsContact O-CB 3.29Å; K861-F876 WeakPolarHBondContact O-CB 3.38Å; L862-F876 HydrophobicContact CD1-CB 3.92Å; V874-F876 HydrophobicContact CB-CD1 4.36Å; V874-F876 HydrophobicContact CG2-CD1 4.02Å; V874-F876 HydrophobicContact CG2-CE1 3.95Å; F876-I878 HydrophobicContact CD2-CG2 3.86Å; F876-I878 HydrophobicContact CE2-CG2 3.67Å; F876-C910 HydrophobicContact CD1-CB 4.15Å; F876-C910 HydrophobicContact CD2-CB 3.94Å; F876-C910 HydrophobicContact CE1-CB 3.69Å; F876-C910 HydrophobicContact CE2-CB 3.47Å; F876-C910 VanDerWaalsContact CE2-CB 3.47Å; F876-C910 HydrophobicContact CG-CB 4.26Å; F876-C910 HydrophobicContact CZ-CB 3.32Å; F876-C910 PolarHBondContact N-O 2.05Å; F876-C910 PolarHBondContact O-N 3.2Å; F876-I924 HydrophobicContact CE1-CD1 3.99Å; F876-I924 HydrophobicContact CE1-CG2 3.79Å; F876-I924 HydrophobicContact CZ-CD1 4.35Å; F876-I924 HydrophobicContact CZ-CG2 3.73Å
877	T	92.3	Very high	87.3	Confident	19 Å²	19	50.4 Å²	50.4	12%	0.117	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	144.7	177.9	54.9	0	0	0	0	111.8	E860 K861 T863 V907 I908 V909	E860-T877 PolarHBondContact N-O 3.17Å; K861-T877 PolarHBondContact N-OG1 2.89Å; K861-T877 PolarHBondContact O-N 3.45Å; K861-T877 PolarHBondContact O-OG1 3.13Å; T863-T877 HydrophobicContact CG2-CG2 4.28Å; T877-V907 HydrophobicContact CG2-CG1 3.63Å; T877-I908 CarbonylContact C-O 3.48Å; T877-I908 WeakPolarHBondContact CA-O 3.33Å; T877-V909 HydrophobicContact CG2-CG2 4.22Å
878	I	92.3	Very high	87.5	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	150.5	174.4	60.4	171.4	0	0	0	110.9	M845 M850 I852 V857 R858 V859 F876 I908 C910	M845-I878 HydrophobicContact CG-CG2 4.42Å; M845-I878 HydrophobicContact SD-CG2 4.22Å; M850-I878 HydrophobicContact CE-CD1 3.33Å; M850-I878 HydrophobicContact CG-CD1 4.07Å; I852-I878 HydrophobicContact CD1-CD1 4.07Å; I852-I878 HydrophobicContact CD1-CG1 4.1Å; V857-I878 HydrophobicContact CB-CB 4.3Å; V857-I878 HydrophobicContact CB-CD1 4.3Å; V857-I878 HydrophobicContact CG1-CD1 4.2Å; V857-I878 HydrophobicContact CG2-CD1 4.32Å; R858-I878 CarbonylContact O-C 3.46Å; R858-I878 VanDerWaalsContact O-CA 3.25Å; R858-I878 WeakPolarHBondContact O-CA 3.1Å; V859-I878 HydrophobicContact CG2-CG2 4.13Å; F876-I878 HydrophobicContact CD2-CG2 3.86Å; F876-I878 HydrophobicContact CE2-CG2 3.67Å; I878-I908 HydrophobicContact CD1-CB 4.34Å; I878-I908 HydrophobicContact CG1-CB 3.85Å; I878-I908 HydrophobicContact CG1-CG2 4.45Å; I878-I908 PolarHBondContact N-O 2.9Å; I878-I908 PolarHBondContact O-N 2.96Å; I878-C910 VanDerWaalsContact CD1-SG 3.59Å
879	S	91.6	Very high	87.8	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.014	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	145.9	-178.7	-68	0	0	0	0	111.1	V857 R858 E860	V857-S879 WeakPolarHBondContact CA-O 3.4Å; R858-S879 PolarHBondContact N-O 2.94Å; R858-S879 PolarHBondContact O-N 2.85Å; E860-S879 PolarHBondContact OE2-OG 3.3Å
880	E	91.7	Very high	88.5	Confident	14 Å²	14	52.4 Å²	52.4	7%	0.065	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	137.9	-179.5	-167.3	-176.7	171.6	0	0	110.7	I852 H855 V901 V902 T905	I852-E880 HydrophobicContact CB-CB 4.06Å; I852-E880 HydrophobicContact CB-CG 4.09Å; I852-E880 HydrophobicContact CG2-CB 3.99Å; I852-E880 HydrophobicContact CG2-CG 4.1Å; H855-E880 HydrophobicContact CB-CG 3.79Å; H855-E880 IonicContact CE1-OE1 3.47Å; H855-E880 IonicContact CG-OE1 3.54Å; H855-E880 IonicContact ND1-OE1 2.72Å; H855-E880 PolarHBondContact ND1-OE1 3.5Å; E880-V901 WeakPolarHBondContact O-CA 3.25Å; E880-V902 HydrophobicContact CG-CG2 4.48Å; E880-V902 PolarHBondContact O-N 3.32Å; E880-T905 HydrophobicContact CB-CG2 3.49Å; E880-T905 VanDerWaalsContact CB-CG2 3.49Å
881	T	92.5	Very high	89.4	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	167.9	173.2	70.4	0	0	0	0	111.6	H855 H856 R858 C883 S900	H855-T881 WeakPolarHBondContact CB-O 3.49Å; H856-T881 WeakPolarHBondContact CB-OG1 3.35Å; H856-T881 WeakPolarHBondContact O-CB 3.43Å; H856-T881 WeakPolarHBondContact O-CG2 3.45Å; H856-T881 PolarHBondContact O-N 2.73Å; H856-T881 PolarHBondContact O-OG1 2.92Å; R858-T881 HydrophobicContact CB-CG2 3.79Å; T881-C883 PolarHBondContact O-N 2.76Å; T881-C883 PolarHBondContact OG1-N 3.22Å; T881-S900 CarbonylContact C-O 3.49Å; T881-S900 VanDerWaalsContact CA-O 3.3Å; T881-S900 WeakPolarHBondContact CA-O 3.31Å
882	T	92.9	Very high	89.8	Confident	72 Å²	72	58.4 Å²	58.4	44%	0.442	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	-8.9	173.5	49.6	0	0	0	0	113.6	S900 V902	T882-S900 WeakPolarHBondContact CG2-OG 3.3Å; T882-S900 PolarHBondContact N-O 2.83Å; T882-S900 PolarHBondContact OG1-N 2.89Å; T882-S900 PolarHBondContact OG1-O 3.27Å; T882-S900 PolarHBondContact OG1-OG 3.3Å; T882-S900 VanDerWaalsContact OG1-OG 3.06Å; T882-V902 HydrophobicContact CG2-CG2 3.9Å
883	C	92.7	Very high	89.9	Confident	15 Å²	15	59.5 Å²	59.5	10%	0.101	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	127.5	-175.2	-79.2	0	0	0	0	111.8	H855 H856 T881 G885 L889 R898 C899	H855-C883 CarbonylContact C-O 3.53Å; H855-C883 VanDerWaalsContact CA-O 3.27Å; H855-C883 WeakPolarHBondContact CA-O 3.4Å; H855-C883 WeakPolarHBondContact CB-O 3.18Å; H856-C883 HydrophobicContact CB-CB 4.44Å; H856-C883 PolarHBondContact N-O 3.37Å; T881-C883 PolarHBondContact O-N 2.76Å; T881-C883 PolarHBondContact OG1-N 3.22Å; C883-G885 PolarHBondContact O-N 3.35Å; C883-L889 HydrophobicContact CB-CD1 3.58Å; C883-R898 PolarHBondContact SG-O 2.85Å; C883-R898 VanDerWaalsContact SG-O 3.37Å; C883-C899 HydrophobicContact CB-CB 3.76Å; C883-C899 WeakPolarHBondContact CB-SG 3.25Å; C883-C899 WeakPolarHBondContact SG-CA 3.41Å; C883-C899 WeakPolarHBondContact SG-CB 3.32Å; C883-C899 CovalentContact SG-SG 2.02Å; C883-C899 PolarHBondContact SG-SG 3.2Å
884	S	90.1	Very high	90	Very high	41 Å²	41	56.8 Å²	56.8	29%	0.287	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	129.9	176.4	-177.9	0	0	0	0	111.4	H856 R886 L887	H856-S884 PolarHBondContact CD2-O 2.9Å; H856-S884 PolarHBondContact NE2-O 3.47Å; S884-R886 PolarHBondContact O-N 3.42Å; S884-R886 PolarHBondContact OG-N 3.14Å; S884-L887 WeakPolarHBondContact O-CB 3.48Å; S884-L887 PolarHBondContact O-N 3.19Å
885	G	86	Confident	90	Very high	25 Å²	25	58.9 Å²	58.9	26%	0.258	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-12.7	173.2	0	0	0	0	0	113.7	G854 C883 L887	G854-G885 WeakPolarHBondContact O-CA 3.38Å; G854-G885 PolarHBondContact O-N 3.5Å; C883-G885 PolarHBondContact O-N 3.35Å; G885-L887 VanDerWaalsContact C-N 3.31Å
886	R	83.1	Confident	89.9	Confident	234 Å²	234	57.2 Å²	57.2	88%	0.883	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-18.7	172.7	-61.2	-176.8	178.4	-176.9	0.4	113.2	S884	S884-R886 PolarHBondContact O-N 3.42Å; S884-R886 PolarHBondContact OG-N 3.14Å
887	L	84.3	Confident	89.7	Confident	96 Å²	96	66.3 Å²	66.3	50%	0.503	32%	0.323	S	S	.	.	S	Bend	trans	-86	132.1	178.7	-62.5	173.4	0	0	0	109.9	H856 S884 G885 L889	H856-L887 PolarHBondContact CE1-O 3.26Å; H856-L887 PolarHBondContact NE2-O 2.9Å; S884-L887 WeakPolarHBondContact O-CB 3.48Å; S884-L887 PolarHBondContact O-N 3.19Å; G885-L887 VanDerWaalsContact C-N 3.31Å; L887-L889 HydrophobicContact CB-CD1 4.43Å; L887-L889 HydrophobicContact CB-CD2 3.98Å; L887-L889 HydrophobicContact CB-CG 3.97Å; L887-L889 PolarHBondContact O-N 2.88Å
888	R	84.7	Confident	89.6	Confident	241 Å²	241	75.1 Å²	75.1	91%	0.909	35%	0.354	S	S	*	.			trans	-80.1	98.8	170.5	-75	-174.2	166.2	-176.2	-3.8	109.5
889	L	87	Confident	89.6	Confident	37 Å²	37	75.1 Å²	75.1	19%	0.194	35%	0.354	C	S	.	.			trans	-104.8	151.1	-179.1	-58	-178.5	0	0	0	110.7	C883 L887 V893 I894 C899	C883-L889 HydrophobicContact CB-CD1 3.58Å; L887-L889 HydrophobicContact CB-CD1 4.43Å; L887-L889 HydrophobicContact CB-CD2 3.98Å; L887-L889 HydrophobicContact CB-CG 3.97Å; L887-L889 PolarHBondContact O-N 2.88Å; L889-V893 HydrophobicContact CB-CB 4.34Å; L889-V893 HydrophobicContact CB-CG1 4.35Å; L889-V893 HydrophobicContact CD1-CG1 4.24Å; L889-V893 HydrophobicContact CD2-CG1 4.01Å; L889-V893 HydrophobicContact CG-CG1 4.44Å; L889-I894 HydrophobicContact CB-CD1 4.17Å; L889-I894 HydrophobicContact CB-CG1 3.78Å; L889-I894 HydrophobicContact CD1-CG1 4.22Å; L889-C899 WeakPolarHBondContact CD1-SG 3.09Å
890	T	88.8	Confident	89.6	Confident	80 Å²	80	77.6 Å²	77.6	49%	0.491	37%	0.372	S	S	.	.			trans	-80.6	162.6	170.5	62.3	0	0	0	0	110	E892 V893 I894	T890-E892 PolarHBondContact O-N 3.12Å; T890-V893 PolarHBondContact O-N 2.93Å; T890-V893 WeakPolarHBondContact OG1-CG2 3.35Å; T890-V893 PolarHBondContact OG1-N 3.17Å; T890-I894 PolarHBondContact O-N 2.96Å; T890-I894 VanDerWaalsContact O-N 3.07Å
891	L	90.1	Very high	89.5	Confident	40 Å²	40	79.7 Å²	79.7	21%	0.209	39%	0.386	C	S	.	.	H	α-helix	trans	-56.2	-40.3	175.5	-159.3	72.7	0	0	0	111.2	Q842 K843 L846 V893 I894 Y895	Q842-L891 HydrophobicContact CB-CD1 4.01Å; Q842-L891 HydrophobicContact CB-CD2 4.24Å; Q842-L891 WeakPolarHBondContact O-CD1 3.31Å; K843-L891 HydrophobicContact CG-CD2 4.17Å; L846-L891 HydrophobicContact CB-CD1 4.22Å; L846-L891 HydrophobicContact CD2-CB 4.05Å; L846-L891 HydrophobicContact CD2-CD1 4Å; L891-V893 VanDerWaalsContact C-N 3.33Å; L891-V893 PolarHBondContact O-N 3.36Å; L891-I894 PolarHBondContact O-N 2.83Å; L891-Y895 HydrophobicContact CD1-CD2 4.13Å; L891-Y895 HydrophobicContact CD1-CE2 3.81Å; L891-Y895 HydrophobicContact CG-CD2 4.07Å; L891-Y895 HydrophobicContact CG-CE2 4.2Å; L891-Y895 VanDerWaalsContact O-CD2 3.26Å; L891-Y895 WeakPolarHBondContact O-CD2 3.47Å; L891-Y895 PolarHBondContact O-N 2.79Å
892	E	88.9	Confident	89.3	Confident	165 Å²	165	81.4 Å²	81.4	77%	0.771	40%	0.396	S	S	*	.	H	α-helix	trans	-59.2	-41.4	176.4	-67.2	170.8	-171.7	0	0	112.5	T890 Y895 S896	T890-E892 PolarHBondContact O-N 3.12Å; E892-Y895 CarbonylContact O-C 3.55Å; E892-Y895 PolarHBondContact O-N 2.87Å; E892-S896 VanDerWaalsContact O-CB 3.29Å; E892-S896 WeakPolarHBondContact O-CB 3.36Å; E892-S896 PolarHBondContact O-N 2.91Å
893	V	90.6	Very high	88.4	Confident	37 Å²	37	87.8 Å²	87.8	22%	0.224	42%	0.421	C	S	.	.	H	α-helix	trans	-71.6	-42.3	179.8	177.5	0	0	0	0	111.5	L889 T890 L891 Y895 S896 R898 C899	L889-V893 HydrophobicContact CB-CB 4.34Å; L889-V893 HydrophobicContact CB-CG1 4.35Å; L889-V893 HydrophobicContact CD1-CG1 4.24Å; L889-V893 HydrophobicContact CD2-CG1 4.01Å; L889-V893 HydrophobicContact CG-CG1 4.44Å; T890-V893 PolarHBondContact O-N 2.93Å; T890-V893 WeakPolarHBondContact OG1-CG2 3.35Å; T890-V893 PolarHBondContact OG1-N 3.17Å; L891-V893 VanDerWaalsContact C-N 3.33Å; L891-V893 PolarHBondContact O-N 3.36Å; V893-Y895 PolarHBondContact O-N 3.12Å; V893-S896 WeakPolarHBondContact O-CB 3.44Å; V893-S896 PolarHBondContact O-N 2.85Å; V893-S896 PolarHBondContact O-OG 3.03Å; V893-R898 HydrophobicContact CG1-CB 4.4Å; V893-C899 PolarHBondContact O-SG 3.45Å
894	I	91.6	Very high	87.1	Confident	4 Å²	4	92 Å²	92	2%	0.021	45%	0.45	C	S	.	.	H	α-helix	trans	-62.4	-36.1	177.2	-65.7	172.4	0	0	0	111.2	L846 H856 R858 L889 T890 L891 S896 C899	L846-I894 HydrophobicContact CD1-CD1 3.37Å; L846-I894 HydrophobicContact CD2-CD1 4.37Å; L846-I894 HydrophobicContact CG-CD1 4.34Å; H856-I894 HydrophobicContact CB-CD1 4.36Å; H856-I894 HydrophobicContact CB-CG1 4.44Å; R858-I894 PolarHBondContact NH1-O 3.5Å; L889-I894 HydrophobicContact CB-CD1 4.17Å; L889-I894 HydrophobicContact CB-CG1 3.78Å; L889-I894 HydrophobicContact CD1-CG1 4.22Å; T890-I894 PolarHBondContact O-N 2.96Å; T890-I894 VanDerWaalsContact O-N 3.07Å; L891-I894 PolarHBondContact O-N 2.83Å; I894-S896 VanDerWaalsContact C-N 3.34Å; I894-C899 WeakPolarHBondContact O-CB 3.4Å
895	Y	91.2	Very high	85.7	Confident	47 Å²	47	91.5 Å²	91.5	18%	0.184	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	9.9	176.6	-70	-101	0	0	0	113.4	Q842 R858 V859 L891 E892 V893	Q842-Y895 HydrophobicContact CB-CE2 4.29Å; Q842-Y895 HydrophobicContact CG-CE1 4.18Å; Q842-Y895 HydrophobicContact CG-CE2 4.27Å; Q842-Y895 VanDerWaalsContact CG-OH 3.3Å; Q842-Y895 WeakPolarHBondContact CG-OH 3.47Å; R858-Y895 HydrophobicContact CG-CD1 3.66Å; R858-Y895 HydrophobicContact CG-CE1 3.3Å; R858-Y895 HydrophobicContact CG-CE2 4.33Å; R858-Y895 HydrophobicContact CG-CG 4.28Å; R858-Y895 PolarHBondContact NH2-O 2.92Å; V859-Y895 WeakPolarHBondContact CB-OH 3.49Å; V859-Y895 WeakPolarHBondContact CG2-OH 3.37Å; V859-Y895 PolarHBondContact N-OH 2.69Å; L891-Y895 HydrophobicContact CD1-CD2 4.13Å; L891-Y895 HydrophobicContact CD1-CE2 3.81Å; L891-Y895 HydrophobicContact CG-CD2 4.07Å; L891-Y895 HydrophobicContact CG-CE2 4.2Å; L891-Y895 VanDerWaalsContact O-CD2 3.26Å; L891-Y895 WeakPolarHBondContact O-CD2 3.47Å; L891-Y895 PolarHBondContact O-N 2.79Å; E892-Y895 CarbonylContact O-C 3.55Å; E892-Y895 PolarHBondContact O-N 2.87Å; V893-Y895 PolarHBondContact O-N 3.12Å
896	S	91.3	Very high	84.9	Confident	33 Å²	33	94.5 Å²	94.5	23%	0.231	46%	0.459	C	S	.	.	S	Bend	trans	-90.3	174.2	171.2	76.1	0	0	0	0	111.3	R858 E892 V893 I894 R898 C899	R858-S896 PolarHBondContact NH1-O 3.08Å; E892-S896 VanDerWaalsContact O-CB 3.29Å; E892-S896 WeakPolarHBondContact O-CB 3.36Å; E892-S896 PolarHBondContact O-N 2.91Å; V893-S896 WeakPolarHBondContact O-CB 3.44Å; V893-S896 PolarHBondContact O-N 2.85Å; V893-S896 PolarHBondContact O-OG 3.03Å; I894-S896 VanDerWaalsContact C-N 3.34Å; S896-R898 PolarHBondContact O-N 2.92Å; S896-R898 VanDerWaalsContact OG-CB 3.3Å; S896-R898 WeakPolarHBondContact OG-CB 3.39Å; S896-R898 PolarHBondContact OG-N 3.12Å; S896-R898 VanDerWaalsContact OG-N 3.11Å; S896-C899 PolarHBondContact O-N 3.33Å
897	E	90.2	Very high	84.8	Confident	190 Å²	190	86.7 Å²	86.7	89%	0.888	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-65.6	-16.2	170.6	-63.1	-175.7	168.4	0	0	112.8	C899	E897-C899 PolarHBondContact O-N 3.04Å
898	R	89.9	Confident	84.9	Confident	204 Å²	204	82.7 Å²	82.7	77%	0.77	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-67.7	-23.6	177.6	-57.1	-177.7	177.5	-171.5	-0.1	113	C883 V893 S896	C883-R898 PolarHBondContact SG-O 2.85Å; C883-R898 VanDerWaalsContact SG-O 3.37Å; V893-R898 HydrophobicContact CG1-CB 4.4Å; S896-R898 PolarHBondContact O-N 2.92Å; S896-R898 VanDerWaalsContact OG-CB 3.3Å; S896-R898 WeakPolarHBondContact OG-CB 3.39Å; S896-R898 PolarHBondContact OG-N 3.12Å; S896-R898 VanDerWaalsContact OG-N 3.11Å
899	C	92.2	Very high	85.2	Confident	0 Å²	0	74 Å²	74	0%	0	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-121.5	67.1	174.8	-61.2	0	0	0	0	109.3	R858 C883 L889 V893 I894 S896 E897	R858-C899 PolarHBondContact NH1-O 3.31Å; C883-C899 HydrophobicContact CB-CB 3.76Å; C883-C899 WeakPolarHBondContact CB-SG 3.25Å; C883-C899 WeakPolarHBondContact SG-CA 3.41Å; C883-C899 WeakPolarHBondContact SG-CB 3.32Å; C883-C899 CovalentContact SG-SG 2.02Å; C883-C899 PolarHBondContact SG-SG 3.2Å; L889-C899 WeakPolarHBondContact CD1-SG 3.09Å; V893-C899 PolarHBondContact O-SG 3.45Å; I894-C899 WeakPolarHBondContact O-CB 3.4Å; S896-C899 PolarHBondContact O-N 3.33Å; E897-C899 PolarHBondContact O-N 3.04Å
900	S	91.8	Very high	85.5	Confident	54 Å²	54	72.2 Å²	72.2	38%	0.378	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-59.4	142.8	177.1	56.1	0	0	0	0	111	T881 T882 V902	T881-S900 CarbonylContact C-O 3.49Å; T881-S900 VanDerWaalsContact CA-O 3.3Å; T881-S900 WeakPolarHBondContact CA-O 3.31Å; T882-S900 WeakPolarHBondContact CG2-OG 3.3Å; T882-S900 PolarHBondContact N-O 2.83Å; T882-S900 PolarHBondContact OG1-N 2.89Å; T882-S900 PolarHBondContact OG1-O 3.27Å; T882-S900 PolarHBondContact OG1-OG 3.3Å; T882-S900 VanDerWaalsContact OG1-OG 3.06Å; S900-V902 PolarHBondContact O-N 3.13Å
901	V	90.7	Very high	85.7	Confident	59 Å²	59	75.2 Å²	75.2	36%	0.358	39%	0.387	S	S	.	.	B	Isolated β-bridge	trans	-65.9	132.6	171	-179.7	0	0	0	0	108.6	R858 E880 Q903	R858-V901 HydrophobicContact CB-CG2 4.34Å; E880-V901 WeakPolarHBondContact O-CA 3.25Å; V901-Q903 PolarHBondContact O-N 3.49Å
902	V	87.4	Confident	85.8	Confident	36 Å²	36	73.8 Å²	73.8	22%	0.218	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-68.1	125.3	177.5	177.8	0	0	0	0	107.9	E880 T882 S900 S904 T905	E880-V902 HydrophobicContact CG-CG2 4.48Å; E880-V902 PolarHBondContact O-N 3.32Å; T882-V902 HydrophobicContact CG2-CG2 3.9Å; S900-V902 PolarHBondContact O-N 3.13Å; V902-S904 WeakPolarHBondContact CG1-OG 3.41Å; V902-S904 PolarHBondContact O-N 2.76Å; V902-T905 HydrophobicContact CB-CG2 3.61Å; V902-T905 HydrophobicContact CG1-CG2 4.15Å; V902-T905 WeakPolarHBondContact O-CB 3.4Å; V902-T905 WeakPolarHBondContact O-CG2 3.18Å; V902-T905 PolarHBondContact O-N 2.75Å; V902-T905 PolarHBondContact O-OG1 3.46Å
903	Q	74.8	Confident	85.8	Confident	205 Å²	205	67 Å²	67	96%	0.958	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-11.3	-171	-68.4	-176.7	8.1	0	0	114.5	V901	V901-Q903 PolarHBondContact O-N 3.49Å
904	S	64.9	Low	85.6	Confident	103 Å²	103	66.2 Å²	66.2	72%	0.72	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	23.2	-176.8	61.6	0	0	0	0	113.9	V902	V902-S904 WeakPolarHBondContact CG1-OG 3.41Å; V902-S904 PolarHBondContact O-N 2.76Å
905	T	61	Low	84.8	Confident	32 Å²	32	67.3 Å²	67.3	20%	0.196	35%	0.352	C	S	.	.			trans	-89.2	123.9	-157.8	40	0	0	0	0	115	E880 V902 V907	E880-T905 HydrophobicContact CB-CG2 3.49Å; E880-T905 VanDerWaalsContact CB-CG2 3.49Å; V902-T905 HydrophobicContact CB-CG2 3.61Å; V902-T905 HydrophobicContact CG1-CG2 4.15Å; V902-T905 WeakPolarHBondContact O-CB 3.4Å; V902-T905 WeakPolarHBondContact O-CG2 3.18Å; V902-T905 PolarHBondContact O-N 2.75Å; V902-T905 PolarHBondContact O-OG1 3.46Å; T905-V907 PolarHBondContact O-N 3.24Å; T905-V907 VanDerWaalsContact O-N 3.14Å
906	T	68.1	Low	83.5	Confident	87 Å²	87	70.6 Å²	70.6	53%	0.534	38%	0.377	S	S	.	.			trans	-55	109.3	155.9	41.5	0	0	0	0	109	I908	T906-I908 PolarHBondContact O-N 3.45Å
907	V	80.6	Confident	82.1	Confident	71 Å²	71	76.1 Å²	76.1	43%	0.43	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-72.6	123	173.7	-177.6	0	0	0	0	108.6	T877 T905	T877-V907 HydrophobicContact CG2-CG1 3.63Å; T905-V907 PolarHBondContact O-N 3.24Å; T905-V907 VanDerWaalsContact O-N 3.14Å
908	I	88	Confident	80.5	Confident	11 Å²	11	75.8 Å²	75.8	6%	0.056	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	129.7	-177.1	-53.7	-167.6	0	0	0	109.5	I852 T877 I878 T906 C926 G928	I852-I908 HydrophobicContact CD1-CB 4.42Å; I852-I908 HydrophobicContact CD1-CD1 3.55Å; I852-I908 HydrophobicContact CD1-CG1 3.87Å; I852-I908 HydrophobicContact CG1-CD1 3.64Å; I852-I908 HydrophobicContact CG1-CG1 4.5Å; I852-I908 HydrophobicContact CG2-CD1 4.27Å; T877-I908 CarbonylContact C-O 3.48Å; T877-I908 WeakPolarHBondContact CA-O 3.33Å; I878-I908 HydrophobicContact CD1-CB 4.34Å; I878-I908 HydrophobicContact CG1-CB 3.85Å; I878-I908 HydrophobicContact CG1-CG2 4.45Å; I878-I908 PolarHBondContact N-O 2.9Å; I878-I908 PolarHBondContact O-N 2.96Å; T906-I908 PolarHBondContact O-N 3.45Å; I908-C926 HydrophobicContact CG2-CB 4.13Å; I908-G928 WeakPolarHBondContact CD1-O 3.27Å
909	V	90.5	Very high	78.8	Confident	59 Å²	59	70.2 Å²	70.2	36%	0.358	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	128.9	176.8	-176.2	0	0	0	0	109.7	E875 T877 S927	E875-V909 HydrophobicContact CG-CG1 4.06Å; T877-V909 HydrophobicContact CG2-CG2 4.22Å; V909-S927 PolarHBondContact N-OG 3.45Å; V909-S927 PolarHBondContact O-N 3.42Å; V909-S927 PolarHBondContact O-OG 3.08Å
910	C	93.1	Very high	77.3	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	138.4	174.4	-60.2	0	0	0	0	110.4	E875 F876 I878 I924 R925 C926	E875-C910 CarbonylContact C-O 3.57Å; E875-C910 WeakPolarHBondContact CA-O 3.37Å; F876-C910 HydrophobicContact CD1-CB 4.15Å; F876-C910 HydrophobicContact CD2-CB 3.94Å; F876-C910 HydrophobicContact CE1-CB 3.69Å; F876-C910 HydrophobicContact CE2-CB 3.47Å; F876-C910 VanDerWaalsContact CE2-CB 3.47Å; F876-C910 HydrophobicContact CG-CB 4.26Å; F876-C910 HydrophobicContact CZ-CB 3.32Å; F876-C910 PolarHBondContact N-O 2.05Å; F876-C910 PolarHBondContact O-N 3.2Å; I878-C910 VanDerWaalsContact CD1-SG 3.59Å; C910-I924 HydrophobicContact CB-CG2 4.12Å; C910-R925 CarbonylContact C-O 3.51Å; C910-R925 VanDerWaalsContact CA-O 3.29Å; C910-R925 WeakPolarHBondContact CA-O 3.22Å; C910-C926 HydrophobicContact CB-CB 4.1Å; C910-C926 WeakPolarHBondContact CB-SG 3.07Å; C910-C926 WeakPolarHBondContact SG-CB 3.46Å; C910-C926 CovalentContact SG-SG 2.03Å; C910-C926 PolarHBondContact SG-SG 3.44Å
911	K	93.3	Very high	76.3	Confident	143 Å²	143	77 Å²	77	62%	0.622	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144	143.2	179.9	65.4	-173.8	179.4	-175.9	0	111.9	V874 E875 I924 R925	V874-K911 WeakPolarHBondContact O-CA 3.18Å; E875-K911 HydrophobicContact CG-CB 4.14Å; K911-I924 CarbonylContact O-C 3.48Å; K911-I924 WeakPolarHBondContact O-CA 3.18Å; K911-R925 PolarHBondContact N-O 3.39Å; K911-R925 PolarHBondContact O-N 2.9Å
912	G	91.2	Very high	76	Confident	9 Å²	9	75.4 Å²	75.4	9%	0.093	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	159.5	-169.6	171.4	0	0	0	0	0	113.7	L873 V874	L873-G912 WeakPolarHBondContact CA-O 3.48Å; V874-G912 WeakPolarHBondContact CG2-O 3.14Å; V874-G912 PolarHBondContact N-O 3.2Å; V874-G912 PolarHBondContact O-N 3.36Å
913	L	88.8	Confident	76	Confident	24 Å²	24	77.5 Å²	77.5	13%	0.126	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	123.9	-178.3	-166.3	94	0	0	0	110.3	V868 S870 P915 H922 T923	V868-L913 HydrophobicContact CG2-CD1 3.33Å; S870-L913 WeakPolarHBondContact OG-CD1 3.41Å; L913-P915 WeakPolarHBondContact O-CD 3.26Å; L913-H922 WeakPolarHBondContact O-CA 3.41Å; L913-H922 WeakPolarHBondContact O-CB 3.43Å; L913-T923 HydrophobicContact CB-CG2 4.43Å; L913-T923 WeakPolarHBondContact CB-OG1 3.24Å; L913-T923 PolarHBondContact N-OG1 3.38Å; L913-T923 PolarHBondContact O-N 3.48Å
914	L	87.3	Confident	76.7	Confident	19 Å²	19	67.9 Å²	67.9	10%	0.099	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	109.5	167.1	-164.4	92.8	0	0	0	108.5	V841 L844 V872 V874 I924	V841-L914 HydrophobicContact CG2-CD1 4.15Å; L844-L914 HydrophobicContact CD2-CD1 3.92Å; V872-L914 HydrophobicContact CB-CB 4.5Å; V872-L914 PolarHBondContact N-O 2.92Å; V872-L914 WeakPolarHBondContact O-CB 3.3Å; V872-L914 PolarHBondContact O-N 3.49Å; V874-L914 HydrophobicContact CG1-CB 4.44Å; V874-L914 HydrophobicContact CG2-CB 4.38Å; L914-I924 HydrophobicContact CD1-CD1 3.91Å
915	P	73.5	Confident	77.7	Confident	28 Å²	28	68.8 Å²	68.8	18%	0.182	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	140.4	-177	24	-27.6	0	0	0	110.8	L913 R917 I920 H922	L913-P915 WeakPolarHBondContact O-CD 3.26Å; P915-R917 VanDerWaalsContact C-N 3.35Å; P915-I920 HydrophobicContact CB-CB 3.89Å; P915-I920 HydrophobicContact CB-CG2 4.01Å; P915-I920 HydrophobicContact CG-CB 4.42Å; P915-I920 WeakPolarHBondContact CG-O 3.35Å; P915-H922 HydrophobicContact CG-CB 4.41Å
916	V	65.2	Low	79	Confident	115 Å²	115	68.7 Å²	68.7	70%	0.697	38%	0.381	S	S	*	.	S	Bend	trans	-81.9	-18.8	180	172.9	0	0	0	0	111.6	V872	V872-V916 HydrophobicContact CG2-CG2 4.24Å
917	R	60.8	Low	79.6	Confident	149 Å²	149	69.1 Å²	69.1	56%	0.562	39%	0.387	S	S	*	.	S	Bend	trans	-109	141	-178.6	-62.3	-172.3	-178.2	-178.6	-0.7	111	P915 I920	P915-R917 VanDerWaalsContact C-N 3.35Å; R917-I920 HydrophobicContact CB-CD1 4.29Å
918	Q	56.8	Low	79.1	Confident	183 Å²	183	67.9 Å²	67.9	86%	0.855	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	145.7	169.5	-68.8	177.9	-23.5	0	0	109.7
919	G	55.1	Low	77.9	Confident	88 Å²	88	68.4 Å²	68.4	91%	0.907	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.2	-4.5	179.6	0	0	0	0	0	116.3
920	I	61.2	Low	76.9	Confident	98 Å²	98	70.4 Å²	70.4	50%	0.503	41%	0.406	S	S	.	.	S	Bend	trans	-102.6	129.2	169.6	-55.9	176	0	0	0	107.7	P915 R917	P915-I920 HydrophobicContact CB-CB 3.89Å; P915-I920 HydrophobicContact CB-CG2 4.01Å; P915-I920 HydrophobicContact CG-CB 4.42Å; P915-I920 WeakPolarHBondContact CG-O 3.35Å; R917-I920 HydrophobicContact CB-CD1 4.29Å
921	S	69.9	Low	75.3	Confident	99 Å²	99	73.3 Å²	73.3	69%	0.692	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-67.5	145	174.8	52.1	0	0	0	0	111.1
922	H	85.2	Confident	73.5	Confident	24 Å²	24	67.3 Å²	67.3	11%	0.111	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-72.9	160.1	171.4	65.1	81.3	0	0	0	111	L844 E848 L913 P915 I924	L844-H922 WeakPolarHBondContact CD1-CD2 3.48Å; L844-H922 HydrophobicContact CD2-CB 4.13Å; E848-H922 IonicContact OE1-NE2 3.97Å; L913-H922 WeakPolarHBondContact O-CA 3.41Å; L913-H922 WeakPolarHBondContact O-CB 3.43Å; P915-H922 HydrophobicContact CG-CB 4.41Å; H922-I924 HydrophobicContact CB-CG1 4.27Å; H922-I924 PolarHBondContact ND1-N 3.1Å
923	T	86.4	Confident	71.1	Confident	80 Å²	80	70.1 Å²	70.1	49%	0.491	41%	0.408	S	S	.	.			trans	-109.7	17.7	173.2	67.4	0	0	0	0	113	L913 R925	L913-T923 HydrophobicContact CB-CG2 4.43Å; L913-T923 WeakPolarHBondContact CB-OG1 3.24Å; L913-T923 PolarHBondContact N-OG1 3.38Å; L913-T923 PolarHBondContact O-N 3.48Å; T923-R925 PolarHBondContact O-N 2.8Å
924	I	89	Confident	68.6	Low	3 Å²	3	75.5 Å²	75.5	2%	0.015	43%	0.433	C	S	.	.			trans	-64.4	122.8	179.2	-58.1	-179.3	0	0	0	110.8	L844 V874 F876 C910 K911 L914 H922 L932	L844-I924 HydrophobicContact CD2-CD1 3.4Å; L844-I924 VanDerWaalsContact CD2-CD1 3.4Å; L844-I924 HydrophobicContact CD2-CG1 4.37Å; V874-I924 HydrophobicContact CG2-CD1 3.89Å; V874-I924 HydrophobicContact CG2-CG1 4.3Å; F876-I924 HydrophobicContact CE1-CD1 3.99Å; F876-I924 HydrophobicContact CE1-CG2 3.79Å; F876-I924 HydrophobicContact CZ-CD1 4.35Å; F876-I924 HydrophobicContact CZ-CG2 3.73Å; C910-I924 HydrophobicContact CB-CG2 4.12Å; K911-I924 CarbonylContact O-C 3.48Å; K911-I924 WeakPolarHBondContact O-CA 3.18Å; L914-I924 HydrophobicContact CD1-CD1 3.91Å; H922-I924 HydrophobicContact CB-CG1 4.27Å; H922-I924 PolarHBondContact ND1-N 3.1Å; I924-L932 HydrophobicContact CG2-CD1 4.5Å
925	R	87	Confident	66	Low	122 Å²	122	81.5 Å²	81.5	46%	0.46	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	139.3	173.6	-65	-173.7	175.5	-165.7	-1.8	109.8	C910 K911 T923 E935	C910-R925 CarbonylContact C-O 3.51Å; C910-R925 VanDerWaalsContact CA-O 3.29Å; C910-R925 WeakPolarHBondContact CA-O 3.22Å; K911-R925 PolarHBondContact N-O 3.39Å; K911-R925 PolarHBondContact O-N 2.9Å; T923-R925 PolarHBondContact O-N 2.8Å; R925-E935 IonicContact NH2-OE2 2.62Å; R925-E935 PolarHBondContact NH2-OE2 3.23Å
926	C	88.5	Confident	63.9	Low	30 Å²	30	88.6 Å²	88.6	20%	0.203	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	142.7	179.5	-60.2	0	0	0	0	110.5	M850 I908 C910 G928	M850-C926 HydrophobicContact CE-CB 3.5Å; M850-C926 VanDerWaalsContact CE-SG 3.56Å; I908-C926 HydrophobicContact CG2-CB 4.13Å; C910-C926 HydrophobicContact CB-CB 4.1Å; C910-C926 WeakPolarHBondContact CB-SG 3.07Å; C910-C926 WeakPolarHBondContact SG-CB 3.46Å; C910-C926 CovalentContact SG-SG 2.03Å; C910-C926 PolarHBondContact SG-SG 3.44Å; C926-G928 PolarHBondContact O-N 3.22Å
927	S	79.3	Confident	62.4	Low	96 Å²	96	88 Å²	88	67%	0.671	48%	0.483	S	S	*	.	S	Bend	trans	-74.9	2.1	-171.1	40	0	0	0	0	116	V909	V909-S927 PolarHBondContact N-OG 3.45Å; V909-S927 PolarHBondContact O-N 3.42Å; V909-S927 PolarHBondContact O-OG 3.08Å
928	G	70.5	Confident	60.9	Low	45 Å²	45	84.4 Å²	84.4	46%	0.464	49%	0.493	S	S	.	.	S	Bend	trans	178.4	27.4	179.8	0	0	0	0	0	116	I908 C926	I908-G928 WeakPolarHBondContact CD1-O 3.27Å; C926-G928 PolarHBondContact O-N 3.22Å
929	G	63.9	Low	59.5	Low	22 Å²	22	78.9 Å²	78.9	23%	0.227	49%	0.485	C	S	.	.			trans	-107.6	155.6	175.1	0	0	0	0	0	111.9	M850	M850-G929 VanDerWaalsContact CE-CA 3.46Å
930	D	68.2	Low	58.4	Low	102 Å²	102	80.2 Å²	80.2	55%	0.545	48%	0.478	S	S	.	.	S	Bend	trans	-90.2	-5.9	-156.9	-58	-37.3	0	0	0	113.8	T851 K853	T851-D930 PolarHBondContact O-N 3.33Å; K853-D930 WeakPolarHBondContact CA-OD2 3.42Å; K853-D930 PolarHBondContact N-OD2 3.21Å
931	K	60.1	Low	56.9	Low	60 Å²	60	83.9 Å²	83.9	26%	0.261	50%	0.498	S	S	.	.			trans	-164.3	108.3	167.8	-127.6	178.7	-171.2	-171.7	0	116.9	M850 Y1042 A1043	M850-K931 WeakPolarHBondContact CA-O 3.33Å; M850-K931 VanDerWaalsContact SD-C 3.6Å; K931-Y1042 WeakPolarHBondContact CE-O 3.25Å; K931-Y1042 PolarHBondContact NZ-O 3.2Å; K931-A1043 VanDerWaalsContact NZ-CA 3.32Å; K931-A1043 PolarHBondContact NZ-OXT 2.95Å
932	L	55.2	Low	54.9	Low	17 Å²	17	87.9 Å²	87.9	9%	0.089	50%	0.499	C	S	.	.	S	Bend	trans	-149.1	75.7	147.3	-67.8	-176.9	0	0	0	105.6	M845 E848 M850 I924	M845-L932 HydrophobicContact CE-CD1 3.38Å; M845-L932 HydrophobicContact SD-CD1 3.81Å; E848-L932 HydrophobicContact CB-CD2 2.92Å; E848-L932 HydrophobicContact CB-CG 4.39Å; E848-L932 HydrophobicContact CG-CD2 3.71Å; M850-L932 HydrophobicContact CB-CD1 4.39Å; M850-L932 HydrophobicContact CB-CD2 3.94Å; M850-L932 HydrophobicContact CB-CG 4Å; M850-L932 HydrophobicContact CG-CD1 4.38Å; M850-L932 HydrophobicContact CG-CG 4.17Å; M850-L932 HydrophobicContact SD-CD1 4.34Å; M850-L932 HydrophobicContact SD-CG 3.79Å; I924-L932 HydrophobicContact CG2-CD1 4.5Å
933	T	41.4	Very low	52.2	Low	68 Å²	68	92.3 Å²	92.3	42%	0.417	53%	0.53	S	S	.	.			trans	46	91.8	177.3	11.8	0	0	0	0	116.4	E935 Y1042	T933-E935 PolarHBondContact O-N 2.83Å; T933-Y1042 HydrophobicContact CG2-CD1 4.22Å; T933-Y1042 HydrophobicContact CG2-CD2 4.16Å; T933-Y1042 HydrophobicContact CG2-CE2 4.45Å; T933-Y1042 HydrophobicContact CG2-CG 4.03Å
934	E	36.2	Very low	49.3	Very low	137 Å²	137	92.7 Å²	92.7	64%	0.64	54%	0.536	S	S	*	.			trans	-63.4	97.3	160.9	-88.3	-173.8	146.5	0	0	110.3	Y936	E934-Y936 HydrophobicContact CB-CD2 4.29Å; E934-Y936 PolarHBondContact O-N 3.47Å; E934-Y936 WeakPolarHBondContact OE2-CE2 3.48Å
935	E	32	Very low	46.4	Very low	146 Å²	146	99.1 Å²	99.1	68%	0.682	57%	0.57	S	S	*	*			trans	-82.7	92.5	154.7	-169.9	-176.9	-144.2	0	0	107.1	R925 T933 P937	R925-E935 IonicContact NH2-OE2 2.62Å; R925-E935 PolarHBondContact NH2-OE2 3.23Å; T933-E935 PolarHBondContact O-N 2.83Å; E935-P937 WeakPolarHBondContact O-CD 3.26Å
936	Y	29.9	Very low	43.8	Very low	176 Å²	176	98.6 Å²	98.6	69%	0.69	59%	0.585	S	S	*	*			trans	-59.5	121	178.8	-111.6	-94.4	0	0	0	111.5	E934	E934-Y936 HydrophobicContact CB-CD2 4.29Å; E934-Y936 PolarHBondContact O-N 3.47Å; E934-Y936 WeakPolarHBondContact OE2-CE2 3.48Å
937	P	33.2	Very low	41	Very low	102 Å²	102	104.9 Å²	104.9	66%	0.662	62%	0.617	S	S	*	*			trans	-107.4	102.4	160.7	23.5	-1.5	0	0	0	109.3	E935	E935-P937 WeakPolarHBondContact O-CD 3.26Å
938	G	29.6	Very low	39	Very low	75 Å²	75	103.9 Å²	103.9	77%	0.773	62%	0.622	S	S	*	*			trans	82.1	116.6	157.6	0	0	0	0	0	119.1
939	G	27.2	Very low	38	Very low	66 Å²	66	110.2 Å²	110.2	68%	0.68	64%	0.64	S	S	*	*			trans	149.3	134.3	159.7	0	0	0	0	0	113.4
940	P	32.4	Very low	37.7	Very low	117 Å²	117	113.4 Å²	113.4	76%	0.76	65%	0.649	S	S	*	*			trans	-100.8	137.3	-136.3	36.3	-31	0	0	0	115.5
941	L	28.7	Very low	37.8	Very low	175 Å²	175	112.6 Å²	112.6	92%	0.916	65%	0.645	S	S	*	*			trans	-130	85.8	147.5	-79.9	170.5	0	0	0	107.6
942	Y	29.3	Very low	38.7	Very low	182 Å²	182	115.6 Å²	115.6	71%	0.714	66%	0.658	S	S	*	*			trans	-75.8	139.7	147.9	-84.8	-92.6	0	0	0	106.5
943	P	28	Very low	40	Very low	117 Å²	117	120.3 Å²	120.3	76%	0.76	68%	0.683	S	S	*	*				-121.6	136.4	94.3	33.7	-28.4	0	0	0	112.5
944	S	26.5	Very low	41.7	Very low	89 Å²	89	120.2 Å²	120.2	62%	0.622	69%	0.686	S	S	*	*			trans	60.6	98.9	161.1	73.7	0	0	0	0	118.6	S946	S944-S946 PolarHBondContact O-N 3.27Å
945	D	27.2	Very low	44	Very low	137 Å²	137	114 Å²	114	73%	0.733	66%	0.657	S	S	*	*				26.5	87.9	116.5	-56.2	-29.1	0	0	0	116.4
946	S	31.9	Very low	46.5	Very low	112 Å²	112	110.4 Å²	110.4	78%	0.783	64%	0.638	S	S	*	*			trans	-172.8	145.2	145.8	46.4	0	0	0	0	110.8	S944 G948	S944-S946 PolarHBondContact O-N 3.27Å; S946-G948 PolarHBondContact O-N 2.77Å
947	D	30.6	Very low	49.2	Very low	161 Å²	161	108 Å²	108	86%	0.861	64%	0.636	S	S	*	*			trans	-21.6	112.6	176.3	-78	-42.7	0	0	0	116.1	Q949	D947-Q949 VanDerWaalsContact C-N 3.26Å; D947-Q949 PolarHBondContact O-N 3.32Å
948	G	36.8	Very low	51.6	Low	76 Å²	76	106.8 Å²	106.8	78%	0.784	62%	0.623	S	S	*	*			trans	-71.9	66.5	-173	0	0	0	0	0	115.6	S946	S946-G948 PolarHBondContact O-N 2.77Å
949	Q	50.5	Low	54.4	Low	178 Å²	178	103.9 Å²	103.9	83%	0.832	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-73.3	116.1	161.4	-173.2	164.6	-5.6	0	0	107.7	D947 D951	D947-Q949 VanDerWaalsContact C-N 3.26Å; D947-Q949 PolarHBondContact O-N 3.32Å; Q949-D951 PolarHBondContact O-N 2.81Å; Q949-D951 VanDerWaalsContact O-N 3.11Å
950	M	57.5	Low	57.3	Low	88 Å²	88	105.5 Å²	105.5	43%	0.433	58%	0.578	S	S	.	*	P	Polyproline II helix	trans	-53.5	122.4	171.3	-104.3	-171.5	76.5	0	0	108.5	I955	M950-I955 HydrophobicContact CB-CD1 4.29Å; M950-I955 HydrophobicContact CE-CD1 4.33Å; M950-I955 HydrophobicContact CE-CG1 3.59Å
951	D	70.5	Confident	59.7	Low	85 Å²	85	105.3 Å²	105.3	46%	0.455	57%	0.565	S	S	.	*	P	Polyproline II helix	trans	-62.4	141.3	-177	171.8	47.1	0	0	0	111.5	Q949 D953 S954 I955	Q949-D951 PolarHBondContact O-N 2.81Å; Q949-D951 VanDerWaalsContact O-N 3.11Å; D951-D953 PolarHBondContact O-N 2.8Å; D951-D953 VanDerWaalsContact OD2-CB 3.28Å; D951-D953 WeakPolarHBondContact OD2-CB 3.25Å; D951-D953 PolarHBondContact OD2-N 3.27Å; D951-S954 WeakPolarHBondContact O-CB 3.43Å; D951-S954 PolarHBondContact O-N 3.34Å; D951-I955 PolarHBondContact O-N 3.09Å
952	K	78.6	Confident	62.2	Low	124 Å²	124	98.1 Å²	98.1	54%	0.539	53%	0.529	S	S	.	.	H	α-helix	trans	-62.4	-33.3	-175.9	-169.9	179.5	178.7	178.9	0	111.1	I955 Y956 L980 I983	K952-I955 PolarHBondContact O-N 2.77Å; K952-Y956 WeakPolarHBondContact O-CB 3.11Å; K952-Y956 PolarHBondContact O-N 2.83Å; K952-L980 HydrophobicContact CG-CD2 4.07Å; K952-I983 HydrophobicContact CG-CD1 4.37Å
953	D	81.6	Confident	64.9	Low	115 Å²	115	90.1 Å²	90.1	62%	0.615	50%	0.498	S	S	*	.	H	α-helix	trans	-71.8	-35.3	-179	-61.8	-24	0	0	0	111.6	D951 I955 Y956 L957	D951-D953 PolarHBondContact O-N 2.8Å; D951-D953 VanDerWaalsContact OD2-CB 3.28Å; D951-D953 WeakPolarHBondContact OD2-CB 3.25Å; D951-D953 PolarHBondContact OD2-N 3.27Å; D953-I955 PolarHBondContact O-N 2.88Å; D953-Y956 PolarHBondContact O-N 3.24Å; D953-L957 WeakPolarHBondContact O-CB 3.28Å; D953-L957 PolarHBondContact O-N 3.16Å
954	S	77.6	Confident	67.4	Low	67 Å²	67	91.1 Å²	91.1	47%	0.469	49%	0.491	S	S	.	.	H	α-helix	trans	-62	-43	173.9	-64.2	0	0	0	0	111.9	D951 L958	D951-S954 WeakPolarHBondContact O-CB 3.43Å; D951-S954 PolarHBondContact O-N 3.34Å; S954-L958 WeakPolarHBondContact O-CB 3.38Å; S954-L958 PolarHBondContact O-N 3.43Å; S954-L958 VanDerWaalsContact O-N 3.13Å
955	I	84.1	Confident	69.8	Low	5 Å²	5	91.5 Å²	91.5	3%	0.026	49%	0.486	C	S	.	.	H	α-helix	trans	-66.4	-42.1	176	-62.5	167.3	0	0	0	110.5	M950 D951 K952 D953 L957 L958 L959 L980 I983 L991 V993	M950-I955 HydrophobicContact CB-CD1 4.29Å; M950-I955 HydrophobicContact CE-CD1 4.33Å; M950-I955 HydrophobicContact CE-CG1 3.59Å; D951-I955 PolarHBondContact O-N 3.09Å; K952-I955 PolarHBondContact O-N 2.77Å; D953-I955 PolarHBondContact O-N 2.88Å; I955-L957 PolarHBondContact O-N 3.47Å; I955-L958 PolarHBondContact O-N 3.29Å; I955-L959 HydrophobicContact CG2-CD1 4.12Å; I955-L959 WeakPolarHBondContact O-CG 3.43Å; I955-L959 PolarHBondContact O-N 2.9Å; I955-L980 HydrophobicContact CB-CD2 4.12Å; I955-L980 HydrophobicContact CG2-CD1 4.31Å; I955-L980 HydrophobicContact CG2-CD2 3.65Å; I955-I983 HydrophobicContact CD1-CD1 3.8Å; I955-I983 HydrophobicContact CD1-CG1 4.41Å; I955-I983 HydrophobicContact CD1-CG2 3.98Å; I955-L991 HydrophobicContact CD1-CD2 3.82Å; I955-L991 HydrophobicContact CG1-CD2 3.95Å; I955-L991 HydrophobicContact CG2-CD2 4.38Å; I955-V993 HydrophobicContact CG2-CG1 3.94Å
956	Y	85.6	Confident	72.4	Confident	72 Å²	72	89.8 Å²	89.8	28%	0.282	47%	0.472	S	S	.	.	H	α-helix	trans	-62.5	-42.3	179.7	-170.2	-99.5	0	0	0	112.2	K952 D953 L959 K960 L977	K952-Y956 WeakPolarHBondContact O-CB 3.11Å; K952-Y956 PolarHBondContact O-N 2.83Å; D953-Y956 PolarHBondContact O-N 3.24Å; Y956-L959 PolarHBondContact O-N 3.13Å; Y956-K960 HydrophobicContact CD1-CD 4.25Å; Y956-K960 HydrophobicContact CE1-CD 3.95Å; Y956-K960 VanDerWaalsContact CE1-NZ 3.27Å; Y956-K960 PolarHBondContact O-N 3.01Å; Y956-K960 VanDerWaalsContact O-N 3.12Å; Y956-L977 HydrophobicContact CD2-CD2 3.41Å; Y956-L977 VanDerWaalsContact CD2-CD2 3.41Å; Y956-L977 HydrophobicContact CD2-CG 4.27Å; Y956-L977 HydrophobicContact CE2-CD2 3.44Å; Y956-L977 VanDerWaalsContact CE2-CD2 3.44Å; Y956-L977 HydrophobicContact CE2-CG 3.85Å; Y956-L977 HydrophobicContact CG-CD2 3.96Å
957	L	85.6	Confident	74.7	Confident	124 Å²	124	86.9 Å²	86.9	65%	0.649	46%	0.455	S	S	*	.	H	α-helix	trans	-65.3	-41.9	176.1	-170.1	65.4	0	0	0	111.9	D953 I955 L959 K960 K961	D953-L957 WeakPolarHBondContact O-CB 3.28Å; D953-L957 PolarHBondContact O-N 3.16Å; I955-L957 PolarHBondContact O-N 3.47Å; L957-L959 PolarHBondContact O-N 3.4Å; L957-K960 PolarHBondContact O-N 3.47Å; L957-K961 PolarHBondContact O-N 3.19Å; L957-K961 VanDerWaalsContact O-N 3.08Å
958	L	84.1	Confident	77.2	Confident	77 Å²	77	82.2 Å²	82.2	40%	0.403	43%	0.429	S	S	.	.	H	α-helix	trans	-60.9	-44	177.6	-165.1	66.6	0	0	0	112.1	S954 I955 K961 T962 L1041	S954-L958 WeakPolarHBondContact O-CB 3.38Å; S954-L958 PolarHBondContact O-N 3.43Å; S954-L958 VanDerWaalsContact O-N 3.13Å; I955-L958 PolarHBondContact O-N 3.29Å; L958-K961 PolarHBondContact O-N 2.85Å; L958-T962 WeakPolarHBondContact O-CB 3.34Å; L958-T962 PolarHBondContact O-N 2.96Å; L958-T962 PolarHBondContact O-OG1 3.27Å; L958-L1041 HydrophobicContact CD1-CD1 3.51Å; L958-L1041 HydrophobicContact CD1-CD2 3.75Å; L958-L1041 HydrophobicContact CD1-CG 4.18Å; L958-L1041 HydrophobicContact CD2-CD1 4.25Å; L958-L1041 HydrophobicContact CG-CD1 3.85Å
959	L	88.3	Confident	79.5	Confident	15 Å²	15	84 Å²	84	8%	0.079	42%	0.417	C	S	.	.	H	α-helix	trans	-64.8	-43.5	177.6	-75.2	172.4	0	0	0	112	I955 Y956 L957 K961 T962 L963 L977 L980 V993 F995	I955-L959 HydrophobicContact CG2-CD1 4.12Å; I955-L959 WeakPolarHBondContact O-CG 3.43Å; I955-L959 PolarHBondContact O-N 2.9Å; Y956-L959 PolarHBondContact O-N 3.13Å; L957-L959 PolarHBondContact O-N 3.4Å; L959-K961 PolarHBondContact O-N 2.87Å; L959-T962 PolarHBondContact O-N 3.33Å; L959-L963 WeakPolarHBondContact O-CG 3.45Å; L959-L963 PolarHBondContact O-N 3.04Å; L959-L977 HydrophobicContact CB-CD1 4.34Å; L959-L977 HydrophobicContact CB-CD2 3.69Å; L959-L977 HydrophobicContact CD1-CD1 4.39Å; L959-L977 HydrophobicContact CD1-CD2 4.3Å; L959-L980 HydrophobicContact CD1-CD1 3.6Å; L959-V993 HydrophobicContact CD1-CG2 4.27Å; L959-V993 HydrophobicContact CD2-CG2 4.07Å; L959-F995 HydrophobicContact CD1-CB 4.28Å; L959-F995 HydrophobicContact CD1-CD1 3.94Å; L959-F995 HydrophobicContact CD1-CG 4.14Å; L959-F995 HydrophobicContact CD2-CD1 3.84Å; L959-F995 HydrophobicContact CD2-CE1 3.62Å; L959-F995 HydrophobicContact CD2-CG 4.47Å; L959-F995 HydrophobicContact CD2-CZ 4.08Å
960	K	87.5	Confident	81	Confident	100 Å²	100	78 Å²	78	44%	0.435	39%	0.391	S	S	.	.	H	α-helix	trans	-57.4	-47.7	174.8	-80.1	-178.5	168.9	178.8	0	112	Y956 L957 T962 L963 F964 L977	Y956-K960 HydrophobicContact CD1-CD 4.25Å; Y956-K960 HydrophobicContact CE1-CD 3.95Å; Y956-K960 VanDerWaalsContact CE1-NZ 3.27Å; Y956-K960 PolarHBondContact O-N 3.01Å; Y956-K960 VanDerWaalsContact O-N 3.12Å; L957-K960 PolarHBondContact O-N 3.47Å; K960-T962 VanDerWaalsContact C-N 3.31Å; K960-T962 PolarHBondContact O-N 2.74Å; K960-L963 PolarHBondContact O-N 2.84Å; K960-F964 PolarHBondContact O-N 2.05Å; K960-L977 HydrophobicContact CG-CB 4.04Å; K960-L977 HydrophobicContact CG-CD2 4.06Å
961	K	82.8	Confident	82.2	Confident	112 Å²	112	81.3 Å²	81.3	49%	0.487	41%	0.41	S	S	.	.	H	α-helix	trans	-62.3	-40.7	178.4	-167.9	178.5	180	-173.9	0	111.2	L957 L958 L959 F964 N965 L1041	L957-K961 PolarHBondContact O-N 3.19Å; L957-K961 VanDerWaalsContact O-N 3.08Å; L958-K961 PolarHBondContact O-N 2.85Å; L959-K961 PolarHBondContact O-N 2.87Å; K961-F964 PolarHBondContact O-N 3.12Å; K961-N965 VanDerWaalsContact O-CB 3.3Å; K961-N965 WeakPolarHBondContact O-CB 3.44Å; K961-N965 VanDerWaalsContact O-CG 3.23Å; K961-N965 PolarHBondContact O-N 2.95Å; K961-L1041 HydrophobicContact CD-CD2 4.45Å
962	T	81.8	Confident	82.7	Confident	24 Å²	24	78.5 Å²	78.5	15%	0.147	40%	0.401	C	S	.	.	H	α-helix	trans	-66.1	-45.3	178.8	-56.1	0	0	0	0	112.3	L958 L959 K960 F964 N965 K966 T1037	L958-T962 WeakPolarHBondContact O-CB 3.34Å; L958-T962 PolarHBondContact O-N 2.96Å; L958-T962 PolarHBondContact O-OG1 3.27Å; L959-T962 PolarHBondContact O-N 3.33Å; K960-T962 VanDerWaalsContact C-N 3.31Å; K960-T962 PolarHBondContact O-N 2.74Å; T962-F964 VanDerWaalsContact C-N 3.29Å; T962-F964 PolarHBondContact O-N 3.15Å; T962-N965 PolarHBondContact O-N 3.25Å; T962-K966 HydrophobicContact CG2-CD 4.28Å; T962-K966 HydrophobicContact CG2-CG 4.32Å; T962-K966 WeakPolarHBondContact O-CB 3.42Å; T962-K966 PolarHBondContact O-N 3.34Å; T962-T1037 HydrophobicContact CG2-CG2 3.95Å
963	L	85.2	Confident	83.1	Confident	14 Å²	14	77 Å²	77	7%	0.073	39%	0.392	C	S	.	.	H	α-helix	trans	-59.8	-40.1	177.4	-72.1	172	0	0	0	112	L959 K960 I968 A975 L977 F995 I997	L959-L963 WeakPolarHBondContact O-CG 3.45Å; L959-L963 PolarHBondContact O-N 3.04Å; K960-L963 PolarHBondContact O-N 2.84Å; L963-I968 HydrophobicContact CD2-CB 4.23Å; L963-I968 HydrophobicContact CD2-CG1 4.14Å; L963-I968 HydrophobicContact CD2-CG2 4.39Å; L963-I968 PolarHBondContact O-N 2.97Å; L963-A975 HydrophobicContact CD2-CB 4.45Å; L963-L977 HydrophobicContact CD1-CB 3.82Å; L963-L977 HydrophobicContact CD1-CD1 4.17Å; L963-F995 HydrophobicContact CD2-CE2 4.32Å; L963-I997 HydrophobicContact CD1-CG2 3.61Å; L963-I997 HydrophobicContact CD2-CG2 3.86Å; L963-I997 HydrophobicContact CG-CG2 4.41Å
964	F	81.2	Confident	83.4	Confident	139 Å²	139	74.3 Å²	74.3	61%	0.61	37%	0.374	S	S	*	.	H	α-helix	trans	-69.5	-50.2	176.4	-175.8	-101.6	0	0	0	111.9	K960 K961 T962 K966 A967	K960-F964 PolarHBondContact O-N 2.05Å; K961-F964 PolarHBondContact O-N 3.12Å; T962-F964 VanDerWaalsContact C-N 3.29Å; T962-F964 PolarHBondContact O-N 3.15Å; F964-K966 PolarHBondContact O-N 3.49Å; F964-A967 PolarHBondContact O-N 3.11Å; F964-A967 VanDerWaalsContact O-N 3.1Å
965	N	78.2	Confident	84	Confident	96 Å²	96	71.7 Å²	71.7	51%	0.513	36%	0.356	S	S	.	.	H	α-helix	trans	-67.3	-35.9	-176.3	-73.9	-2.5	0	0	0	113.4	K961 T962 A967	K961-N965 VanDerWaalsContact O-CB 3.3Å; K961-N965 WeakPolarHBondContact O-CB 3.44Å; K961-N965 VanDerWaalsContact O-CG 3.23Å; K961-N965 PolarHBondContact O-N 2.95Å; T962-N965 PolarHBondContact O-N 3.25Å; N965-A967 PolarHBondContact O-N 3.32Å
966	K	80.9	Confident	84.3	Confident	101 Å²	101	78.2 Å²	78.2	44%	0.439	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	2.5	175	-72.7	-160.6	173.2	-169	0	113.3	T962 F964 I968 D1036	T962-K966 HydrophobicContact CG2-CD 4.28Å; T962-K966 HydrophobicContact CG2-CG 4.32Å; T962-K966 WeakPolarHBondContact O-CB 3.42Å; T962-K966 PolarHBondContact O-N 3.34Å; F964-K966 PolarHBondContact O-N 3.49Å; K966-I968 HydrophobicContact CB-CD1 3.88Å; K966-I968 HydrophobicContact CB-CG1 3.96Å; K966-I968 PolarHBondContact O-N 2.89Å; K966-D1036 PolarHBondContact NZ-O 3.27Å
967	A	81.1	Confident	84.6	Confident	52 Å²	52	75.2 Å²	75.2	43%	0.43	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.2	38.6	-179.5	0	0	0	0	0	113.6	F964 N965 H969	F964-A967 PolarHBondContact O-N 3.11Å; F964-A967 VanDerWaalsContact O-N 3.1Å; N965-A967 PolarHBondContact O-N 3.32Å; A967-H969 PolarHBondContact O-CD2 2.97Å; A967-H969 PolarHBondContact O-N 3.27Å
968	I	82.7	Confident	84.8	Confident	62 Å²	62	72.6 Å²	72.6	32%	0.318	36%	0.358	S	S	.	.			trans	-66.1	124.7	-179.3	-55	-60	0	0	0	108.9	L963 K966 A975 I997	L963-I968 HydrophobicContact CD2-CB 4.23Å; L963-I968 HydrophobicContact CD2-CG1 4.14Å; L963-I968 HydrophobicContact CD2-CG2 4.39Å; L963-I968 PolarHBondContact O-N 2.97Å; K966-I968 HydrophobicContact CB-CD1 3.88Å; K966-I968 HydrophobicContact CB-CG1 3.96Å; K966-I968 PolarHBondContact O-N 2.89Å; I968-A975 HydrophobicContact CB-CB 4.14Å; I968-A975 HydrophobicContact CG2-CB 3.85Å; I968-A975 WeakPolarHBondContact O-CB 3.47Å; I968-A975 PolarHBondContact O-N 3.02Å; I968-I997 HydrophobicContact CG2-CD1 4.23Å
969	H	84.3	Confident	84.9	Confident	113 Å²	113	70.8 Å²	70.8	52%	0.523	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	140.5	-179.5	56.1	60	0	0	0	112.5	A967 W973	A967-H969 PolarHBondContact O-CD2 2.97Å; A967-H969 PolarHBondContact O-N 3.27Å; H969-W973 CarbonylContact C-O 3.55Å; H969-W973 WeakPolarHBondContact CA-O 3.23Å; H969-W973 WeakPolarHBondContact CB-O 3.44Å
970	L	83.2	Confident	84.7	Confident	53 Å²	53	71 Å²	71	28%	0.277	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	111.6	173.8	-64.3	167.9	0	0	0	107.6	G972 W973 A975 I997 A998 P999	L970-G972 VanDerWaalsContact C-N 3.31Å; L970-G972 PolarHBondContact O-N 3.49Å; L970-W973 PolarHBondContact N-O 3.12Å; L970-W973 WeakPolarHBondContact O-CB 3.19Å; L970-W973 PolarHBondContact O-N 3.4Å; L970-A975 HydrophobicContact CD1-CB 4.26Å; L970-A975 HydrophobicContact CG-CB 4.38Å; L970-I997 HydrophobicContact CD1-CB 4.38Å; L970-I997 HydrophobicContact CD1-CD1 4Å; L970-I997 HydrophobicContact CD1-CG1 4.01Å; L970-I997 HydrophobicContact CD2-CD1 4.1Å; L970-I997 HydrophobicContact CG-CD1 4.26Å; L970-A998 VanDerWaalsContact CD1-C 3.48Å; L970-P999 HydrophobicContact CB-CG 4.17Å; L970-P999 HydrophobicContact CD1-CG 4.39Å
971	N	82.1	Confident	84.5	Confident	158 Å²	158	70.5 Å²	70.5	85%	0.845	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	46.4	-179.3	-59.8	-12.8	0	0	0	113.2	W973	N971-W973 PolarHBondContact O-N 3.35Å
972	G	80.3	Confident	84.5	Confident	25 Å²	25	70.6 Å²	70.6	26%	0.258	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.1	1	-179.4	0	0	0	0	0	115.2	L970 R1003 S1004	L970-G972 VanDerWaalsContact C-N 3.31Å; L970-G972 PolarHBondContact O-N 3.49Å; G972-R1003 CarbonylContact O-C 3.47Å; G972-R1003 WeakPolarHBondContact O-CA 3.26Å; G972-S1004 WeakPolarHBondContact O-CB 3.07Å; G972-S1004 PolarHBondContact O-N 2.87Å; G972-S1004 PolarHBondContact O-OG 3.46Å
973	W	87.4	Confident	84.4	Confident	92 Å²	92	72.9 Å²	72.9	35%	0.348	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	138.5	173.9	-55.1	93.1	0	0	0	110.8	H969 L970 N971 A975 P999 K1001 C1002 R1003	H969-W973 CarbonylContact C-O 3.55Å; H969-W973 WeakPolarHBondContact CA-O 3.23Å; H969-W973 WeakPolarHBondContact CB-O 3.44Å; L970-W973 PolarHBondContact N-O 3.12Å; L970-W973 WeakPolarHBondContact O-CB 3.19Å; L970-W973 PolarHBondContact O-N 3.4Å; N971-W973 PolarHBondContact O-N 3.35Å; W973-A975 PolarHBondContact O-N 2.75Å; W973-P999 HydrophobicContact CB-CB 3.95Å; W973-P999 HydrophobicContact CG-CB 4.28Å; W973-K1001 WeakPolarHBondContact CZ3-O 3.32Å; W973-C1002 CarbonylContact C-O 3.54Å; W973-C1002 VanDerWaalsContact CA-O 3.27Å; W973-C1002 WeakPolarHBondContact CA-O 3.37Å; W973-C1002 VanDerWaalsContact CE3-C 3.42Å; W973-R1003 HydrophobicContact CD2-CG 4.33Å; W973-R1003 HydrophobicContact CE3-CB 4.39Å; W973-R1003 HydrophobicContact CE3-CG 3.78Å; W973-R1003 HydrophobicContact CH2-CG 3.84Å; W973-R1003 HydrophobicContact CZ2-CG 4.34Å; W973-R1003 HydrophobicContact CZ3-CB 4.38Å; W973-R1003 HydrophobicContact CZ3-CG 3.51Å
974	Y	86.7	Confident	84	Confident	60 Å²	60	76.7 Å²	76.7	24%	0.235	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.9	139.2	172.2	-76.6	-77.9	0	0	0	110.5	S1000 C1002	Y974-S1000 WeakPolarHBondContact CB-OG 3.26Å; Y974-S1000 WeakPolarHBondContact O-CB 3.23Å; Y974-S1000 PolarHBondContact O-N 3.03Å; Y974-S1000 PolarHBondContact O-OG 3.14Å; Y974-C1002 HydrophobicContact CD2-CB 4.02Å; Y974-C1002 WeakPolarHBondContact CD2-O 3.33Å; Y974-C1002 PolarHBondContact N-O 2.98Å
975	A	90.6	Very high	83.6	Confident	11 Å²	11	76.4 Å²	76.4	9%	0.091	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	136.4	174.3	0	0	0	0	0	110.7	L963 I968 L970 W973 I997	L963-A975 HydrophobicContact CD2-CB 4.45Å; I968-A975 HydrophobicContact CB-CB 4.14Å; I968-A975 HydrophobicContact CG2-CB 3.85Å; I968-A975 WeakPolarHBondContact O-CB 3.47Å; I968-A975 PolarHBondContact O-N 3.02Å; L970-A975 HydrophobicContact CD1-CB 4.26Å; L970-A975 HydrophobicContact CG-CB 4.38Å; W973-A975 PolarHBondContact O-N 2.75Å; A975-I997 HydrophobicContact CB-CB 4.3Å; A975-I997 HydrophobicContact CB-CD1 4.03Å
976	R	91	Very high	82.8	Confident	142 Å²	142	73.7 Å²	73.7	54%	0.536	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	143.6	165.8	63.2	169.9	-177.9	143.7	7.7	110	V978 I997 A998 P999	R976-V978 PolarHBondContact O-N 2.93Å; R976-I997 CarbonylContact O-C 3.43Å; R976-I997 VanDerWaalsContact O-CA 3.23Å; R976-I997 WeakPolarHBondContact O-CA 3.37Å; R976-A998 HydrophobicContact CG-CB 4.34Å; R976-A998 VanDerWaalsContact CG-O 3.26Å; R976-A998 WeakPolarHBondContact CG-O 3.44Å; R976-A998 PolarHBondContact N-O 3.49Å; R976-A998 PolarHBondContact O-N 3.44Å; R976-P999 PolarHBondContact NE-O 3.28Å
977	L	91.4	Very high	81.8	Confident	10 Å²	10	74.9 Å²	74.9	5%	0.052	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	125.3	171.2	-169.4	65	0	0	0	109.7	Y956 L959 K960 L963 F995	Y956-L977 HydrophobicContact CD2-CD2 3.41Å; Y956-L977 VanDerWaalsContact CD2-CD2 3.41Å; Y956-L977 HydrophobicContact CD2-CG 4.27Å; Y956-L977 HydrophobicContact CE2-CD2 3.44Å; Y956-L977 VanDerWaalsContact CE2-CD2 3.44Å; Y956-L977 HydrophobicContact CE2-CG 3.85Å; Y956-L977 HydrophobicContact CG-CD2 3.96Å; L959-L977 HydrophobicContact CB-CD1 4.34Å; L959-L977 HydrophobicContact CB-CD2 3.69Å; L959-L977 HydrophobicContact CD1-CD1 4.39Å; L959-L977 HydrophobicContact CD1-CD2 4.3Å; K960-L977 HydrophobicContact CG-CB 4.04Å; K960-L977 HydrophobicContact CG-CD2 4.06Å; L963-L977 HydrophobicContact CD1-CB 3.82Å; L963-L977 HydrophobicContact CD1-CD1 4.17Å; L977-F995 HydrophobicContact CD1-CB 3.75Å; L977-F995 HydrophobicContact CD1-CD2 3.64Å; L977-F995 HydrophobicContact CD1-CG 3.93Å
978	V	89.4	Confident	81	Confident	69 Å²	69	82.1 Å²	82.1	42%	0.418	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	-54.7	178.6	178.9	0	0	0	0	110	R976 T996 A998	R976-V978 PolarHBondContact O-N 2.93Å; V978-T996 HydrophobicContact CB-CG2 4.15Å; V978-T996 WeakPolarHBondContact CB-O 3.09Å; V978-T996 HydrophobicContact CG2-CG2 4.47Å; V978-T996 PolarHBondContact N-O 2.82Å; V978-A998 HydrophobicContact CG2-CB 3.34Å
979	S	86.9	Confident	80.1	Confident	39 Å²	39	84.7 Å²	84.7	27%	0.273	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	154.2	-176.9	56.3	0	0	0	0	111.1	D981 F995 T996	S979-D981 WeakPolarHBondContact CB-OD1 3.49Å; S979-D981 PolarHBondContact OG-OD1 2.81Å; S979-F995 CarbonylContact O-C 3.48Å; S979-F995 VanDerWaalsContact O-CA 3.23Å; S979-F995 WeakPolarHBondContact O-CA 3.36Å; S979-F995 WeakPolarHBondContact O-CB 3.26Å; S979-T996 PolarHBondContact N-O 2.78Å; S979-T996 PolarHBondContact O-N 3.46Å; S979-T996 WeakPolarHBondContact OG-CB 3.49Å; S979-T996 PolarHBondContact OG-OG1 3Å
980	L	85	Confident	79.4	Confident	19 Å²	19	82.9 Å²	82.9	10%	0.099	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	103.6	168	-178.2	60.3	0	0	0	106.9	K952 I955 L959 I983 V993 F995	K952-L980 HydrophobicContact CG-CD2 4.07Å; I955-L980 HydrophobicContact CB-CD2 4.12Å; I955-L980 HydrophobicContact CG2-CD1 4.31Å; I955-L980 HydrophobicContact CG2-CD2 3.65Å; L959-L980 HydrophobicContact CD1-CD1 3.6Å; L980-I983 HydrophobicContact CD1-CG1 4.25Å; L980-I983 HydrophobicContact CD2-CD1 3.59Å; L980-I983 HydrophobicContact CD2-CG1 3.86Å; L980-I983 HydrophobicContact CG-CD1 4.16Å; L980-I983 HydrophobicContact CG-CG1 3.96Å; L980-V993 HydrophobicContact CD1-CB 3.95Å; L980-V993 HydrophobicContact CD1-CG1 4.31Å; L980-F995 HydrophobicContact CD1-CB 4.13Å
981	D	83	Confident	78.9	Confident	89 Å²	89	82.3 Å²	82.3	48%	0.476	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	-36.5	-165.8	-53.2	-42.8	0	0	0	112	S979 S994 F995 T996	S979-D981 WeakPolarHBondContact CB-OD1 3.49Å; S979-D981 PolarHBondContact OG-OD1 2.81Å; D981-S994 WeakPolarHBondContact CA-O 3.33Å; D981-S994 PolarHBondContact N-O 3.2Å; D981-F995 WeakPolarHBondContact OD2-CA 3.11Å; D981-T996 PolarHBondContact OD2-N 2.76Å; D981-T996 VanDerWaalsContact OD2-N 3.11Å; D981-T996 PolarHBondContact OD2-OG1 2.91Å
982	K	81.4	Confident	78.5	Confident	114 Å²	114	77.9 Å²	77.9	50%	0.496	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	143.4	179.2	-163.4	179.5	-179.4	-169.8	0	111.6	V993 S994	K982-V993 CarbonylContact O-C 3.56Å; K982-V993 VanDerWaalsContact O-CA 3.26Å; K982-V993 WeakPolarHBondContact O-CA 3.45Å; K982-S994 PolarHBondContact N-O 3.07Å; K982-S994 PolarHBondContact O-N 3.29Å
983	I	80.9	Confident	78.6	Confident	72 Å²	72	77 Å²	77	37%	0.369	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	126	171.2	-52.9	164.5	0	0	0	106.7	K952 I955 L980 L991 L992 V993	K952-I983 HydrophobicContact CG-CD1 4.37Å; I955-I983 HydrophobicContact CD1-CD1 3.8Å; I955-I983 HydrophobicContact CD1-CG1 4.41Å; I955-I983 HydrophobicContact CD1-CG2 3.98Å; L980-I983 HydrophobicContact CD1-CG1 4.25Å; L980-I983 HydrophobicContact CD2-CD1 3.59Å; L980-I983 HydrophobicContact CD2-CG1 3.86Å; L980-I983 HydrophobicContact CG-CD1 4.16Å; L980-I983 HydrophobicContact CG-CG1 3.96Å; I983-L991 HydrophobicContact CG2-CD1 3.86Å; I983-L991 HydrophobicContact CG2-CG 4.21Å; I983-L992 CarbonylContact C-O 3.58Å; I983-L992 WeakPolarHBondContact CA-O 3.46Å; I983-V993 HydrophobicContact CB-CG1 4.43Å; I983-V993 HydrophobicContact CG1-CG1 4.18Å; I983-V993 HydrophobicContact CG2-CG1 4.13Å
984	Q	76.6	Confident	78.3	Confident	94 Å²	94	75.1 Å²	75.1	44%	0.439	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	130.9	-177.8	-176.7	171.6	-6.6	0	0	109.9	L992	Q984-L992 HydrophobicContact CB-CB 4.36Å; Q984-L992 PolarHBondContact N-O 3.43Å; Q984-L992 WeakPolarHBondContact O-CA 3.27Å; Q984-L992 VanDerWaalsContact O-CB 3.24Å; Q984-L992 WeakPolarHBondContact O-CB 3.07Å; Q984-L992 PolarHBondContact O-N 3.43Å
985	R	72.3	Confident	78.5	Confident	133 Å²	133	74.2 Å²	74.2	50%	0.502	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	128.8	169.7	-77.1	-175.5	-177.6	-134.1	7.3	110.6	N989 E990 L991	R985-N989 PolarHBondContact NH1-OD1 3.11Å; R985-E990 CarbonylContact C-O 3.48Å; R985-E990 WeakPolarHBondContact CA-O 3.49Å; R985-L991 HydrophobicContact CG-CD1 4.26Å
986	S	62.6	Low	78.4	Confident	39 Å²	39	76.6 Å²	76.6	27%	0.273	37%	0.373	S	S	.	.			trans	-67	161.6	170.8	176.5	0	0	0	0	110.8	R988 N989 E990	S986-R988 PolarHBondContact O-N 2.78Å; S986-R988 PolarHBondContact OG-N 3.06Å; S986-N989 PolarHBondContact O-N 2.66Å; S986-E990 WeakPolarHBondContact CB-O 3.42Å; S986-E990 PolarHBondContact N-O 2.67Å; S986-E990 PolarHBondContact OG-OE2 2.8Å
987	I	59.3	Low	78.4	Confident	126 Å²	126	72.3 Å²	72.3	65%	0.646	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-22.7	174	-46.5	172.5	0	0	0	111	R149 N989	R149-I987 VanDerWaalsContact NH2-CG2 3.26Å; I987-N989 VanDerWaalsContact C-N 3.32Å
988	R	64.7	Low	78.3	Confident	205 Å²	205	72.9 Å²	72.9	77%	0.774	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	12	174.2	-65.4	-176.9	178	-171.1	-0.8	113.8	S986 E990	S986-R988 PolarHBondContact O-N 2.78Å; S986-R988 PolarHBondContact OG-N 3.06Å; R988-E990 HydrophobicContact CB-CG 4.13Å; R988-E990 PolarHBondContact O-N 3.07Å
989	N	63.1	Low	78.4	Confident	115 Å²	115	72.3 Å²	72.3	62%	0.615	36%	0.364	S	S	*	.	S	Bend	trans	63.3	17	-174.3	-155.6	35.3	0	0	0	114.5	R985 S986 I987	R985-N989 PolarHBondContact NH1-OD1 3.11Å; S986-N989 PolarHBondContact O-N 2.66Å; I987-N989 VanDerWaalsContact C-N 3.32Å
990	E	68.6	Low	78.4	Confident	75 Å²	75	72 Å²	72	35%	0.35	36%	0.362	S	S	.	.			trans	-77.7	145	171.5	-58.3	154.4	166	0	0	110.4	R985 S986 R988 L992	R985-E990 CarbonylContact C-O 3.48Å; R985-E990 WeakPolarHBondContact CA-O 3.49Å; S986-E990 WeakPolarHBondContact CB-O 3.42Å; S986-E990 PolarHBondContact N-O 2.67Å; S986-E990 PolarHBondContact OG-OE2 2.8Å; R988-E990 HydrophobicContact CB-CG 4.13Å; R988-E990 PolarHBondContact O-N 3.07Å; E990-L992 PolarHBondContact O-N 2.78Å
991	L	72.9	Confident	78.3	Confident	42 Å²	42	79.5 Å²	79.5	22%	0.22	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	104.3	177.5	-166	89.6	0	0	0	110.2	I955 I983 R985 V993	I955-L991 HydrophobicContact CD1-CD2 3.82Å; I955-L991 HydrophobicContact CG1-CD2 3.95Å; I955-L991 HydrophobicContact CG2-CD2 4.38Å; I983-L991 HydrophobicContact CG2-CD1 3.86Å; I983-L991 HydrophobicContact CG2-CG 4.21Å; R985-L991 HydrophobicContact CG-CD1 4.26Å; L991-V993 HydrophobicContact CD2-CG1 3.78Å; L991-V993 HydrophobicContact CG-CG1 4.1Å
992	L	74.8	Confident	78.3	Confident	65 Å²	65	78.8 Å²	78.8	34%	0.34	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	120.6	173.4	-135.4	84.2	0	0	0	109.7	I983 Q984 E990	I983-L992 CarbonylContact C-O 3.58Å; I983-L992 WeakPolarHBondContact CA-O 3.46Å; Q984-L992 HydrophobicContact CB-CB 4.36Å; Q984-L992 PolarHBondContact N-O 3.43Å; Q984-L992 WeakPolarHBondContact O-CA 3.27Å; Q984-L992 VanDerWaalsContact O-CB 3.24Å; Q984-L992 WeakPolarHBondContact O-CB 3.07Å; Q984-L992 PolarHBondContact O-N 3.43Å; E990-L992 PolarHBondContact O-N 2.78Å
993	V	82.7	Confident	78.3	Confident	5 Å²	5	79.2 Å²	79.2	3%	0.03	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	140	177.2	-63	0	0	0	0	111.5	I955 L959 L980 K982 I983 L991 F995 V1034	I955-V993 HydrophobicContact CG2-CG1 3.94Å; L959-V993 HydrophobicContact CD1-CG2 4.27Å; L959-V993 HydrophobicContact CD2-CG2 4.07Å; L980-V993 HydrophobicContact CD1-CB 3.95Å; L980-V993 HydrophobicContact CD1-CG1 4.31Å; K982-V993 CarbonylContact O-C 3.56Å; K982-V993 VanDerWaalsContact O-CA 3.26Å; K982-V993 WeakPolarHBondContact O-CA 3.45Å; I983-V993 HydrophobicContact CB-CG1 4.43Å; I983-V993 HydrophobicContact CG1-CG1 4.18Å; I983-V993 HydrophobicContact CG2-CG1 4.13Å; L991-V993 HydrophobicContact CD2-CG1 3.78Å; L991-V993 HydrophobicContact CG-CG1 4.1Å; V993-F995 HydrophobicContact CG2-CD1 4.01Å; V993-F995 HydrophobicContact CG2-CE1 4.18Å; V993-V1034 HydrophobicContact CG2-CB 3.99Å; V993-V1034 HydrophobicContact CG2-CG1 4.08Å; V993-V1034 HydrophobicContact CG2-CG2 3.41Å; V993-V1034 VanDerWaalsContact CG2-CG2 3.41Å
994	S	81.1	Confident	77.8	Confident	53 Å²	53	77.4 Å²	77.4	37%	0.371	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	132	170.2	-51.9	0	0	0	0	108.1	D981 K982	D981-S994 WeakPolarHBondContact CA-O 3.33Å; D981-S994 PolarHBondContact N-O 3.2Å; K982-S994 PolarHBondContact N-O 3.07Å; K982-S994 PolarHBondContact O-N 3.29Å
995	F	90.5	Very high	77.2	Confident	41 Å²	41	79.7 Å²	79.7	18%	0.18	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	154.5	-174.8	56.3	-90.5	0	0	0	110.9	L959 L963 L977 S979 L980 D981 V993 I997 V1034	L959-F995 HydrophobicContact CD1-CB 4.28Å; L959-F995 HydrophobicContact CD1-CD1 3.94Å; L959-F995 HydrophobicContact CD1-CG 4.14Å; L959-F995 HydrophobicContact CD2-CD1 3.84Å; L959-F995 HydrophobicContact CD2-CE1 3.62Å; L959-F995 HydrophobicContact CD2-CG 4.47Å; L959-F995 HydrophobicContact CD2-CZ 4.08Å; L963-F995 HydrophobicContact CD2-CE2 4.32Å; L977-F995 HydrophobicContact CD1-CB 3.75Å; L977-F995 HydrophobicContact CD1-CD2 3.64Å; L977-F995 HydrophobicContact CD1-CG 3.93Å; S979-F995 CarbonylContact O-C 3.48Å; S979-F995 VanDerWaalsContact O-CA 3.23Å; S979-F995 WeakPolarHBondContact O-CA 3.36Å; S979-F995 WeakPolarHBondContact O-CB 3.26Å; L980-F995 HydrophobicContact CD1-CB 4.13Å; D981-F995 WeakPolarHBondContact OD2-CA 3.11Å; V993-F995 HydrophobicContact CG2-CD1 4.01Å; V993-F995 HydrophobicContact CG2-CE1 4.18Å; F995-I997 HydrophobicContact CD2-CG2 3.9Å; F995-I997 HydrophobicContact CE2-CG2 3.93Å; F995-V1034 HydrophobicContact CE1-CG2 3.84Å
996	T	87.9	Confident	76.4	Confident	62 Å²	62	82.5 Å²	82.5	38%	0.38	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	136	178.4	-63.1	0	0	0	0	109.9	V978 S979 D981	V978-T996 HydrophobicContact CB-CG2 4.15Å; V978-T996 WeakPolarHBondContact CB-O 3.09Å; V978-T996 HydrophobicContact CG2-CG2 4.47Å; V978-T996 PolarHBondContact N-O 2.82Å; S979-T996 PolarHBondContact N-O 2.78Å; S979-T996 PolarHBondContact O-N 3.46Å; S979-T996 WeakPolarHBondContact OG-CB 3.49Å; S979-T996 PolarHBondContact OG-OG1 3Å; D981-T996 PolarHBondContact OD2-N 2.76Å; D981-T996 VanDerWaalsContact OD2-N 3.11Å; D981-T996 PolarHBondContact OD2-OG1 2.91Å
997	I	92.3	Very high	75.4	Confident	52 Å²	52	89 Å²	89	27%	0.267	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	150	173.9	55.7	170.4	0	0	0	111.1	L963 I968 L970 A975 R976 F995	L963-I997 HydrophobicContact CD1-CG2 3.61Å; L963-I997 HydrophobicContact CD2-CG2 3.86Å; L963-I997 HydrophobicContact CG-CG2 4.41Å; I968-I997 HydrophobicContact CG2-CD1 4.23Å; L970-I997 HydrophobicContact CD1-CB 4.38Å; L970-I997 HydrophobicContact CD1-CD1 4Å; L970-I997 HydrophobicContact CD1-CG1 4.01Å; L970-I997 HydrophobicContact CD2-CD1 4.1Å; L970-I997 HydrophobicContact CG-CD1 4.26Å; A975-I997 HydrophobicContact CB-CB 4.3Å; A975-I997 HydrophobicContact CB-CD1 4.03Å; R976-I997 CarbonylContact O-C 3.43Å; R976-I997 VanDerWaalsContact O-CA 3.23Å; R976-I997 WeakPolarHBondContact O-CA 3.37Å; F995-I997 HydrophobicContact CD2-CG2 3.9Å; F995-I997 HydrophobicContact CE2-CG2 3.93Å
998	A	89.4	Confident	74.4	Confident	21 Å²	21	88.1 Å²	88.1	17%	0.174	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	162.4	173.4	0	0	0	0	0	110.5	L970 R976 V978 S1000	L970-A998 VanDerWaalsContact CD1-C 3.48Å; R976-A998 HydrophobicContact CG-CB 4.34Å; R976-A998 VanDerWaalsContact CG-O 3.26Å; R976-A998 WeakPolarHBondContact CG-O 3.44Å; R976-A998 PolarHBondContact N-O 3.49Å; R976-A998 PolarHBondContact O-N 3.44Å; V978-A998 HydrophobicContact CG2-CB 3.34Å; A998-S1000 PolarHBondContact O-N 3.16Å
999	P	90.3	Very high	72.9	Confident	58 Å²	58	83.8 Å²	83.8	38%	0.377	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	131.6	168.7	-24.8	34.9	0	0	0	110.8	L970 W973 R976 K1001	L970-P999 HydrophobicContact CB-CG 4.17Å; L970-P999 HydrophobicContact CD1-CG 4.39Å; W973-P999 HydrophobicContact CB-CB 3.95Å; W973-P999 HydrophobicContact CG-CB 4.28Å; R976-P999 PolarHBondContact NE-O 3.28Å; P999-K1001 PolarHBondContact O-N 3.3Å
1000	S	86.6	Confident	71.4	Confident	32 Å²	32	82.3 Å²	82.3	22%	0.224	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	-9.5	175.6	63.7	0	0	0	0	113.6	Y974 A998 C1002	Y974-S1000 WeakPolarHBondContact CB-OG 3.26Å; Y974-S1000 WeakPolarHBondContact O-CB 3.23Å; Y974-S1000 PolarHBondContact O-N 3.03Å; Y974-S1000 PolarHBondContact O-OG 3.14Å; A998-S1000 PolarHBondContact O-N 3.16Å; S1000-C1002 PolarHBondContact O-N 2.92Å; S1000-C1002 WeakPolarHBondContact OG-CB 3.28Å; S1000-C1002 PolarHBondContact OG-N 3.21Å; S1000-C1002 VanDerWaalsContact OG-N 3.07Å
1001	K	84	Confident	69.6	Low	177 Å²	177	84.4 Å²	84.4	77%	0.77	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	61.2	16.8	-165.8	-50.8	-178.7	178.9	-178	0	114	W973 P999	W973-K1001 WeakPolarHBondContact CZ3-O 3.32Å; P999-K1001 PolarHBondContact O-N 3.3Å
1002	C	82.1	Confident	67.5	Low	73 Å²	73	94.2 Å²	94.2	49%	0.493	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	118.3	165.5	-62.5	0	0	0	0	109.7	W973 Y974 S1000 S1004	W973-C1002 CarbonylContact C-O 3.54Å; W973-C1002 VanDerWaalsContact CA-O 3.27Å; W973-C1002 WeakPolarHBondContact CA-O 3.37Å; W973-C1002 VanDerWaalsContact CE3-C 3.42Å; Y974-C1002 HydrophobicContact CD2-CB 4.02Å; Y974-C1002 WeakPolarHBondContact CD2-O 3.33Å; Y974-C1002 PolarHBondContact N-O 2.98Å; S1000-C1002 PolarHBondContact O-N 2.92Å; S1000-C1002 WeakPolarHBondContact OG-CB 3.28Å; S1000-C1002 PolarHBondContact OG-N 3.21Å; S1000-C1002 VanDerWaalsContact OG-N 3.07Å; C1002-S1004 PolarHBondContact O-N 3.45Å
1003	R	81.9	Confident	65.4	Low	123 Å²	123	94.6 Å²	94.6	46%	0.464	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	133.8	178.7	-77.5	-161.2	-178.1	-170.6	4	110	G972 W973 E1005 R1006	G972-R1003 CarbonylContact O-C 3.47Å; G972-R1003 WeakPolarHBondContact O-CA 3.26Å; W973-R1003 HydrophobicContact CD2-CG 4.33Å; W973-R1003 HydrophobicContact CE3-CB 4.39Å; W973-R1003 HydrophobicContact CE3-CG 3.78Å; W973-R1003 HydrophobicContact CH2-CG 3.84Å; W973-R1003 HydrophobicContact CZ2-CG 4.34Å; W973-R1003 HydrophobicContact CZ3-CB 4.38Å; W973-R1003 HydrophobicContact CZ3-CG 3.51Å; R1003-E1005 IonicContact NH1-OE2 3.14Å; R1003-E1005 PolarHBondContact NH1-OE2 2.71Å; R1003-E1005 VanDerWaalsContact NH1-OE2 3.14Å; R1003-E1005 PolarHBondContact O-N 3.23Å; R1003-R1006 HydrophobicContact CB-CG 4.27Å; R1003-R1006 WeakPolarHBondContact O-CB 3.38Å; R1003-R1006 PolarHBondContact O-N 3.32Å
1004	S	70.8	Confident	63.1	Low	34 Å²	34	106.2 Å²	106.2	24%	0.238	56%	0.558	C	S	.	*	T	Hydrogen-bonded Turn	trans	-58.5	-32.9	172.1	54.9	0	0	0	0	112.3	G972 C1002 R1006	G972-S1004 WeakPolarHBondContact O-CB 3.07Å; G972-S1004 PolarHBondContact O-N 2.87Å; G972-S1004 PolarHBondContact O-OG 3.46Å; C1002-S1004 PolarHBondContact O-N 3.45Å; S1004-R1006 PolarHBondContact O-N 3.1Å
1005	E	63.9	Low	60.8	Low	143 Å²	143	113 Å²	113	67%	0.668	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	-20.1	175.3	-62.7	168	175.1	0	0	113.6	R1003 K1007	R1003-E1005 IonicContact NH1-OE2 3.14Å; R1003-E1005 PolarHBondContact NH1-OE2 2.71Å; R1003-E1005 VanDerWaalsContact NH1-OE2 3.14Å; R1003-E1005 PolarHBondContact O-N 3.23Å; E1005-K1007 PolarHBondContact O-N 3.26Å; E1005-K1007 VanDerWaalsContact O-N 3.09Å
1006	R	54.6	Low	57.9	Low	192 Å²	192	118 Å²	118	73%	0.725	61%	0.608	S	S	*	*			trans	-82.1	90.4	171.3	-68.3	-174.7	178.7	-179.5	0.3	107.5	R1003 S1004 A1008	R1003-R1006 HydrophobicContact CB-CG 4.27Å; R1003-R1006 WeakPolarHBondContact O-CB 3.38Å; R1003-R1006 PolarHBondContact O-N 3.32Å; S1004-R1006 PolarHBondContact O-N 3.1Å; R1006-A1008 PolarHBondContact O-N 3.48Å
1007	K	41.3	Very low	55.5	Low	176 Å²	176	122 Å²	122	77%	0.765	63%	0.633	S	S	*	*			trans	-43.1	129.4	151.4	-86	-178.4	177.1	175.7	0	106.2	E1005 V1009	E1005-K1007 PolarHBondContact O-N 3.26Å; E1005-K1007 VanDerWaalsContact O-N 3.09Å; K1007-V1009 HydrophobicContact CB-CG2 4.01Å; K1007-V1009 PolarHBondContact O-N 3.3Å
1008	A	38.1	Very low	52.6	Low	107 Å²	107	127.5 Å²	127.5	88%	0.884	66%	0.658	S	S	*	*			trans	-63.2	79.1	169.4	0	0	0	0	0	107.9	R1006 A1010	R1006-A1008 PolarHBondContact O-N 3.48Å; A1008-A1010 PolarHBondContact O-N 2.63Å
1009	V	34.7	Very low	50	Low	113 Å²	113	134.5 Å²	134.5	69%	0.685	69%	0.692	S	S	*	*			trans	-81.4	104.2	170.5	177.7	0	0	0	0	104.5	K1007 T1011	K1007-V1009 HydrophobicContact CB-CG2 4.01Å; K1007-V1009 PolarHBondContact O-N 3.3Å; V1009-T1011 PolarHBondContact O-N 3.34Å
1010	A	31	Very low	47.2	Very low	85 Å²	85	136.5 Å²	136.5	70%	0.702	71%	0.714	S	S	*	*			trans	-54.4	111.4	156.7	0	0	0	0	0	107.9	A1008	A1008-A1010 PolarHBondContact O-N 2.63Å
1011	T	30.2	Very low	44.3	Very low	118 Å²	118	140.9 Å²	140.9	72%	0.724	74%	0.739	S	S	*	*	S	Bend	trans	76.5	121	152.5	-24.4	0	0	0	0	118.8	V1009	V1009-T1011 PolarHBondContact O-N 3.34Å
1012	R	29.8	Very low	41.7	Very low	249 Å²	249	142.7 Å²	142.7	94%	0.94	75%	0.747	S	S	*	*			trans	74.7	107	157.6	-89.2	178.9	179.8	173.7	0.6	120.6
1013	G	30.4	Very low	39	Very low	72 Å²	72	145.2 Å²	145.2	74%	0.742	75%	0.754	S	S	*	*				118.9	103.6	124.1	0	0	0	0	0	118.5
1014	R	33.4	Very low	36.5	Very low	250 Å²	250	146.9 Å²	146.9	94%	0.943	77%	0.77	S	S	*	*			trans	54.9	145.2	144.1	-73.4	-179.8	-172.6	166.5	2.2	118.9
1015	K	33.1	Very low	34.4	Very low	194 Å²	194	152.1 Å²	152.1	84%	0.843	79%	0.791	S	S	*	*			cis	-167.5	152.1	-7.3	-166.5	175.5	-176.7	-173.5	0	105.1
1016	L	30.3	Very low	32.7	Very low	146 Å²	146	153.9 Å²	153.9	76%	0.764	80%	0.797	S	S	*	*			trans	-58.6	160.6	-173.7	-63.3	118.8	0	0	0	116.4
1017	T	37.7	Very low	31.4	Very low	147 Å²	147	150.6 Å²	150.6	90%	0.902	80%	0.8	S	S	*	*				-161.3	147.2	105.7	36.4	0	0	0	0	112.5
1018	E	31.5	Very low	30.8	Very low	167 Å²	167	147.8 Å²	147.8	78%	0.78	80%	0.798	S	S	*	*			trans	-77	157	-176.5	-66.7	164.9	125.8	0	0	112.7
1019	D	33.7	Very low	30.4	Very low	168 Å²	168	148 Å²	148	90%	0.898	80%	0.8	S	S	*	*				-168.8	144.4	125.9	-94	-27.3	0	0	0	113.4
1020	A	32.2	Very low	30.2	Very low	101 Å²	101	146.8 Å²	146.8	84%	0.835	80%	0.802	S	S	*	*			trans	79	83.1	166.8	0	0	0	0	0	119.7
1021	V	25.5	Very low	30	Very low	124 Å²	124	147.3 Å²	147.3	75%	0.752	81%	0.806	S	S	*	*			trans	-85.8	130.6	149.8	168.6	0	0	0	0	109.1	I1023	V1021-I1023 HydrophobicContact CG1-CD1 3.99Å; V1021-I1023 HydrophobicContact CG1-CG1 3.75Å
1022	K	29.4	Very low	30	Very low	214 Å²	214	146.1 Å²	146.1	93%	0.93	80%	0.798	S	S	*	*			trans	-139.1	125.7	148.4	-133.6	175.4	-173.1	179.1	0	111
1023	I	26.4	Very low	30	Very low	127 Å²	127	139.3 Å²	139.3	65%	0.651	78%	0.784	S	S	*	*			trans	-85.5	154	-170.8	-67.2	155.3	0	0	0	109.6	V1021	V1021-I1023 HydrophobicContact CG1-CD1 3.99Å; V1021-I1023 HydrophobicContact CG1-CG1 3.75Å
1024	I	27.8	Very low	30.1	Very low	157 Å²	157	137.2 Å²	137.2	81%	0.805	76%	0.757	S	S	*	*				-172.7	106.5	126.7	-84.1	148	0	0	0	110.8
1025	E	27.7	Very low	30.1	Very low	145 Å²	145	128.5 Å²	128.5	68%	0.678	74%	0.738	S	S	*	*			trans	60.3	116.4	132.7	-55.8	-160.7	156.4	0	0	126
1026	K	28.2	Very low	30	Very low	180 Å²	180	126.1 Å²	126.1	78%	0.783	74%	0.735	S	S	*	*				98.8	136.8	129.2	-82.1	172.8	-177.5	158.6	0	121.2
1027	P	27	Very low	30	Very low	122 Å²	122	120.7 Å²	120.7	79%	0.792	71%	0.708	S	S	*	*			trans	-102.3	140.9	-161.9	37.7	-26.3	0	0	0	112.7
1028	T	29.4	Very low	29.7	Very low	118 Å²	118	122 Å²	122	72%	0.724	71%	0.706	S	S	*	*			trans	-122.6	128.9	166.2	31.4	0	0	0	0	110.4	V280 A1030	V280-T1028 HydrophobicContact CG1-CG2 4.49Å; T1028-A1030 PolarHBondContact O-N 3.43Å
1029	A	28.6	Very low	29.6	Very low	111 Å²	111	123 Å²	123	92%	0.917	71%	0.711	S	S	*	*			trans	-59.2	118.6	-178.5	0	0	0	0	0	111.3
1030	A	30.5	Very low	29.5	Very low	88 Å²	88	123.4 Å²	123.4	73%	0.727	70%	0.701	S	S	*	*			trans	-104.7	114.9	169.8	0	0	0	0	0	109.2	T1028 V1032	T1028-A1030 PolarHBondContact O-N 3.43Å; A1030-V1032 PolarHBondContact O-N 3.46Å
1031	A	27.8	Very low	29.3	Very low	96 Å²	96	121.3 Å²	121.3	79%	0.793	68%	0.675	S	S	*	*			trans	-65.7	110.6	167.6	0	0	0	0	0	108.9	T1033	A1031-T1033 PolarHBondContact O-N 3.1Å
1032	V	29.6	Very low	29.3	Very low	93 Å²	93	122.9 Å²	122.9	56%	0.564	67%	0.669	S	S	*	*			trans	-81.4	109.8	170.9	178.8	0	0	0	0	107.6	A1030 V1034	A1030-V1032 PolarHBondContact O-N 3.46Å; V1032-V1034 PolarHBondContact O-N 3.37Å
1033	T	30.3	Very low	29.3	Very low	105 Å²	105	118 Å²	118	64%	0.644	67%	0.668	S	S	*	*			trans	-67.9	111.7	167.1	39.5	0	0	0	0	109.2	A1031 A1035	A1031-T1033 PolarHBondContact O-N 3.1Å; T1033-A1035 PolarHBondContact O-N 3.29Å
1034	V	32.4	Very low	29.4	Very low	28 Å²	28	117.5 Å²	117.5	17%	0.17	67%	0.669	C	S	.	*	T	Hydrogen-bonded Turn	trans	-72.8	79.2	170.4	179.3	0	0	0	0	108.4	V993 F995 V1032 T1037	V993-V1034 HydrophobicContact CG2-CB 3.99Å; V993-V1034 HydrophobicContact CG2-CG1 4.08Å; V993-V1034 HydrophobicContact CG2-CG2 3.41Å; V993-V1034 VanDerWaalsContact CG2-CG2 3.41Å; F995-V1034 HydrophobicContact CE1-CG2 3.84Å; V1032-V1034 PolarHBondContact O-N 3.37Å; V1034-T1037 WeakPolarHBondContact CG1-OG1 3.1Å
1035	A	32.7	Very low	29.5	Very low	67 Å²	67	115.4 Å²	115.4	55%	0.554	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.1	-22.2	168.1	0	0	0	0	0	111.8	T1033 T1037	T1033-A1035 PolarHBondContact O-N 3.29Å; A1035-T1037 PolarHBondContact O-N 2.99Å
1036	D	31.4	Very low	29.6	Very low	144 Å²	144	113.8 Å²	113.8	77%	0.77	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	34	179.3	-65	-24.4	0	0	0	114.1	K966	K966-D1036 PolarHBondContact NZ-O 3.27Å
1037	T	31.2	Very low	29.7	Very low	32 Å²	32	109.9 Å²	109.9	20%	0.196	65%	0.654	C	S	.	*	T	Hydrogen-bonded Turn	trans	-132	8.1	-175.6	39.4	0	0	0	0	115.9	T962 V1034 A1035	T962-T1037 HydrophobicContact CG2-CG2 3.95Å; V1034-T1037 WeakPolarHBondContact CG1-OG1 3.1Å; A1035-T1037 PolarHBondContact O-N 2.99Å
1038	M	29.8	Very low	29.9	Very low	176 Å²	176	109.1 Å²	109.1	87%	0.867	65%	0.645	S	S	*	*	S	Bend	trans	-93.3	-0.4	170.8	-75.8	-155.1	80.4	0	0	114.9
1039	E	30.9	Very low	29.9	Very low	188 Å²	188	108.5 Å²	108.5	88%	0.879	64%	0.64	S	S	*	*	S	Bend	trans	-102.8	6.4	179.6	-126.7	178	-175.2	0	0	114.7
1040	Y	29.8	Very low	30	Very low	176 Å²	176	108.4 Å²	108.4	69%	0.69	62%	0.62	S	S	*	*	S	Bend	trans	-134	18.9	-176.6	-108.3	-83.7	0	0	0	115.4
1041	L	28.9	Very low	29.9	Very low	56 Å²	56	109.9 Å²	109.9	29%	0.293	61%	0.612	S	S	.	*	S	Bend	trans	-118.6	16.6	178.1	-85.5	156.3	0	0	0	114.6	L958 K961	L958-L1041 HydrophobicContact CD1-CD1 3.51Å; L958-L1041 HydrophobicContact CD1-CD2 3.75Å; L958-L1041 HydrophobicContact CD1-CG 4.18Å; L958-L1041 HydrophobicContact CD2-CD1 4.25Å; L958-L1041 HydrophobicContact CG-CD1 3.85Å; K961-L1041 HydrophobicContact CD-CD2 4.45Å
1042	Y	25.9	Very low	30.1	Very low	157 Å²	157	111.1 Å²	111.1	62%	0.616	60%	0.597	S	S	*	*			trans	-107.4	42.8	151.5	-90.9	-84.1	0	0	0	110.8	K931 T933	K931-Y1042 WeakPolarHBondContact CE-O 3.25Å; K931-Y1042 PolarHBondContact NZ-O 3.2Å; T933-Y1042 HydrophobicContact CG2-CD1 4.22Å; T933-Y1042 HydrophobicContact CG2-CD2 4.16Å; T933-Y1042 HydrophobicContact CG2-CE2 4.45Å; T933-Y1042 HydrophobicContact CG2-CG 4.03Å
1043	A	28.5	Very low	30.2	Very low	111 Å²	111	112.7 Å²	112.7	92%	0.917	60%	0.6	S	S	*	*			trans	-119.5	0	161	0	0	0	0	0	109.8	K931	K931-A1043 VanDerWaalsContact NZ-CA 3.32Å; K931-A1043 PolarHBondContact NZ-OXT 2.95Å

Retrieved 1,043 of 1,043 residues in 931.5 ms (Link to these results)

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