A0A077Z250_TRITR Loading...

26S proteasome non-ATPase regulatory subunit 2

Binds to the intracellular domain of tumor necrosis factor type 1 receptor. The binding domain of TRAP1 and TRAP2 resides outside the death domain of TNFR1. Component of the 26S proteasome, a multiprotein complex involved in the ATP-dependent degradation of ubiquitinated proteins. This complex plays a key role in the maintenance of protein homeostasis by removing misfolded or damaged proteins, which could impair cellular functions, and by removing proteins whose functions are no longer required. Therefore, the proteasome participates in numerous cellular processes, including cell cycle progression, apoptosis, or DNA damage repair.

AlphaFold DB , UniProt , Accession A0A077Z250, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 857 aa.

						>A0A077Z250_TRITR|A0A077Z250
MLWFDSYFSVQSEEDRKLLMDLEVYVDSLQSEDQSLYVPALEGLRTIIRSSTTSVTSVPKPLKFMRPYYATMKEVHAKITNDAAKKLCADIISALAMTCSRRGDHDCLKYHLLGSREQVDSWGHEYVRHLSCEISTQWEEEMHSDMQDDTKLKTLKLLTREIVPYFLKHNGEAEACDFLMEMEDVELIEEFCDAEAYPRICLYLMSCVPYVPEPENSNLLWTVMRIYLKFGRHFEALRCALMLNDMDKVKDIFLNCDEIVVQKQMAFLLARHQVFIDIPDDLDIMEPKVPEDVYKTNVDMNVVNADSARANLASSFVNGFVNTGFCVDKLITEDANSWFYKNKDHAMISAAASQGLIYRWDVDNGLTNIDKFLYSNDDNIKAGSLLAVGVVSCGVHHECDPAQALLLDYVQSPKNILRICSTLGLGLAYANSKLASVEETIVPQLVNSLSNPKNNNEISGIIGLALGFILVSSANNSIATLLWQFLLDKEESELKDPNLRLLVLGIALIYLGRQDAADVIMESLKVLPKSFGSFASTLVEVSAYAGTGNVLKIQDLLFLCSTRTNKQEQKSTGEKDKKEKKKESESDRFDPSIMEQAVAVLGIALIALGEDIGASMSFRLLGHLIRYGEPHVRRAVPLALGLISVSNPQLNVLEMLTKFSHDQDVEIAYNAIFALGLIGAGTNNARLGTTLRQLALYHARDASCFMMVRIAQGLTHLGKGTMTLSPFHSERQLLNPSAMAGLFTTCFCFLDVYSTILSKQHYLLYSLVPAINPRMLITFVLNNDEEAQLIQHNVNVRVGQAVDVVGQAGKPKTITGFQTYSTPVLLGHGERAELATDDCKLTRNFGWSSATSVFIRF
					

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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	40.3	Very low	40.9	Very low	215 Å²	215	146.2 Å²	146.2	100%	1.059	71%	0.707	S	S	*	*				0	-53.4	0	-90.5	177.5	173.5	0	0	112.6	W3 F4	M1-W3 PolarHBondContact O-N 3.21Å; M1-F4 PolarHBondContact O-N 3.19Å
2	L	36.6	Very low	43	Very low	159 Å²	159	137.3 Å²	137.3	83%	0.832	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	-14.8	-178	-72.4	163.5	0	0	0	116.8
3	W	31.2	Very low	45	Very low	216 Å²	216	138.1 Å²	138.1	82%	0.818	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	-11.9	177.8	-102.6	69.7	0	0	0	114.3	M1 S6	M1-W3 PolarHBondContact O-N 3.21Å; W3-S6 PolarHBondContact O-OG 3.3Å
4	F	37.7	Very low	46.6	Very low	170 Å²	170	138.3 Å²	138.3	75%	0.746	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95	-26	-174	-113.4	-93.4	0	0	0	113.1	M1 S6	M1-F4 PolarHBondContact O-N 3.19Å; F4-S6 VanDerWaalsContact C-N 3.34Å
5	D	37.2	Very low	48	Very low	118 Å²	118	130.3 Å²	130.3	63%	0.631	63%	0.634	S	S	*	*	G	3₁₀ helix	trans	-75.8	-21.1	179	-73.7	-24.7	0	0	0	113.1	Y7	D5-Y7 VanDerWaalsContact C-N 3.35Å; D5-Y7 PolarHBondContact O-N 2.8Å
6	S	35.9	Very low	49.3	Very low	89 Å²	89	131.1 Å²	131.1	62%	0.622	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-80.7	-7	-177.6	38.6	0	0	0	0	115.1	W3 F4	W3-S6 PolarHBondContact O-OG 3.3Å; F4-S6 VanDerWaalsContact C-N 3.34Å
7	Y	40.7	Very low	50.7	Low	192 Å²	192	130.5 Å²	130.5	75%	0.753	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-95.6	5.4	177.8	-100.1	-87.1	0	0	0	114.1	D5 S9	D5-Y7 VanDerWaalsContact C-N 3.35Å; D5-Y7 PolarHBondContact O-N 2.8Å; Y7-S9 PolarHBondContact O-N 3.17Å
8	F	44.4	Very low	51.7	Low	137 Å²	137	126.6 Å²	126.6	60%	0.601	61%	0.605	S	S	*	*			trans	-76.9	31.6	179.9	-104	-82.2	0	0	0	114.7	V10	F8-V10 PolarHBondContact O-N 3.04Å
9	S	41.6	Very low	52.9	Low	64 Å²	64	122.5 Å²	122.5	45%	0.448	59%	0.587	S	S	.	*			trans	-79.3	103.5	171.7	62.7	0	0	0	0	109.9	Y7 Q11	Y7-S9 PolarHBondContact O-N 3.17Å; S9-Q11 VanDerWaalsContact C-N 3.3Å; S9-Q11 PolarHBondContact O-N 3.11Å; S9-Q11 WeakPolarHBondContact OG-CG 3.37Å; S9-Q11 PolarHBondContact OG-NE2 3.21Å
10	V	51.2	Low	54	Low	80 Å²	80	120.6 Å²	120.6	49%	0.485	58%	0.578	S	S	.	*			trans	-54.6	92.2	161.6	-180	0	0	0	0	107.7	F8 R16	F8-V10 PolarHBondContact O-N 3.04Å; V10-R16 HydrophobicContact CG1-CB 4.11Å
11	Q	53.5	Low	55.1	Low	168 Å²	168	118.8 Å²	118.8	79%	0.785	57%	0.571	S	S	*	*			trans	-99	-15.3	-171.3	-84	-175.2	8.3	0	0	114.3	S9	S9-Q11 VanDerWaalsContact C-N 3.3Å; S9-Q11 PolarHBondContact O-N 3.11Å; S9-Q11 WeakPolarHBondContact OG-CG 3.37Å; S9-Q11 PolarHBondContact OG-NE2 3.21Å
12	S	65.9	Low	56.8	Low	40 Å²	40	108.7 Å²	108.7	28%	0.28	52%	0.522	S	S	.	.			trans	-119.8	144.6	178.2	96.8	0	0	0	0	112.2	E14 D15 R16	S12-E14 PolarHBondContact O-N 3.27Å; S12-E14 WeakPolarHBondContact OG-CB 3.31Å; S12-E14 PolarHBondContact OG-N 3.24Å; S12-D15 PolarHBondContact O-N 3.18Å; S12-D15 PolarHBondContact OG-N 3.02Å; S12-R16 PolarHBondContact O-N 3.49Å
13	E	68.3	Low	58.7	Low	147 Å²	147	104.4 Å²	104.4	69%	0.687	50%	0.497	S	S	*	.	H	α-helix	trans	-58.3	-27.8	171.4	-83.9	-170.2	152.5	0	0	112.1	R16 K17	E13-R16 PolarHBondContact O-N 2.9Å; E13-K17 WeakPolarHBondContact O-CB 3.15Å; E13-K17 VanDerWaalsContact O-CG 3.3Å; E13-K17 WeakPolarHBondContact O-CG 3.43Å; E13-K17 PolarHBondContact O-N 3.31Å
14	E	67.9	Low	61.1	Low	141 Å²	141	98.2 Å²	98.2	66%	0.659	48%	0.483	S	S	*	.	H	α-helix	trans	-68.9	-42.9	176.6	-57.8	175.2	165.5	0	0	111	S12 R16 K17 L18	S12-E14 PolarHBondContact O-N 3.27Å; S12-E14 WeakPolarHBondContact OG-CB 3.31Å; S12-E14 PolarHBondContact OG-N 3.24Å; E14-R16 VanDerWaalsContact C-N 3.27Å; E14-R16 PolarHBondContact O-N 3.11Å; E14-K17 PolarHBondContact O-N 3.34Å; E14-L18 WeakPolarHBondContact O-CB 3.32Å; E14-L18 VanDerWaalsContact O-CG 3.3Å; E14-L18 WeakPolarHBondContact O-CG 3.35Å; E14-L18 PolarHBondContact O-N 3.08Å
15	D	67.4	Low	62.9	Low	19 Å²	19	93.3 Å²	93.3	10%	0.102	46%	0.46	C	S	.	.	H	α-helix	trans	-63.8	-35.1	175.8	-73.1	-17.9	0	0	0	110.7	S12 L19 K60	S12-D15 PolarHBondContact O-N 3.18Å; S12-D15 PolarHBondContact OG-N 3.02Å; D15-L19 WeakPolarHBondContact O-CB 3.43Å; D15-L19 PolarHBondContact O-N 2.71Å; D15-L19 VanDerWaalsContact O-N 3.08Å; D15-K60 IonicContact OD1-NZ 2.93Å; D15-K60 PolarHBondContact OD1-NZ 3.13Å; D15-K60 VanDerWaalsContact OD1-NZ 3.11Å; D15-K60 IonicContact OD2-NZ 3.72Å; D15-K60 PolarHBondContact OD2-NZ 2.7Å
16	R	68.3	Low	64.6	Low	142 Å²	142	87.8 Å²	87.8	54%	0.536	43%	0.431	S	S	.	.	H	α-helix	trans	-71.3	-40	174.8	-159.9	-176.7	81.6	165.9	2.9	112.5	V10 S12 E13 E14 L19 M20	V10-R16 HydrophobicContact CG1-CB 4.11Å; S12-R16 PolarHBondContact O-N 3.49Å; E13-R16 PolarHBondContact O-N 2.9Å; E14-R16 VanDerWaalsContact C-N 3.27Å; E14-R16 PolarHBondContact O-N 3.11Å; R16-L19 PolarHBondContact O-N 3.21Å; R16-M20 HydrophobicContact CG-CE 4.4Å; R16-M20 VanDerWaalsContact O-CG 3.31Å; R16-M20 WeakPolarHBondContact O-CG 3.39Å; R16-M20 PolarHBondContact O-N 3.39Å
17	K	73.9	Confident	66.6	Low	122 Å²	122	87.8 Å²	87.8	53%	0.53	42%	0.424	S	S	.	.	H	α-helix	trans	-63.5	-45.2	174.7	-77.6	173.2	-178.4	172.4	0	111.2	E13 E14 L19 M20 D21	E13-K17 WeakPolarHBondContact O-CB 3.15Å; E13-K17 VanDerWaalsContact O-CG 3.3Å; E13-K17 WeakPolarHBondContact O-CG 3.43Å; E13-K17 PolarHBondContact O-N 3.31Å; E14-K17 PolarHBondContact O-N 3.34Å; K17-L19 VanDerWaalsContact C-N 3.29Å; K17-L19 PolarHBondContact O-N 3.49Å; K17-M20 WeakPolarHBondContact O-CB 3.31Å; K17-M20 PolarHBondContact O-N 3.19Å; K17-D21 WeakPolarHBondContact O-CB 3.5Å; K17-D21 VanDerWaalsContact O-CG 3.22Å; K17-D21 PolarHBondContact O-N 3.21Å
18	L	69.4	Low	68	Low	60 Å²	60	80.3 Å²	80.3	31%	0.314	40%	0.4	S	S	.	.	H	α-helix	trans	-58.8	-41.7	175.1	-75.7	163.4	0	0	0	111.8	E14 D21 L22	E14-L18 WeakPolarHBondContact O-CB 3.32Å; E14-L18 VanDerWaalsContact O-CG 3.3Å; E14-L18 WeakPolarHBondContact O-CG 3.35Å; E14-L18 PolarHBondContact O-N 3.08Å; L18-D21 PolarHBondContact O-N 3.43Å; L18-L22 WeakPolarHBondContact O-CB 3.27Å; L18-L22 WeakPolarHBondContact O-CG 3.46Å; L18-L22 PolarHBondContact O-N 3.2Å
19	L	72.9	Confident	69	Low	49 Å²	49	73.8 Å²	73.8	26%	0.257	37%	0.371	S	S	.	.	H	α-helix	trans	-66.1	-42	176.4	-170.1	146	0	0	0	111.9	D15 R16 K17 L22 E23 F64	D15-L19 WeakPolarHBondContact O-CB 3.43Å; D15-L19 PolarHBondContact O-N 2.71Å; D15-L19 VanDerWaalsContact O-N 3.08Å; R16-L19 PolarHBondContact O-N 3.21Å; K17-L19 VanDerWaalsContact C-N 3.29Å; K17-L19 PolarHBondContact O-N 3.49Å; L19-L22 PolarHBondContact O-N 2.88Å; L19-E23 HydrophobicContact CD2-CG 4.33Å; L19-E23 WeakPolarHBondContact CD2-OE1 3.49Å; L19-E23 WeakPolarHBondContact O-CB 3.44Å; L19-E23 WeakPolarHBondContact O-CG 3.4Å; L19-E23 PolarHBondContact O-N 3.22Å; L19-F64 HydrophobicContact CD1-CD1 4.07Å; L19-F64 HydrophobicContact CD1-CE1 4.42Å; L19-F64 HydrophobicContact CD1-CG 4.45Å
20	M	76.6	Confident	70.4	Confident	84 Å²	84	76.1 Å²	76.1	41%	0.414	38%	0.375	S	S	.	.	H	α-helix	trans	-62.9	-43.8	174.1	-74.1	174.1	165.2	0	0	112.3	R16 K17 E23 V24	R16-M20 HydrophobicContact CG-CE 4.4Å; R16-M20 VanDerWaalsContact O-CG 3.31Å; R16-M20 WeakPolarHBondContact O-CG 3.39Å; R16-M20 PolarHBondContact O-N 3.39Å; K17-M20 WeakPolarHBondContact O-CB 3.31Å; K17-M20 PolarHBondContact O-N 3.19Å; M20-E23 PolarHBondContact O-N 3.43Å; M20-V24 VanDerWaalsContact O-CG2 3.27Å; M20-V24 WeakPolarHBondContact O-CG2 3.45Å; M20-V24 PolarHBondContact O-N 3.31Å
21	D	77.1	Confident	71.2	Confident	82 Å²	82	75 Å²	75	44%	0.439	37%	0.371	S	S	.	.	H	α-helix	trans	-63.7	-43.3	178.8	-67.6	-21.5	0	0	0	110.5	K17 L18 V24 Y25	K17-D21 WeakPolarHBondContact O-CB 3.5Å; K17-D21 VanDerWaalsContact O-CG 3.22Å; K17-D21 PolarHBondContact O-N 3.21Å; L18-D21 PolarHBondContact O-N 3.43Å; D21-V24 PolarHBondContact O-N 2.81Å; D21-Y25 HydrophobicContact CB-CE2 4.48Å; D21-Y25 WeakPolarHBondContact O-CD2 3.48Å; D21-Y25 PolarHBondContact O-N 3.09Å; D21-Y25 VanDerWaalsContact O-N 3.13Å
22	L	74.3	Confident	71.5	Confident	3 Å²	3	75.9 Å²	75.9	2%	0.016	38%	0.375	C	S	.	.	H	α-helix	trans	-63.5	-42	175	-70.4	171.7	0	0	0	112.3	L18 L19 Y25 V26 L44 I47 F64 M65	L18-L22 WeakPolarHBondContact O-CB 3.27Å; L18-L22 WeakPolarHBondContact O-CG 3.46Å; L18-L22 PolarHBondContact O-N 3.2Å; L19-L22 PolarHBondContact O-N 2.88Å; L22-Y25 PolarHBondContact O-N 2.93Å; L22-V26 WeakPolarHBondContact O-CG2 3.29Å; L22-V26 PolarHBondContact O-N 2.9Å; L22-L44 HydrophobicContact CD2-CD1 3.98Å; L22-I47 HydrophobicContact CD2-CG2 4.43Å; L22-F64 HydrophobicContact CD1-CB 4.32Å; L22-M65 HydrophobicContact CB-SD 4.25Å; L22-M65 HydrophobicContact CD1-CG 4.31Å; L22-M65 HydrophobicContact CD1-SD 4.22Å; L22-M65 HydrophobicContact CD2-SD 3.94Å; L22-M65 HydrophobicContact CG-SD 4.37Å
23	E	77.5	Confident	71.5	Confident	69 Å²	69	78.7 Å²	78.7	32%	0.322	39%	0.387	S	S	.	.	H	α-helix	trans	-59.7	-45.5	174.5	-82.7	175.1	177.5	0	0	111.8	L19 M20 Y25 V26 D27 Y68	L19-E23 HydrophobicContact CD2-CG 4.33Å; L19-E23 WeakPolarHBondContact CD2-OE1 3.49Å; L19-E23 WeakPolarHBondContact O-CB 3.44Å; L19-E23 WeakPolarHBondContact O-CG 3.4Å; L19-E23 PolarHBondContact O-N 3.22Å; M20-E23 PolarHBondContact O-N 3.43Å; E23-Y25 VanDerWaalsContact C-N 3.28Å; E23-Y25 PolarHBondContact O-N 3.15Å; E23-V26 PolarHBondContact O-N 3.18Å; E23-V26 VanDerWaalsContact O-N 3.12Å; E23-D27 WeakPolarHBondContact O-CB 3.32Å; E23-D27 PolarHBondContact O-N 3.47Å; E23-Y68 HydrophobicContact CG-CE2 4.49Å; E23-Y68 VanDerWaalsContact CG-OH 3.23Å; E23-Y68 WeakPolarHBondContact CG-OH 3.45Å; E23-Y68 PolarHBondContact OE1-OH 3.19Å
24	V	81	Confident	71.3	Confident	86 Å²	86	75.6 Å²	75.6	52%	0.521	37%	0.372	S	S	.	.	H	α-helix	trans	-59	-40.8	177	170.1	0	0	0	0	111.3	M20 D21 S28	M20-V24 VanDerWaalsContact O-CG2 3.27Å; M20-V24 WeakPolarHBondContact O-CG2 3.45Å; M20-V24 PolarHBondContact O-N 3.31Å; D21-V24 PolarHBondContact O-N 2.81Å; V24-S28 VanDerWaalsContact O-CB 3.32Å; V24-S28 WeakPolarHBondContact O-CB 3.17Å; V24-S28 PolarHBondContact O-N 2.69Å; V24-S28 PolarHBondContact O-OG 2.95Å
25	Y	75.4	Confident	71.2	Confident	67 Å²	67	73.4 Å²	73.4	26%	0.263	37%	0.372	S	S	.	.	H	α-helix	trans	-67.9	-40.2	176	-68.3	-56.5	0	0	0	112.4	D21 L22 E23 S28 L29 A40 I47	D21-Y25 HydrophobicContact CB-CE2 4.48Å; D21-Y25 WeakPolarHBondContact O-CD2 3.48Å; D21-Y25 PolarHBondContact O-N 3.09Å; D21-Y25 VanDerWaalsContact O-N 3.13Å; L22-Y25 PolarHBondContact O-N 2.93Å; E23-Y25 VanDerWaalsContact C-N 3.28Å; E23-Y25 PolarHBondContact O-N 3.15Å; Y25-S28 PolarHBondContact O-N 2.8Å; Y25-L29 VanDerWaalsContact O-CG 3.29Å; Y25-L29 WeakPolarHBondContact O-CG 3.33Å; Y25-L29 PolarHBondContact O-N 3.03Å; Y25-L29 VanDerWaalsContact O-N 3.16Å; Y25-A40 HydrophobicContact CD1-CB 4.05Å; Y25-I47 HydrophobicContact CD2-CD1 4.14Å; Y25-I47 HydrophobicContact CE2-CD1 3.53Å
26	V	73.5	Confident	71.3	Confident	2 Å²	2	76.4 Å²	76.4	1%	0.012	39%	0.388	C	S	.	.	H	α-helix	trans	-70	-38.8	178.4	175.7	0	0	0	0	112	L22 E23 S28 L29 Q30 M65 Y68 T71 M72	L22-V26 WeakPolarHBondContact O-CG2 3.29Å; L22-V26 PolarHBondContact O-N 2.9Å; E23-V26 PolarHBondContact O-N 3.18Å; E23-V26 VanDerWaalsContact O-N 3.12Å; V26-S28 VanDerWaalsContact C-N 3.33Å; V26-L29 WeakPolarHBondContact O-CA 3.35Å; V26-L29 WeakPolarHBondContact O-CB 3.43Å; V26-L29 PolarHBondContact O-N 3.16Å; V26-L29 VanDerWaalsContact O-N 3.09Å; V26-Q30 PolarHBondContact O-N 2.93Å; V26-M65 HydrophobicContact CG2-CE 4.25Å; V26-Y68 HydrophobicContact CB-CD1 4.29Å; V26-Y68 HydrophobicContact CG1-CD1 3.62Å; V26-Y68 HydrophobicContact CG1-CE1 4.12Å; V26-Y68 HydrophobicContact CG1-CG 4.14Å; V26-Y68 HydrophobicContact CG2-CD1 4.22Å; V26-Y68 HydrophobicContact CG2-CD2 4.27Å; V26-Y68 HydrophobicContact CG2-CG 3.94Å; V26-T71 HydrophobicContact CG1-CG2 4.35Å; V26-M72 HydrophobicContact CG2-CE 4.35Å
27	D	76.9	Confident	71.3	Confident	89 Å²	89	70.2 Å²	70.2	48%	0.476	37%	0.365	S	S	.	.	H	α-helix	trans	-67	-37.6	176.1	-73.9	-12.8	0	0	0	111.3	E23 L29 Q30 S31	E23-D27 WeakPolarHBondContact O-CB 3.32Å; E23-D27 PolarHBondContact O-N 3.47Å; D27-L29 PolarHBondContact O-N 3.03Å; D27-Q30 PolarHBondContact O-N 3.15Å; D27-Q30 VanDerWaalsContact O-N 3.15Å; D27-S31 PolarHBondContact O-N 3.33Å; D27-S31 PolarHBondContact O-OG 3.47Å; D27-S31 VanDerWaalsContact O-OG 3.11Å
28	S	71.5	Confident	71.3	Confident	35 Å²	35	66.3 Å²	66.3	25%	0.245	35%	0.351	C	S	.	.	H	α-helix	trans	-62.1	-29.2	171.8	-59.8	0	0	0	0	112	V24 Y25 V26	V24-S28 VanDerWaalsContact O-CB 3.32Å; V24-S28 WeakPolarHBondContact O-CB 3.17Å; V24-S28 PolarHBondContact O-N 2.69Å; V24-S28 PolarHBondContact O-OG 2.95Å; Y25-S28 PolarHBondContact O-N 2.8Å; V26-S28 VanDerWaalsContact C-N 3.33Å
29	L	65.7	Low	71.7	Confident	1 Å²	1	67 Å²	67	1%	0.005	36%	0.359	C	S	.	.	H	α-helix	trans	-79.8	-19.7	176.4	-72.9	172.9	0	0	0	113.8	Y25 V26 D27 Y37 L41 M72 V75	Y25-L29 VanDerWaalsContact O-CG 3.29Å; Y25-L29 WeakPolarHBondContact O-CG 3.33Å; Y25-L29 PolarHBondContact O-N 3.03Å; Y25-L29 VanDerWaalsContact O-N 3.16Å; V26-L29 WeakPolarHBondContact O-CA 3.35Å; V26-L29 WeakPolarHBondContact O-CB 3.43Å; V26-L29 PolarHBondContact O-N 3.16Å; V26-L29 VanDerWaalsContact O-N 3.09Å; D27-L29 PolarHBondContact O-N 3.03Å; L29-Y37 HydrophobicContact CD2-CD1 3.63Å; L29-Y37 HydrophobicContact CD2-CE1 4.35Å; L29-Y37 HydrophobicContact CD2-CG 4.3Å; L29-Y37 WeakPolarHBondContact O-CE1 3.26Å; L29-L41 HydrophobicContact CD1-CD2 4.04Å; L29-L41 HydrophobicContact CD2-CD1 4.44Å; L29-L41 HydrophobicContact CD2-CD2 3.9Å; L29-L41 HydrophobicContact CD2-CG 3.94Å; L29-M72 HydrophobicContact CD1-CE 3.47Å; L29-M72 VanDerWaalsContact CD1-CE 3.47Å; L29-M72 HydrophobicContact CD1-SD 3.62Å; L29-V75 HydrophobicContact CB-CG1 4.12Å; L29-V75 HydrophobicContact CB-CG2 4.24Å; L29-V75 HydrophobicContact CD2-CG1 4.29Å; L29-V75 WeakPolarHBondContact O-CG2 3.41Å
30	Q	69.7	Low	71.9	Confident	112 Å²	112	65 Å²	65	52%	0.523	35%	0.349	S	S	.	.	H	α-helix	trans	-86.2	-21.5	174.6	-67.8	-177.1	13.9	0	0	113.3	V26 D27 T71	V26-Q30 PolarHBondContact O-N 2.93Å; D27-Q30 PolarHBondContact O-N 3.15Å; D27-Q30 VanDerWaalsContact O-N 3.15Å; Q30-T71 HydrophobicContact CG-CG2 4.02Å
31	S	69.6	Low	71.8	Confident	57 Å²	57	61 Å²	61	40%	0.399	33%	0.33	S	S	.	.	S	Bend	trans	-68.8	146.9	179.4	-61	0	0	0	0	111.3	D27 D33 Y37	D27-S31 PolarHBondContact O-N 3.33Å; D27-S31 PolarHBondContact O-OG 3.47Å; D27-S31 VanDerWaalsContact O-OG 3.11Å; S31-D33 PolarHBondContact O-N 3.48Å; S31-Y37 WeakPolarHBondContact O-CE1 3.44Å; S31-Y37 PolarHBondContact O-OH 3.49Å
32	E	59.8	Low	71.9	Confident	187 Å²	187	62 Å²	62	87%	0.874	33%	0.332	S	S	*	.	S	Bend	trans	-68.8	-12.9	-172.3	-64.1	-176.5	165.6	0	0	114.5	Q34	E32-Q34 PolarHBondContact O-N 2.85Å
33	D	65.6	Low	72.1	Confident	99 Å²	99	62.5 Å²	62.5	53%	0.529	34%	0.338	S	S	.	.			trans	-78.9	101.8	-173.2	-75.9	-30.3	0	0	0	113.2	S31 S35 L36	S31-D33 PolarHBondContact O-N 3.48Å; D33-S35 PolarHBondContact O-N 2.96Å; D33-L36 HydrophobicContact CB-CD1 3.98Å; D33-L36 HydrophobicContact CB-CG 4.29Å; D33-L36 PolarHBondContact O-N 3.42Å; D33-L36 VanDerWaalsContact O-N 3.11Å
34	Q	62.8	Low	72.2	Confident	82 Å²	82	59.2 Å²	59.2	38%	0.383	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-15.7	179.7	-67.2	-172.6	-6.6	0	0	115.2	E32 Y37 T80	E32-Q34 PolarHBondContact O-N 2.85Å; Q34-Y37 HydrophobicContact CB-CD2 4.29Å; Q34-Y37 HydrophobicContact CB-CE2 4.39Å; Q34-Y37 HydrophobicContact CG-CD2 4.33Å; Q34-Y37 HydrophobicContact CG-CE2 3.99Å; Q34-T80 PolarHBondContact NE2-OG1 2.63Å; Q34-T80 PolarHBondContact OE1-OG1 3.22Å
35	S	66	Low	71.9	Confident	94 Å²	94	57.3 Å²	57.3	66%	0.657	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-25.6	176.7	53	0	0	0	0	113.5	D33 P39	D33-S35 PolarHBondContact O-N 2.96Å; S35-P39 WeakPolarHBondContact O-CD 3.41Å
36	L	69.2	Low	72.1	Confident	82 Å²	82	57.6 Å²	57.6	43%	0.429	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-15.7	-176.8	-66.8	172.2	0	0	0	112.9	D33 V38 P39 A40	D33-L36 HydrophobicContact CB-CD1 3.98Å; D33-L36 HydrophobicContact CB-CG 4.29Å; D33-L36 PolarHBondContact O-N 3.42Å; D33-L36 VanDerWaalsContact O-N 3.11Å; L36-V38 PolarHBondContact O-N 3.35Å; L36-P39 WeakPolarHBondContact O-CD 3.24Å; L36-A40 VanDerWaalsContact O-CB 3.3Å; L36-A40 WeakPolarHBondContact O-CB 3.36Å; L36-A40 PolarHBondContact O-N 2.9Å
37	Y	69.9	Low	72.2	Confident	13 Å²	13	58.9 Å²	58.9	5%	0.051	32%	0.321	C	S	.	.	H	α-helix	trans	-63.4	-42.9	-179.5	-64.8	-31.7	0	0	0	112.9	L29 S31 Q34 A40 L41 I79	L29-Y37 HydrophobicContact CD2-CD1 3.63Å; L29-Y37 HydrophobicContact CD2-CE1 4.35Å; L29-Y37 HydrophobicContact CD2-CG 4.3Å; L29-Y37 WeakPolarHBondContact O-CE1 3.26Å; S31-Y37 WeakPolarHBondContact O-CE1 3.44Å; S31-Y37 PolarHBondContact O-OH 3.49Å; Q34-Y37 HydrophobicContact CB-CD2 4.29Å; Q34-Y37 HydrophobicContact CB-CE2 4.39Å; Q34-Y37 HydrophobicContact CG-CD2 4.33Å; Q34-Y37 HydrophobicContact CG-CE2 3.99Å; Y37-A40 PolarHBondContact O-N 3.22Å; Y37-L41 WeakPolarHBondContact O-CB 3.28Å; Y37-L41 VanDerWaalsContact O-CD1 3.28Å; Y37-L41 WeakPolarHBondContact O-CD1 3.28Å; Y37-L41 WeakPolarHBondContact O-CG 3.47Å; Y37-L41 PolarHBondContact O-N 3.41Å; Y37-I79 HydrophobicContact CD2-CD1 4.34Å; Y37-I79 HydrophobicContact CD2-CG1 3.93Å; Y37-I79 HydrophobicContact CE2-CG1 3.87Å
38	V	72.4	Confident	72.1	Confident	39 Å²	39	54.8 Å²	54.8	24%	0.236	30%	0.299	C	S	.	.	H	α-helix	trans	-64.6	-50.7	-176.1	-179.4	0	0	0	0	112	L36 A40 L41 E42 A84 L87	L36-V38 PolarHBondContact O-N 3.35Å; V38-A40 VanDerWaalsContact C-N 3.34Å; V38-A40 PolarHBondContact O-N 3.05Å; V38-L41 PolarHBondContact O-N 2.88Å; V38-E42 WeakPolarHBondContact O-CG 3.34Å; V38-E42 PolarHBondContact O-N 3.05Å; V38-A84 HydrophobicContact CG2-CB 4.1Å; V38-L87 HydrophobicContact CG1-CD1 4.34Å
39	P	78.2	Confident	72.1	Confident	76 Å²	76	58.2 Å²	58.2	49%	0.494	31%	0.307	S	S	.	.	H	α-helix	trans	-63.9	-35.9	176.9	-22.9	34.4	0	0	0	113.8	S35 L36 G43	S35-P39 WeakPolarHBondContact O-CD 3.41Å; L36-P39 WeakPolarHBondContact O-CD 3.24Å; P39-G43 PolarHBondContact O-N 3.38Å
40	A	76.8	Confident	72.4	Confident	6 Å²	6	61.8 Å²	61.8	5%	0.05	33%	0.332	C	S	.	.	H	α-helix	trans	-66.7	-41.1	178.4	0	0	0	0	0	111.7	Y25 L36 Y37 V38 G43 L44	Y25-A40 HydrophobicContact CD1-CB 4.05Å; L36-A40 VanDerWaalsContact O-CB 3.3Å; L36-A40 WeakPolarHBondContact O-CB 3.36Å; L36-A40 PolarHBondContact O-N 2.9Å; Y37-A40 PolarHBondContact O-N 3.22Å; V38-A40 VanDerWaalsContact C-N 3.34Å; V38-A40 PolarHBondContact O-N 3.05Å; A40-G43 PolarHBondContact O-N 3.27Å; A40-L44 WeakPolarHBondContact O-CB 3.36Å; A40-L44 PolarHBondContact O-N 3.09Å
41	L	75.6	Confident	72.3	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-69	-39.9	176.2	-66.9	164.5	0	0	0	112	L29 Y37 V38 G43 L44 R45 A84 L87 C88 I91	L29-L41 HydrophobicContact CD1-CD2 4.04Å; L29-L41 HydrophobicContact CD2-CD1 4.44Å; L29-L41 HydrophobicContact CD2-CD2 3.9Å; L29-L41 HydrophobicContact CD2-CG 3.94Å; Y37-L41 WeakPolarHBondContact O-CB 3.28Å; Y37-L41 VanDerWaalsContact O-CD1 3.28Å; Y37-L41 WeakPolarHBondContact O-CD1 3.28Å; Y37-L41 WeakPolarHBondContact O-CG 3.47Å; Y37-L41 PolarHBondContact O-N 3.41Å; V38-L41 PolarHBondContact O-N 2.88Å; L41-G43 VanDerWaalsContact C-N 3.35Å; L41-L44 PolarHBondContact O-N 3.45Å; L41-R45 VanDerWaalsContact O-CB 3.27Å; L41-R45 WeakPolarHBondContact O-CB 3.29Å; L41-R45 PolarHBondContact O-N 2.95Å; L41-A84 HydrophobicContact CD1-CB 4.2Å; L41-A84 WeakPolarHBondContact CD1-O 3.31Å; L41-L87 HydrophobicContact CB-CB 4.34Å; L41-L87 HydrophobicContact CD1-CB 4.19Å; L41-C88 HydrophobicContact CD1-CB 4.44Å; L41-C88 WeakPolarHBondContact CD1-SG 3.44Å; L41-C88 HydrophobicContact CD2-CB 4.4Å; L41-C88 WeakPolarHBondContact CD2-SG 3.37Å; L41-I91 HydrophobicContact CB-CD1 3.99Å; L41-I91 HydrophobicContact CD2-CD1 3.62Å; L41-I91 HydrophobicContact CG-CD1 4.43Å; L41-I91 WeakPolarHBondContact O-CD1 3.27Å
42	E	78.4	Confident	72	Confident	101 Å²	101	56.2 Å²	56.2	47%	0.472	30%	0.304	S	S	.	.	H	α-helix	trans	-64.4	-39	174.8	-75.3	-180	173.5	0	0	112.5	V38 T46	V38-E42 WeakPolarHBondContact O-CG 3.34Å; V38-E42 PolarHBondContact O-N 3.05Å; E42-T46 WeakPolarHBondContact O-CB 3.1Å; E42-T46 PolarHBondContact O-N 3.21Å; E42-T46 PolarHBondContact O-OG1 2.7Å
43	G	79.8	Confident	72.2	Confident	14 Å²	14	52.1 Å²	52.1	14%	0.144	29%	0.293	C	S	.	.	H	α-helix	trans	-60.8	-49.8	172.8	0	0	0	0	0	111.8	P39 A40 L41 R45 T46 I47	P39-G43 PolarHBondContact O-N 3.38Å; A40-G43 PolarHBondContact O-N 3.27Å; L41-G43 VanDerWaalsContact C-N 3.35Å; G43-R45 PolarHBondContact O-N 3.26Å; G43-T46 PolarHBondContact O-N 3.32Å; G43-I47 WeakPolarHBondContact O-CG1 3.26Å; G43-I47 PolarHBondContact O-N 3.04Å; G43-I47 VanDerWaalsContact O-N 3.13Å
44	L	77.9	Confident	71.8	Confident	0 Å²	0	52 Å²	52	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-62.5	-43.1	178.7	-163.9	116.9	0	0	0	112.2	L22 A40 L41 T46 I47 I48 M65 M72 I91	L22-L44 HydrophobicContact CD2-CD1 3.98Å; A40-L44 WeakPolarHBondContact O-CB 3.36Å; A40-L44 PolarHBondContact O-N 3.09Å; L41-L44 PolarHBondContact O-N 3.45Å; L44-T46 VanDerWaalsContact C-N 3.31Å; L44-T46 PolarHBondContact O-N 2.98Å; L44-I47 PolarHBondContact O-N 3.47Å; L44-I48 HydrophobicContact CD2-CD1 3.65Å; L44-I48 HydrophobicContact CG-CD1 4.18Å; L44-I48 WeakPolarHBondContact O-CG1 3.43Å; L44-I48 PolarHBondContact O-N 2.63Å; L44-M65 HydrophobicContact CD1-CE 3.88Å; L44-M65 HydrophobicContact CD1-SD 4.41Å; L44-M65 HydrophobicContact CD2-CE 4.38Å; L44-M72 HydrophobicContact CD1-CE 4.23Å; L44-M72 HydrophobicContact CD2-CE 4.06Å; L44-I91 HydrophobicContact CB-CD1 4.33Å; L44-I91 HydrophobicContact CD2-CB 4.22Å; L44-I91 HydrophobicContact CD2-CD1 3.72Å; L44-I91 HydrophobicContact CD2-CG1 3.97Å; L44-I91 HydrophobicContact CD2-CG2 3.23Å
45	R	75.5	Confident	71.4	Confident	46 Å²	46	51.3 Å²	51.3	17%	0.174	30%	0.301	C	S	.	.	H	α-helix	trans	-57.4	-43.5	174	175.3	179.9	169.5	-167.6	-2.3	111.8	L41 G43 I47 I48 R49 I91 E117 W122	L41-R45 VanDerWaalsContact O-CB 3.27Å; L41-R45 WeakPolarHBondContact O-CB 3.29Å; L41-R45 PolarHBondContact O-N 2.95Å; G43-R45 PolarHBondContact O-N 3.26Å; R45-I47 VanDerWaalsContact C-N 3.35Å; R45-I47 PolarHBondContact O-N 3.39Å; R45-I48 PolarHBondContact O-N 3.45Å; R45-R49 VanDerWaalsContact O-CB 3.3Å; R45-R49 WeakPolarHBondContact O-CB 3.3Å; R45-R49 PolarHBondContact O-N 2.88Å; R45-I91 HydrophobicContact CB-CD1 4.42Å; R45-E117 VanDerWaalsContact CZ-CD 3.47Å; R45-E117 IonicContact CZ-OE1 2.76Å; R45-E117 IonicContact CZ-OE2 2.77Å; R45-E117 IonicContact NE-OE2 3.59Å; R45-E117 IonicContact NH1-OE1 3.69Å; R45-E117 PolarHBondContact NH1-OE1 3.48Å; R45-E117 IonicContact NH1-OE2 3.8Å; R45-E117 PolarHBondContact NH1-OE2 2.97Å; R45-E117 IonicContact NH2-OE1 3.67Å; R45-E117 PolarHBondContact NH2-OE1 2.68Å; R45-E117 IonicContact NH2-OE2 2.72Å; R45-E117 PolarHBondContact NH2-OE2 3.26Å; R45-W122 HydrophobicContact CB-CH2 4.34Å; R45-W122 HydrophobicContact CG-CH2 3.87Å; R45-W122 HydrophobicContact CG-CZ2 4.05Å
46	T	78.7	Confident	70.9	Confident	74 Å²	74	53.4 Å²	53.4	45%	0.454	31%	0.309	S	S	.	.	H	α-helix	trans	-65	-39.8	-179.3	-57.9	0	0	0	0	111.7	E42 G43 L44 S50	E42-T46 WeakPolarHBondContact O-CB 3.1Å; E42-T46 PolarHBondContact O-N 3.21Å; E42-T46 PolarHBondContact O-OG1 2.7Å; G43-T46 PolarHBondContact O-N 3.32Å; L44-T46 VanDerWaalsContact C-N 3.31Å; L44-T46 PolarHBondContact O-N 2.98Å; T46-S50 WeakPolarHBondContact O-CB 3.45Å; T46-S50 PolarHBondContact O-N 3.18Å; T46-S50 PolarHBondContact O-OG 3.24Å
47	I	77.1	Confident	70.5	Confident	28 Å²	28	53 Å²	53	14%	0.144	31%	0.314	C	S	.	.	H	α-helix	trans	-68	-41.6	177.8	-66.8	168.3	0	0	0	111.6	L22 Y25 G43 L44 R45 S50 S51	L22-I47 HydrophobicContact CD2-CG2 4.43Å; Y25-I47 HydrophobicContact CD2-CD1 4.14Å; Y25-I47 HydrophobicContact CE2-CD1 3.53Å; G43-I47 WeakPolarHBondContact O-CG1 3.26Å; G43-I47 PolarHBondContact O-N 3.04Å; G43-I47 VanDerWaalsContact O-N 3.13Å; L44-I47 PolarHBondContact O-N 3.47Å; R45-I47 VanDerWaalsContact C-N 3.35Å; R45-I47 PolarHBondContact O-N 3.39Å; I47-S50 PolarHBondContact O-OG 3.23Å; I47-S51 WeakPolarHBondContact O-CB 3.44Å; I47-S51 PolarHBondContact O-N 3.4Å; I47-S51 PolarHBondContact O-OG 3.45Å
48	I	73.9	Confident	69.9	Low	4 Å²	4	56 Å²	56	2%	0.021	33%	0.333	C	S	.	.	H	α-helix	trans	-67	-47	178.1	-62.5	167.4	0	0	0	109.7	L44 R45 S50 S51 T52 I91 W122	L44-I48 HydrophobicContact CD2-CD1 3.65Å; L44-I48 HydrophobicContact CG-CD1 4.18Å; L44-I48 WeakPolarHBondContact O-CG1 3.43Å; L44-I48 PolarHBondContact O-N 2.63Å; R45-I48 PolarHBondContact O-N 3.45Å; I48-S50 PolarHBondContact O-N 3.29Å; I48-S51 PolarHBondContact O-N 3.12Å; I48-S51 VanDerWaalsContact O-N 3.09Å; I48-T52 HydrophobicContact CG2-CG2 4.1Å; I48-T52 WeakPolarHBondContact O-CG2 3.24Å; I48-T52 PolarHBondContact O-N 3.33Å; I48-T52 PolarHBondContact O-OG1 2.94Å; I48-I91 HydrophobicContact CD1-CG2 4.43Å; I48-W122 HydrophobicContact CB-CZ3 3.88Å; I48-W122 HydrophobicContact CD1-CZ3 4.5Å; I48-W122 HydrophobicContact CG2-CE3 3.99Å; I48-W122 HydrophobicContact CG2-CZ3 3.55Å
49	R	71.6	Confident	69.4	Low	106 Å²	106	55.1 Å²	55.1	40%	0.4	33%	0.328	S	S	.	.	H	α-helix	trans	-62.3	-41.2	179.7	-173.7	177.1	69.4	-177.1	-0.4	113.3	R45 S51 T52 T53 S121	R45-R49 VanDerWaalsContact O-CB 3.3Å; R45-R49 WeakPolarHBondContact O-CB 3.3Å; R45-R49 PolarHBondContact O-N 2.88Å; R49-S51 PolarHBondContact O-N 2.87Å; R49-T52 PolarHBondContact O-N 3.37Å; R49-T52 PolarHBondContact O-OG1 3.41Å; R49-T53 WeakPolarHBondContact O-CG2 3.38Å; R49-S121 WeakPolarHBondContact CG-O 3.43Å
50	S	72.9	Confident	68.9	Low	76 Å²	76	56.6 Å²	56.6	53%	0.531	33%	0.327	S	S	.	.	H	α-helix	trans	-63.9	-27	177.5	65.3	0	0	0	0	112.1	T46 I47 I48	T46-S50 WeakPolarHBondContact O-CB 3.45Å; T46-S50 PolarHBondContact O-N 3.18Å; T46-S50 PolarHBondContact O-OG 3.24Å; I47-S50 PolarHBondContact O-OG 3.23Å; I48-S50 PolarHBondContact O-N 3.29Å
51	S	67.2	Low	68.3	Low	30 Å²	30	57 Å²	57	21%	0.21	33%	0.329	C	S	.	.	H	α-helix	trans	-90.1	-24.9	-177.4	-55.7	0	0	0	0	114	I47 I48 R49	I47-S51 WeakPolarHBondContact O-CB 3.44Å; I47-S51 PolarHBondContact O-N 3.4Å; I47-S51 PolarHBondContact O-OG 3.45Å; I48-S51 PolarHBondContact O-N 3.12Å; I48-S51 VanDerWaalsContact O-N 3.09Å; R49-S51 PolarHBondContact O-N 2.87Å
52	T	63.8	Low	67.8	Low	22 Å²	22	57.3 Å²	57.3	14%	0.135	33%	0.331	C	S	.	.	H	α-helix	trans	-86.9	-22.9	-176	51.4	0	0	0	0	114.6	I48 R49 S54 P59 W122	I48-T52 HydrophobicContact CG2-CG2 4.1Å; I48-T52 WeakPolarHBondContact O-CG2 3.24Å; I48-T52 PolarHBondContact O-N 3.33Å; I48-T52 PolarHBondContact O-OG1 2.94Å; R49-T52 PolarHBondContact O-N 3.37Å; R49-T52 PolarHBondContact O-OG1 3.41Å; T52-S54 VanDerWaalsContact C-N 3.26Å; T52-S54 PolarHBondContact O-N 2.91Å; T52-S54 VanDerWaalsContact O-N 3.14Å; T52-P59 HydrophobicContact CG2-CG 4.32Å; T52-W122 WeakPolarHBondContact CB-O 3.06Å; T52-W122 PolarHBondContact OG1-O 3.35Å
53	T	62.6	Low	67.3	Low	102 Å²	102	57.5 Å²	57.5	63%	0.626	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-11	-170.5	46.5	0	0	0	0	116.2	R49	R49-T53 WeakPolarHBondContact O-CG2 3.38Å
54	S	58	Low	66.7	Low	96 Å²	96	58.3 Å²	58.3	67%	0.671	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.6	-2.6	-165.1	44.4	0	0	0	0	116.5	T52	T52-S54 VanDerWaalsContact C-N 3.26Å; T52-S54 PolarHBondContact O-N 2.91Å; T52-S54 VanDerWaalsContact O-N 3.14Å
55	V	54.5	Low	66.2	Low	68 Å²	68	58.4 Å²	58.4	41%	0.412	33%	0.33	S	S	.	.			trans	-133.7	120.4	-168.1	-166.5	0	0	0	0	112.3	S57	V55-S57 WeakPolarHBondContact CG1-OG 3.34Å; V55-S57 PolarHBondContact O-N 3Å
56	T	55.7	Low	65.8	Low	137 Å²	137	63.3 Å²	63.3	84%	0.84	35%	0.348	S	S	*	.	S	Bend	trans	-68.6	11	172.2	50.3	0	0	0	0	114.3
57	S	59.4	Low	65.3	Low	75 Å²	75	63.9 Å²	63.9	52%	0.524	35%	0.353	S	S	.	.	S	Bend	trans	-133.4	137.2	-177.6	71.8	0	0	0	0	109.4	V55 P59	V55-S57 WeakPolarHBondContact CG1-OG 3.34Å; V55-S57 PolarHBondContact O-N 3Å; S57-P59 WeakPolarHBondContact O-CD 3.36Å
58	V	57.1	Low	64.9	Low	74 Å²	74	65 Å²	65	45%	0.448	36%	0.356	S	S	.	.			trans	-47.2	111.4	-174.2	-179.4	0	0	0	0	110.8	K60 L62 K63 T98	V58-K60 PolarHBondContact O-N 2.98Å; V58-L62 HydrophobicContact CG1-CB 4.16Å; V58-L62 HydrophobicContact CG1-CD1 4.23Å; V58-K63 HydrophobicContact CG1-CG 4.46Å; V58-T98 HydrophobicContact CG1-CG2 3.59Å
59	P	63.7	Low	64.7	Low	21 Å²	21	65.8 Å²	65.8	14%	0.136	36%	0.359	C	S	.	.			trans	-53.7	138.6	-177	-28.9	33.5	0	0	0	112.1	T52 S57 L62	T52-P59 HydrophobicContact CG2-CG 4.32Å; S57-P59 WeakPolarHBondContact O-CD 3.36Å; P59-L62 HydrophobicContact CG-CD1 4.36Å; P59-L62 WeakPolarHBondContact O-CB 3.33Å; P59-L62 PolarHBondContact O-N 3.17Å
60	K	66	Low	64.7	Low	108 Å²	108	63.7 Å²	63.7	47%	0.47	36%	0.364	S	S	.	.	H	α-helix	trans	-49.9	-37.8	174.5	-63.9	-177.1	-179.1	-178.9	0	113.3	D15 V58 L62 K63 F64	D15-K60 IonicContact OD1-NZ 2.93Å; D15-K60 PolarHBondContact OD1-NZ 3.13Å; D15-K60 VanDerWaalsContact OD1-NZ 3.11Å; D15-K60 IonicContact OD2-NZ 3.72Å; D15-K60 PolarHBondContact OD2-NZ 2.7Å; V58-K60 PolarHBondContact O-N 2.98Å; K60-L62 VanDerWaalsContact C-N 3.29Å; K60-L62 PolarHBondContact O-N 3.28Å; K60-K63 WeakPolarHBondContact O-CB 3.43Å; K60-K63 PolarHBondContact O-N 3.28Å; K60-F64 HydrophobicContact CB-CD2 4.48Å; K60-F64 HydrophobicContact CB-CE2 3.97Å; K60-F64 WeakPolarHBondContact O-CD2 3.16Å; K60-F64 PolarHBondContact O-N 2.86Å; K60-F64 VanDerWaalsContact O-N 3.14Å
61	P	65.3	Low	64.4	Low	15 Å²	15	61.5 Å²	61.5	10%	0.097	35%	0.348	C	S	.	.	H	α-helix	trans	-55.3	-39.5	174.9	-28.5	36.8	0	0	0	114	K63 F64 M65	P61-K63 VanDerWaalsContact C-N 3.31Å; P61-K63 PolarHBondContact O-N 3.37Å; P61-F64 PolarHBondContact O-N 3.12Å; P61-M65 VanDerWaalsContact O-CG 3.26Å; P61-M65 WeakPolarHBondContact O-CG 3.07Å; P61-M65 PolarHBondContact O-N 3.34Å; P61-M65 VanDerWaalsContact O-N 3.08Å
62	L	64.6	Low	64.5	Low	6 Å²	6	60.2 Å²	60.2	3%	0.031	34%	0.339	C	S	.	.	H	α-helix	trans	-67	-34.1	177.6	-63.6	176.6	0	0	0	111.8	V58 P59 K60 F64 M65 R66 L95 M97 T98	V58-L62 HydrophobicContact CG1-CB 4.16Å; V58-L62 HydrophobicContact CG1-CD1 4.23Å; P59-L62 HydrophobicContact CG-CD1 4.36Å; P59-L62 WeakPolarHBondContact O-CB 3.33Å; P59-L62 PolarHBondContact O-N 3.17Å; K60-L62 VanDerWaalsContact C-N 3.29Å; K60-L62 PolarHBondContact O-N 3.28Å; L62-F64 VanDerWaalsContact C-N 3.35Å; L62-M65 PolarHBondContact O-N 2.84Å; L62-R66 PolarHBondContact O-N 2.89Å; L62-L95 HydrophobicContact CD2-CD2 3.98Å; L62-M97 HydrophobicContact CD1-CE 4.05Å; L62-T98 HydrophobicContact CB-CG2 3.87Å; L62-T98 HydrophobicContact CD1-CG2 3.78Å; L62-T98 HydrophobicContact CG-CG2 4.38Å
63	K	67.5	Low	64.9	Low	105 Å²	105	62 Å²	62	46%	0.457	35%	0.345	S	S	.	.	H	α-helix	trans	-66.4	-37.4	175.7	-62.8	-178.3	-177.8	175.8	0	111.9	V58 K60 P61	V58-K63 HydrophobicContact CG1-CG 4.46Å; K60-K63 WeakPolarHBondContact O-CB 3.43Å; K60-K63 PolarHBondContact O-N 3.28Å; P61-K63 VanDerWaalsContact C-N 3.31Å; P61-K63 PolarHBondContact O-N 3.37Å
64	F	67	Low	65.5	Low	32 Å²	32	62.7 Å²	62.7	14%	0.14	34%	0.341	C	S	.	.	H	α-helix	trans	-75.5	-22.8	177.4	-61.3	-48.1	0	0	0	113.5	L19 L22 K60 P61 L62 P67	L19-F64 HydrophobicContact CD1-CD1 4.07Å; L19-F64 HydrophobicContact CD1-CE1 4.42Å; L19-F64 HydrophobicContact CD1-CG 4.45Å; L22-F64 HydrophobicContact CD1-CB 4.32Å; K60-F64 HydrophobicContact CB-CD2 4.48Å; K60-F64 HydrophobicContact CB-CE2 3.97Å; K60-F64 WeakPolarHBondContact O-CD2 3.16Å; K60-F64 PolarHBondContact O-N 2.86Å; K60-F64 VanDerWaalsContact O-N 3.14Å; P61-F64 PolarHBondContact O-N 3.12Å; L62-F64 VanDerWaalsContact C-N 3.35Å; F64-P67 WeakPolarHBondContact O-CD 3.14Å
65	M	67.9	Low	66	Low	2 Å²	2	58.3 Å²	58.3	1%	0.01	31%	0.31	C	S	.	.	H	α-helix	trans	-84.5	-10.9	179.4	-71.2	-64.6	-68.4	0	0	114.9	L22 V26 L44 P61 L62 Y68 Y69 M72 L95	L22-M65 HydrophobicContact CB-SD 4.25Å; L22-M65 HydrophobicContact CD1-CG 4.31Å; L22-M65 HydrophobicContact CD1-SD 4.22Å; L22-M65 HydrophobicContact CD2-SD 3.94Å; L22-M65 HydrophobicContact CG-SD 4.37Å; V26-M65 HydrophobicContact CG2-CE 4.25Å; L44-M65 HydrophobicContact CD1-CE 3.88Å; L44-M65 HydrophobicContact CD1-SD 4.41Å; L44-M65 HydrophobicContact CD2-CE 4.38Å; P61-M65 VanDerWaalsContact O-CG 3.26Å; P61-M65 WeakPolarHBondContact O-CG 3.07Å; P61-M65 PolarHBondContact O-N 3.34Å; P61-M65 VanDerWaalsContact O-N 3.08Å; L62-M65 PolarHBondContact O-N 2.84Å; M65-Y68 PolarHBondContact O-N 3.45Å; M65-Y68 HydrophobicContact SD-CD2 4.09Å; M65-Y69 PolarHBondContact O-N 3.38Å; M65-M72 HydrophobicContact CE-CE 3.83Å; M65-L95 HydrophobicContact CB-CD2 3.48Å; M65-L95 VanDerWaalsContact CB-CD2 3.48Å; M65-L95 HydrophobicContact CE-CD1 3.9Å; M65-L95 HydrophobicContact CE-CD2 4.3Å; M65-L95 HydrophobicContact CG-CD2 3.95Å
66	R	66.5	Low	66.5	Low	148 Å²	148	56 Å²	56	56%	0.558	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.4	-48.8	177	-75.2	-174.1	166.6	-157.3	-8.2	115.4	L62 Y68 Y69 T98	L62-R66 PolarHBondContact O-N 2.89Å; R66-Y68 VanDerWaalsContact C-N 3.27Å; R66-Y68 PolarHBondContact O-N 3.45Å; R66-Y69 WeakPolarHBondContact O-CB 3.17Å; R66-Y69 PolarHBondContact O-N 2.87Å; R66-T98 PolarHBondContact NE-O 3.2Å; R66-T98 PolarHBondContact NH2-O 3.2Å
67	P	69.8	Low	67.2	Low	86 Å²	86	53.5 Å²	53.5	56%	0.558	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-29.1	178.9	25	-34.2	0	0	0	113.1	F64 Y69	F64-P67 WeakPolarHBondContact O-CD 3.14Å; P67-Y69 VanDerWaalsContact C-N 3.31Å; P67-Y69 PolarHBondContact O-N 3Å
68	Y	68.6	Low	67.6	Low	51 Å²	51	56.5 Å²	56.5	20%	0.2	29%	0.292	C	S	.	.	H	α-helix	trans	-83	-6.9	-176.9	-59.8	-59.9	0	0	0	113.8	E23 V26 M65 R66 A70 T71 M72	E23-Y68 HydrophobicContact CG-CE2 4.49Å; E23-Y68 VanDerWaalsContact CG-OH 3.23Å; E23-Y68 WeakPolarHBondContact CG-OH 3.45Å; E23-Y68 PolarHBondContact OE1-OH 3.19Å; V26-Y68 HydrophobicContact CB-CD1 4.29Å; V26-Y68 HydrophobicContact CG1-CD1 3.62Å; V26-Y68 HydrophobicContact CG1-CE1 4.12Å; V26-Y68 HydrophobicContact CG1-CG 4.14Å; V26-Y68 HydrophobicContact CG2-CD1 4.22Å; V26-Y68 HydrophobicContact CG2-CD2 4.27Å; V26-Y68 HydrophobicContact CG2-CG 3.94Å; M65-Y68 PolarHBondContact O-N 3.45Å; M65-Y68 HydrophobicContact SD-CD2 4.09Å; R66-Y68 VanDerWaalsContact C-N 3.27Å; R66-Y68 PolarHBondContact O-N 3.45Å; Y68-A70 VanDerWaalsContact C-N 3.34Å; Y68-A70 PolarHBondContact O-N 3.29Å; Y68-T71 WeakPolarHBondContact O-CB 2.93Å; Y68-T71 PolarHBondContact O-N 3.01Å; Y68-M72 WeakPolarHBondContact O-CG 3.48Å; Y68-M72 PolarHBondContact O-N 3.37Å
69	Y	68.7	Low	68	Low	21 Å²	21	53.3 Å²	53.3	8%	0.082	27%	0.272	C	S	.	.	H	α-helix	trans	-60.2	-41.2	179.5	-174.5	-107	0	0	0	112.8	M65 R66 P67 M72 K73 I92 L95 A96 C99 D106	M65-Y69 PolarHBondContact O-N 3.38Å; R66-Y69 WeakPolarHBondContact O-CB 3.17Å; R66-Y69 PolarHBondContact O-N 2.87Å; P67-Y69 VanDerWaalsContact C-N 3.31Å; P67-Y69 PolarHBondContact O-N 3Å; Y69-M72 PolarHBondContact O-N 3.47Å; Y69-K73 HydrophobicContact CE1-CD 4.28Å; Y69-K73 VanDerWaalsContact CZ-CE 3.45Å; Y69-K73 PolarHBondContact O-N 2.84Å; Y69-K73 VanDerWaalsContact OH-CE 3.24Å; Y69-K73 WeakPolarHBondContact OH-CE 3.46Å; Y69-I92 HydrophobicContact CE2-CG2 4Å; Y69-L95 HydrophobicContact CD2-CB 4.03Å; Y69-L95 HydrophobicContact CE2-CB 4.32Å; Y69-A96 HydrophobicContact CE2-CB 4.36Å; Y69-C99 HydrophobicContact CD1-CB 3.98Å; Y69-C99 HydrophobicContact CD2-CB 3.92Å; Y69-C99 HydrophobicContact CE1-CB 4.28Å; Y69-C99 HydrophobicContact CE2-CB 4.25Å; Y69-C99 HydrophobicContact CG-CB 3.79Å; Y69-D106 WeakPolarHBondContact OH-CB 3.26Å; Y69-D106 VanDerWaalsContact OH-CG 3.28Å; Y69-D106 PolarHBondContact OH-OD2 3.29Å
70	A	71	Confident	68	Low	62 Å²	62	57.7 Å²	57.7	51%	0.512	30%	0.298	S	S	.	.	H	α-helix	trans	-65.3	-43.3	176.2	0	0	0	0	0	111.6	Y68 M72 K73 E74	Y68-A70 VanDerWaalsContact C-N 3.34Å; Y68-A70 PolarHBondContact O-N 3.29Å; A70-M72 VanDerWaalsContact C-N 3.32Å; A70-M72 PolarHBondContact O-N 3.15Å; A70-K73 WeakPolarHBondContact O-CB 3.33Å; A70-K73 PolarHBondContact O-N 3.33Å; A70-E74 PolarHBondContact O-N 2.57Å
71	T	68.2	Low	68.2	Low	31 Å²	31	55.7 Å²	55.7	19%	0.19	29%	0.293	C	S	.	.	H	α-helix	trans	-61.1	-40.8	176.3	-45	0	0	0	0	111.6	V26 Q30 Y68 K73 E74 V75	V26-T71 HydrophobicContact CG1-CG2 4.35Å; Q30-T71 HydrophobicContact CG-CG2 4.02Å; Y68-T71 WeakPolarHBondContact O-CB 2.93Å; Y68-T71 PolarHBondContact O-N 3.01Å; T71-K73 VanDerWaalsContact C-N 3.33Å; T71-K73 PolarHBondContact O-N 2.97Å; T71-E74 WeakPolarHBondContact O-CB 3.31Å; T71-E74 PolarHBondContact O-N 2.97Å; T71-V75 VanDerWaalsContact O-CG2 3.27Å; T71-V75 WeakPolarHBondContact O-CG2 3.21Å; T71-V75 PolarHBondContact O-N 3.36Å
72	M	68.4	Low	68.4	Low	3 Å²	3	59.6 Å²	59.6	2%	0.015	31%	0.313	C	S	.	.	H	α-helix	trans	-63.7	-35.6	177	-74.4	-69	-159.5	0	0	112.6	V26 L29 L44 M65 Y68 Y69 A70 V75 H76 I91 I92 L95	V26-M72 HydrophobicContact CG2-CE 4.35Å; L29-M72 HydrophobicContact CD1-CE 3.47Å; L29-M72 VanDerWaalsContact CD1-CE 3.47Å; L29-M72 HydrophobicContact CD1-SD 3.62Å; L44-M72 HydrophobicContact CD1-CE 4.23Å; L44-M72 HydrophobicContact CD2-CE 4.06Å; M65-M72 HydrophobicContact CE-CE 3.83Å; Y68-M72 WeakPolarHBondContact O-CG 3.48Å; Y68-M72 PolarHBondContact O-N 3.37Å; Y69-M72 PolarHBondContact O-N 3.47Å; A70-M72 VanDerWaalsContact C-N 3.32Å; A70-M72 PolarHBondContact O-N 3.15Å; M72-V75 PolarHBondContact O-N 3.16Å; M72-H76 WeakPolarHBondContact O-CB 3.45Å; M72-H76 PolarHBondContact O-N 2.97Å; M72-I91 HydrophobicContact CE-CG2 4.36Å; M72-I92 HydrophobicContact CB-CD1 4.38Å; M72-I92 HydrophobicContact CB-CG1 4.05Å; M72-L95 HydrophobicContact CG-CD1 4.36Å
73	K	71.4	Confident	68.6	Low	59 Å²	59	61.8 Å²	61.8	26%	0.257	33%	0.332	S	S	.	.	H	α-helix	trans	-64.5	-40.5	173.1	-70.8	-170.4	174.7	-176.3	0	112	Y69 A70 T71 H76 A77 D106	Y69-K73 HydrophobicContact CE1-CD 4.28Å; Y69-K73 VanDerWaalsContact CZ-CE 3.45Å; Y69-K73 PolarHBondContact O-N 2.84Å; Y69-K73 VanDerWaalsContact OH-CE 3.24Å; Y69-K73 WeakPolarHBondContact OH-CE 3.46Å; A70-K73 WeakPolarHBondContact O-CB 3.33Å; A70-K73 PolarHBondContact O-N 3.33Å; T71-K73 VanDerWaalsContact C-N 3.33Å; T71-K73 PolarHBondContact O-N 2.97Å; K73-H76 PolarHBondContact O-N 3.37Å; K73-A77 PolarHBondContact O-N 3.21Å; K73-D106 VanDerWaalsContact NZ-CG 3.26Å; K73-D106 IonicContact NZ-OD1 3.03Å; K73-D106 PolarHBondContact NZ-OD1 3.18Å; K73-D106 IonicContact NZ-OD2 3.41Å; K73-D106 PolarHBondContact NZ-OD2 3.44Å
74	E	75.4	Confident	68.7	Low	116 Å²	116	56.8 Å²	56.8	54%	0.542	31%	0.311	S	S	.	.	H	α-helix	trans	-66.7	-40.7	174.9	-66.3	-177.4	-173.6	0	0	112.2	A70 T71 A77 K78	A70-E74 PolarHBondContact O-N 2.57Å; T71-E74 WeakPolarHBondContact O-CB 3.31Å; T71-E74 PolarHBondContact O-N 2.97Å; E74-A77 PolarHBondContact O-N 2.8Å; E74-K78 WeakPolarHBondContact O-CG 3.41Å; E74-K78 PolarHBondContact O-N 3.01Å
75	V	68.5	Low	69.1	Low	5 Å²	5	59.1 Å²	59.1	3%	0.03	32%	0.321	C	S	.	.	H	α-helix	trans	-62.9	-44.2	175.9	168.8	0	0	0	0	110.5	L29 T71 M72 A77 K78 I79	L29-V75 HydrophobicContact CB-CG1 4.12Å; L29-V75 HydrophobicContact CB-CG2 4.24Å; L29-V75 HydrophobicContact CD2-CG1 4.29Å; L29-V75 WeakPolarHBondContact O-CG2 3.41Å; T71-V75 VanDerWaalsContact O-CG2 3.27Å; T71-V75 WeakPolarHBondContact O-CG2 3.21Å; T71-V75 PolarHBondContact O-N 3.36Å; M72-V75 PolarHBondContact O-N 3.16Å; V75-A77 PolarHBondContact O-N 3.07Å; V75-K78 PolarHBondContact O-N 3.29Å; V75-I79 HydrophobicContact CG1-CD1 3.61Å; V75-I79 HydrophobicContact CG1-CG1 4.28Å; V75-I79 VanDerWaalsContact O-CG1 3.31Å; V75-I79 WeakPolarHBondContact O-CG1 3.44Å; V75-I79 PolarHBondContact O-N 3.32Å
76	H	65.6	Low	69.5	Low	19 Å²	19	62.7 Å²	62.7	9%	0.088	34%	0.336	C	S	.	.	H	α-helix	trans	-60.6	-30.7	175.5	179.1	-87	0	0	0	112.9	M72 K73 I92 Y110	M72-H76 WeakPolarHBondContact O-CB 3.45Å; M72-H76 PolarHBondContact O-N 2.97Å; K73-H76 PolarHBondContact O-N 3.37Å; H76-I92 HydrophobicContact CB-CD1 3.67Å; H76-Y110 AromaticContact CE1-CE1 3.88Å; H76-Y110 AromaticContact CG-CE1 3.96Å; H76-Y110 AromaticContact ND1-CE1 3.77Å
77	A	70.5	Confident	69.8	Low	85 Å²	85	56.8 Å²	56.8	70%	0.702	32%	0.315	S	S	*	.	H	α-helix	trans	-75.5	-25.7	174.4	0	0	0	0	0	113.6	K73 E74 V75	K73-A77 PolarHBondContact O-N 3.21Å; E74-A77 PolarHBondContact O-N 2.8Å; V75-A77 PolarHBondContact O-N 3.07Å
78	K	68.3	Low	69.9	Low	137 Å²	137	52.8 Å²	52.8	60%	0.596	29%	0.289	S	S	*	.	H	α-helix	trans	-87.9	-19.6	-178	-70.5	171.4	-175.2	171.7	0	113.9	E74 V75	E74-K78 WeakPolarHBondContact O-CG 3.41Å; E74-K78 PolarHBondContact O-N 3.01Å; V75-K78 PolarHBondContact O-N 3.29Å
79	I	65.6	Low	70.1	Confident	7 Å²	7	50.3 Å²	50.3	4%	0.036	28%	0.28	C	S	.	.			trans	-80.4	121.8	-175.9	-67.8	164.6	0	0	0	111.7	Y37 V75 N81 A84 K85 C88	Y37-I79 HydrophobicContact CD2-CD1 4.34Å; Y37-I79 HydrophobicContact CD2-CG1 3.93Å; Y37-I79 HydrophobicContact CE2-CG1 3.87Å; V75-I79 HydrophobicContact CG1-CD1 3.61Å; V75-I79 HydrophobicContact CG1-CG1 4.28Å; V75-I79 VanDerWaalsContact O-CG1 3.31Å; V75-I79 WeakPolarHBondContact O-CG1 3.44Å; V75-I79 PolarHBondContact O-N 3.32Å; I79-N81 HydrophobicContact CG2-CB 4.31Å; I79-N81 WeakPolarHBondContact CG2-O 3.44Å; I79-A84 HydrophobicContact CG2-CB 3.93Å; I79-K85 HydrophobicContact CG2-CB 4.12Å; I79-C88 HydrophobicContact CD1-CB 4.47Å; I79-C88 WeakPolarHBondContact CD1-SG 3.41Å
80	T	62.5	Low	70.3	Confident	113 Å²	113	49.7 Å²	49.7	69%	0.693	28%	0.278	S	S	*	.			trans	-92.1	-14.4	172.3	56.6	0	0	0	0	113.8	Q34	Q34-T80 PolarHBondContact NE2-OG1 2.63Å; Q34-T80 PolarHBondContact OE1-OG1 3.22Å
81	N	70.2	Confident	70.5	Confident	67 Å²	67	46.8 Å²	46.8	36%	0.358	25%	0.254	S	S	.	.			trans	-84.3	119.4	-176.1	-164.2	-5.9	0	0	0	111.3	I79 A83 A84 K85	I79-N81 HydrophobicContact CG2-CB 4.31Å; I79-N81 WeakPolarHBondContact CG2-O 3.44Å; N81-A83 VanDerWaalsContact C-N 3.35Å; N81-A83 PolarHBondContact O-N 2.76Å; N81-A84 HydrophobicContact CB-CB 4.26Å; N81-A84 PolarHBondContact O-N 3.24Å; N81-K85 WeakPolarHBondContact O-CB 3.27Å; N81-K85 PolarHBondContact O-N 2.99Å
82	D	69.2	Low	70.8	Confident	96 Å²	96	45.3 Å²	45.3	51%	0.513	25%	0.245	S	C	.	.	H	α-helix	trans	-61.2	-38.1	-171.4	-170.4	52.2	0	0	0	113.1	K86	D82-K86 VanDerWaalsContact O-CG 3.31Å; D82-K86 WeakPolarHBondContact O-CG 3.17Å; D82-K86 PolarHBondContact O-N 2.82Å; D82-K86 VanDerWaalsContact O-N 3.08Å; D82-K86 IonicContact OD1-NZ 3.26Å; D82-K86 WeakPolarHBondContact OD2-CE 3.47Å; D82-K86 IonicContact OD2-NZ 3.77Å; D82-K86 PolarHBondContact OD2-NZ 3.29Å
83	A	70.6	Confident	70.9	Confident	53 Å²	53	45.2 Å²	45.2	44%	0.438	24%	0.244	S	C	.	.	H	α-helix	trans	-69.8	-44.8	178.7	0	0	0	0	0	112.5	N81 K85 K86 L87	N81-A83 VanDerWaalsContact C-N 3.35Å; N81-A83 PolarHBondContact O-N 2.76Å; A83-K85 VanDerWaalsContact C-N 3.31Å; A83-K85 PolarHBondContact O-N 3.45Å; A83-K86 PolarHBondContact O-N 2.96Å; A83-L87 WeakPolarHBondContact O-CG 3.42Å; A83-L87 PolarHBondContact O-N 2.98Å; A83-L87 VanDerWaalsContact O-N 3.09Å
84	A	69.2	Low	70.9	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-67.5	-34.8	176.9	0	0	0	0	0	111.3	V38 L41 I79 N81 L87 C88	V38-A84 HydrophobicContact CG2-CB 4.1Å; L41-A84 HydrophobicContact CD1-CB 4.2Å; L41-A84 WeakPolarHBondContact CD1-O 3.31Å; I79-A84 HydrophobicContact CG2-CB 3.93Å; N81-A84 HydrophobicContact CB-CB 4.26Å; N81-A84 PolarHBondContact O-N 3.24Å; A84-L87 PolarHBondContact O-N 3.18Å; A84-C88 VanDerWaalsContact O-CB 3.29Å; A84-C88 WeakPolarHBondContact O-CB 3.42Å; A84-C88 PolarHBondContact O-N 3.41Å; A84-C88 PolarHBondContact O-SG 3.01Å; A84-C88 VanDerWaalsContact O-SG 3.33Å
85	K	75.7	Confident	70.7	Confident	81 Å²	81	36.9 Å²	36.9	35%	0.352	21%	0.206	S	C	.	.	H	α-helix	trans	-64.6	-44	176.7	-168.7	174.9	-176.6	177.9	0	112	I79 N81 A83 C88 A89	I79-K85 HydrophobicContact CG2-CB 4.12Å; N81-K85 WeakPolarHBondContact O-CB 3.27Å; N81-K85 PolarHBondContact O-N 2.99Å; A83-K85 VanDerWaalsContact C-N 3.31Å; A83-K85 PolarHBondContact O-N 3.45Å; K85-C88 PolarHBondContact O-N 3.5Å; K85-A89 WeakPolarHBondContact O-CB 3.23Å; K85-A89 PolarHBondContact O-N 3.32Å
86	K	75.7	Confident	70.8	Confident	76 Å²	76	36.7 Å²	36.7	33%	0.33	21%	0.205	S	C	.	.	H	α-helix	trans	-62.4	-46.6	175.1	-74.2	167.5	176.9	166	0	112.1	D82 A83 A89 D90	D82-K86 VanDerWaalsContact O-CG 3.31Å; D82-K86 WeakPolarHBondContact O-CG 3.17Å; D82-K86 PolarHBondContact O-N 2.82Å; D82-K86 VanDerWaalsContact O-N 3.08Å; D82-K86 IonicContact OD1-NZ 3.26Å; D82-K86 WeakPolarHBondContact OD2-CE 3.47Å; D82-K86 IonicContact OD2-NZ 3.77Å; D82-K86 PolarHBondContact OD2-NZ 3.29Å; A83-K86 PolarHBondContact O-N 2.96Å; K86-A89 WeakPolarHBondContact O-CB 3.16Å; K86-A89 PolarHBondContact O-N 2.92Å; K86-A89 VanDerWaalsContact O-N 3.15Å; K86-D90 PolarHBondContact O-N 3.45Å
87	L	72.4	Confident	70.9	Confident	25 Å²	25	37 Å²	37	13%	0.131	21%	0.207	C	C	.	.	H	α-helix	trans	-65.3	-39.8	177.4	-69.9	173	0	0	0	112.8	V38 L41 A83 A84 A89 D90 I91	V38-L87 HydrophobicContact CG1-CD1 4.34Å; L41-L87 HydrophobicContact CB-CB 4.34Å; L41-L87 HydrophobicContact CD1-CB 4.19Å; A83-L87 WeakPolarHBondContact O-CG 3.42Å; A83-L87 PolarHBondContact O-N 2.98Å; A83-L87 VanDerWaalsContact O-N 3.09Å; A84-L87 PolarHBondContact O-N 3.18Å; L87-A89 VanDerWaalsContact C-N 3.3Å; L87-D90 PolarHBondContact O-N 3.4Å; L87-I91 PolarHBondContact O-N 3.36Å; L87-I91 VanDerWaalsContact O-N 3.15Å
88	C	71.6	Confident	70.7	Confident	1 Å²	1	34 Å²	34	1%	0.007	18%	0.18	C	C	.	.	H	α-helix	trans	-59.5	-43.4	170.8	-82.6	0	0	0	0	111.3	L41 I79 A84 K85 I91 I92	L41-C88 HydrophobicContact CD1-CB 4.44Å; L41-C88 WeakPolarHBondContact CD1-SG 3.44Å; L41-C88 HydrophobicContact CD2-CB 4.4Å; L41-C88 WeakPolarHBondContact CD2-SG 3.37Å; I79-C88 HydrophobicContact CD1-CB 4.47Å; I79-C88 WeakPolarHBondContact CD1-SG 3.41Å; A84-C88 VanDerWaalsContact O-CB 3.29Å; A84-C88 WeakPolarHBondContact O-CB 3.42Å; A84-C88 PolarHBondContact O-N 3.41Å; A84-C88 PolarHBondContact O-SG 3.01Å; A84-C88 VanDerWaalsContact O-SG 3.33Å; K85-C88 PolarHBondContact O-N 3.5Å; C88-I91 PolarHBondContact O-N 2.93Å; C88-I92 WeakPolarHBondContact O-CB 3.49Å; C88-I92 WeakPolarHBondContact O-CD1 3.43Å; C88-I92 WeakPolarHBondContact O-CG1 3.31Å; C88-I92 PolarHBondContact O-N 3.45Å
89	A	73.8	Confident	70.3	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-64.1	-42	-179.3	0	0	0	0	0	111.4	K85 K86 L87 I91 I92 S93 Y110 L113	K85-A89 WeakPolarHBondContact O-CB 3.23Å; K85-A89 PolarHBondContact O-N 3.32Å; K86-A89 WeakPolarHBondContact O-CB 3.16Å; K86-A89 PolarHBondContact O-N 2.92Å; K86-A89 VanDerWaalsContact O-N 3.15Å; L87-A89 VanDerWaalsContact C-N 3.3Å; A89-I91 VanDerWaalsContact C-N 3.31Å; A89-I91 PolarHBondContact O-N 2.95Å; A89-I92 PolarHBondContact O-N 3.18Å; A89-S93 PolarHBondContact O-N 3.04Å; A89-Y110 HydrophobicContact CB-CD1 4.33Å; A89-Y110 VanDerWaalsContact CB-O 3.26Å; A89-Y110 WeakPolarHBondContact CB-O 3.47Å; A89-Y110 WeakPolarHBondContact O-CB 3.1Å; A89-L113 HydrophobicContact CB-CB 3.93Å
90	D	72.5	Confident	70	Confident	7 Å²	7	30.2 Å²	30.2	4%	0.037	17%	0.171	C	C	.	.	H	α-helix	trans	-62.5	-35.8	174.7	-63.9	-37.4	0	0	0	112.9	K86 L87 S93 A94 G114 S115 W122	K86-D90 PolarHBondContact O-N 3.45Å; L87-D90 PolarHBondContact O-N 3.4Å; D90-S93 PolarHBondContact O-OG 3.19Å; D90-A94 PolarHBondContact O-N 3.48Å; D90-G114 WeakPolarHBondContact OD1-CA 3.43Å; D90-S115 PolarHBondContact OD1-N 3.21Å; D90-S115 VanDerWaalsContact OD2-CB 3.31Å; D90-S115 WeakPolarHBondContact OD2-CB 3.37Å; D90-S115 PolarHBondContact OD2-N 3.2Å; D90-S115 PolarHBondContact OD2-OG 3.13Å; D90-W122 HydrophobicContact CB-CZ2 4.33Å
91	I	75.2	Confident	69.8	Low	2 Å²	2	34.5 Å²	34.5	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-71.3	-42	174.5	-76.3	162.3	0	0	0	111	L41 L44 R45 I48 M72 L87 C88 A89 S93 A94 L95 W122	L41-I91 HydrophobicContact CB-CD1 3.99Å; L41-I91 HydrophobicContact CD2-CD1 3.62Å; L41-I91 HydrophobicContact CG-CD1 4.43Å; L41-I91 WeakPolarHBondContact O-CD1 3.27Å; L44-I91 HydrophobicContact CB-CD1 4.33Å; L44-I91 HydrophobicContact CD2-CB 4.22Å; L44-I91 HydrophobicContact CD2-CD1 3.72Å; L44-I91 HydrophobicContact CD2-CG1 3.97Å; L44-I91 HydrophobicContact CD2-CG2 3.23Å; R45-I91 HydrophobicContact CB-CD1 4.42Å; I48-I91 HydrophobicContact CD1-CG2 4.43Å; M72-I91 HydrophobicContact CE-CG2 4.36Å; L87-I91 PolarHBondContact O-N 3.36Å; L87-I91 VanDerWaalsContact O-N 3.15Å; C88-I91 PolarHBondContact O-N 2.93Å; A89-I91 VanDerWaalsContact C-N 3.31Å; A89-I91 PolarHBondContact O-N 2.95Å; I91-S93 VanDerWaalsContact C-N 3.28Å; I91-S93 PolarHBondContact O-N 3.45Å; I91-A94 PolarHBondContact O-N 3.47Å; I91-L95 HydrophobicContact CG2-CD1 3.77Å; I91-L95 HydrophobicContact CG2-CG 4.26Å; I91-L95 WeakPolarHBondContact O-CB 2.94Å; I91-L95 VanDerWaalsContact O-CG 3.24Å; I91-L95 WeakPolarHBondContact O-CG 3.35Å; I91-L95 PolarHBondContact O-N 3.42Å; I91-W122 HydrophobicContact CG1-CH2 4.26Å
92	I	75	Confident	68.9	Low	0 Å²	0	43.8 Å²	43.8	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-64.7	-37	179.2	-67.5	163.3	0	0	0	110.1	Y69 M72 H76 C88 A89 L95 A96 Y110	Y69-I92 HydrophobicContact CE2-CG2 4Å; M72-I92 HydrophobicContact CB-CD1 4.38Å; M72-I92 HydrophobicContact CB-CG1 4.05Å; H76-I92 HydrophobicContact CB-CD1 3.67Å; C88-I92 WeakPolarHBondContact O-CB 3.49Å; C88-I92 WeakPolarHBondContact O-CD1 3.43Å; C88-I92 WeakPolarHBondContact O-CG1 3.31Å; C88-I92 PolarHBondContact O-N 3.45Å; A89-I92 PolarHBondContact O-N 3.18Å; I92-L95 PolarHBondContact O-N 3.48Å; I92-A96 WeakPolarHBondContact O-CB 3.1Å; I92-A96 PolarHBondContact O-N 2.72Å; I92-Y110 HydrophobicContact CB-CD1 4.16Å; I92-Y110 HydrophobicContact CB-CD2 4.27Å; I92-Y110 HydrophobicContact CB-CG 3.96Å; I92-Y110 HydrophobicContact CD1-CD1 4.16Å; I92-Y110 HydrophobicContact CD1-CE1 4.05Å; I92-Y110 HydrophobicContact CG2-CD1 3.89Å; I92-Y110 HydrophobicContact CG2-CD2 3.28Å; I92-Y110 HydrophobicContact CG2-CE1 4.11Å; I92-Y110 HydrophobicContact CG2-CE2 3.6Å; I92-Y110 HydrophobicContact CG2-CG 3.48Å; I92-Y110 VanDerWaalsContact CG2-CG 3.48Å
93	S	71	Confident	68.2	Low	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-64.1	-46.2	174.1	72.1	0	0	0	0	111.2	A89 D90 I91 L95 A96 C107 Y126	A89-S93 PolarHBondContact O-N 3.04Å; D90-S93 PolarHBondContact O-OG 3.19Å; I91-S93 VanDerWaalsContact C-N 3.28Å; I91-S93 PolarHBondContact O-N 3.45Å; S93-L95 VanDerWaalsContact C-N 3.3Å; S93-L95 PolarHBondContact O-N 3.09Å; S93-A96 WeakPolarHBondContact O-CB 3.35Å; S93-A96 PolarHBondContact O-N 2.86Å; S93-A96 VanDerWaalsContact O-N 3.16Å; S93-C107 WeakPolarHBondContact CB-O 3.42Å; S93-C107 PolarHBondContact O-SG 3.25Å; S93-Y126 PolarHBondContact OG-OH 2.72Å; S93-Y126 VanDerWaalsContact OG-OH 3.04Å
94	A	71.4	Confident	67.7	Low	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.7	-34.4	175.4	0	0	0	0	0	113	D90 I91 M97 W122 Y126	D90-A94 PolarHBondContact O-N 3.48Å; I91-A94 PolarHBondContact O-N 3.47Å; A94-M97 HydrophobicContact CB-CE 4.32Å; A94-M97 WeakPolarHBondContact O-CB 3.36Å; A94-M97 WeakPolarHBondContact O-CE 3.44Å; A94-M97 WeakPolarHBondContact O-CG 3.24Å; A94-W122 HydrophobicContact CB-CD2 4.24Å; A94-W122 HydrophobicContact CB-CE3 3.66Å; A94-W122 HydrophobicContact CB-CH2 4.25Å; A94-W122 HydrophobicContact CB-CZ3 3.67Å; A94-Y126 HydrophobicContact CB-CE2 4.49Å
95	L	71.2	Confident	67.4	Low	1 Å²	1	44.7 Å²	44.7	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-73.6	-31.8	175.6	-70.1	173.8	0	0	0	112.6	L62 M65 Y69 M72 I91 I92 S93 M97 T98	L62-L95 HydrophobicContact CD2-CD2 3.98Å; M65-L95 HydrophobicContact CB-CD2 3.48Å; M65-L95 VanDerWaalsContact CB-CD2 3.48Å; M65-L95 HydrophobicContact CE-CD1 3.9Å; M65-L95 HydrophobicContact CE-CD2 4.3Å; M65-L95 HydrophobicContact CG-CD2 3.95Å; Y69-L95 HydrophobicContact CD2-CB 4.03Å; Y69-L95 HydrophobicContact CE2-CB 4.32Å; M72-L95 HydrophobicContact CG-CD1 4.36Å; I91-L95 HydrophobicContact CG2-CD1 3.77Å; I91-L95 HydrophobicContact CG2-CG 4.26Å; I91-L95 WeakPolarHBondContact O-CB 2.94Å; I91-L95 VanDerWaalsContact O-CG 3.24Å; I91-L95 WeakPolarHBondContact O-CG 3.35Å; I91-L95 PolarHBondContact O-N 3.42Å; I92-L95 PolarHBondContact O-N 3.48Å; S93-L95 VanDerWaalsContact C-N 3.3Å; S93-L95 PolarHBondContact O-N 3.09Å; L95-M97 PolarHBondContact O-N 3.18Å; L95-T98 PolarHBondContact O-N 2.97Å; L95-T98 PolarHBondContact O-OG1 3.23Å
96	A	70.1	Confident	66.8	Low	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-58.8	-28.8	178.6	0	0	0	0	0	112	Y69 I92 S93 T98 C99 S100 D106 C107	Y69-A96 HydrophobicContact CE2-CB 4.36Å; I92-A96 WeakPolarHBondContact O-CB 3.1Å; I92-A96 PolarHBondContact O-N 2.72Å; S93-A96 WeakPolarHBondContact O-CB 3.35Å; S93-A96 PolarHBondContact O-N 2.86Å; S93-A96 VanDerWaalsContact O-N 3.16Å; A96-T98 PolarHBondContact O-N 3.16Å; A96-C99 PolarHBondContact O-N 3.3Å; A96-C99 VanDerWaalsContact O-N 3.1Å; A96-S100 PolarHBondContact O-N 3.35Å; A96-S100 PolarHBondContact O-OG 2.88Å; A96-D106 HydrophobicContact CB-CB 4.19Å; A96-C107 HydrophobicContact CB-CB 3.96Å
97	M	68.3	Low	66.2	Low	27 Å²	27	37.9 Å²	37.9	13%	0.133	18%	0.183	C	C	.	.	H	α-helix	trans	-47	-28	173.9	-68.4	-166.6	-75.9	0	0	114.8	L62 A94 L95 Y126 H129	L62-M97 HydrophobicContact CD1-CE 4.05Å; A94-M97 HydrophobicContact CB-CE 4.32Å; A94-M97 WeakPolarHBondContact O-CB 3.36Å; A94-M97 WeakPolarHBondContact O-CE 3.44Å; A94-M97 WeakPolarHBondContact O-CG 3.24Å; L95-M97 PolarHBondContact O-N 3.18Å; M97-Y126 HydrophobicContact CE-CD2 4.24Å; M97-Y126 HydrophobicContact CG-CD2 3.96Å; M97-Y126 WeakPolarHBondContact SD-CA 3.33Å; M97-Y126 HydrophobicContact SD-CD2 3.75Å; M97-Y126 HydrophobicContact SD-CG 4.21Å; M97-H129 HydrophobicContact CG-CB 4.2Å; M97-H129 PolarHBondContact O-NE2 3.04Å
98	T	65	Low	65.8	Low	22 Å²	22	36.7 Å²	36.7	14%	0.135	18%	0.177	C	C	.	.	H	α-helix	trans	-120.7	-7.5	-175.5	62.9	0	0	0	0	114.1	V58 L62 R66 L95 A96	V58-T98 HydrophobicContact CG1-CG2 3.59Å; L62-T98 HydrophobicContact CB-CG2 3.87Å; L62-T98 HydrophobicContact CD1-CG2 3.78Å; L62-T98 HydrophobicContact CG-CG2 4.38Å; R66-T98 PolarHBondContact NE-O 3.2Å; R66-T98 PolarHBondContact NH2-O 3.2Å; L95-T98 PolarHBondContact O-N 2.97Å; L95-T98 PolarHBondContact O-OG1 3.23Å; A96-T98 PolarHBondContact O-N 3.16Å
99	C	60.2	Low	65.6	Low	29 Å²	29	42.5 Å²	42.5	20%	0.196	20%	0.203	C	C	.	.	H	α-helix	trans	-124.9	-14.7	-166.1	-63.5	0	0	0	0	113.7	Y69 A96 R101	Y69-C99 HydrophobicContact CD1-CB 3.98Å; Y69-C99 HydrophobicContact CD2-CB 3.92Å; Y69-C99 HydrophobicContact CE1-CB 4.28Å; Y69-C99 HydrophobicContact CE2-CB 4.25Å; Y69-C99 HydrophobicContact CG-CB 3.79Å; A96-C99 PolarHBondContact O-N 3.3Å; A96-C99 VanDerWaalsContact O-N 3.1Å; C99-R101 PolarHBondContact O-N 3.34Å
100	S	59	Low	65	Low	35 Å²	35	43.5 Å²	43.5	25%	0.245	21%	0.206	C	C	.	.			trans	-63.2	127.4	176.5	59.5	0	0	0	0	109.5	A96	A96-S100 PolarHBondContact O-N 3.35Å; A96-S100 PolarHBondContact O-OG 2.88Å
101	R	58.8	Low	64.7	Low	203 Å²	203	44 Å²	44	77%	0.766	21%	0.209	S	C	*	.			trans	-68.6	137.8	160	-79.1	178.3	175.7	166.4	-0.2	105.8	C99 G103 D104	C99-R101 PolarHBondContact O-N 3.34Å; R101-G103 PolarHBondContact O-N 3Å; R101-D104 PolarHBondContact O-N 2.82Å
102	R	51.9	Low	64.2	Low	262 Å²	262	47.6 Å²	47.6	99%	0.989	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-44.7	114.4	171.1	-75.8	-177.5	172.1	-178.5	-5.6	108.8
103	G	54.8	Low	63.7	Low	51 Å²	51	51.3 Å²	51.3	53%	0.526	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	108.9	-13.7	178.8	0	0	0	0	0	116.6	R101 H105	R101-G103 PolarHBondContact O-N 3Å; G103-H105 PolarHBondContact O-N 3.48Å
104	D	59.9	Low	63.3	Low	84 Å²	84	51.7 Å²	51.7	45%	0.449	25%	0.251	S	S	.	.			trans	-91.9	96.9	169.2	-68.9	-32.7	0	0	0	107.9	R101 D106	R101-D104 PolarHBondContact O-N 2.82Å; D104-D106 WeakPolarHBondContact CB-OD2 3.49Å; D104-D106 PolarHBondContact O-N 3.17Å
105	H	61.3	Low	62.6	Low	33 Å²	33	53.7 Å²	53.7	15%	0.153	27%	0.265	C	S	.	.			trans	-66.1	49.2	176	-61.5	-61.4	0	0	0	112.8	G103 K109 T136 E140	G103-H105 PolarHBondContact O-N 3.48Å; H105-K109 WeakPolarHBondContact O-CB 3.42Å; H105-K109 PolarHBondContact O-N 2.92Å; H105-T136 PolarHBondContact CE1-OG1 2.86Å; H105-E140 IonicContact CD2-OE2 2.65Å; H105-E140 PolarHBondContact CD2-OE2 2.82Å; H105-E140 IonicContact CE1-OE1 3.96Å; H105-E140 IonicContact CE1-OE2 3.21Å; H105-E140 IonicContact NE2-OE1 2.63Å; H105-E140 PolarHBondContact NE2-OE1 3.42Å; H105-E140 IonicContact NE2-OE2 3.01Å; H105-E140 PolarHBondContact NE2-OE2 2.97Å
106	D	63.3	Low	62	Low	13 Å²	13	64.6 Å²	64.6	7%	0.07	31%	0.306	C	S	.	.	H	α-helix	trans	-71.2	-36.4	-175.5	-73.1	-45	0	0	0	110.3	Y69 K73 A96 D104 L108 K109 Y110	Y69-D106 WeakPolarHBondContact OH-CB 3.26Å; Y69-D106 VanDerWaalsContact OH-CG 3.28Å; Y69-D106 PolarHBondContact OH-OD2 3.29Å; K73-D106 VanDerWaalsContact NZ-CG 3.26Å; K73-D106 IonicContact NZ-OD1 3.03Å; K73-D106 PolarHBondContact NZ-OD1 3.18Å; K73-D106 IonicContact NZ-OD2 3.41Å; K73-D106 PolarHBondContact NZ-OD2 3.44Å; A96-D106 HydrophobicContact CB-CB 4.19Å; D104-D106 WeakPolarHBondContact CB-OD2 3.49Å; D104-D106 PolarHBondContact O-N 3.17Å; D106-L108 PolarHBondContact O-N 3.36Å; D106-K109 PolarHBondContact O-N 3.36Å; D106-Y110 HydrophobicContact CB-CD2 3.93Å; D106-Y110 HydrophobicContact CB-CE2 4.03Å; D106-Y110 WeakPolarHBondContact O-CB 3.19Å; D106-Y110 WeakPolarHBondContact O-CD2 3.41Å; D106-Y110 PolarHBondContact O-N 2.88Å
107	C	63	Low	61.5	Low	0 Å²	0	67.6 Å²	67.6	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-62.6	-47.4	179.6	-162.7	0	0	0	0	110.1	S93 A96 H111 E133	S93-C107 WeakPolarHBondContact CB-O 3.42Å; S93-C107 PolarHBondContact O-SG 3.25Å; A96-C107 HydrophobicContact CB-CB 3.96Å; C107-H111 WeakPolarHBondContact O-CB 3.29Å; C107-H111 PolarHBondContact O-N 3.47Å; C107-E133 WeakPolarHBondContact CA-OE2 3.38Å; C107-E133 HydrophobicContact CB-CG 4.49Å; C107-E133 WeakPolarHBondContact CB-OE1 3.44Å; C107-E133 WeakPolarHBondContact CB-OE2 3.43Å; C107-E133 PolarHBondContact N-OE2 3.24Å; C107-E133 VanDerWaalsContact N-OE2 3.09Å
108	L	63.9	Low	61.1	Low	1 Å²	1	73.5 Å²	73.5	1%	0.005	35%	0.347	C	S	.	.	H	α-helix	trans	-64.8	-48.6	176.8	-162.8	99.6	0	0	0	112.1	D106 Y110 H111 L112 E133 I134 Q137 L155 L158	D106-L108 PolarHBondContact O-N 3.36Å; L108-Y110 VanDerWaalsContact C-N 3.27Å; L108-Y110 PolarHBondContact O-N 3.04Å; L108-H111 PolarHBondContact O-N 3.02Å; L108-H111 VanDerWaalsContact O-N 3.17Å; L108-L112 HydrophobicContact CD2-CD1 3.7Å; L108-L112 HydrophobicContact CD2-CG 4.29Å; L108-L112 HydrophobicContact CG-CD1 4.18Å; L108-L112 HydrophobicContact CG-CG 4.25Å; L108-L112 WeakPolarHBondContact O-CB 3.35Å; L108-L112 VanDerWaalsContact O-CG 3.31Å; L108-L112 WeakPolarHBondContact O-CG 3.37Å; L108-L112 PolarHBondContact O-N 3.28Å; L108-E133 PolarHBondContact N-OE2 2.89Å; L108-I134 HydrophobicContact CD1-CB 4.45Å; L108-I134 HydrophobicContact CD1-CD1 4.26Å; L108-I134 HydrophobicContact CD1-CG1 3.34Å; L108-Q137 HydrophobicContact CD2-CG 4.5Å; L108-L155 HydrophobicContact CD1-CD2 3.69Å; L108-L155 HydrophobicContact CD2-CD2 3.64Å; L108-L155 HydrophobicContact CG-CD2 4.33Å; L108-L158 HydrophobicContact CD1-CD1 4.25Å
109	K	68.1	Low	61	Low	123 Å²	123	72.8 Å²	72.8	54%	0.535	34%	0.343	S	S	.	.	H	α-helix	trans	-58.4	-41.5	-177.4	-176.8	177.4	-178.2	176.8	0	112.1	H105 D106 L113	H105-K109 WeakPolarHBondContact O-CB 3.42Å; H105-K109 PolarHBondContact O-N 2.92Å; D106-K109 PolarHBondContact O-N 3.36Å; K109-L113 WeakPolarHBondContact O-CD1 3.36Å; K109-L113 VanDerWaalsContact O-CG 3.24Å; K109-L113 WeakPolarHBondContact O-CG 3.44Å; K109-L113 PolarHBondContact O-N 3.19Å
110	Y	61.9	Low	61	Low	20 Å²	20	75.4 Å²	75.4	8%	0.078	36%	0.355	C	S	.	.	H	α-helix	trans	-81.7	-27.9	179	-70.3	-72.7	0	0	0	112.4	H76 A89 I92 D106 L108 L113 G114	H76-Y110 AromaticContact CE1-CE1 3.88Å; H76-Y110 AromaticContact CG-CE1 3.96Å; H76-Y110 AromaticContact ND1-CE1 3.77Å; A89-Y110 HydrophobicContact CB-CD1 4.33Å; A89-Y110 VanDerWaalsContact CB-O 3.26Å; A89-Y110 WeakPolarHBondContact CB-O 3.47Å; A89-Y110 WeakPolarHBondContact O-CB 3.1Å; I92-Y110 HydrophobicContact CB-CD1 4.16Å; I92-Y110 HydrophobicContact CB-CD2 4.27Å; I92-Y110 HydrophobicContact CB-CG 3.96Å; I92-Y110 HydrophobicContact CD1-CD1 4.16Å; I92-Y110 HydrophobicContact CD1-CE1 4.05Å; I92-Y110 HydrophobicContact CG2-CD1 3.89Å; I92-Y110 HydrophobicContact CG2-CD2 3.28Å; I92-Y110 HydrophobicContact CG2-CE1 4.11Å; I92-Y110 HydrophobicContact CG2-CE2 3.6Å; I92-Y110 HydrophobicContact CG2-CG 3.48Å; I92-Y110 VanDerWaalsContact CG2-CG 3.48Å; D106-Y110 HydrophobicContact CB-CD2 3.93Å; D106-Y110 HydrophobicContact CB-CE2 4.03Å; D106-Y110 WeakPolarHBondContact O-CB 3.19Å; D106-Y110 WeakPolarHBondContact O-CD2 3.41Å; D106-Y110 PolarHBondContact O-N 2.88Å; L108-Y110 VanDerWaalsContact C-N 3.27Å; L108-Y110 PolarHBondContact O-N 3.04Å; Y110-L113 HydrophobicContact CD1-CD1 4.31Å; Y110-L113 PolarHBondContact O-N 2.87Å; Y110-G114 PolarHBondContact O-N 2.86Å; Y110-G114 VanDerWaalsContact O-N 3.12Å
111	H	64.8	Low	61.3	Low	19 Å²	19	75.2 Å²	75.2	9%	0.088	35%	0.353	C	S	.	.	H	α-helix	trans	-66.7	-39.8	170.7	-172.9	59.3	0	0	0	112.1	C107 L108 L113 G114 Y126 L130	C107-H111 WeakPolarHBondContact O-CB 3.29Å; C107-H111 PolarHBondContact O-N 3.47Å; L108-H111 PolarHBondContact O-N 3.02Å; L108-H111 VanDerWaalsContact O-N 3.17Å; H111-L113 VanDerWaalsContact C-N 3.27Å; H111-L113 PolarHBondContact O-N 3.28Å; H111-G114 PolarHBondContact O-N 3.4Å; H111-Y126 PolarHBondContact ND1-OH 2.86Å; H111-L130 HydrophobicContact CB-CD1 4.46Å
112	L	65.4	Low	61.7	Low	77 Å²	77	66.1 Å²	66.1	40%	0.403	32%	0.319	S	S	.	.	H	α-helix	trans	-66.1	-28.4	175	-71.4	-178.4	0	0	0	113.5	L108 G114 T154 L158	L108-L112 HydrophobicContact CD2-CD1 3.7Å; L108-L112 HydrophobicContact CD2-CG 4.29Å; L108-L112 HydrophobicContact CG-CD1 4.18Å; L108-L112 HydrophobicContact CG-CG 4.25Å; L108-L112 WeakPolarHBondContact O-CB 3.35Å; L108-L112 VanDerWaalsContact O-CG 3.31Å; L108-L112 WeakPolarHBondContact O-CG 3.37Å; L108-L112 PolarHBondContact O-N 3.28Å; L112-G114 VanDerWaalsContact C-N 3.3Å; L112-T154 HydrophobicContact CD2-CG2 3.35Å; L112-L158 HydrophobicContact CD2-CD1 3.83Å
113	L	65.5	Low	62.5	Low	77 Å²	77	54.1 Å²	54.1	40%	0.403	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-9	173.9	-68.2	170.4	0	0	0	112.7	A89 K109 Y110 H111	A89-L113 HydrophobicContact CB-CB 3.93Å; K109-L113 WeakPolarHBondContact O-CD1 3.36Å; K109-L113 VanDerWaalsContact O-CG 3.24Å; K109-L113 WeakPolarHBondContact O-CG 3.44Å; K109-L113 PolarHBondContact O-N 3.19Å; Y110-L113 HydrophobicContact CD1-CD1 4.31Å; Y110-L113 PolarHBondContact O-N 2.87Å; H111-L113 VanDerWaalsContact C-N 3.27Å; H111-L113 PolarHBondContact O-N 3.28Å
114	G	61.5	Low	63.2	Low	9 Å²	9	54.8 Å²	54.8	9%	0.093	27%	0.266	C	S	.	.	S	Bend	trans	-79.8	-176.1	-174	0	0	0	0	0	115.9	D90 Y110 H111 L112 R116	D90-G114 WeakPolarHBondContact OD1-CA 3.43Å; Y110-G114 PolarHBondContact O-N 2.86Å; Y110-G114 VanDerWaalsContact O-N 3.12Å; H111-G114 PolarHBondContact O-N 3.4Å; L112-G114 VanDerWaalsContact C-N 3.3Å; G114-R116 VanDerWaalsContact C-N 3.33Å; G114-R116 PolarHBondContact O-N 3.13Å
115	S	57.1	Low	63.7	Low	42 Å²	42	55.4 Å²	55.4	29%	0.294	27%	0.267	S	S	.	.			trans	-83.4	7.1	-167.2	62.9	0	0	0	0	116.1	D90 E117	D90-S115 PolarHBondContact OD1-N 3.21Å; D90-S115 VanDerWaalsContact OD2-CB 3.31Å; D90-S115 WeakPolarHBondContact OD2-CB 3.37Å; D90-S115 PolarHBondContact OD2-N 3.2Å; D90-S115 PolarHBondContact OD2-OG 3.13Å; S115-E117 PolarHBondContact O-N 2.95Å; S115-E117 WeakPolarHBondContact OG-CG 3.35Å
116	R	58.8	Low	64.3	Low	229 Å²	229	54 Å²	54	86%	0.864	26%	0.26	S	S	*	.			trans	53.6	30.9	-171	-63.3	-174.8	177.6	176.1	-2.8	113.5	G114	G114-R116 VanDerWaalsContact C-N 3.33Å; G114-R116 PolarHBondContact O-N 3.13Å
117	E	60.1	Low	64.9	Low	63 Å²	63	53.3 Å²	53.3	29%	0.294	26%	0.256	S	S	.	.			trans	-70.1	146.8	172.8	-83.2	-174.8	159.4	0	0	111.7	R45 S115 V119	R45-E117 VanDerWaalsContact CZ-CD 3.47Å; R45-E117 IonicContact CZ-OE1 2.76Å; R45-E117 IonicContact CZ-OE2 2.77Å; R45-E117 IonicContact NE-OE2 3.59Å; R45-E117 IonicContact NH1-OE1 3.69Å; R45-E117 PolarHBondContact NH1-OE1 3.48Å; R45-E117 IonicContact NH1-OE2 3.8Å; R45-E117 PolarHBondContact NH1-OE2 2.97Å; R45-E117 IonicContact NH2-OE1 3.67Å; R45-E117 PolarHBondContact NH2-OE1 2.68Å; R45-E117 IonicContact NH2-OE2 2.72Å; R45-E117 PolarHBondContact NH2-OE2 3.26Å; S115-E117 PolarHBondContact O-N 2.95Å; S115-E117 WeakPolarHBondContact OG-CG 3.35Å; E117-V119 PolarHBondContact O-N 3.11Å
118	Q	59.3	Low	65.3	Low	151 Å²	151	59 Å²	59	71%	0.706	28%	0.278	S	S	*	.			trans	-52.6	122.4	-179.8	-71.3	175.7	-21.9	0	0	110.9	D120 S121	Q118-D120 HydrophobicContact CB-CB 4.43Å; Q118-D120 PolarHBondContact O-N 3.16Å; Q118-S121 WeakPolarHBondContact O-CB 3.3Å; Q118-S121 PolarHBondContact O-N 3.06Å; Q118-S121 PolarHBondContact O-OG 2.9Å
119	V	62.3	Low	65.8	Low	7 Å²	7	61.6 Å²	61.6	4%	0.042	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-52.2	-28.3	-179.3	176.4	0	0	0	0	111.8	E117 S121 W122 Y126 V127 L130	E117-V119 PolarHBondContact O-N 3.11Å; V119-S121 PolarHBondContact O-N 3.06Å; V119-W122 PolarHBondContact O-N 3.34Å; V119-Y126 HydrophobicContact CG1-CD1 4.46Å; V119-Y126 HydrophobicContact CG1-CE1 4.5Å; V119-V127 HydrophobicContact CG1-CB 4.25Å; V119-V127 HydrophobicContact CG1-CG1 4.11Å; V119-V127 HydrophobicContact CG1-CG2 3.51Å; V119-L130 HydrophobicContact CG1-CD2 4.38Å
120	D	61	Low	66.3	Low	85 Å²	85	55.7 Å²	55.7	46%	0.455	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-47.4	-30.6	173.6	-57.2	5.4	0	0	0	114.4	Q118 W122 Y165	Q118-D120 HydrophobicContact CB-CB 4.43Å; Q118-D120 PolarHBondContact O-N 3.16Å; D120-W122 PolarHBondContact O-N 3.04Å; D120-Y165 HydrophobicContact CB-CD2 4.44Å; D120-Y165 HydrophobicContact CB-CE2 4.2Å; D120-Y165 WeakPolarHBondContact OD1-CD2 3.3Å
121	S	65.8	Low	67	Low	30 Å²	30	55.3 Å²	55.3	21%	0.21	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-75.8	-20.3	-168.8	60.6	0	0	0	0	115	R49 Q118 V119	R49-S121 WeakPolarHBondContact CG-O 3.43Å; Q118-S121 WeakPolarHBondContact O-CB 3.3Å; Q118-S121 PolarHBondContact O-N 3.06Å; Q118-S121 PolarHBondContact O-OG 2.9Å; V119-S121 PolarHBondContact O-N 3.06Å
122	W	66.3	Low	67.6	Low	12 Å²	12	57.6 Å²	57.6	5%	0.045	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-99.2	-8.3	-174.9	-67.6	97.2	0	0	0	114.3	R45 I48 T52 D90 I91 A94 V119 D120 Y126	R45-W122 HydrophobicContact CB-CH2 4.34Å; R45-W122 HydrophobicContact CG-CH2 3.87Å; R45-W122 HydrophobicContact CG-CZ2 4.05Å; I48-W122 HydrophobicContact CB-CZ3 3.88Å; I48-W122 HydrophobicContact CD1-CZ3 4.5Å; I48-W122 HydrophobicContact CG2-CE3 3.99Å; I48-W122 HydrophobicContact CG2-CZ3 3.55Å; T52-W122 WeakPolarHBondContact CB-O 3.06Å; T52-W122 PolarHBondContact OG1-O 3.35Å; D90-W122 HydrophobicContact CB-CZ2 4.33Å; I91-W122 HydrophobicContact CG1-CH2 4.26Å; A94-W122 HydrophobicContact CB-CD2 4.24Å; A94-W122 HydrophobicContact CB-CE3 3.66Å; A94-W122 HydrophobicContact CB-CH2 4.25Å; A94-W122 HydrophobicContact CB-CZ3 3.67Å; V119-W122 PolarHBondContact O-N 3.34Å; D120-W122 PolarHBondContact O-N 3.04Å; W122-Y126 HydrophobicContact CB-CD1 3.65Å; W122-Y126 HydrophobicContact CB-CD2 4.35Å; W122-Y126 HydrophobicContact CB-CE1 4.33Å; W122-Y126 HydrophobicContact CB-CG 3.66Å; W122-Y126 HydrophobicContact CG-CD1 4.33Å; W122-Y126 HydrophobicContact CG-CG 4.48Å
123	G	68.8	Low	68.2	Low	10 Å²	10	54.6 Å²	54.6	10%	0.103	27%	0.265	C	S	.	.			trans	94.8	163.4	176.3	0	0	0	0	0	114	E125 Y126 V127	G123-E125 VanDerWaalsContact C-N 3.34Å; G123-E125 PolarHBondContact O-N 3.35Å; G123-Y126 WeakPolarHBondContact O-CB 3.4Å; G123-Y126 PolarHBondContact O-N 3.2Å; G123-Y126 VanDerWaalsContact O-N 3.1Å; G123-V127 WeakPolarHBondContact O-CG2 3.34Å; G123-V127 PolarHBondContact O-N 3.1Å
124	H	69.7	Low	68.8	Low	66 Å²	66	50.9 Å²	50.9	31%	0.306	25%	0.246	S	C	.	.	H	α-helix	trans	-61.2	-35.4	-171.4	-173.7	66	0	0	0	113.9	Y126 V127 R128 Y165 F166 E174	H124-Y126 VanDerWaalsContact C-N 3.32Å; H124-Y126 PolarHBondContact O-N 3.04Å; H124-V127 PolarHBondContact O-N 2.89Å; H124-R128 WeakPolarHBondContact O-CB 3.49Å; H124-R128 PolarHBondContact O-N 3.37Å; H124-Y165 AromaticContact ND1-CE1 3.92Å; H124-F166 AromaticContact CE1-CE1 3.86Å; H124-E174 IonicContact CE1-OE2 3.77Å; H124-E174 PolarHBondContact CE1-OE2 3.3Å; H124-E174 VanDerWaalsContact CE1-OE2 3.26Å; H124-E174 IonicContact NE2-OE2 3.77Å; H124-E174 PolarHBondContact NE2-OE2 3.12Å
125	E	69.1	Low	69.4	Low	97 Å²	97	50.6 Å²	50.6	45%	0.453	24%	0.243	S	C	.	.	H	α-helix	trans	-64.1	-34.1	175.8	-71.4	-67.8	140.1	0	0	113	G123 H129	G123-E125 VanDerWaalsContact C-N 3.34Å; G123-E125 PolarHBondContact O-N 3.35Å; E125-H129 PolarHBondContact O-N 3.14Å
126	Y	74.1	Confident	70.4	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.008	25%	0.245	C	C	.	.	H	α-helix	trans	-67.8	-44.9	174.3	175.3	-98.5	0	0	0	110.9	S93 A94 M97 H111 V119 W122 G123 H124 R128 H129 L130	S93-Y126 PolarHBondContact OG-OH 2.72Å; S93-Y126 VanDerWaalsContact OG-OH 3.04Å; A94-Y126 HydrophobicContact CB-CE2 4.49Å; M97-Y126 HydrophobicContact CE-CD2 4.24Å; M97-Y126 HydrophobicContact CG-CD2 3.96Å; M97-Y126 WeakPolarHBondContact SD-CA 3.33Å; M97-Y126 HydrophobicContact SD-CD2 3.75Å; M97-Y126 HydrophobicContact SD-CG 4.21Å; H111-Y126 PolarHBondContact ND1-OH 2.86Å; V119-Y126 HydrophobicContact CG1-CD1 4.46Å; V119-Y126 HydrophobicContact CG1-CE1 4.5Å; W122-Y126 HydrophobicContact CB-CD1 3.65Å; W122-Y126 HydrophobicContact CB-CD2 4.35Å; W122-Y126 HydrophobicContact CB-CE1 4.33Å; W122-Y126 HydrophobicContact CB-CG 3.66Å; W122-Y126 HydrophobicContact CG-CD1 4.33Å; W122-Y126 HydrophobicContact CG-CG 4.48Å; G123-Y126 WeakPolarHBondContact O-CB 3.4Å; G123-Y126 PolarHBondContact O-N 3.2Å; G123-Y126 VanDerWaalsContact O-N 3.1Å; H124-Y126 VanDerWaalsContact C-N 3.32Å; H124-Y126 PolarHBondContact O-N 3.04Å; Y126-R128 VanDerWaalsContact C-N 3.27Å; Y126-R128 PolarHBondContact O-N 3.05Å; Y126-H129 PolarHBondContact O-N 3.27Å; Y126-L130 HydrophobicContact CE1-CD2 4.07Å; Y126-L130 WeakPolarHBondContact O-CB 3.41Å; Y126-L130 PolarHBondContact O-N 3.42Å
127	V	75.6	Confident	71	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.7	-40.8	177.6	-169.4	0	0	0	0	110.8	V119 G123 H124 L130 S131 I162 Y165 F166	V119-V127 HydrophobicContact CG1-CB 4.25Å; V119-V127 HydrophobicContact CG1-CG1 4.11Å; V119-V127 HydrophobicContact CG1-CG2 3.51Å; G123-V127 WeakPolarHBondContact O-CG2 3.34Å; G123-V127 PolarHBondContact O-N 3.1Å; H124-V127 PolarHBondContact O-N 2.89Å; V127-L130 PolarHBondContact O-N 3.3Å; V127-S131 WeakPolarHBondContact O-CB 3.5Å; V127-S131 PolarHBondContact O-N 3.39Å; V127-S131 PolarHBondContact O-OG 3.48Å; V127-I162 HydrophobicContact CG1-CG1 4.48Å; V127-I162 HydrophobicContact CG1-CG2 3.77Å; V127-Y165 HydrophobicContact CB-CD1 4.3Å; V127-Y165 HydrophobicContact CB-CE1 4.11Å; V127-Y165 HydrophobicContact CG1-CD1 3.93Å; V127-Y165 HydrophobicContact CG1-CE1 4.25Å; V127-Y165 HydrophobicContact CG2-CD1 3.97Å; V127-Y165 HydrophobicContact CG2-CE1 3.58Å; V127-F166 HydrophobicContact CG1-CE1 4.43Å; V127-F166 HydrophobicContact CG1-CE2 4.01Å; V127-F166 HydrophobicContact CG1-CZ 3.84Å
128	R	72.5	Confident	71.8	Confident	120 Å²	120	38.7 Å²	38.7	45%	0.453	20%	0.196	S	C	.	.	H	α-helix	trans	-65.9	-42.2	176.6	-173.5	-179.9	-178.4	150.6	11.1	113.1	H124 Y126 L130 S131 C132 E174	H124-R128 WeakPolarHBondContact O-CB 3.49Å; H124-R128 PolarHBondContact O-N 3.37Å; Y126-R128 VanDerWaalsContact C-N 3.27Å; Y126-R128 PolarHBondContact O-N 3.05Å; R128-L130 VanDerWaalsContact C-N 3.34Å; R128-S131 WeakPolarHBondContact CA-OG 3.48Å; R128-S131 PolarHBondContact O-OG 3.08Å; R128-C132 PolarHBondContact O-N 3.08Å; R128-C132 VanDerWaalsContact O-N 3.12Å; R128-C132 PolarHBondContact O-SG 3.26Å; R128-E174 IonicContact CZ-OE1 3.22Å; R128-E174 IonicContact NH1-OE1 2.82Å
129	H	75.3	Confident	72.4	Confident	54 Å²	54	36.6 Å²	36.6	25%	0.25	19%	0.186	C	C	.	.	H	α-helix	trans	-69.5	-37.7	176.5	-163.8	-73.5	0	0	0	111.5	M97 E125 Y126 C132 E133	M97-H129 HydrophobicContact CG-CB 4.2Å; M97-H129 PolarHBondContact O-NE2 3.04Å; E125-H129 PolarHBondContact O-N 3.14Å; Y126-H129 PolarHBondContact O-N 3.27Å; H129-C132 PolarHBondContact O-N 3.38Å; H129-E133 IonicContact CE1-OE1 3.32Å; H129-E133 PolarHBondContact CE1-OE1 3.45Å; H129-E133 IonicContact ND1-OE1 3.11Å; H129-E133 PolarHBondContact ND1-OE1 2.85Å; H129-E133 PolarHBondContact O-N 2.93Å
130	L	77.6	Confident	73	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-64.2	-43.3	175.9	-177.3	66.8	0	0	0	111	H111 V119 Y126 V127 R128 E133 I134 I162	H111-L130 HydrophobicContact CB-CD1 4.46Å; V119-L130 HydrophobicContact CG1-CD2 4.38Å; Y126-L130 HydrophobicContact CE1-CD2 4.07Å; Y126-L130 WeakPolarHBondContact O-CB 3.41Å; Y126-L130 PolarHBondContact O-N 3.42Å; V127-L130 PolarHBondContact O-N 3.3Å; R128-L130 VanDerWaalsContact C-N 3.34Å; L130-E133 PolarHBondContact O-N 3.21Å; L130-I134 HydrophobicContact CD1-CD1 4.28Å; L130-I134 HydrophobicContact CD2-CD1 4.49Å; L130-I134 HydrophobicContact CG-CD1 3.84Å; L130-I134 HydrophobicContact CG-CG1 4.48Å; L130-I134 WeakPolarHBondContact O-CB 3.2Å; L130-I134 WeakPolarHBondContact O-CD1 3.3Å; L130-I134 WeakPolarHBondContact O-CG1 3.4Å; L130-I134 PolarHBondContact O-N 3Å; L130-I162 HydrophobicContact CD2-CD1 3.9Å; L130-I162 HydrophobicContact CG-CD1 4.29Å
131	S	77.1	Confident	73.1	Confident	11 Å²	11	38.2 Å²	38.2	8%	0.077	19%	0.19	C	C	.	.	H	α-helix	trans	-61.6	-46.4	175.8	64	0	0	0	0	111.1	V127 R128 E133 I134 S135	V127-S131 WeakPolarHBondContact O-CB 3.5Å; V127-S131 PolarHBondContact O-N 3.39Å; V127-S131 PolarHBondContact O-OG 3.48Å; R128-S131 WeakPolarHBondContact CA-OG 3.48Å; R128-S131 PolarHBondContact O-OG 3.08Å; S131-E133 PolarHBondContact O-N 3.39Å; S131-I134 PolarHBondContact O-N 2.87Å; S131-S135 PolarHBondContact O-N 2.98Å; S131-S135 PolarHBondContact O-OG 2.55Å
132	C	76.9	Confident	72.8	Confident	67 Å²	67	40.8 Å²	40.8	45%	0.453	20%	0.2	S	C	.	.	H	α-helix	trans	-59.6	-41.7	176.2	-66.8	0	0	0	0	113	R128 H129 S135 T136	R128-C132 PolarHBondContact O-N 3.08Å; R128-C132 VanDerWaalsContact O-N 3.12Å; R128-C132 PolarHBondContact O-SG 3.26Å; H129-C132 PolarHBondContact O-N 3.38Å; C132-S135 PolarHBondContact O-N 3.02Å; C132-T136 WeakPolarHBondContact O-CG2 3.3Å; C132-T136 PolarHBondContact O-N 3.44Å; C132-T136 PolarHBondContact O-OG1 3.24Å
133	E	77.4	Confident	72.6	Confident	14 Å²	14	48 Å²	48	7%	0.065	23%	0.234	C	C	.	.	H	α-helix	trans	-68.3	-40.4	177.3	-79.1	-165.8	-154	0	0	112.1	C107 L108 H129 L130 S131 S135 T136 Q137	C107-E133 WeakPolarHBondContact CA-OE2 3.38Å; C107-E133 HydrophobicContact CB-CG 4.49Å; C107-E133 WeakPolarHBondContact CB-OE1 3.44Å; C107-E133 WeakPolarHBondContact CB-OE2 3.43Å; C107-E133 PolarHBondContact N-OE2 3.24Å; C107-E133 VanDerWaalsContact N-OE2 3.09Å; L108-E133 PolarHBondContact N-OE2 2.89Å; H129-E133 IonicContact CE1-OE1 3.32Å; H129-E133 PolarHBondContact CE1-OE1 3.45Å; H129-E133 IonicContact ND1-OE1 3.11Å; H129-E133 PolarHBondContact ND1-OE1 2.85Å; H129-E133 PolarHBondContact O-N 2.93Å; L130-E133 PolarHBondContact O-N 3.21Å; S131-E133 PolarHBondContact O-N 3.39Å; E133-S135 VanDerWaalsContact C-N 3.29Å; E133-S135 PolarHBondContact O-N 3.45Å; E133-T136 WeakPolarHBondContact CA-OG1 3.42Å; E133-T136 PolarHBondContact O-N 3.32Å; E133-T136 PolarHBondContact O-OG1 2.9Å; E133-Q137 WeakPolarHBondContact O-CB 3.06Å; E133-Q137 PolarHBondContact O-N 3.38Å
134	I	78.4	Confident	72.1	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-57.3	-46	174	-73.3	165.3	0	0	0	110	L108 L130 S131 Q137 W138 L155 L158 I162 F178 M182	L108-I134 HydrophobicContact CD1-CB 4.45Å; L108-I134 HydrophobicContact CD1-CD1 4.26Å; L108-I134 HydrophobicContact CD1-CG1 3.34Å; L130-I134 HydrophobicContact CD1-CD1 4.28Å; L130-I134 HydrophobicContact CD2-CD1 4.49Å; L130-I134 HydrophobicContact CG-CD1 3.84Å; L130-I134 HydrophobicContact CG-CG1 4.48Å; L130-I134 WeakPolarHBondContact O-CB 3.2Å; L130-I134 WeakPolarHBondContact O-CD1 3.3Å; L130-I134 WeakPolarHBondContact O-CG1 3.4Å; L130-I134 PolarHBondContact O-N 3Å; S131-I134 PolarHBondContact O-N 2.87Å; I134-Q137 PolarHBondContact O-N 3.34Å; I134-W138 WeakPolarHBondContact O-CB 3.41Å; I134-W138 PolarHBondContact O-N 3.12Å; I134-L155 HydrophobicContact CG1-CD2 4.35Å; I134-L155 HydrophobicContact CG2-CD2 4.26Å; I134-L158 HydrophobicContact CD1-CB 4.34Å; I134-I162 HydrophobicContact CD1-CD1 3.51Å; I134-F178 HydrophobicContact CB-CE2 4.05Å; I134-F178 HydrophobicContact CB-CZ 4.34Å; I134-F178 HydrophobicContact CD1-CZ 4.25Å; I134-F178 HydrophobicContact CG2-CE2 3.76Å; I134-F178 HydrophobicContact CG2-CZ 3.86Å; I134-M182 HydrophobicContact CG2-CE 3.86Å; I134-M182 HydrophobicContact CG2-SD 3.48Å; I134-M182 WeakPolarHBondContact CG2-SD 3.4Å
135	S	73.7	Confident	71.1	Confident	3 Å²	3	54.7 Å²	54.7	2%	0.021	27%	0.273	C	S	.	.	H	α-helix	trans	-61.2	-48	177.1	-54.3	0	0	0	0	111.9	S131 C132 E133 Q137 W138 E139 E181	S131-S135 PolarHBondContact O-N 2.98Å; S131-S135 PolarHBondContact O-OG 2.55Å; C132-S135 PolarHBondContact O-N 3.02Å; E133-S135 VanDerWaalsContact C-N 3.29Å; E133-S135 PolarHBondContact O-N 3.45Å; S135-Q137 VanDerWaalsContact C-N 3.32Å; S135-Q137 PolarHBondContact O-N 3Å; S135-W138 WeakPolarHBondContact O-CB 3.48Å; S135-W138 PolarHBondContact O-N 3.45Å; S135-E139 PolarHBondContact O-N 3.42Å; S135-E181 WeakPolarHBondContact CB-OE2 3.49Å; S135-E181 PolarHBondContact OG-OE2 2.96Å
136	T	78.3	Confident	69.9	Low	55 Å²	55	57.1 Å²	57.1	34%	0.337	29%	0.286	S	S	.	.	H	α-helix	trans	-64.2	-36.4	178.4	54.4	0	0	0	0	113	H105 C132 E133 W138 E139 E140	H105-T136 PolarHBondContact CE1-OG1 2.86Å; C132-T136 WeakPolarHBondContact O-CG2 3.3Å; C132-T136 PolarHBondContact O-N 3.44Å; C132-T136 PolarHBondContact O-OG1 3.24Å; E133-T136 WeakPolarHBondContact CA-OG1 3.42Å; E133-T136 PolarHBondContact O-N 3.32Å; E133-T136 PolarHBondContact O-OG1 2.9Å; T136-W138 VanDerWaalsContact C-N 3.35Å; T136-E139 PolarHBondContact O-N 2.93Å; T136-E140 WeakPolarHBondContact O-CG 3.46Å; T136-E140 PolarHBondContact O-N 3.09Å
137	Q	72.3	Confident	68.7	Low	20 Å²	20	64 Å²	64	9%	0.093	32%	0.318	C	S	.	.	H	α-helix	trans	-73	-32.5	177.1	-176.2	166.3	-28.3	0	0	111.5	L108 E133 I134 S135 E140 E141	L108-Q137 HydrophobicContact CD2-CG 4.5Å; E133-Q137 WeakPolarHBondContact O-CB 3.06Å; E133-Q137 PolarHBondContact O-N 3.38Å; I134-Q137 PolarHBondContact O-N 3.34Å; S135-Q137 VanDerWaalsContact C-N 3.32Å; S135-Q137 PolarHBondContact O-N 3Å; Q137-E140 PolarHBondContact O-N 3.44Å; Q137-E141 HydrophobicContact CG-CG 4.06Å; Q137-E141 WeakPolarHBondContact O-CB 3.38Å; Q137-E141 WeakPolarHBondContact O-CG 3Å; Q137-E141 PolarHBondContact O-N 3.36Å
138	W	76.4	Confident	67.6	Low	9 Å²	9	67.5 Å²	67.5	3%	0.034	34%	0.337	C	S	.	.	H	α-helix	trans	-61.4	-47.8	171.6	-174.2	-98.1	0	0	0	111	I134 S135 T136 E140 E141 M142 L152 L155 K156 M182	I134-W138 WeakPolarHBondContact O-CB 3.41Å; I134-W138 PolarHBondContact O-N 3.12Å; S135-W138 WeakPolarHBondContact O-CB 3.48Å; S135-W138 PolarHBondContact O-N 3.45Å; T136-W138 VanDerWaalsContact C-N 3.35Å; W138-E140 PolarHBondContact O-N 3.27Å; W138-E141 PolarHBondContact O-N 3.12Å; W138-M142 HydrophobicContact CD2-CE 4.12Å; W138-M142 VanDerWaalsContact CE2-CE 3.42Å; W138-M142 HydrophobicContact CH2-CE 3.69Å; W138-M142 HydrophobicContact CZ2-CE 3.2Å; W138-M142 HydrophobicContact CZ3-CE 4.34Å; W138-M142 WeakPolarHBondContact O-CB 3.41Å; W138-M142 VanDerWaalsContact O-CG 3.29Å; W138-M142 WeakPolarHBondContact O-CG 3.46Å; W138-M142 PolarHBondContact O-N 3.35Å; W138-L152 HydrophobicContact CE3-CD2 3.77Å; W138-L152 HydrophobicContact CH2-CD2 3.93Å; W138-L152 HydrophobicContact CZ3-CD2 3.37Å; W138-L155 HydrophobicContact CE3-CB 4.47Å; W138-L155 HydrophobicContact CE3-CD1 4.12Å; W138-K156 HydrophobicContact CH2-CG 4.46Å; W138-K156 HydrophobicContact CZ3-CG 4.37Å; W138-M182 HydrophobicContact CB-CE 4.14Å; W138-M182 HydrophobicContact CB-SD 3.73Å; W138-M182 HydrophobicContact CD2-CE 3.53Å; W138-M182 HydrophobicContact CD2-SD 4.07Å; W138-M182 HydrophobicContact CE3-CE 3.28Å; W138-M182 HydrophobicContact CE3-SD 4.35Å; W138-M182 HydrophobicContact CG-CE 3.93Å; W138-M182 HydrophobicContact CG-SD 3.81Å; W138-M182 WeakPolarHBondContact CZ2-O 3.2Å; W138-M182 HydrophobicContact CZ3-CE 3.84Å; W138-M182 PolarHBondContact NE1-O 3.37Å
139	E	73.1	Confident	67	Low	106 Å²	106	66.2 Å²	66.2	50%	0.495	34%	0.339	S	S	.	.	H	α-helix	trans	-58.4	-45.8	175.3	-70.8	177.4	179.7	0	0	112.3	S135 T136 M142 H143	S135-E139 PolarHBondContact O-N 3.42Å; T136-E139 PolarHBondContact O-N 2.93Å; E139-M142 PolarHBondContact O-N 2.84Å; E139-H143 PolarHBondContact O-CD2 3.05Å; E139-H143 PolarHBondContact O-N 3.4Å; E139-H143 VanDerWaalsContact O-N 3.13Å
140	E	72.9	Confident	66.4	Low	99 Å²	99	68.5 Å²	68.5	46%	0.463	36%	0.357	S	S	.	.	H	α-helix	trans	-67	-40.2	179.7	-75.7	-178.5	-166.3	0	0	113	H105 T136 Q137 W138 H143 S144	H105-E140 IonicContact CD2-OE2 2.65Å; H105-E140 PolarHBondContact CD2-OE2 2.82Å; H105-E140 IonicContact CE1-OE1 3.96Å; H105-E140 IonicContact CE1-OE2 3.21Å; H105-E140 IonicContact NE2-OE1 2.63Å; H105-E140 PolarHBondContact NE2-OE1 3.42Å; H105-E140 IonicContact NE2-OE2 3.01Å; H105-E140 PolarHBondContact NE2-OE2 2.97Å; T136-E140 WeakPolarHBondContact O-CG 3.46Å; T136-E140 PolarHBondContact O-N 3.09Å; Q137-E140 PolarHBondContact O-N 3.44Å; W138-E140 PolarHBondContact O-N 3.27Å; E140-H143 PolarHBondContact O-N 2.9Å; E140-S144 PolarHBondContact O-N 3.34Å
141	E	63.6	Low	65.6	Low	28 Å²	28	72 Å²	72	13%	0.131	37%	0.373	C	S	.	.	H	α-helix	trans	-71.7	-32.5	178.8	-68.1	-88.7	172.5	0	0	111	Q137 W138 S144 K151	Q137-E141 HydrophobicContact CG-CG 4.06Å; Q137-E141 WeakPolarHBondContact O-CB 3.38Å; Q137-E141 WeakPolarHBondContact O-CG 3Å; Q137-E141 PolarHBondContact O-N 3.36Å; W138-E141 PolarHBondContact O-N 3.12Å; E141-S144 PolarHBondContact O-N 3.1Å; E141-S144 PolarHBondContact O-OG 2.84Å; E141-K151 WeakPolarHBondContact OE1-CD 3.44Å; E141-K151 IonicContact OE1-NZ 2.71Å; E141-K151 PolarHBondContact OE1-NZ 3.19Å; E141-K151 IonicContact OE2-NZ 2.8Å
142	M	59.5	Low	65	Low	83 Å²	83	72.6 Å²	72.6	41%	0.409	38%	0.375	S	S	.	.	H	α-helix	trans	-66.1	-34.9	172.6	-75.9	-59.4	163.7	0	0	113.2	W138 E139 S144 L152	W138-M142 HydrophobicContact CD2-CE 4.12Å; W138-M142 VanDerWaalsContact CE2-CE 3.42Å; W138-M142 HydrophobicContact CH2-CE 3.69Å; W138-M142 HydrophobicContact CZ2-CE 3.2Å; W138-M142 HydrophobicContact CZ3-CE 4.34Å; W138-M142 WeakPolarHBondContact O-CB 3.41Å; W138-M142 VanDerWaalsContact O-CG 3.29Å; W138-M142 WeakPolarHBondContact O-CG 3.46Å; W138-M142 PolarHBondContact O-N 3.35Å; E139-M142 PolarHBondContact O-N 2.84Å; M142-S144 VanDerWaalsContact C-N 3.31Å; M142-L152 HydrophobicContact CE-CD2 4.09Å
143	H	63	Low	64.6	Low	164 Å²	164	76.3 Å²	76.3	76%	0.759	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-7.1	175	-72	-47.6	0	0	0	114.1	E139 E140	E139-H143 PolarHBondContact O-CD2 3.05Å; E139-H143 PolarHBondContact O-N 3.4Å; E139-H143 VanDerWaalsContact O-N 3.13Å; E140-H143 PolarHBondContact O-N 2.9Å
144	S	57.4	Low	64.2	Low	46 Å²	46	78.4 Å²	78.4	32%	0.322	40%	0.397	S	S	.	.	S	Bend	trans	-92.1	126.1	177.7	77.7	0	0	0	0	111.3	E140 E141 M142 M146	E140-S144 PolarHBondContact O-N 3.34Å; E141-S144 PolarHBondContact O-N 3.1Å; E141-S144 PolarHBondContact O-OG 2.84Å; M142-S144 VanDerWaalsContact C-N 3.31Å; S144-M146 PolarHBondContact O-N 3.32Å
145	D	48.2	Very low	63.7	Low	170 Å²	170	78.4 Å²	78.4	91%	0.909	40%	0.397	S	S	*	.	S	Bend	trans	-63.8	-3	-177.4	-67.9	-41.4	0	0	0	114.7
146	M	43.9	Very low	63.5	Low	149 Å²	149	81.9 Å²	81.9	73%	0.734	41%	0.412	S	S	*	.	S	Bend	trans	-117.8	85.4	-174.1	-67.1	-76.2	-72.5	0	0	110	S144 D148	S144-M146 PolarHBondContact O-N 3.32Å; M146-D148 PolarHBondContact O-N 3.25Å
147	Q	48.9	Very low	63.4	Low	146 Å²	146	83.7 Å²	83.7	68%	0.682	42%	0.419	S	S	*	.			trans	-60.5	99.6	176.6	-70.9	174.4	-22.9	0	0	111.4	D149	Q147-D149 VanDerWaalsContact C-N 3.28Å; Q147-D149 PolarHBondContact O-N 3.39Å
148	D	53.7	Low	63.3	Low	74 Å²	74	83.3 Å²	83.3	40%	0.396	42%	0.417	S	S	.	.			trans	-77.8	81.7	163.7	-84.6	-23.7	0	0	0	108.7	M146 T150 K151 L152	M146-D148 PolarHBondContact O-N 3.25Å; D148-T150 PolarHBondContact O-N 3.35Å; D148-K151 HydrophobicContact CB-CB 4.29Å; D148-K151 HydrophobicContact CB-CD 3.91Å; D148-K151 HydrophobicContact CB-CG 4.04Å; D148-K151 PolarHBondContact O-N 3.33Å; D148-K151 WeakPolarHBondContact OD2-CE 3.48Å; D148-K151 IonicContact OD2-NZ 3.32Å; D148-K151 PolarHBondContact OD2-NZ 3.44Å; D148-L152 PolarHBondContact O-N 3.18Å
149	D	60.1	Low	63.3	Low	93 Å²	93	83 Å²	83	50%	0.497	42%	0.416	S	S	.	.	H	α-helix	trans	-45.1	-31.3	177.5	-85.4	-17.5	0	0	0	113.8	Q147 K153	Q147-D149 VanDerWaalsContact C-N 3.28Å; Q147-D149 PolarHBondContact O-N 3.39Å; D149-K153 WeakPolarHBondContact O-CB 3.21Å; D149-K153 VanDerWaalsContact O-CG 3.26Å; D149-K153 WeakPolarHBondContact O-CG 3.48Å; D149-K153 PolarHBondContact O-N 3.4Å
150	T	63.2	Low	63.3	Low	102 Å²	102	83.9 Å²	83.9	63%	0.626	42%	0.415	S	S	*	.	H	α-helix	trans	-70.1	-38.3	179.4	49.2	0	0	0	0	112.9	D148 T154	D148-T150 PolarHBondContact O-N 3.35Å; T150-T154 PolarHBondContact O-N 3.27Å; T150-T154 PolarHBondContact O-OG1 2.98Å
151	K	60.8	Low	63.5	Low	74 Å²	74	84 Å²	84	32%	0.322	42%	0.415	S	S	.	.	H	α-helix	trans	-71.8	-44.3	176.7	-68.1	179.4	-170.8	153.1	0	110.1	E141 D148 K153 T154 L155	E141-K151 WeakPolarHBondContact OE1-CD 3.44Å; E141-K151 IonicContact OE1-NZ 2.71Å; E141-K151 PolarHBondContact OE1-NZ 3.19Å; E141-K151 IonicContact OE2-NZ 2.8Å; D148-K151 HydrophobicContact CB-CB 4.29Å; D148-K151 HydrophobicContact CB-CD 3.91Å; D148-K151 HydrophobicContact CB-CG 4.04Å; D148-K151 PolarHBondContact O-N 3.33Å; D148-K151 WeakPolarHBondContact OD2-CE 3.48Å; D148-K151 IonicContact OD2-NZ 3.32Å; D148-K151 PolarHBondContact OD2-NZ 3.44Å; K151-K153 VanDerWaalsContact C-N 3.33Å; K151-K153 PolarHBondContact O-N 3.47Å; K151-T154 CarbonylContact O-C 3.57Å; K151-T154 WeakPolarHBondContact O-CA 3.21Å; K151-T154 WeakPolarHBondContact O-CB 3.45Å; K151-T154 PolarHBondContact O-N 3.22Å; K151-L155 WeakPolarHBondContact O-CG 3.46Å; K151-L155 PolarHBondContact O-N 3.01Å
152	L	63.4	Low	64.1	Low	23 Å²	23	82.7 Å²	82.7	12%	0.12	41%	0.409	C	S	.	.	H	α-helix	trans	-57	-44.8	176.6	-70.4	164.9	0	0	0	111.9	W138 M142 D148 T154 L155 K156	W138-L152 HydrophobicContact CE3-CD2 3.77Å; W138-L152 HydrophobicContact CH2-CD2 3.93Å; W138-L152 HydrophobicContact CZ3-CD2 3.37Å; M142-L152 HydrophobicContact CE-CD2 4.09Å; D148-L152 PolarHBondContact O-N 3.18Å; L152-T154 VanDerWaalsContact C-N 3.27Å; L152-T154 PolarHBondContact O-N 3.05Å; L152-L155 PolarHBondContact O-N 2.86Å; L152-K156 WeakPolarHBondContact O-CG 3.38Å; L152-K156 PolarHBondContact O-N 3.28Å
153	K	67.9	Low	64.8	Low	144 Å²	144	78.8 Å²	78.8	63%	0.626	39%	0.39	S	S	*	.	H	α-helix	trans	-62.4	-35	174.2	-76.8	171.6	-175.9	168.2	0	113	D149 K151 L157	D149-K153 WeakPolarHBondContact O-CB 3.21Å; D149-K153 VanDerWaalsContact O-CG 3.26Å; D149-K153 WeakPolarHBondContact O-CG 3.48Å; D149-K153 PolarHBondContact O-N 3.4Å; K151-K153 VanDerWaalsContact C-N 3.33Å; K151-K153 PolarHBondContact O-N 3.47Å; K153-L157 PolarHBondContact O-N 3.41Å; K153-L157 VanDerWaalsContact O-N 3.16Å
154	T	68.8	Low	65.4	Low	58 Å²	58	72.4 Å²	72.4	36%	0.356	36%	0.364	S	S	.	.	H	α-helix	trans	-73.2	-39.6	179.5	-50.4	0	0	0	0	110.9	L112 T150 K151 L152 L157 L158	L112-T154 HydrophobicContact CD2-CG2 3.35Å; T150-T154 PolarHBondContact O-N 3.27Å; T150-T154 PolarHBondContact O-OG1 2.98Å; K151-T154 CarbonylContact O-C 3.57Å; K151-T154 WeakPolarHBondContact O-CA 3.21Å; K151-T154 WeakPolarHBondContact O-CB 3.45Å; K151-T154 PolarHBondContact O-N 3.22Å; L152-T154 VanDerWaalsContact C-N 3.27Å; L152-T154 PolarHBondContact O-N 3.05Å; T154-L157 PolarHBondContact O-N 3.22Å; T154-L158 WeakPolarHBondContact O-CG 3.47Å; T154-L158 PolarHBondContact O-N 3.29Å; T154-L158 VanDerWaalsContact O-N 3.07Å
155	L	69.2	Low	66.2	Low	1 Å²	1	71.2 Å²	71.2	1%	0.005	35%	0.352	C	S	.	.	H	α-helix	trans	-61.1	-47.7	172.9	-68.1	172.9	0	0	0	111.2	L108 I134 W138 K151 L152 L157 L158 T159 M182	L108-L155 HydrophobicContact CD1-CD2 3.69Å; L108-L155 HydrophobicContact CD2-CD2 3.64Å; L108-L155 HydrophobicContact CG-CD2 4.33Å; I134-L155 HydrophobicContact CG1-CD2 4.35Å; I134-L155 HydrophobicContact CG2-CD2 4.26Å; W138-L155 HydrophobicContact CE3-CB 4.47Å; W138-L155 HydrophobicContact CE3-CD1 4.12Å; K151-L155 WeakPolarHBondContact O-CG 3.46Å; K151-L155 PolarHBondContact O-N 3.01Å; L152-L155 PolarHBondContact O-N 2.86Å; L155-L157 VanDerWaalsContact C-N 3.26Å; L155-L157 PolarHBondContact O-N 2.88Å; L155-L158 WeakPolarHBondContact O-CB 3.4Å; L155-L158 PolarHBondContact O-N 3.04Å; L155-L158 VanDerWaalsContact O-N 3.11Å; L155-T159 PolarHBondContact O-N 3.48Å; L155-T159 PolarHBondContact O-OG1 3.45Å; L155-T159 VanDerWaalsContact O-OG1 3.06Å; L155-M182 HydrophobicContact CB-CE 4.42Å
156	K	69.2	Low	67.3	Low	75 Å²	75	63.2 Å²	63.2	33%	0.326	31%	0.309	S	S	.	.	H	α-helix	trans	-59	-35.8	176.1	-70	-169.5	-175	-132.9	0	113.1	W138 L152 R160 D184	W138-K156 HydrophobicContact CH2-CG 4.46Å; W138-K156 HydrophobicContact CZ3-CG 4.37Å; L152-K156 WeakPolarHBondContact O-CG 3.38Å; L152-K156 PolarHBondContact O-N 3.28Å; K156-R160 WeakPolarHBondContact O-CG 3.39Å; K156-R160 PolarHBondContact O-N 3.19Å; K156-R160 VanDerWaalsContact O-N 3.16Å; K156-D184 WeakPolarHBondContact CD-OD2 3.49Å; K156-D184 WeakPolarHBondContact CE-OD2 3.24Å; K156-D184 VanDerWaalsContact NZ-CG 3.25Å; K156-D184 IonicContact NZ-OD1 3.95Å; K156-D184 PolarHBondContact NZ-OD1 3Å; K156-D184 IonicContact NZ-OD2 3.86Å; K156-D184 PolarHBondContact NZ-OD2 3.1Å
157	L	75.7	Confident	68.6	Low	94 Å²	94	57.1 Å²	57.1	49%	0.492	28%	0.28	S	S	.	.	H	α-helix	trans	-69.6	-40.1	177.1	-168.6	131.6	0	0	0	111.7	K153 T154 L155 R160 E161	K153-L157 PolarHBondContact O-N 3.41Å; K153-L157 VanDerWaalsContact O-N 3.16Å; T154-L157 PolarHBondContact O-N 3.22Å; L155-L157 VanDerWaalsContact C-N 3.26Å; L155-L157 PolarHBondContact O-N 2.88Å; L157-R160 PolarHBondContact O-N 2.82Å; L157-E161 PolarHBondContact O-N 3.02Å
158	L	71.6	Confident	69.9	Low	12 Å²	12	58.3 Å²	58.3	6%	0.063	28%	0.282	C	S	.	.	H	α-helix	trans	-64.8	-42.1	173.9	-68.6	173.5	0	0	0	111.8	L108 L112 I134 T154 L155 R160 E161 I162	L108-L158 HydrophobicContact CD1-CD1 4.25Å; L112-L158 HydrophobicContact CD2-CD1 3.83Å; I134-L158 HydrophobicContact CD1-CB 4.34Å; T154-L158 WeakPolarHBondContact O-CG 3.47Å; T154-L158 PolarHBondContact O-N 3.29Å; T154-L158 VanDerWaalsContact O-N 3.07Å; L155-L158 WeakPolarHBondContact O-CB 3.4Å; L155-L158 PolarHBondContact O-N 3.04Å; L155-L158 VanDerWaalsContact O-N 3.11Å; L158-R160 VanDerWaalsContact C-N 3.28Å; L158-R160 PolarHBondContact O-N 3.18Å; L158-E161 PolarHBondContact O-N 3.31Å; L158-I162 WeakPolarHBondContact O-CG1 3.23Å; L158-I162 PolarHBondContact O-N 3.25Å
159	T	74.5	Confident	70.8	Confident	1 Å²	1	60 Å²	60	1%	0.006	29%	0.288	C	S	.	.	H	α-helix	trans	-56.3	-43.4	174.9	-59.2	0	0	0	0	111.4	L155 E161 I162 V163 F178 L179 M182 L187	L155-T159 PolarHBondContact O-N 3.48Å; L155-T159 PolarHBondContact O-OG1 3.45Å; L155-T159 VanDerWaalsContact O-OG1 3.06Å; T159-E161 VanDerWaalsContact C-N 3.25Å; T159-E161 PolarHBondContact O-N 3.48Å; T159-I162 PolarHBondContact O-N 3.33Å; T159-V163 HydrophobicContact CG2-CG2 4.16Å; T159-V163 VanDerWaalsContact O-CG2 3.23Å; T159-V163 WeakPolarHBondContact O-CG2 3.36Å; T159-V163 PolarHBondContact O-N 3.27Å; T159-F178 HydrophobicContact CG2-CD1 4.33Å; T159-F178 HydrophobicContact CG2-CE1 3.62Å; T159-F178 HydrophobicContact CG2-CZ 4.11Å; T159-L179 HydrophobicContact CG2-CD2 3.8Å; T159-M182 HydrophobicContact CG2-CG 4.47Å; T159-L187 HydrophobicContact CG2-CD1 4.19Å
160	R	74.8	Confident	71.3	Confident	126 Å²	126	61.4 Å²	61.4	48%	0.475	30%	0.295	S	S	.	.	H	α-helix	trans	-62.8	-27.3	176.3	-75.6	176	177.4	-159.4	-5.9	114.3	K156 L157 L158 P164 L187	K156-R160 WeakPolarHBondContact O-CG 3.39Å; K156-R160 PolarHBondContact O-N 3.19Å; K156-R160 VanDerWaalsContact O-N 3.16Å; L157-R160 PolarHBondContact O-N 2.82Å; L158-R160 VanDerWaalsContact C-N 3.28Å; L158-R160 PolarHBondContact O-N 3.18Å; R160-P164 WeakPolarHBondContact O-CD 3.5Å; R160-P164 WeakPolarHBondContact O-CG 3.48Å; R160-L187 HydrophobicContact CG-CD2 3.83Å
161	E	75.4	Confident	71.8	Confident	100 Å²	100	57 Å²	57	47%	0.467	27%	0.271	S	S	.	.	H	α-helix	trans	-82.5	-32.5	177	-68.2	179	179.2	0	0	111.9	L157 L158 T159	L157-E161 PolarHBondContact O-N 3.02Å; L158-E161 PolarHBondContact O-N 3.31Å; T159-E161 VanDerWaalsContact C-N 3.25Å; T159-E161 PolarHBondContact O-N 3.48Å
162	I	76.5	Confident	72.4	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-79.5	-39.3	-176.4	-69.3	167.8	0	0	0	112.4	V127 L130 I134 L158 T159 Y165 F166 F178	V127-I162 HydrophobicContact CG1-CG1 4.48Å; V127-I162 HydrophobicContact CG1-CG2 3.77Å; L130-I162 HydrophobicContact CD2-CD1 3.9Å; L130-I162 HydrophobicContact CG-CD1 4.29Å; I134-I162 HydrophobicContact CD1-CD1 3.51Å; L158-I162 WeakPolarHBondContact O-CG1 3.23Å; L158-I162 PolarHBondContact O-N 3.25Å; T159-I162 PolarHBondContact O-N 3.33Å; I162-Y165 VanDerWaalsContact O-CB 3.31Å; I162-Y165 WeakPolarHBondContact O-CB 3.21Å; I162-Y165 PolarHBondContact O-N 3.23Å; I162-Y165 VanDerWaalsContact O-N 3.08Å; I162-F166 HydrophobicContact CG2-CD2 3.49Å; I162-F166 VanDerWaalsContact CG2-CD2 3.49Å; I162-F166 HydrophobicContact CG2-CE2 3.19Å; I162-F166 HydrophobicContact CG2-CZ 4.26Å; I162-F166 PolarHBondContact O-N 3.48Å; I162-F178 HydrophobicContact CB-CE1 4.2Å; I162-F178 HydrophobicContact CD1-CZ 4.41Å; I162-F178 HydrophobicContact CG2-CD1 4.27Å; I162-F178 HydrophobicContact CG2-CE1 3.91Å
163	V	73.9	Confident	73.1	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.006	27%	0.27	C	S	.	.	H	α-helix	trans	-59.3	-45.3	-176.3	170.2	0	0	0	0	113.4	T159 Y165 F166 L167 F178 L179 F191	T159-V163 HydrophobicContact CG2-CG2 4.16Å; T159-V163 VanDerWaalsContact O-CG2 3.23Å; T159-V163 WeakPolarHBondContact O-CG2 3.36Å; T159-V163 PolarHBondContact O-N 3.27Å; V163-Y165 PolarHBondContact O-N 2.99Å; V163-F166 PolarHBondContact O-N 2.94Å; V163-L167 HydrophobicContact CG1-CD1 4.01Å; V163-L167 WeakPolarHBondContact O-CG 3.07Å; V163-L167 PolarHBondContact O-N 2.84Å; V163-L167 VanDerWaalsContact O-N 3.16Å; V163-F178 HydrophobicContact CG2-CD1 4.25Å; V163-F178 HydrophobicContact CG2-CE1 4.46Å; V163-L179 HydrophobicContact CG1-CD1 3.91Å; V163-L179 HydrophobicContact CG2-CD1 3.74Å; V163-L179 HydrophobicContact CG2-CD2 3.8Å; V163-L179 HydrophobicContact CG2-CG 3.85Å; V163-F191 HydrophobicContact CB-CD2 4.49Å; V163-F191 HydrophobicContact CG1-CD2 3.9Å
164	P	76.6	Confident	73.5	Confident	31 Å²	31	51 Å²	51	20%	0.201	25%	0.252	C	S	.	.	H	α-helix	trans	-62.6	-28.6	176.1	-22.2	33.7	0	0	0	113.3	R160 K168 F191	R160-P164 WeakPolarHBondContact O-CD 3.5Å; R160-P164 WeakPolarHBondContact O-CG 3.48Å; P164-K168 WeakPolarHBondContact O-CG 3.35Å; P164-K168 PolarHBondContact O-N 2.7Å; P164-K168 VanDerWaalsContact O-N 3.14Å; P164-F191 HydrophobicContact CB-CD1 4.27Å; P164-F191 HydrophobicContact CB-CE1 4.47Å; P164-F191 HydrophobicContact CG-CD1 3.62Å; P164-F191 HydrophobicContact CG-CD2 4.34Å; P164-F191 HydrophobicContact CG-CE1 3.48Å; P164-F191 VanDerWaalsContact CG-CE1 3.48Å; P164-F191 HydrophobicContact CG-CE2 4.22Å; P164-F191 HydrophobicContact CG-CG 4.05Å; P164-F191 HydrophobicContact CG-CZ 3.79Å
165	Y	73	Confident	74	Confident	21 Å²	21	48.4 Å²	48.4	8%	0.082	24%	0.237	C	C	.	.	H	α-helix	trans	-69.5	-47.6	177.8	177.9	-95.5	0	0	0	111	D120 H124 V127 I162 V163 L167 K168 H169	D120-Y165 HydrophobicContact CB-CD2 4.44Å; D120-Y165 HydrophobicContact CB-CE2 4.2Å; D120-Y165 WeakPolarHBondContact OD1-CD2 3.3Å; H124-Y165 AromaticContact ND1-CE1 3.92Å; V127-Y165 HydrophobicContact CB-CD1 4.3Å; V127-Y165 HydrophobicContact CB-CE1 4.11Å; V127-Y165 HydrophobicContact CG1-CD1 3.93Å; V127-Y165 HydrophobicContact CG1-CE1 4.25Å; V127-Y165 HydrophobicContact CG2-CD1 3.97Å; V127-Y165 HydrophobicContact CG2-CE1 3.58Å; I162-Y165 VanDerWaalsContact O-CB 3.31Å; I162-Y165 WeakPolarHBondContact O-CB 3.21Å; I162-Y165 PolarHBondContact O-N 3.23Å; I162-Y165 VanDerWaalsContact O-N 3.08Å; V163-Y165 PolarHBondContact O-N 2.99Å; Y165-L167 VanDerWaalsContact C-N 3.29Å; Y165-L167 PolarHBondContact O-N 3.41Å; Y165-K168 PolarHBondContact O-N 2.89Å; Y165-H169 AromaticContact CD2-CD2 3.73Å; Y165-H169 AromaticContact CD2-NE2 3.93Å; Y165-H169 AromaticContact CE1-CD2 3.86Å; Y165-H169 AromaticContact CE2-CD2 3.35Å; Y165-H169 WeakPolarHBondContact CE2-CD2 3.41Å; Y165-H169 AromaticContact CE2-NE2 3.24Å; Y165-H169 WeakPolarHBondContact CE2-NE2 3.46Å; Y165-H169 AromaticContact CZ-CD2 3.42Å; Y165-H169 VanDerWaalsContact CZ-CD2 3.42Å; Y165-H169 AromaticContact CZ-NE2 3.55Å; Y165-H169 PolarHBondContact O-CD2 3.19Å; Y165-H169 PolarHBondContact O-N 2.82Å
166	F	73.2	Confident	74.4	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.009	24%	0.237	C	C	.	.	H	α-helix	trans	-59.1	-41.7	176.1	-77.9	-63.3	0	0	0	111.9	H124 V127 I162 V163 K168 H169 G171 E174 A175	H124-F166 AromaticContact CE1-CE1 3.86Å; V127-F166 HydrophobicContact CG1-CE1 4.43Å; V127-F166 HydrophobicContact CG1-CE2 4.01Å; V127-F166 HydrophobicContact CG1-CZ 3.84Å; I162-F166 HydrophobicContact CG2-CD2 3.49Å; I162-F166 VanDerWaalsContact CG2-CD2 3.49Å; I162-F166 HydrophobicContact CG2-CE2 3.19Å; I162-F166 HydrophobicContact CG2-CZ 4.26Å; I162-F166 PolarHBondContact O-N 3.48Å; V163-F166 PolarHBondContact O-N 2.94Å; F166-K168 PolarHBondContact O-N 2.85Å; F166-H169 PolarHBondContact O-N 3.23Å; F166-G171 WeakPolarHBondContact O-CA 3.49Å; F166-G171 PolarHBondContact O-N 3.37Å; F166-E174 HydrophobicContact CD1-CB 4.06Å; F166-E174 HydrophobicContact CE1-CB 4.07Å; F166-E174 WeakPolarHBondContact CE1-OE2 3.31Å; F166-A175 HydrophobicContact CB-CB 3.71Å; F166-A175 HydrophobicContact CG-CB 4.42Å
167	L	71.1	Confident	75.1	Confident	21 Å²	21	47.7 Å²	47.7	11%	0.11	24%	0.237	C	C	.	.	H	α-helix	trans	-64.1	-41.9	178.8	-68.8	168.6	0	0	0	112.7	V163 Y165 H169 N170 E172 F191 I200	V163-L167 HydrophobicContact CG1-CD1 4.01Å; V163-L167 WeakPolarHBondContact O-CG 3.07Å; V163-L167 PolarHBondContact O-N 2.84Å; V163-L167 VanDerWaalsContact O-N 3.16Å; Y165-L167 VanDerWaalsContact C-N 3.29Å; Y165-L167 PolarHBondContact O-N 3.41Å; L167-H169 VanDerWaalsContact C-N 3.27Å; L167-H169 PolarHBondContact O-N 3.49Å; L167-N170 PolarHBondContact O-N 2.98Å; L167-E172 HydrophobicContact CD2-CG 4.11Å; L167-F191 HydrophobicContact CD1-CB 3.43Å; L167-F191 VanDerWaalsContact CD1-CB 3.43Å; L167-F191 WeakPolarHBondContact CD1-O 3.38Å; L167-I200 HydrophobicContact CD2-CD1 3.76Å
168	K	75.8	Confident	75.3	Confident	170 Å²	170	43.4 Å²	43.4	74%	0.739	21%	0.214	S	C	*	.	H	α-helix	trans	-65.5	-28.5	177.5	-76.4	176.2	-177.7	173.8	0	113.8	P164 Y165 F166	P164-K168 WeakPolarHBondContact O-CG 3.35Å; P164-K168 PolarHBondContact O-N 2.7Å; P164-K168 VanDerWaalsContact O-N 3.14Å; Y165-K168 PolarHBondContact O-N 2.89Å; F166-K168 PolarHBondContact O-N 2.85Å
169	H	72.5	Confident	75.6	Confident	111 Å²	111	42.9 Å²	42.9	51%	0.514	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	14.5	-178.4	-76.8	-72.7	0	0	0	114	Y165 F166 L167 G171	Y165-H169 AromaticContact CD2-CD2 3.73Å; Y165-H169 AromaticContact CD2-NE2 3.93Å; Y165-H169 AromaticContact CE1-CD2 3.86Å; Y165-H169 AromaticContact CE2-CD2 3.35Å; Y165-H169 WeakPolarHBondContact CE2-CD2 3.41Å; Y165-H169 AromaticContact CE2-NE2 3.24Å; Y165-H169 WeakPolarHBondContact CE2-NE2 3.46Å; Y165-H169 AromaticContact CZ-CD2 3.42Å; Y165-H169 VanDerWaalsContact CZ-CD2 3.42Å; Y165-H169 AromaticContact CZ-NE2 3.55Å; Y165-H169 PolarHBondContact O-CD2 3.19Å; Y165-H169 PolarHBondContact O-N 2.82Å; F166-H169 PolarHBondContact O-N 3.23Å; L167-H169 VanDerWaalsContact C-N 3.27Å; L167-H169 PolarHBondContact O-N 3.49Å; H169-G171 PolarHBondContact O-N 2.94Å
170	N	71.3	Confident	75.6	Confident	121 Å²	121	45.2 Å²	45.2	65%	0.647	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.5	20.1	-173.1	-60.1	-55.4	0	0	0	114.1	L167 E172	L167-N170 PolarHBondContact O-N 2.98Å; N170-E172 PolarHBondContact O-N 3.1Å
171	G	72.6	Confident	75.7	Confident	11 Å²	11	43.6 Å²	43.6	11%	0.113	22%	0.221	C	C	.	.			trans	-85.6	45.3	174.9	0	0	0	0	0	112.6	F166 H169 A173 E174 A175	F166-G171 WeakPolarHBondContact O-CA 3.49Å; F166-G171 PolarHBondContact O-N 3.37Å; H169-G171 PolarHBondContact O-N 2.94Å; G171-A173 PolarHBondContact O-N 3.41Å; G171-E174 PolarHBondContact O-N 3.16Å; G171-A175 PolarHBondContact O-N 3.04Å
172	E	72.9	Confident	75.4	Confident	17 Å²	17	38.9 Å²	38.9	8%	0.079	20%	0.199	C	C	.	.	H	α-helix	trans	-64.4	-37.5	-173.8	-65.6	163.6	-177.7	0	0	112.6	L167 N170 A175 C176 A196 R199 I200	L167-E172 HydrophobicContact CD2-CG 4.11Å; N170-E172 PolarHBondContact O-N 3.1Å; E172-A175 PolarHBondContact O-N 3.22Å; E172-C176 PolarHBondContact O-N 3.18Å; E172-C176 PolarHBondContact O-SG 3.3Å; E172-A196 HydrophobicContact CG-CB 4.37Å; E172-A196 WeakPolarHBondContact OE1-CA 3.44Å; E172-A196 VanDerWaalsContact OE1-CB 3.26Å; E172-A196 WeakPolarHBondContact OE1-CB 3.46Å; E172-R199 IonicContact OE1-NH1 3.98Å; E172-R199 WeakPolarHBondContact OE2-CB 3.39Å; E172-R199 WeakPolarHBondContact OE2-CD 3.29Å; E172-I200 HydrophobicContact CB-CG1 4.1Å; E172-I200 HydrophobicContact CG-CG1 4.26Å
173	A	78.6	Confident	75.2	Confident	42 Å²	42	44.6 Å²	44.6	35%	0.347	23%	0.225	S	C	.	.	H	α-helix	trans	-66.8	-44.8	176.3	0	0	0	0	0	111.5	G171 A175 C176 D177 Y203	G171-A173 PolarHBondContact O-N 3.41Å; A173-A175 VanDerWaalsContact C-N 3.3Å; A173-A175 PolarHBondContact O-N 3.31Å; A173-C176 PolarHBondContact O-N 3.14Å; A173-C176 VanDerWaalsContact O-N 3.13Å; A173-D177 VanDerWaalsContact O-CG 3.31Å; A173-D177 PolarHBondContact O-N 3.08Å; A173-Y203 HydrophobicContact CB-CD2 4.21Å; A173-Y203 HydrophobicContact CB-CE1 4.44Å; A173-Y203 HydrophobicContact CB-CE2 3.93Å
174	E	76.9	Confident	74.9	Confident	55 Å²	55	46.4 Å²	46.4	26%	0.257	24%	0.235	S	C	.	.	H	α-helix	trans	-64	-35.9	177.4	-61.7	-175.7	163.1	0	0	111.7	H124 R128 F166 G171 F178	H124-E174 IonicContact CE1-OE2 3.77Å; H124-E174 PolarHBondContact CE1-OE2 3.3Å; H124-E174 VanDerWaalsContact CE1-OE2 3.26Å; H124-E174 IonicContact NE2-OE2 3.77Å; H124-E174 PolarHBondContact NE2-OE2 3.12Å; R128-E174 IonicContact CZ-OE1 3.22Å; R128-E174 IonicContact NH1-OE1 2.82Å; F166-E174 HydrophobicContact CD1-CB 4.06Å; F166-E174 HydrophobicContact CE1-CB 4.07Å; F166-E174 WeakPolarHBondContact CE1-OE2 3.31Å; G171-E174 PolarHBondContact O-N 3.16Å; E174-F178 VanDerWaalsContact O-CB 3.29Å; E174-F178 WeakPolarHBondContact O-CB 3.38Å; E174-F178 PolarHBondContact O-N 3.46Å
175	A	78.4	Confident	74.6	Confident	4 Å²	4	45.6 Å²	45.6	3%	0.033	23%	0.229	C	C	.	.	H	α-helix	trans	-64.3	-41.9	173	0	0	0	0	0	112.2	F166 G171 E172 A173 L179	F166-A175 HydrophobicContact CB-CB 3.71Å; F166-A175 HydrophobicContact CG-CB 4.42Å; G171-A175 PolarHBondContact O-N 3.04Å; E172-A175 PolarHBondContact O-N 3.22Å; A173-A175 VanDerWaalsContact C-N 3.3Å; A173-A175 PolarHBondContact O-N 3.31Å; A175-L179 WeakPolarHBondContact O-CB 3.48Å; A175-L179 WeakPolarHBondContact O-CD1 3.46Å; A175-L179 VanDerWaalsContact O-CG 3.29Å; A175-L179 WeakPolarHBondContact O-CG 3.44Å; A175-L179 PolarHBondContact O-N 3.27Å
176	C	78.4	Confident	74.4	Confident	2 Å²	2	50 Å²	50	1%	0.014	25%	0.251	C	S	.	.	H	α-helix	trans	-67.1	-44.4	178.1	-66	0	0	0	0	111.2	E172 A173 F178 L179 M180 Y203 L204	E172-C176 PolarHBondContact O-N 3.18Å; E172-C176 PolarHBondContact O-SG 3.3Å; A173-C176 PolarHBondContact O-N 3.14Å; A173-C176 VanDerWaalsContact O-N 3.13Å; C176-F178 PolarHBondContact O-N 3.17Å; C176-L179 PolarHBondContact O-N 3.07Å; C176-M180 WeakPolarHBondContact O-CB 3.29Å; C176-M180 VanDerWaalsContact O-CG 3.31Å; C176-M180 WeakPolarHBondContact O-CG 3.31Å; C176-M180 PolarHBondContact O-N 3.37Å; C176-Y203 HydrophobicContact CB-CD1 3.47Å; C176-Y203 VanDerWaalsContact CB-CD1 3.47Å; C176-Y203 HydrophobicContact CB-CE1 3.57Å; C176-L204 HydrophobicContact CB-CD2 4.29Å
177	D	83.1	Confident	74.2	Confident	58 Å²	58	50.6 Å²	50.6	31%	0.31	25%	0.254	S	S	.	.	H	α-helix	trans	-60.1	-46.4	177.1	-69.1	-18	0	0	0	111	A173 L179 M180 E181 Y203	A173-D177 VanDerWaalsContact O-CG 3.31Å; A173-D177 PolarHBondContact O-N 3.08Å; D177-L179 VanDerWaalsContact C-N 3.31Å; D177-L179 PolarHBondContact O-N 3.15Å; D177-M180 WeakPolarHBondContact O-CB 3.4Å; D177-M180 PolarHBondContact O-N 3.22Å; D177-E181 WeakPolarHBondContact O-CG 3.24Å; D177-E181 PolarHBondContact O-N 3.16Å; D177-Y203 VanDerWaalsContact CG-OH 3.24Å; D177-Y203 WeakPolarHBondContact OD1-CE1 3.45Å; D177-Y203 PolarHBondContact OD1-OH 2.96Å; D177-Y203 PolarHBondContact OD2-OH 3.19Å
178	F	80.2	Confident	74.2	Confident	4 Å²	4	49.8 Å²	49.8	2%	0.018	25%	0.25	C	C	.	.	H	α-helix	trans	-61	-39.9	176.9	178.5	-126.8	0	0	0	112.4	I134 T159 I162 V163 E174 C176 E181 M182	I134-F178 HydrophobicContact CB-CE2 4.05Å; I134-F178 HydrophobicContact CB-CZ 4.34Å; I134-F178 HydrophobicContact CD1-CZ 4.25Å; I134-F178 HydrophobicContact CG2-CE2 3.76Å; I134-F178 HydrophobicContact CG2-CZ 3.86Å; T159-F178 HydrophobicContact CG2-CD1 4.33Å; T159-F178 HydrophobicContact CG2-CE1 3.62Å; T159-F178 HydrophobicContact CG2-CZ 4.11Å; I162-F178 HydrophobicContact CB-CE1 4.2Å; I162-F178 HydrophobicContact CD1-CZ 4.41Å; I162-F178 HydrophobicContact CG2-CD1 4.27Å; I162-F178 HydrophobicContact CG2-CE1 3.91Å; V163-F178 HydrophobicContact CG2-CD1 4.25Å; V163-F178 HydrophobicContact CG2-CE1 4.46Å; E174-F178 VanDerWaalsContact O-CB 3.29Å; E174-F178 WeakPolarHBondContact O-CB 3.38Å; E174-F178 PolarHBondContact O-N 3.46Å; C176-F178 PolarHBondContact O-N 3.17Å; F178-E181 PolarHBondContact O-N 3.26Å; F178-M182 HydrophobicContact CD2-CG 4.19Å; F178-M182 HydrophobicContact CE2-CG 3.86Å; F178-M182 HydrophobicContact CE2-SD 4.29Å; F178-M182 HydrophobicContact CZ-CG 4.15Å; F178-M182 WeakPolarHBondContact O-CB 3.35Å; F178-M182 WeakPolarHBondContact O-CG 3.16Å; F178-M182 PolarHBondContact O-N 3.24Å; F178-M182 VanDerWaalsContact O-N 3.1Å
179	L	77.5	Confident	74	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-74.7	-29.1	178.7	-75	168.1	0	0	0	113.2	T159 V163 A175 C176 D177 E183 D184 L187 I188	T159-L179 HydrophobicContact CG2-CD2 3.8Å; V163-L179 HydrophobicContact CG1-CD1 3.91Å; V163-L179 HydrophobicContact CG2-CD1 3.74Å; V163-L179 HydrophobicContact CG2-CD2 3.8Å; V163-L179 HydrophobicContact CG2-CG 3.85Å; A175-L179 WeakPolarHBondContact O-CB 3.48Å; A175-L179 WeakPolarHBondContact O-CD1 3.46Å; A175-L179 VanDerWaalsContact O-CG 3.29Å; A175-L179 WeakPolarHBondContact O-CG 3.44Å; A175-L179 PolarHBondContact O-N 3.27Å; C176-L179 PolarHBondContact O-N 3.07Å; D177-L179 VanDerWaalsContact C-N 3.31Å; D177-L179 PolarHBondContact O-N 3.15Å; L179-E183 PolarHBondContact O-N 3.14Å; L179-D184 PolarHBondContact O-N 3.37Å; L179-L187 HydrophobicContact CD2-CB 4.08Å; L179-L187 HydrophobicContact CD2-CD1 4.21Å; L179-I188 HydrophobicContact CB-CD1 4.43Å; L179-I188 HydrophobicContact CB-CG1 4.46Å; L179-I188 HydrophobicContact CD1-CB 4.42Å; L179-I188 HydrophobicContact CD1-CD1 3.83Å; L179-I188 HydrophobicContact CD1-CG1 3.16Å; L179-I188 HydrophobicContact CG-CG1 4.38Å
180	M	74.8	Confident	74	Confident	51 Å²	51	44 Å²	44	25%	0.251	23%	0.226	S	C	.	.	H	α-helix	trans	-65.3	-47.1	170.1	-78.2	172	31.8	0	0	110.9	C176 D177 M182 E183 V185 C207 V211 L219	C176-M180 WeakPolarHBondContact O-CB 3.29Å; C176-M180 VanDerWaalsContact O-CG 3.31Å; C176-M180 WeakPolarHBondContact O-CG 3.31Å; C176-M180 PolarHBondContact O-N 3.37Å; D177-M180 WeakPolarHBondContact O-CB 3.4Å; D177-M180 PolarHBondContact O-N 3.22Å; M180-M182 VanDerWaalsContact C-N 3.26Å; M180-M182 PolarHBondContact O-N 3.3Å; M180-E183 PolarHBondContact O-N 2.97Å; M180-E183 VanDerWaalsContact O-N 3.12Å; M180-V185 HydrophobicContact CG-CG2 4.47Å; M180-C207 HydrophobicContact SD-CB 4.29Å; M180-V211 HydrophobicContact CE-CG2 4.44Å; M180-L219 HydrophobicContact CG-CD2 4.11Å
181	E	76.2	Confident	73.7	Confident	92 Å²	92	41 Å²	41	43%	0.43	21%	0.207	S	C	.	.	H	α-helix	trans	-63.5	-31.3	177.7	-70.9	175.7	173.3	0	0	112.8	S135 D177 F178 E183	S135-E181 WeakPolarHBondContact CB-OE2 3.49Å; S135-E181 PolarHBondContact OG-OE2 2.96Å; D177-E181 WeakPolarHBondContact O-CG 3.24Å; D177-E181 PolarHBondContact O-N 3.16Å; F178-E181 PolarHBondContact O-N 3.26Å; E181-E183 VanDerWaalsContact C-N 3.3Å
182	M	70.5	Confident	73.4	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.005	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-0.9	177.1	-67.9	-60.3	-63.1	0	0	114.2	I134 W138 L155 T159 F178 M180 D184	I134-M182 HydrophobicContact CG2-CE 3.86Å; I134-M182 HydrophobicContact CG2-SD 3.48Å; I134-M182 WeakPolarHBondContact CG2-SD 3.4Å; W138-M182 HydrophobicContact CB-CE 4.14Å; W138-M182 HydrophobicContact CB-SD 3.73Å; W138-M182 HydrophobicContact CD2-CE 3.53Å; W138-M182 HydrophobicContact CD2-SD 4.07Å; W138-M182 HydrophobicContact CE3-CE 3.28Å; W138-M182 HydrophobicContact CE3-SD 4.35Å; W138-M182 HydrophobicContact CG-CE 3.93Å; W138-M182 HydrophobicContact CG-SD 3.81Å; W138-M182 WeakPolarHBondContact CZ2-O 3.2Å; W138-M182 HydrophobicContact CZ3-CE 3.84Å; W138-M182 PolarHBondContact NE1-O 3.37Å; L155-M182 HydrophobicContact CB-CE 4.42Å; T159-M182 HydrophobicContact CG2-CG 4.47Å; F178-M182 HydrophobicContact CD2-CG 4.19Å; F178-M182 HydrophobicContact CE2-CG 3.86Å; F178-M182 HydrophobicContact CE2-SD 4.29Å; F178-M182 HydrophobicContact CZ-CG 4.15Å; F178-M182 WeakPolarHBondContact O-CB 3.35Å; F178-M182 WeakPolarHBondContact O-CG 3.16Å; F178-M182 PolarHBondContact O-N 3.24Å; F178-M182 VanDerWaalsContact O-N 3.1Å; M180-M182 VanDerWaalsContact C-N 3.26Å; M180-M182 PolarHBondContact O-N 3.3Å; M182-D184 PolarHBondContact O-N 3.38Å
183	E	70.8	Confident	73.4	Confident	120 Å²	120	46 Å²	46	56%	0.561	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.1	7.2	-175.1	-60.5	-179.8	168.4	0	0	115.5	L179 M180 E181	L179-E183 PolarHBondContact O-N 3.14Å; M180-E183 PolarHBondContact O-N 2.97Å; M180-E183 VanDerWaalsContact O-N 3.12Å; E181-E183 VanDerWaalsContact C-N 3.3Å
184	D	68.5	Low	73	Confident	39 Å²	39	47.4 Å²	47.4	21%	0.209	25%	0.245	C	C	.	.			trans	-110.6	55.2	-174.9	-85.1	-20.8	0	0	0	111.1	K156 L179 M182 E186 L187	K156-D184 WeakPolarHBondContact CD-OD2 3.49Å; K156-D184 WeakPolarHBondContact CE-OD2 3.24Å; K156-D184 VanDerWaalsContact NZ-CG 3.25Å; K156-D184 IonicContact NZ-OD1 3.95Å; K156-D184 PolarHBondContact NZ-OD1 3Å; K156-D184 IonicContact NZ-OD2 3.86Å; K156-D184 PolarHBondContact NZ-OD2 3.1Å; L179-D184 PolarHBondContact O-N 3.37Å; M182-D184 PolarHBondContact O-N 3.38Å; D184-E186 PolarHBondContact O-N 3.33Å; D184-L187 HydrophobicContact CB-CD1 3.8Å; D184-L187 HydrophobicContact CB-CG 4.48Å; D184-L187 PolarHBondContact O-N 3.15Å
185	V	69.9	Low	72.8	Confident	14 Å²	14	53 Å²	53	9%	0.085	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-65.8	-22.1	-175.7	-168.7	0	0	0	0	112.7	M180 L187 I188 L219 T222	M180-V185 HydrophobicContact CG-CG2 4.47Å; V185-L187 PolarHBondContact O-N 3.32Å; V185-I188 HydrophobicContact CG1-CD1 3.71Å; V185-I188 HydrophobicContact CG1-CG1 4.36Å; V185-I188 WeakPolarHBondContact O-CB 3.24Å; V185-I188 WeakPolarHBondContact O-CG1 3.39Å; V185-I188 PolarHBondContact O-N 2.82Å; V185-L219 HydrophobicContact CB-CD2 4.27Å; V185-L219 HydrophobicContact CG1-CD2 3.9Å; V185-L219 HydrophobicContact CG2-CD2 3.75Å; V185-T222 HydrophobicContact CG1-CG2 3.96Å; V185-T222 WeakPolarHBondContact O-CG2 3.39Å
186	E	68.7	Low	72.5	Confident	113 Å²	113	53.2 Å²	53.2	53%	0.528	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-56.8	-23.7	176.7	-59.9	-164.6	134.6	0	0	113.5	D184 I188 E189 R225	D184-E186 PolarHBondContact O-N 3.33Å; E186-I188 PolarHBondContact O-N 3.24Å; E186-E189 VanDerWaalsContact O-CB 3.24Å; E186-E189 WeakPolarHBondContact O-CB 3.42Å; E186-E189 VanDerWaalsContact O-CG 3.24Å; E186-E189 WeakPolarHBondContact O-CG 3.49Å; E186-E189 PolarHBondContact O-N 3.32Å; E186-E189 VanDerWaalsContact O-N 3.17Å; E186-R225 IonicContact OE1-CZ 2.66Å; E186-R225 IonicContact OE1-NH1 2.73Å; E186-R225 PolarHBondContact OE1-NH1 3.35Å; E186-R225 IonicContact OE1-NH2 2.6Å
187	L	69.2	Low	72.4	Confident	15 Å²	15	54.6 Å²	54.6	8%	0.079	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-66.2	-21.8	178.4	-70.2	164.2	0	0	0	113.4	T159 R160 L179 D184 V185 E189 E190 F191	T159-L187 HydrophobicContact CG2-CD1 4.19Å; R160-L187 HydrophobicContact CG-CD2 3.83Å; L179-L187 HydrophobicContact CD2-CB 4.08Å; L179-L187 HydrophobicContact CD2-CD1 4.21Å; D184-L187 HydrophobicContact CB-CD1 3.8Å; D184-L187 HydrophobicContact CB-CG 4.48Å; D184-L187 PolarHBondContact O-N 3.15Å; V185-L187 PolarHBondContact O-N 3.32Å; L187-E189 PolarHBondContact O-N 2.97Å; L187-E190 PolarHBondContact O-N 3.18Å; L187-F191 WeakPolarHBondContact O-CD2 2.86Å
188	I	72.5	Confident	72.1	Confident	5 Å²	5	54.3 Å²	54.3	3%	0.026	28%	0.279	C	S	.	.	H	α-helix	trans	-57.7	-33.8	174.7	-65.6	-176	0	0	0	110.5	L179 V185 E186 E190 F191 C192 I200 L204 I226	L179-I188 HydrophobicContact CB-CD1 4.43Å; L179-I188 HydrophobicContact CB-CG1 4.46Å; L179-I188 HydrophobicContact CD1-CB 4.42Å; L179-I188 HydrophobicContact CD1-CD1 3.83Å; L179-I188 HydrophobicContact CD1-CG1 3.16Å; L179-I188 HydrophobicContact CG-CG1 4.38Å; V185-I188 HydrophobicContact CG1-CD1 3.71Å; V185-I188 HydrophobicContact CG1-CG1 4.36Å; V185-I188 WeakPolarHBondContact O-CB 3.24Å; V185-I188 WeakPolarHBondContact O-CG1 3.39Å; V185-I188 PolarHBondContact O-N 2.82Å; E186-I188 PolarHBondContact O-N 3.24Å; I188-E190 PolarHBondContact O-N 3.11Å; I188-E190 VanDerWaalsContact O-N 3.1Å; I188-F191 PolarHBondContact O-N 3.32Å; I188-F191 VanDerWaalsContact O-N 3.15Å; I188-C192 WeakPolarHBondContact CG2-SG 3.42Å; I188-C192 PolarHBondContact O-N 3.32Å; I188-C192 PolarHBondContact O-SG 3.46Å; I188-I200 HydrophobicContact CG2-CG2 4.06Å; I188-L204 HydrophobicContact CD1-CD1 4.28Å; I188-I226 HydrophobicContact CB-CD1 4.39Å; I188-I226 HydrophobicContact CG2-CD1 3.63Å
189	E	69.8	Low	71.9	Confident	32 Å²	32	61 Å²	61	15%	0.15	30%	0.304	C	S	.	.	H	α-helix	trans	-61.9	-23.5	-173.2	-63.4	-173.6	-157.1	0	0	114.4	E186 L187 T222 R225 I226 K229	E186-E189 VanDerWaalsContact O-CB 3.24Å; E186-E189 WeakPolarHBondContact O-CB 3.42Å; E186-E189 VanDerWaalsContact O-CG 3.24Å; E186-E189 WeakPolarHBondContact O-CG 3.49Å; E186-E189 PolarHBondContact O-N 3.32Å; E186-E189 VanDerWaalsContact O-N 3.17Å; L187-E189 PolarHBondContact O-N 2.97Å; E189-T222 HydrophobicContact CG-CG2 4.19Å; E189-R225 WeakPolarHBondContact OE1-CD 3.34Å; E189-R225 IonicContact OE1-CZ 3.26Å; E189-R225 IonicContact OE1-NE 3.62Å; E189-R225 IonicContact OE1-NH1 2.63Å; E189-R225 PolarHBondContact OE1-NH1 3.07Å; E189-I226 HydrophobicContact CG-CG1 4.49Å; E189-K229 VanDerWaalsContact CB-NZ 3.31Å; E189-K229 PolarHBondContact O-NZ 3.21Å; E189-K229 WeakPolarHBondContact OE2-CE 3.36Å; E189-K229 IonicContact OE2-NZ 3.92Å; E189-K229 PolarHBondContact OE2-NZ 3.41Å
190	E	73.1	Confident	72	Confident	127 Å²	127	61 Å²	61	59%	0.593	30%	0.304	S	S	*	.	H	α-helix	trans	-86.2	-22	-178.4	-66.1	-174.5	175	0	0	112.9	L187 I188	L187-E190 PolarHBondContact O-N 3.18Å; I188-E190 PolarHBondContact O-N 3.11Å; I188-E190 VanDerWaalsContact O-N 3.1Å
191	F	65.9	Low	72.1	Confident	58 Å²	58	58.6 Å²	58.6	25%	0.254	29%	0.292	S	S	.	.	H	α-helix	trans	-116.1	1.4	-169	-57.1	-66.4	0	0	0	114.5	V163 P164 L167 L187 I188 D193	V163-F191 HydrophobicContact CB-CD2 4.49Å; V163-F191 HydrophobicContact CG1-CD2 3.9Å; P164-F191 HydrophobicContact CB-CD1 4.27Å; P164-F191 HydrophobicContact CB-CE1 4.47Å; P164-F191 HydrophobicContact CG-CD1 3.62Å; P164-F191 HydrophobicContact CG-CD2 4.34Å; P164-F191 HydrophobicContact CG-CE1 3.48Å; P164-F191 VanDerWaalsContact CG-CE1 3.48Å; P164-F191 HydrophobicContact CG-CE2 4.22Å; P164-F191 HydrophobicContact CG-CG 4.05Å; P164-F191 HydrophobicContact CG-CZ 3.79Å; L167-F191 HydrophobicContact CD1-CB 3.43Å; L167-F191 VanDerWaalsContact CD1-CB 3.43Å; L167-F191 WeakPolarHBondContact CD1-O 3.38Å; L187-F191 WeakPolarHBondContact O-CD2 2.86Å; I188-F191 PolarHBondContact O-N 3.32Å; I188-F191 VanDerWaalsContact O-N 3.15Å; F191-D193 PolarHBondContact O-N 3.02Å
192	C	66.1	Low	72.3	Confident	23 Å²	23	60.1 Å²	60.1	16%	0.155	30%	0.303	C	S	.	.			trans	-68.5	121.3	177.5	-73.6	0	0	0	0	112.7	I188 F230	I188-C192 WeakPolarHBondContact CG2-SG 3.42Å; I188-C192 PolarHBondContact O-N 3.32Å; I188-C192 PolarHBondContact O-SG 3.46Å; C192-F230 HydrophobicContact CB-CE2 3.7Å; C192-F230 HydrophobicContact CB-CZ 3.74Å; C192-F230 WeakPolarHBondContact O-CZ 3.26Å
193	D	71.5	Confident	72.9	Confident	109 Å²	109	63.1 Å²	63.1	58%	0.583	31%	0.314	S	S	*	.			trans	-89.6	159.2	167.7	-75.1	-37.6	0	0	0	112.3	F191 E195 A196 Y197	F191-D193 PolarHBondContact O-N 3.02Å; D193-E195 PolarHBondContact O-N 3.2Å; D193-E195 VanDerWaalsContact O-N 3.11Å; D193-A196 PolarHBondContact O-N 3.4Å; D193-A196 VanDerWaalsContact O-N 3.15Å; D193-Y197 PolarHBondContact O-N 2.84Å; D193-Y197 VanDerWaalsContact O-N 3.14Å
194	A	70	Confident	73.3	Confident	72 Å²	72	57.4 Å²	57.4	60%	0.595	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-16.7	178.4	0	0	0	0	0	114.6	Y197 F230	A194-Y197 VanDerWaalsContact O-CD1 3.22Å; A194-Y197 WeakPolarHBondContact O-CD1 3.43Å; A194-Y197 WeakPolarHBondContact O-CE1 3.43Å; A194-F230 HydrophobicContact CB-CE1 4.35Å
195	E	72.8	Confident	73.8	Confident	174 Å²	174	57.2 Å²	57.2	81%	0.813	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-29.7	176	-63.7	-168.7	168.5	0	0	112.7	D193 P198	D193-E195 PolarHBondContact O-N 3.2Å; D193-E195 VanDerWaalsContact O-N 3.11Å; E195-P198 WeakPolarHBondContact O-CD 3.43Å
196	A	72.5	Confident	74.1	Confident	8 Å²	8	59.2 Å²	59.2	7%	0.066	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-31.2	-173.4	0	0	0	0	0	113.1	E172 D193 P198 R199 I200	E172-A196 HydrophobicContact CG-CB 4.37Å; E172-A196 WeakPolarHBondContact OE1-CA 3.44Å; E172-A196 VanDerWaalsContact OE1-CB 3.26Å; E172-A196 WeakPolarHBondContact OE1-CB 3.46Å; D193-A196 PolarHBondContact O-N 3.4Å; D193-A196 VanDerWaalsContact O-N 3.15Å; A196-P198 VanDerWaalsContact C-CD 3.41Å; A196-R199 PolarHBondContact O-N 3.38Å; A196-R199 VanDerWaalsContact O-N 3.13Å; A196-I200 HydrophobicContact CB-CD1 3.92Å; A196-I200 WeakPolarHBondContact O-CG1 3.42Å; A196-I200 PolarHBondContact O-N 3.02Å
197	Y	76	Confident	74.6	Confident	31 Å²	31	54.4 Å²	54.4	12%	0.122	28%	0.28	C	S	.	.	H	α-helix	trans	-55	-39.8	-176.2	81	-92.7	0	0	0	115.7	D193 A194 R199 I200 C201 F230 R232	D193-Y197 PolarHBondContact O-N 2.84Å; D193-Y197 VanDerWaalsContact O-N 3.14Å; A194-Y197 VanDerWaalsContact O-CD1 3.22Å; A194-Y197 WeakPolarHBondContact O-CD1 3.43Å; A194-Y197 WeakPolarHBondContact O-CE1 3.43Å; Y197-R199 VanDerWaalsContact C-N 3.26Å; Y197-R199 PolarHBondContact O-N 3.14Å; Y197-I200 PolarHBondContact O-N 3.39Å; Y197-C201 VanDerWaalsContact O-CB 3.31Å; Y197-C201 WeakPolarHBondContact O-CB 3.37Å; Y197-C201 PolarHBondContact O-N 3.08Å; Y197-C201 PolarHBondContact O-SG 3.04Å; Y197-F230 AromaticContact CD1-CD1 3.79Å; Y197-F230 HydrophobicContact CD1-CD1 3.79Å; Y197-F230 AromaticContact CD1-CD2 3.95Å; Y197-F230 HydrophobicContact CD1-CD2 3.95Å; Y197-F230 AromaticContact CD1-CE1 3.81Å; Y197-F230 HydrophobicContact CD1-CE1 3.81Å; Y197-F230 HydrophobicContact CD1-CE2 4.01Å; Y197-F230 AromaticContact CD1-CG 3.86Å; Y197-F230 HydrophobicContact CD1-CG 3.86Å; Y197-F230 AromaticContact CD1-CZ 3.92Å; Y197-F230 HydrophobicContact CD1-CZ 3.92Å; Y197-F230 HydrophobicContact CD2-CD2 4.04Å; Y197-F230 HydrophobicContact CD2-CG 4.26Å; Y197-F230 HydrophobicContact CE1-CD1 4Å; Y197-F230 HydrophobicContact CE1-CE1 4.37Å; Y197-F230 HydrophobicContact CE1-CG 4.16Å; Y197-F230 HydrophobicContact CG-CD1 4.29Å; Y197-F230 AromaticContact CG-CD2 3.59Å; Y197-F230 HydrophobicContact CG-CD2 3.59Å; Y197-F230 HydrophobicContact CG-CE1 4.38Å; Y197-F230 AromaticContact CG-CE2 3.74Å; Y197-F230 HydrophobicContact CG-CE2 3.74Å; Y197-F230 AromaticContact CG-CG 3.91Å; Y197-F230 HydrophobicContact CG-CG 3.91Å; Y197-F230 HydrophobicContact CG-CZ 4.12Å; Y197-R232 VanDerWaalsContact CE2-NE 3.35Å; Y197-R232 VanDerWaalsContact CZ-NH2 3.33Å; Y197-R232 PolarHBondContact OH-NE 3.23Å; Y197-R232 PolarHBondContact OH-NH2 3.45Å
198	P	76.8	Confident	74.8	Confident	51 Å²	51	54.7 Å²	54.7	33%	0.331	28%	0.282	S	S	.	.	H	α-helix	trans	-67.2	-30.8	-178.1	27	-35.4	0	0	0	112.1	E195 A196 L202	E195-P198 WeakPolarHBondContact O-CD 3.43Å; A196-P198 VanDerWaalsContact C-CD 3.41Å; P198-L202 VanDerWaalsContact O-CB 3.26Å; P198-L202 WeakPolarHBondContact O-CB 3.35Å; P198-L202 PolarHBondContact O-N 3.35Å; P198-L202 VanDerWaalsContact O-N 3.13Å
199	R	76.8	Confident	74.7	Confident	144 Å²	144	57.8 Å²	57.8	54%	0.543	30%	0.302	S	S	.	.	H	α-helix	trans	-78.5	-44.5	178.7	-68.3	174.9	-176.6	167.8	4.1	111.1	E172 A196 Y197 C201 L202 Y203	E172-R199 IonicContact OE1-NH1 3.98Å; E172-R199 WeakPolarHBondContact OE2-CB 3.39Å; E172-R199 WeakPolarHBondContact OE2-CD 3.29Å; A196-R199 PolarHBondContact O-N 3.38Å; A196-R199 VanDerWaalsContact O-N 3.13Å; Y197-R199 VanDerWaalsContact C-N 3.26Å; Y197-R199 PolarHBondContact O-N 3.14Å; R199-C201 PolarHBondContact O-N 2.97Å; R199-L202 PolarHBondContact O-N 3.16Å; R199-Y203 WeakPolarHBondContact O-CB 2.8Å; R199-Y203 PolarHBondContact O-N 3.4Å
200	I	79.9	Confident	74.8	Confident	2 Å²	2	65 Å²	65	1%	0.01	33%	0.329	C	S	.	.	H	α-helix	trans	-57.8	-48.8	174.1	-66.5	167.6	0	0	0	110.1	L167 E172 I188 A196 Y197 L202 Y203 L204	L167-I200 HydrophobicContact CD2-CD1 3.76Å; E172-I200 HydrophobicContact CB-CG1 4.1Å; E172-I200 HydrophobicContact CG-CG1 4.26Å; I188-I200 HydrophobicContact CG2-CG2 4.06Å; A196-I200 HydrophobicContact CB-CD1 3.92Å; A196-I200 WeakPolarHBondContact O-CG1 3.42Å; A196-I200 PolarHBondContact O-N 3.02Å; Y197-I200 PolarHBondContact O-N 3.39Å; I200-L202 PolarHBondContact O-N 3.23Å; I200-Y203 PolarHBondContact O-N 3.36Å; I200-L204 HydrophobicContact CG2-CD1 3.8Å; I200-L204 HydrophobicContact CG2-CG 4.32Å; I200-L204 WeakPolarHBondContact O-CG 3.37Å; I200-L204 PolarHBondContact O-N 2.72Å
201	C	77	Confident	74.7	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-64.9	-39.9	179.9	-62.9	0	0	0	0	111.8	Y197 R199 Y203 M205 Y227	Y197-C201 VanDerWaalsContact O-CB 3.31Å; Y197-C201 WeakPolarHBondContact O-CB 3.37Å; Y197-C201 PolarHBondContact O-N 3.08Å; Y197-C201 PolarHBondContact O-SG 3.04Å; R199-C201 PolarHBondContact O-N 2.97Å; C201-Y203 VanDerWaalsContact C-N 3.32Å; C201-Y203 PolarHBondContact O-N 2.83Å; C201-M205 VanDerWaalsContact O-CB 3.22Å; C201-M205 WeakPolarHBondContact O-CB 3.34Å; C201-M205 WeakPolarHBondContact O-CG 3.41Å; C201-M205 PolarHBondContact O-N 2.83Å; C201-Y227 HydrophobicContact CB-CE1 3.99Å; C201-Y227 HydrophobicContact CB-CE2 4.22Å; C201-Y227 VanDerWaalsContact CB-OH 3.27Å; C201-Y227 WeakPolarHBondContact CB-OH 3.34Å
202	L	79.5	Confident	74.8	Confident	125 Å²	125	61 Å²	61	65%	0.654	32%	0.32	S	S	*	.	H	α-helix	trans	-63.8	-40.4	176.1	-173	150.2	0	0	0	111.3	P198 R199 I200 S206	P198-L202 VanDerWaalsContact O-CB 3.26Å; P198-L202 WeakPolarHBondContact O-CB 3.35Å; P198-L202 PolarHBondContact O-N 3.35Å; P198-L202 VanDerWaalsContact O-N 3.13Å; R199-L202 PolarHBondContact O-N 3.16Å; I200-L202 PolarHBondContact O-N 3.23Å; L202-S206 WeakPolarHBondContact O-CB 3.48Å; L202-S206 PolarHBondContact O-N 3.05Å; L202-S206 PolarHBondContact O-OG 3.37Å
203	Y	83	Confident	74.6	Confident	63 Å²	63	61.7 Å²	61.7	25%	0.247	32%	0.321	C	S	.	.	H	α-helix	trans	-63.3	-54.1	176.1	-171.9	-104.6	0	0	0	111.4	A173 C176 D177 R199 I200 C201 M205 S206 C207	A173-Y203 HydrophobicContact CB-CD2 4.21Å; A173-Y203 HydrophobicContact CB-CE1 4.44Å; A173-Y203 HydrophobicContact CB-CE2 3.93Å; C176-Y203 HydrophobicContact CB-CD1 3.47Å; C176-Y203 VanDerWaalsContact CB-CD1 3.47Å; C176-Y203 HydrophobicContact CB-CE1 3.57Å; D177-Y203 VanDerWaalsContact CG-OH 3.24Å; D177-Y203 WeakPolarHBondContact OD1-CE1 3.45Å; D177-Y203 PolarHBondContact OD1-OH 2.96Å; D177-Y203 PolarHBondContact OD2-OH 3.19Å; R199-Y203 WeakPolarHBondContact O-CB 2.8Å; R199-Y203 PolarHBondContact O-N 3.4Å; I200-Y203 PolarHBondContact O-N 3.36Å; C201-Y203 VanDerWaalsContact C-N 3.32Å; C201-Y203 PolarHBondContact O-N 2.83Å; Y203-M205 VanDerWaalsContact C-N 3.31Å; Y203-M205 PolarHBondContact O-N 3.25Å; Y203-S206 CarbonylContact O-C 3.55Å; Y203-S206 WeakPolarHBondContact O-CA 3.15Å; Y203-S206 WeakPolarHBondContact O-CB 3.47Å; Y203-S206 PolarHBondContact O-N 3.45Å; Y203-S206 PolarHBondContact O-OG 3.05Å; Y203-C207 PolarHBondContact O-N 3.3Å; Y203-C207 PolarHBondContact O-SG 3.22Å
204	L	80.2	Confident	74.3	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-58.5	-42.7	178.8	-68.2	173.7	0	0	0	111.8	C176 I188 I200 S206 C207 V208 L219 V223 I226	C176-L204 HydrophobicContact CB-CD2 4.29Å; I188-L204 HydrophobicContact CD1-CD1 4.28Å; I200-L204 HydrophobicContact CG2-CD1 3.8Å; I200-L204 HydrophobicContact CG2-CG 4.32Å; I200-L204 WeakPolarHBondContact O-CG 3.37Å; I200-L204 PolarHBondContact O-N 2.72Å; L204-S206 VanDerWaalsContact C-N 3.25Å; L204-S206 PolarHBondContact O-N 3.24Å; L204-C207 PolarHBondContact O-N 2.95Å; L204-C207 VanDerWaalsContact O-N 3.09Å; L204-V208 WeakPolarHBondContact O-CG2 3.33Å; L204-V208 PolarHBondContact O-N 3.03Å; L204-L219 HydrophobicContact CD2-CD2 4.26Å; L204-V223 HydrophobicContact CB-CG2 3.45Å; L204-V223 VanDerWaalsContact CB-CG2 3.45Å; L204-V223 HydrophobicContact CD1-CG2 3.6Å; L204-V223 HydrophobicContact CG-CG2 4.16Å; L204-I226 HydrophobicContact CD1-CD1 4.29Å
205	M	77.6	Confident	74.3	Confident	36 Å²	36	61 Å²	61	18%	0.177	31%	0.309	C	S	.	.	H	α-helix	trans	-64	-29.2	174.7	-73.3	-64.9	-61.8	0	0	113	C201 Y203 L220 V223	C201-M205 VanDerWaalsContact O-CB 3.22Å; C201-M205 WeakPolarHBondContact O-CB 3.34Å; C201-M205 WeakPolarHBondContact O-CG 3.41Å; C201-M205 PolarHBondContact O-N 2.83Å; Y203-M205 VanDerWaalsContact C-N 3.31Å; Y203-M205 PolarHBondContact O-N 3.25Å; M205-L220 HydrophobicContact SD-CD2 3.97Å; M205-V223 HydrophobicContact CG-CG1 4.29Å; M205-V223 HydrophobicContact SD-CG1 4.15Å
206	S	77.5	Confident	74.4	Confident	55 Å²	55	53.8 Å²	53.8	39%	0.385	28%	0.276	S	S	.	.	H	α-helix	trans	-78.3	-23.3	173.8	74.6	0	0	0	0	113.1	L202 Y203 L204 P209 Y210	L202-S206 WeakPolarHBondContact O-CB 3.48Å; L202-S206 PolarHBondContact O-N 3.05Å; L202-S206 PolarHBondContact O-OG 3.37Å; Y203-S206 CarbonylContact O-C 3.55Å; Y203-S206 WeakPolarHBondContact O-CA 3.15Å; Y203-S206 WeakPolarHBondContact O-CB 3.47Å; Y203-S206 PolarHBondContact O-N 3.45Å; Y203-S206 PolarHBondContact O-OG 3.05Å; L204-S206 VanDerWaalsContact C-N 3.25Å; L204-S206 PolarHBondContact O-N 3.24Å; S206-P209 WeakPolarHBondContact O-CD 3.23Å; S206-Y210 VanDerWaalsContact O-CD2 3.24Å; S206-Y210 WeakPolarHBondContact O-CD2 3.32Å; S206-Y210 VanDerWaalsContact O-CE2 3.3Å; S206-Y210 WeakPolarHBondContact O-CE2 3.28Å
207	C	78.5	Confident	74.5	Confident	13 Å²	13	55.3 Å²	55.3	9%	0.088	29%	0.286	C	S	.	.	H	α-helix	trans	-80.4	-30.2	175.6	-62.9	0	0	0	0	112.5	M180 Y203 L204 P209 Y210 V211	M180-C207 HydrophobicContact SD-CB 4.29Å; Y203-C207 PolarHBondContact O-N 3.3Å; Y203-C207 PolarHBondContact O-SG 3.22Å; L204-C207 PolarHBondContact O-N 2.95Å; L204-C207 VanDerWaalsContact O-N 3.09Å; C207-P209 VanDerWaalsContact C-CD 3.47Å; C207-Y210 PolarHBondContact O-N 3.37Å; C207-V211 WeakPolarHBondContact O-CG2 3.45Å; C207-V211 PolarHBondContact O-N 3.36Å
208	V	73.9	Confident	74.7	Confident	21 Å²	21	58.3 Å²	58.3	13%	0.127	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-44.2	-46.4	-179.9	153.2	0	0	0	0	114.6	L204 Y210 N216 L220	L204-V208 WeakPolarHBondContact O-CG2 3.33Å; L204-V208 PolarHBondContact O-N 3.03Å; V208-Y210 VanDerWaalsContact C-N 3.28Å; V208-Y210 PolarHBondContact O-N 2.86Å; V208-N216 WeakPolarHBondContact CG1-OD1 3.25Å; V208-N216 WeakPolarHBondContact CG2-OD1 3.31Å; V208-N216 PolarHBondContact O-ND2 3.32Å; V208-L220 HydrophobicContact CG1-CD2 4.36Å; V208-L220 HydrophobicContact CG2-CD2 3.74Å; V208-L220 HydrophobicContact CG2-CG 3.92Å
209	P	69.9	Low	74.8	Confident	70 Å²	70	56.1 Å²	56.1	46%	0.455	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-22.4	179.5	-21.6	34.6	0	0	0	114.9	S206 C207	S206-P209 WeakPolarHBondContact O-CD 3.23Å; C207-P209 VanDerWaalsContact C-CD 3.47Å
210	Y	72.2	Confident	74.9	Confident	182 Å²	182	49.8 Å²	49.8	71%	0.714	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-18.7	-174.3	-60.5	-75.4	0	0	0	113.3	S206 C207 V208	S206-Y210 VanDerWaalsContact O-CD2 3.24Å; S206-Y210 WeakPolarHBondContact O-CD2 3.32Å; S206-Y210 VanDerWaalsContact O-CE2 3.3Å; S206-Y210 WeakPolarHBondContact O-CE2 3.28Å; C207-Y210 PolarHBondContact O-N 3.37Å; V208-Y210 VanDerWaalsContact C-N 3.28Å; V208-Y210 PolarHBondContact O-N 2.86Å
211	V	71.4	Confident	75.1	Confident	20 Å²	20	52.3 Å²	52.3	12%	0.121	28%	0.276	C	S	.	.	S	Bend	trans	-89.4	130.3	-176.7	174.7	0	0	0	0	109.1	M180 C207 E215 N216 L219	M180-V211 HydrophobicContact CE-CG2 4.44Å; C207-V211 WeakPolarHBondContact O-CG2 3.45Å; C207-V211 PolarHBondContact O-N 3.36Å; V211-E215 HydrophobicContact CG1-CB 3.32Å; V211-E215 HydrophobicContact CG1-CG 4.46Å; V211-E215 WeakPolarHBondContact CG1-OE2 3.39Å; V211-N216 HydrophobicContact CG1-CB 4.49Å; V211-L219 HydrophobicContact CB-CD1 4.01Å; V211-L219 HydrophobicContact CG1-CD1 3.89Å; V211-L219 HydrophobicContact CG2-CD1 3.78Å
212	P	67	Low	75.2	Confident	81 Å²	81	52.5 Å²	52.5	53%	0.526	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-64.3	153.1	176.1	27.2	-33.2	0	0	0	111.7	E215 N216	P212-E215 PolarHBondContact O-N 3.14Å; P212-N216 PolarHBondContact O-N 3.46Å; P212-N216 VanDerWaalsContact O-N 3.17Å
213	E	61.5	Low	75.3	Confident	39 Å²	39	46.6 Å²	46.6	18%	0.182	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	139.3	162.6	-66.3	-176.2	170.5	0	0	108	N216 Q514 D515	E213-N216 HydrophobicContact CG-CB 4.4Å; E213-Q514 VanDerWaalsContact OE2-CB 3.31Å; E213-Q514 WeakPolarHBondContact OE2-CB 3.37Å; E213-Q514 PolarHBondContact OE2-N 2.9Å; E213-D515 WeakPolarHBondContact CB-OD2 3.46Å
214	P	66.6	Low	75.2	Confident	81 Å²	81	44 Å²	44	53%	0.526	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	cis	-91.3	-8.8	14.6	36	-37.2	0	0	0	115.7	N216 S217 N218	P214-N216 VanDerWaalsContact C-N 3.28Å; P214-N216 PolarHBondContact O-N 3.35Å; P214-S217 WeakPolarHBondContact O-CB 3.47Å; P214-S217 PolarHBondContact O-N 3.43Å; P214-S217 VanDerWaalsContact O-N 3.12Å; P214-N218 PolarHBondContact O-N 3.17Å
215	E	69	Low	75.3	Confident	85 Å²	85	48.8 Å²	48.8	40%	0.397	25%	0.254	S	S	.	.	H	α-helix	trans	-60.4	-37.8	-176.4	-72.9	171.8	-154.7	0	0	112	V211 P212 S217 N218 L219	V211-E215 HydrophobicContact CG1-CB 3.32Å; V211-E215 HydrophobicContact CG1-CG 4.46Å; V211-E215 WeakPolarHBondContact CG1-OE2 3.39Å; P212-E215 PolarHBondContact O-N 3.14Å; E215-S217 VanDerWaalsContact C-N 3.31Å; E215-S217 PolarHBondContact O-N 3.24Å; E215-N218 WeakPolarHBondContact O-CB 3.44Å; E215-N218 PolarHBondContact O-N 3.35Å; E215-L219 WeakPolarHBondContact O-CG 3.39Å; E215-L219 PolarHBondContact O-N 3.13Å
216	N	74.8	Confident	75.5	Confident	22 Å²	22	47.1 Å²	47.1	12%	0.118	25%	0.246	C	C	.	.	H	α-helix	trans	-56.3	-43.7	175.4	-176.8	6.7	0	0	0	112.6	V208 V211 P212 E213 P214 N218 L219 L220	V208-N216 WeakPolarHBondContact CG1-OD1 3.25Å; V208-N216 WeakPolarHBondContact CG2-OD1 3.31Å; V208-N216 PolarHBondContact O-ND2 3.32Å; V211-N216 HydrophobicContact CG1-CB 4.49Å; P212-N216 PolarHBondContact O-N 3.46Å; P212-N216 VanDerWaalsContact O-N 3.17Å; E213-N216 HydrophobicContact CG-CB 4.4Å; P214-N216 VanDerWaalsContact C-N 3.28Å; P214-N216 PolarHBondContact O-N 3.35Å; N216-N218 VanDerWaalsContact C-N 3.31Å; N216-N218 PolarHBondContact O-N 3.39Å; N216-L219 PolarHBondContact O-N 2.89Å; N216-L220 WeakPolarHBondContact O-CG 2.76Å; N216-L220 PolarHBondContact O-N 3.17Å
217	S	75.9	Confident	75.8	Confident	40 Å²	40	45.7 Å²	45.7	28%	0.28	23%	0.233	S	C	.	.	H	α-helix	trans	-63	-40.4	176.8	-70.8	0	0	0	0	111.4	P214 E215 L220 W221	P214-S217 WeakPolarHBondContact O-CB 3.47Å; P214-S217 PolarHBondContact O-N 3.43Å; P214-S217 VanDerWaalsContact O-N 3.12Å; E215-S217 VanDerWaalsContact C-N 3.31Å; E215-S217 PolarHBondContact O-N 3.24Å; S217-L220 PolarHBondContact O-N 2.54Å; S217-W221 PolarHBondContact O-N 2.88Å
218	N	79	Confident	75.9	Confident	95 Å²	95	47.9 Å²	47.9	51%	0.508	24%	0.243	S	C	.	.	H	α-helix	trans	-65.3	-42.5	176.6	-67.5	-19	0	0	0	111.9	P214 E215 N216 L220 W221 T222	P214-N218 PolarHBondContact O-N 3.17Å; E215-N218 WeakPolarHBondContact O-CB 3.44Å; E215-N218 PolarHBondContact O-N 3.35Å; N216-N218 VanDerWaalsContact C-N 3.31Å; N216-N218 PolarHBondContact O-N 3.39Å; N218-L220 PolarHBondContact O-N 3.13Å; N218-W221 WeakPolarHBondContact O-CB 3.24Å; N218-W221 PolarHBondContact O-N 3.26Å; N218-T222 PolarHBondContact O-N 3.32Å; N218-T222 PolarHBondContact O-OG1 3.17Å
219	L	80	Confident	76.2	Confident	5 Å²	5	52.5 Å²	52.5	3%	0.026	26%	0.262	C	S	.	.	H	α-helix	trans	-59.2	-46.6	174.5	-68.1	177.2	0	0	0	111.4	M180 V185 L204 V211 E215 N216 W221 T222 V223	M180-L219 HydrophobicContact CG-CD2 4.11Å; V185-L219 HydrophobicContact CB-CD2 4.27Å; V185-L219 HydrophobicContact CG1-CD2 3.9Å; V185-L219 HydrophobicContact CG2-CD2 3.75Å; L204-L219 HydrophobicContact CD2-CD2 4.26Å; V211-L219 HydrophobicContact CB-CD1 4.01Å; V211-L219 HydrophobicContact CG1-CD1 3.89Å; V211-L219 HydrophobicContact CG2-CD1 3.78Å; E215-L219 WeakPolarHBondContact O-CG 3.39Å; E215-L219 PolarHBondContact O-N 3.13Å; N216-L219 PolarHBondContact O-N 2.89Å; L219-W221 VanDerWaalsContact C-N 3.33Å; L219-W221 PolarHBondContact O-N 3.1Å; L219-T222 PolarHBondContact O-N 3.41Å; L219-V223 VanDerWaalsContact O-CG2 3.26Å; L219-V223 WeakPolarHBondContact O-CG2 3.31Å; L219-V223 PolarHBondContact O-N 2.94Å
220	L	79.3	Confident	76.5	Confident	10 Å²	10	52 Å²	52	5%	0.052	25%	0.253	C	S	.	.	H	α-helix	trans	-63.3	-37.6	176.4	-73.3	171.8	0	0	0	112.1	M205 V208 N216 S217 N218 V223 M224 M242 L243	M205-L220 HydrophobicContact SD-CD2 3.97Å; V208-L220 HydrophobicContact CG1-CD2 4.36Å; V208-L220 HydrophobicContact CG2-CD2 3.74Å; V208-L220 HydrophobicContact CG2-CG 3.92Å; N216-L220 WeakPolarHBondContact O-CG 2.76Å; N216-L220 PolarHBondContact O-N 3.17Å; S217-L220 PolarHBondContact O-N 2.54Å; N218-L220 PolarHBondContact O-N 3.13Å; L220-V223 PolarHBondContact O-N 3.22Å; L220-M224 VanDerWaalsContact O-CB 3.3Å; L220-M224 WeakPolarHBondContact O-CB 3.28Å; L220-M224 PolarHBondContact O-N 3.09Å; L220-M242 HydrophobicContact CD1-CB 4.09Å; L220-L243 HydrophobicContact CB-CD1 3.9Å; L220-L243 HydrophobicContact CB-CD2 3.7Å; L220-L243 HydrophobicContact CB-CG 3.82Å; L220-L243 HydrophobicContact CD1-CD2 3.93Å; L220-L243 HydrophobicContact CD1-CG 4.2Å; L220-L243 HydrophobicContact CG-CD2 4.49Å
221	W	83.3	Confident	76.4	Confident	55 Å²	55	45.6 Å²	45.6	21%	0.208	24%	0.241	C	C	.	.	H	α-helix	trans	-59.8	-47.2	172.7	-77.9	120.8	0	0	0	111.7	S217 N218 L219 M224 R225 L243 D245 K248	S217-W221 PolarHBondContact O-N 2.88Å; N218-W221 WeakPolarHBondContact O-CB 3.24Å; N218-W221 PolarHBondContact O-N 3.26Å; L219-W221 VanDerWaalsContact C-N 3.33Å; L219-W221 PolarHBondContact O-N 3.1Å; W221-M224 HydrophobicContact CE3-CE 3.49Å; W221-M224 VanDerWaalsContact CE3-CE 3.49Å; W221-M224 HydrophobicContact CE3-SD 4.05Å; W221-M224 HydrophobicContact CZ3-CE 3.52Å; W221-M224 HydrophobicContact CZ3-SD 3.68Å; W221-M224 PolarHBondContact O-N 3.41Å; W221-R225 WeakPolarHBondContact O-CG 3.35Å; W221-R225 PolarHBondContact O-N 3.29Å; W221-L243 HydrophobicContact CD2-CD1 3.71Å; W221-L243 HydrophobicContact CE3-CD1 3.67Å; W221-L243 HydrophobicContact CG-CD1 4.24Å; W221-L243 HydrophobicContact CH2-CB 4.28Å; W221-L243 HydrophobicContact CH2-CD1 3.69Å; W221-L243 HydrophobicContact CZ2-CB 4.46Å; W221-L243 HydrophobicContact CZ2-CD1 3.94Å; W221-L243 HydrophobicContact CZ3-CD1 3.55Å; W221-D245 HydrophobicContact CH2-CB 4.06Å; W221-D245 WeakPolarHBondContact CH2-OD2 3.28Å; W221-K248 HydrophobicContact CE3-CD 4.02Å; W221-K248 VanDerWaalsContact CE3-NZ 3.27Å; W221-K248 HydrophobicContact CH2-CD 3.19Å; W221-K248 HydrophobicContact CH2-CG 4.5Å; W221-K248 HydrophobicContact CZ2-CD 4.3Å; W221-K248 HydrophobicContact CZ3-CD 2.99Å; W221-K248 VanDerWaalsContact CZ3-CE 3.46Å; W221-K248 HydrophobicContact CZ3-CG 4.38Å
222	T	78.9	Confident	76.6	Confident	5 Å²	5	46.6 Å²	46.6	3%	0.031	24%	0.243	C	C	.	.	H	α-helix	trans	-65.1	-44.9	179.2	-54.3	0	0	0	0	111.4	V185 E189 N218 L219 M224 R225 I226	V185-T222 HydrophobicContact CG1-CG2 3.96Å; V185-T222 WeakPolarHBondContact O-CG2 3.39Å; E189-T222 HydrophobicContact CG-CG2 4.19Å; N218-T222 PolarHBondContact O-N 3.32Å; N218-T222 PolarHBondContact O-OG1 3.17Å; L219-T222 PolarHBondContact O-N 3.41Å; T222-M224 VanDerWaalsContact C-N 3.32Å; T222-M224 PolarHBondContact O-N 3.07Å; T222-R225 PolarHBondContact O-N 2.86Å; T222-I226 HydrophobicContact CG2-CD1 3.99Å; T222-I226 HydrophobicContact CG2-CG1 4.47Å; T222-I226 VanDerWaalsContact O-CG1 3.28Å; T222-I226 WeakPolarHBondContact O-CG1 3.47Å; T222-I226 PolarHBondContact O-N 3.48Å
223	V	82.3	Confident	76.8	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-58.6	-44	175.8	172.4	0	0	0	0	111.1	L204 M205 L219 L220 R225 I226 Y227	L204-V223 HydrophobicContact CB-CG2 3.45Å; L204-V223 VanDerWaalsContact CB-CG2 3.45Å; L204-V223 HydrophobicContact CD1-CG2 3.6Å; L204-V223 HydrophobicContact CG-CG2 4.16Å; M205-V223 HydrophobicContact CG-CG1 4.29Å; M205-V223 HydrophobicContact SD-CG1 4.15Å; L219-V223 VanDerWaalsContact O-CG2 3.26Å; L219-V223 WeakPolarHBondContact O-CG2 3.31Å; L219-V223 PolarHBondContact O-N 2.94Å; L220-V223 PolarHBondContact O-N 3.22Å; V223-R225 PolarHBondContact O-N 3.12Å; V223-I226 PolarHBondContact O-N 2.87Å; V223-Y227 HydrophobicContact CG1-CD2 3.67Å; V223-Y227 HydrophobicContact CG1-CE2 3.33Å; V223-Y227 VanDerWaalsContact O-CD2 3.24Å; V223-Y227 WeakPolarHBondContact O-CD2 3.4Å; V223-Y227 PolarHBondContact O-N 3.48Å
224	M	80.8	Confident	77.1	Confident	10 Å²	10	43.5 Å²	43.5	5%	0.049	22%	0.221	C	C	.	.	H	α-helix	trans	-61.2	-43.9	177.2	-175.2	-163.8	74.9	0	0	111.6	L220 W221 T222 Y227 L228 A236 C239 A240 K248 I252	L220-M224 VanDerWaalsContact O-CB 3.3Å; L220-M224 WeakPolarHBondContact O-CB 3.28Å; L220-M224 PolarHBondContact O-N 3.09Å; W221-M224 HydrophobicContact CE3-CE 3.49Å; W221-M224 VanDerWaalsContact CE3-CE 3.49Å; W221-M224 HydrophobicContact CE3-SD 4.05Å; W221-M224 HydrophobicContact CZ3-CE 3.52Å; W221-M224 HydrophobicContact CZ3-SD 3.68Å; W221-M224 PolarHBondContact O-N 3.41Å; T222-M224 VanDerWaalsContact C-N 3.32Å; T222-M224 PolarHBondContact O-N 3.07Å; M224-Y227 PolarHBondContact O-N 3.33Å; M224-L228 HydrophobicContact CE-CD1 4.31Å; M224-L228 HydrophobicContact CG-CD1 4.42Å; M224-L228 WeakPolarHBondContact O-CG 3.36Å; M224-L228 PolarHBondContact O-N 2.95Å; M224-A236 HydrophobicContact CG-CB 4.31Å; M224-C239 HydrophobicContact CB-CB 4.04Å; M224-C239 HydrophobicContact CG-CB 4.47Å; M224-A240 HydrophobicContact SD-CB 4.11Å; M224-K248 HydrophobicContact CE-CD 4.19Å; M224-I252 HydrophobicContact CG-CD1 4.24Å; M224-I252 HydrophobicContact SD-CD1 3.99Å
225	R	82.1	Confident	77.4	Confident	99 Å²	99	40.6 Å²	40.6	37%	0.374	20%	0.2	S	C	.	.	H	α-helix	trans	-64.1	-40.3	176.7	-73	179.2	179.8	173.3	7.2	111.9	E186 E189 W221 T222 V223 Y227 L228 K229	E186-R225 IonicContact OE1-CZ 2.66Å; E186-R225 IonicContact OE1-NH1 2.73Å; E186-R225 PolarHBondContact OE1-NH1 3.35Å; E186-R225 IonicContact OE1-NH2 2.6Å; E189-R225 WeakPolarHBondContact OE1-CD 3.34Å; E189-R225 IonicContact OE1-CZ 3.26Å; E189-R225 IonicContact OE1-NE 3.62Å; E189-R225 IonicContact OE1-NH1 2.63Å; E189-R225 PolarHBondContact OE1-NH1 3.07Å; W221-R225 WeakPolarHBondContact O-CG 3.35Å; W221-R225 PolarHBondContact O-N 3.29Å; T222-R225 PolarHBondContact O-N 2.86Å; V223-R225 PolarHBondContact O-N 3.12Å; R225-Y227 VanDerWaalsContact C-N 3.34Å; R225-Y227 PolarHBondContact O-N 2.99Å; R225-L228 PolarHBondContact O-N 3.44Å; R225-K229 WeakPolarHBondContact O-CG 3.3Å; R225-K229 PolarHBondContact O-N 3.12Å
226	I	82.2	Confident	77.7	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-59	-46.9	174	-66.5	164.7	0	0	0	110.1	I188 E189 L204 T222 V223 L228 K229 F230	I188-I226 HydrophobicContact CB-CD1 4.39Å; I188-I226 HydrophobicContact CG2-CD1 3.63Å; E189-I226 HydrophobicContact CG-CG1 4.49Å; L204-I226 HydrophobicContact CD1-CD1 4.29Å; T222-I226 HydrophobicContact CG2-CD1 3.99Å; T222-I226 HydrophobicContact CG2-CG1 4.47Å; T222-I226 VanDerWaalsContact O-CG1 3.28Å; T222-I226 WeakPolarHBondContact O-CG1 3.47Å; T222-I226 PolarHBondContact O-N 3.48Å; V223-I226 PolarHBondContact O-N 2.87Å; I226-L228 VanDerWaalsContact C-N 3.33Å; I226-L228 PolarHBondContact O-N 2.83Å; I226-K229 PolarHBondContact O-N 2.79Å; I226-F230 HydrophobicContact CG2-CD2 3.98Å; I226-F230 HydrophobicContact CG2-CE2 3.93Å; I226-F230 WeakPolarHBondContact O-CD2 3.19Å; I226-F230 PolarHBondContact O-N 3.48Å
227	Y	82.3	Confident	77.7	Confident	25 Å²	25	35.5 Å²	35.5	10%	0.098	18%	0.176	C	C	.	.	H	α-helix	trans	-62.2	-38.4	177.7	-77	-54	0	0	0	113.5	C201 V223 M224 R225 K229 F230 G231 R232 E235	C201-Y227 HydrophobicContact CB-CE1 3.99Å; C201-Y227 HydrophobicContact CB-CE2 4.22Å; C201-Y227 VanDerWaalsContact CB-OH 3.27Å; C201-Y227 WeakPolarHBondContact CB-OH 3.34Å; V223-Y227 HydrophobicContact CG1-CD2 3.67Å; V223-Y227 HydrophobicContact CG1-CE2 3.33Å; V223-Y227 VanDerWaalsContact O-CD2 3.24Å; V223-Y227 WeakPolarHBondContact O-CD2 3.4Å; V223-Y227 PolarHBondContact O-N 3.48Å; M224-Y227 PolarHBondContact O-N 3.33Å; R225-Y227 VanDerWaalsContact C-N 3.34Å; R225-Y227 PolarHBondContact O-N 2.99Å; Y227-K229 VanDerWaalsContact C-N 3.35Å; Y227-F230 PolarHBondContact O-N 3.19Å; Y227-G231 PolarHBondContact O-N 3.19Å; Y227-R232 HydrophobicContact CD1-CB 4.01Å; Y227-R232 PolarHBondContact O-N 3.4Å; Y227-E235 HydrophobicContact CD1-CB 3.72Å; Y227-E235 HydrophobicContact CD2-CB 3.94Å; Y227-E235 HydrophobicContact CE1-CB 3.6Å; Y227-E235 HydrophobicContact CE1-CG 4.08Å; Y227-E235 HydrophobicContact CE2-CB 3.8Å; Y227-E235 HydrophobicContact CG-CB 3.89Å
228	L	81.2	Confident	77.5	Confident	59 Å²	59	34.9 Å²	34.9	31%	0.309	17%	0.167	S	C	.	.	H	α-helix	trans	-65.4	-36.9	175.8	-70.4	171.2	0	0	0	112.4	M224 R225 I226 F230 G231 A236 I252	M224-L228 HydrophobicContact CE-CD1 4.31Å; M224-L228 HydrophobicContact CG-CD1 4.42Å; M224-L228 WeakPolarHBondContact O-CG 3.36Å; M224-L228 PolarHBondContact O-N 2.95Å; R225-L228 PolarHBondContact O-N 3.44Å; I226-L228 VanDerWaalsContact C-N 3.33Å; I226-L228 PolarHBondContact O-N 2.83Å; L228-F230 VanDerWaalsContact C-N 3.29Å; L228-F230 PolarHBondContact O-N 2.91Å; L228-G231 PolarHBondContact O-N 3.31Å; L228-A236 HydrophobicContact CD2-CB 3.9Å; L228-A236 HydrophobicContact CG-CB 3.99Å; L228-I252 HydrophobicContact CD1-CG1 4.4Å; L228-I252 HydrophobicContact CD2-CG1 4.03Å
229	K	80.4	Confident	77.2	Confident	118 Å²	118	30.5 Å²	30.5	51%	0.513	14%	0.144	S	C	.	.	H	α-helix	trans	-63.1	-33.7	175.3	-71.2	-172.8	-174.1	-160.5	0	113	E189 R225 I226 Y227	E189-K229 VanDerWaalsContact CB-NZ 3.31Å; E189-K229 PolarHBondContact O-NZ 3.21Å; E189-K229 WeakPolarHBondContact OE2-CE 3.36Å; E189-K229 IonicContact OE2-NZ 3.92Å; E189-K229 PolarHBondContact OE2-NZ 3.41Å; R225-K229 WeakPolarHBondContact O-CG 3.3Å; R225-K229 PolarHBondContact O-N 3.12Å; I226-K229 PolarHBondContact O-N 2.79Å; Y227-K229 VanDerWaalsContact C-N 3.35Å
230	F	77	Confident	77	Confident	61 Å²	61	30.2 Å²	30.2	27%	0.268	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	10.5	-179.7	-69.7	-70.7	0	0	0	114.5	C192 A194 Y197 I226 Y227 L228 R232	C192-F230 HydrophobicContact CB-CE2 3.7Å; C192-F230 HydrophobicContact CB-CZ 3.74Å; C192-F230 WeakPolarHBondContact O-CZ 3.26Å; A194-F230 HydrophobicContact CB-CE1 4.35Å; Y197-F230 AromaticContact CD1-CD1 3.79Å; Y197-F230 HydrophobicContact CD1-CD1 3.79Å; Y197-F230 AromaticContact CD1-CD2 3.95Å; Y197-F230 HydrophobicContact CD1-CD2 3.95Å; Y197-F230 AromaticContact CD1-CE1 3.81Å; Y197-F230 HydrophobicContact CD1-CE1 3.81Å; Y197-F230 HydrophobicContact CD1-CE2 4.01Å; Y197-F230 AromaticContact CD1-CG 3.86Å; Y197-F230 HydrophobicContact CD1-CG 3.86Å; Y197-F230 AromaticContact CD1-CZ 3.92Å; Y197-F230 HydrophobicContact CD1-CZ 3.92Å; Y197-F230 HydrophobicContact CD2-CD2 4.04Å; Y197-F230 HydrophobicContact CD2-CG 4.26Å; Y197-F230 HydrophobicContact CE1-CD1 4Å; Y197-F230 HydrophobicContact CE1-CE1 4.37Å; Y197-F230 HydrophobicContact CE1-CG 4.16Å; Y197-F230 HydrophobicContact CG-CD1 4.29Å; Y197-F230 AromaticContact CG-CD2 3.59Å; Y197-F230 HydrophobicContact CG-CD2 3.59Å; Y197-F230 HydrophobicContact CG-CE1 4.38Å; Y197-F230 AromaticContact CG-CE2 3.74Å; Y197-F230 HydrophobicContact CG-CE2 3.74Å; Y197-F230 AromaticContact CG-CG 3.91Å; Y197-F230 HydrophobicContact CG-CG 3.91Å; Y197-F230 HydrophobicContact CG-CZ 4.12Å; I226-F230 HydrophobicContact CG2-CD2 3.98Å; I226-F230 HydrophobicContact CG2-CE2 3.93Å; I226-F230 WeakPolarHBondContact O-CD2 3.19Å; I226-F230 PolarHBondContact O-N 3.48Å; Y227-F230 PolarHBondContact O-N 3.19Å; L228-F230 VanDerWaalsContact C-N 3.29Å; L228-F230 PolarHBondContact O-N 2.91Å; F230-R232 HydrophobicContact CB-CG 4.5Å; F230-R232 PolarHBondContact O-N 3.48Å
231	G	70.5	Confident	76.6	Confident	46 Å²	46	30.7 Å²	30.7	47%	0.474	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.9	18	179.5	0	0	0	0	0	113.8	Y227 L228 H233	Y227-G231 PolarHBondContact O-N 3.19Å; L228-G231 PolarHBondContact O-N 3.31Å; G231-H233 PolarHBondContact O-CD2 3.35Å; G231-H233 PolarHBondContact O-N 2.91Å
232	R	74.1	Confident	76	Confident	41 Å²	41	31 Å²	31	16%	0.155	15%	0.15	C	C	.	.			trans	-93.3	70.8	179.6	-72.6	-138.7	-167.8	170.7	5.2	109.9	Y197 Y227 F230 F234 E235 A236	Y197-R232 VanDerWaalsContact CE2-NE 3.35Å; Y197-R232 VanDerWaalsContact CZ-NH2 3.33Å; Y197-R232 PolarHBondContact OH-NE 3.23Å; Y197-R232 PolarHBondContact OH-NH2 3.45Å; Y227-R232 HydrophobicContact CD1-CB 4.01Å; Y227-R232 PolarHBondContact O-N 3.4Å; F230-R232 HydrophobicContact CB-CG 4.5Å; F230-R232 PolarHBondContact O-N 3.48Å; R232-F234 VanDerWaalsContact C-N 3.31Å; R232-F234 PolarHBondContact O-N 2.89Å; R232-E235 WeakPolarHBondContact CB-OE2 3.41Å; R232-E235 WeakPolarHBondContact CD-OE1 3.34Å; R232-E235 IonicContact CZ-OE1 3Å; R232-E235 IonicContact NE-OE1 2.61Å; R232-E235 IonicContact NH1-OE1 3.6Å; R232-E235 PolarHBondContact NH1-OE1 3.29Å; R232-A236 PolarHBondContact O-N 3.5Å
233	H	72.2	Confident	75.5	Confident	44 Å²	44	31.7 Å²	31.7	20%	0.204	15%	0.153	C	C	.	.	H	α-helix	trans	-66.4	-32.9	-172.9	-57.1	-78.8	0	0	0	112.5	G231 A236 L237 I252 C256 M265	G231-H233 PolarHBondContact O-CD2 3.35Å; G231-H233 PolarHBondContact O-N 2.91Å; H233-A236 WeakPolarHBondContact O-CB 3.4Å; H233-A236 PolarHBondContact O-N 3.04Å; H233-L237 WeakPolarHBondContact O-CB 3.36Å; H233-L237 PolarHBondContact O-N 2.84Å; H233-I252 HydrophobicContact CB-CG2 4.39Å; H233-C256 WeakPolarHBondContact CB-SG 3.44Å; H233-M265 HydrophobicContact CB-CE 3.23Å; H233-M265 WeakPolarHBondContact O-CE 3.19Å
234	F	67.3	Low	74.8	Confident	11 Å²	11	32.8 Å²	32.8	5%	0.048	16%	0.159	C	C	.	.	H	α-helix	trans	-65	-45.5	-178.5	-173.6	-93.3	0	0	0	112.2	R232 L237 R238 M265 L268 F845 W847	R232-F234 VanDerWaalsContact C-N 3.31Å; R232-F234 PolarHBondContact O-N 2.89Å; F234-L237 WeakPolarHBondContact O-CB 3.24Å; F234-L237 PolarHBondContact O-N 3.25Å; F234-R238 HydrophobicContact CE1-CG 4.39Å; F234-R238 WeakPolarHBondContact O-CG 3.43Å; F234-R238 PolarHBondContact O-N 3.46Å; F234-R238 VanDerWaalsContact O-N 3.14Å; F234-M265 HydrophobicContact CD2-CG 4.32Å; F234-L268 HydrophobicContact CE2-CB 4.24Å; F234-L268 HydrophobicContact CE2-CD2 4.1Å; F234-L268 HydrophobicContact CZ-CD2 4.13Å; F234-F845 HydrophobicContact CB-CE1 4.34Å; F234-F845 HydrophobicContact CD1-CD1 4.33Å; F234-F845 AromaticContact CD1-CE1 3.92Å; F234-F845 HydrophobicContact CD1-CE1 3.92Å; F234-F845 HydrophobicContact CG-CE1 4.49Å; F234-W847 HydrophobicContact CE1-CH2 4.11Å; F234-W847 HydrophobicContact CE1-CZ2 4.34Å; F234-W847 AromaticContact CE2-CH2 3.77Å; F234-W847 HydrophobicContact CE2-CH2 3.77Å; F234-W847 HydrophobicContact CE2-CZ2 4.45Å; F234-W847 AromaticContact CZ-CH2 3.47Å; F234-W847 HydrophobicContact CZ-CH2 3.47Å; F234-W847 VanDerWaalsContact CZ-CH2 3.47Å; F234-W847 HydrophobicContact CZ-CZ2 4.13Å; F234-W847 AromaticContact CZ-CZ3 3.92Å; F234-W847 HydrophobicContact CZ-CZ3 3.92Å
235	E	72.6	Confident	74.3	Confident	20 Å²	20	34.5 Å²	34.5	9%	0.093	17%	0.168	C	C	.	.	H	α-helix	trans	-68.9	-35.3	174.5	-62	99.9	134.9	0	0	112.5	Y227 R232 L237 R238 C239 F845	Y227-E235 HydrophobicContact CD1-CB 3.72Å; Y227-E235 HydrophobicContact CD2-CB 3.94Å; Y227-E235 HydrophobicContact CE1-CB 3.6Å; Y227-E235 HydrophobicContact CE1-CG 4.08Å; Y227-E235 HydrophobicContact CE2-CB 3.8Å; Y227-E235 HydrophobicContact CG-CB 3.89Å; R232-E235 WeakPolarHBondContact CB-OE2 3.41Å; R232-E235 WeakPolarHBondContact CD-OE1 3.34Å; R232-E235 IonicContact CZ-OE1 3Å; R232-E235 IonicContact NE-OE1 2.61Å; R232-E235 IonicContact NH1-OE1 3.6Å; R232-E235 PolarHBondContact NH1-OE1 3.29Å; E235-L237 VanDerWaalsContact C-N 3.3Å; E235-L237 PolarHBondContact O-N 3.34Å; E235-R238 WeakPolarHBondContact O-CB 3.28Å; E235-R238 PolarHBondContact O-N 3.02Å; E235-C239 PolarHBondContact O-N 3.01Å; E235-C239 VanDerWaalsContact O-N 3.09Å; E235-C239 PolarHBondContact O-SG 2.97Å; E235-F845 HydrophobicContact CG-CE1 4.04Å; E235-F845 VanDerWaalsContact OE1-CE1 3.23Å; E235-F845 WeakPolarHBondContact OE1-CE1 3.17Å; E235-F845 WeakPolarHBondContact OE1-CZ 3.26Å; E235-F845 VanDerWaalsContact OE2-CE1 3.3Å; E235-F845 WeakPolarHBondContact OE2-CE1 3.32Å; E235-F845 WeakPolarHBondContact OE2-CZ 3.47Å
236	A	76.3	Confident	73.4	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-59.4	-42.7	172.2	0	0	0	0	0	111.4	M224 L228 R232 H233 R238 C239 A240 I252	M224-A236 HydrophobicContact CG-CB 4.31Å; L228-A236 HydrophobicContact CD2-CB 3.9Å; L228-A236 HydrophobicContact CG-CB 3.99Å; R232-A236 PolarHBondContact O-N 3.5Å; H233-A236 WeakPolarHBondContact O-CB 3.4Å; H233-A236 PolarHBondContact O-N 3.04Å; A236-R238 VanDerWaalsContact C-N 3.33Å; A236-R238 PolarHBondContact O-N 3.49Å; A236-C239 PolarHBondContact O-N 3.28Å; A236-A240 WeakPolarHBondContact O-CB 3.1Å; A236-A240 PolarHBondContact O-N 3.27Å; A236-I252 HydrophobicContact CB-CD1 4.23Å
237	L	74.6	Confident	72.8	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62.9	-38.6	176.7	-176.9	66.1	0	0	0	112	H233 F234 E235 C239 A240 L241 V249 I252 M265 L268 L269	H233-L237 WeakPolarHBondContact O-CB 3.36Å; H233-L237 PolarHBondContact O-N 2.84Å; F234-L237 WeakPolarHBondContact O-CB 3.24Å; F234-L237 PolarHBondContact O-N 3.25Å; E235-L237 VanDerWaalsContact C-N 3.3Å; E235-L237 PolarHBondContact O-N 3.34Å; L237-C239 VanDerWaalsContact C-N 3.34Å; L237-C239 PolarHBondContact O-N 3.37Å; L237-A240 PolarHBondContact O-N 3.48Å; L237-L241 HydrophobicContact CG-CD1 4.23Å; L237-L241 WeakPolarHBondContact O-CB 3.38Å; L237-L241 VanDerWaalsContact O-CG 3.28Å; L237-L241 WeakPolarHBondContact O-CG 3.41Å; L237-L241 PolarHBondContact O-N 2.92Å; L237-V249 HydrophobicContact CD1-CB 4.28Å; L237-V249 HydrophobicContact CD1-CG1 3.85Å; L237-V249 HydrophobicContact CD1-CG2 4.11Å; L237-I252 HydrophobicContact CB-CG2 4.23Å; L237-M265 HydrophobicContact CB-CE 3.95Å; L237-M265 HydrophobicContact CD2-CB 3.6Å; L237-M265 HydrophobicContact CD2-CE 4.15Å; L237-M265 HydrophobicContact CD2-CG 3.54Å; L237-M265 HydrophobicContact CD2-SD 4.14Å; L237-L268 HydrophobicContact CD2-CD2 4.04Å; L237-L268 HydrophobicContact CG-CD2 4.28Å; L237-L269 HydrophobicContact CD1-CD1 4.49Å; L237-L269 HydrophobicContact CD1-CD2 4.18Å; L237-L269 HydrophobicContact CD1-CG 4.47Å; L237-L269 HydrophobicContact CD2-CD1 4.37Å; L237-L269 HydrophobicContact CD2-CG 4.14Å
238	R	71.5	Confident	72.2	Confident	27 Å²	27	38.7 Å²	38.7	10%	0.102	20%	0.196	C	C	.	.	H	α-helix	trans	-60.5	-44.6	173.6	-66.2	176.4	62.3	152.7	1.8	111.3	F234 E235 A236 L241 M242 L268 S729 L733	F234-R238 HydrophobicContact CE1-CG 4.39Å; F234-R238 WeakPolarHBondContact O-CG 3.43Å; F234-R238 PolarHBondContact O-N 3.46Å; F234-R238 VanDerWaalsContact O-N 3.14Å; E235-R238 WeakPolarHBondContact O-CB 3.28Å; E235-R238 PolarHBondContact O-N 3.02Å; A236-R238 VanDerWaalsContact C-N 3.33Å; A236-R238 PolarHBondContact O-N 3.49Å; R238-L241 PolarHBondContact O-N 3.15Å; R238-M242 WeakPolarHBondContact O-CG 3.41Å; R238-M242 PolarHBondContact O-N 3.11Å; R238-M242 VanDerWaalsContact O-N 3.1Å; R238-L268 HydrophobicContact CG-CD2 3.96Å; R238-S729 PolarHBondContact NH1-OG 3.26Å; R238-S729 PolarHBondContact NH2-O 3.4Å; R238-S729 PolarHBondContact NH2-OG 3.19Å; R238-S729 VanDerWaalsContact NH2-OG 3.12Å; R238-L733 HydrophobicContact CB-CD1 4.47Å; R238-L733 HydrophobicContact CG-CD1 4.13Å
239	C	73.4	Confident	71.7	Confident	3 Å²	3	36.1 Å²	36.1	2%	0.02	18%	0.183	C	C	.	.	H	α-helix	trans	-65.3	-40.9	177.4	-58.2	0	0	0	0	111.6	M224 E235 A236 L237 L241 M242 L243	M224-C239 HydrophobicContact CB-CB 4.04Å; M224-C239 HydrophobicContact CG-CB 4.47Å; E235-C239 PolarHBondContact O-N 3.01Å; E235-C239 VanDerWaalsContact O-N 3.09Å; E235-C239 PolarHBondContact O-SG 2.97Å; A236-C239 PolarHBondContact O-N 3.28Å; L237-C239 VanDerWaalsContact C-N 3.34Å; L237-C239 PolarHBondContact O-N 3.37Å; C239-L241 VanDerWaalsContact C-N 3.3Å; C239-L241 PolarHBondContact O-N 3.39Å; C239-M242 WeakPolarHBondContact O-CB 3.22Å; C239-M242 PolarHBondContact O-N 3.14Å; C239-M242 VanDerWaalsContact O-N 3.16Å; C239-L243 PolarHBondContact O-N 3.41Å; C239-L243 VanDerWaalsContact O-N 3.09Å
240	A	74.7	Confident	71.2	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63	-36.9	175.8	0	0	0	0	0	112.4	M224 A236 L237 L243 N244 V249 I252	M224-A240 HydrophobicContact SD-CB 4.11Å; A236-A240 WeakPolarHBondContact O-CB 3.1Å; A236-A240 PolarHBondContact O-N 3.27Å; L237-A240 PolarHBondContact O-N 3.48Å; A240-L243 PolarHBondContact O-N 3.41Å; A240-N244 PolarHBondContact O-N 3.36Å; A240-V249 HydrophobicContact CB-CG2 3.84Å; A240-I252 HydrophobicContact CB-CD1 3.7Å
241	L	72	Confident	71.1	Confident	19 Å²	19	37.5 Å²	37.5	10%	0.099	19%	0.193	C	C	.	.	H	α-helix	trans	-66.6	-35.1	173.8	-75.1	166.9	0	0	0	112.6	L237 R238 C239 N244 V249 L268 L269 H272 L733	L237-L241 HydrophobicContact CG-CD1 4.23Å; L237-L241 WeakPolarHBondContact O-CB 3.38Å; L237-L241 VanDerWaalsContact O-CG 3.28Å; L237-L241 WeakPolarHBondContact O-CG 3.41Å; L237-L241 PolarHBondContact O-N 2.92Å; R238-L241 PolarHBondContact O-N 3.15Å; C239-L241 VanDerWaalsContact C-N 3.3Å; C239-L241 PolarHBondContact O-N 3.39Å; L241-N244 PolarHBondContact O-N 2.89Å; L241-V249 HydrophobicContact CD2-CG2 4.34Å; L241-V249 HydrophobicContact CG-CG2 4.49Å; L241-L268 HydrophobicContact CD1-CD2 3.7Å; L241-L268 HydrophobicContact CD1-CG 3.89Å; L241-L269 HydrophobicContact CD2-CD2 4.03Å; L241-H272 HydrophobicContact CD2-CB 4.16Å; L241-L733 HydrophobicContact CB-CD2 3.98Å
242	M	69.4	Low	71.2	Confident	61 Å²	61	35.5 Å²	35.5	30%	0.3	17%	0.171	S	C	.	.	H	α-helix	trans	-63.5	-43.5	172	-63	-61.6	-172.7	0	0	111.9	L220 R238 C239 N244 Q732 L733	L220-M242 HydrophobicContact CD1-CB 4.09Å; R238-M242 WeakPolarHBondContact O-CG 3.41Å; R238-M242 PolarHBondContact O-N 3.11Å; R238-M242 VanDerWaalsContact O-N 3.1Å; C239-M242 WeakPolarHBondContact O-CB 3.22Å; C239-M242 PolarHBondContact O-N 3.14Å; C239-M242 VanDerWaalsContact O-N 3.16Å; M242-N244 PolarHBondContact O-N 3.17Å; M242-Q732 HydrophobicContact CE-CB 3.67Å; M242-Q732 WeakPolarHBondContact CE-O 3.25Å; M242-L733 HydrophobicContact CE-CB 4.37Å; M242-L733 HydrophobicContact CE-CD2 3.49Å; M242-L733 VanDerWaalsContact CE-CD2 3.49Å; M242-L733 HydrophobicContact CE-CG 3.76Å; M242-L733 HydrophobicContact CG-CD2 4.2Å; M242-L733 HydrophobicContact SD-CD2 3.71Å; M242-L733 HydrophobicContact SD-CG 4.49Å
243	L	69.7	Low	70.9	Confident	20 Å²	20	35.8 Å²	35.8	11%	0.105	17%	0.174	C	C	.	.	H	α-helix	trans	-70	-14.2	177	-70.2	168.5	0	0	0	112.6	L220 W221 C239 A240 D245	L220-L243 HydrophobicContact CB-CD1 3.9Å; L220-L243 HydrophobicContact CB-CD2 3.7Å; L220-L243 HydrophobicContact CB-CG 3.82Å; L220-L243 HydrophobicContact CD1-CD2 3.93Å; L220-L243 HydrophobicContact CD1-CG 4.2Å; L220-L243 HydrophobicContact CG-CD2 4.49Å; W221-L243 HydrophobicContact CD2-CD1 3.71Å; W221-L243 HydrophobicContact CE3-CD1 3.67Å; W221-L243 HydrophobicContact CG-CD1 4.24Å; W221-L243 HydrophobicContact CH2-CB 4.28Å; W221-L243 HydrophobicContact CH2-CD1 3.69Å; W221-L243 HydrophobicContact CZ2-CB 4.46Å; W221-L243 HydrophobicContact CZ2-CD1 3.94Å; W221-L243 HydrophobicContact CZ3-CD1 3.55Å; C239-L243 PolarHBondContact O-N 3.41Å; C239-L243 VanDerWaalsContact O-N 3.09Å; A240-L243 PolarHBondContact O-N 3.41Å; L243-D245 PolarHBondContact O-N 3.5Å
244	N	67.1	Low	71	Confident	24 Å²	24	39.9 Å²	39.9	13%	0.128	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.9	32	176.7	-158.7	11.6	0	0	0	113.8	A240 L241 M242 K433 S472	A240-N244 PolarHBondContact O-N 3.36Å; L241-N244 PolarHBondContact O-N 2.89Å; M242-N244 PolarHBondContact O-N 3.17Å; N244-K433 PolarHBondContact ND2-NZ 3.07Å; N244-K433 PolarHBondContact O-NZ 2.93Å; N244-K433 PolarHBondContact OD1-NZ 2.88Å; N244-S472 WeakPolarHBondContact ND2-CB 3.26Å; N244-S472 PolarHBondContact ND2-O 2.88Å
245	D	69	Low	71.4	Confident	45 Å²	45	44.4 Å²	44.4	24%	0.241	22%	0.221	C	C	.	.			trans	-100.7	105	178	-174.7	-4	0	0	0	110	W221 L243 D247 K248 V249	W221-D245 HydrophobicContact CH2-CB 4.06Å; W221-D245 WeakPolarHBondContact CH2-OD2 3.28Å; L243-D245 PolarHBondContact O-N 3.5Å; D245-D247 VanDerWaalsContact C-N 3.3Å; D245-D247 PolarHBondContact O-N 3.48Å; D245-D247 PolarHBondContact OD1-N 3.48Å; D245-K248 IonicContact OD2-NZ 2.63Å; D245-V249 WeakPolarHBondContact O-CG2 3.38Å; D245-V249 PolarHBondContact O-N 2.94Å
246	M	65.1	Low	70.9	Confident	46 Å²	46	43.9 Å²	43.9	23%	0.227	22%	0.22	C	C	.	.	H	α-helix	trans	-71.7	-23.5	-173.4	-65.6	-58.8	-69.6	0	0	113.2	V249 K250 V274 K433	M246-V249 WeakPolarHBondContact O-CB 3.47Å; M246-V249 PolarHBondContact O-N 3.44Å; M246-K250 WeakPolarHBondContact O-CG 3.24Å; M246-K250 PolarHBondContact O-N 3.39Å; M246-V274 HydrophobicContact CE-CG2 3.87Å; M246-K433 HydrophobicContact CG-CB 4.14Å; M246-K433 HydrophobicContact CG-CD 3.66Å
247	D	68.9	Low	70.5	Confident	98 Å²	98	51.5 Å²	51.5	52%	0.524	26%	0.26	S	S	.	.	H	α-helix	trans	-74.1	-40.7	-177.6	-69	-30.7	0	0	0	110.7	D245 V249 K250 D251	D245-D247 VanDerWaalsContact C-N 3.3Å; D245-D247 PolarHBondContact O-N 3.48Å; D245-D247 PolarHBondContact OD1-N 3.48Å; D247-V249 VanDerWaalsContact C-N 3.33Å; D247-V249 PolarHBondContact O-N 3.27Å; D247-K250 WeakPolarHBondContact O-CB 3.3Å; D247-K250 PolarHBondContact O-N 3.39Å; D247-K250 VanDerWaalsContact O-N 3.17Å; D247-K250 IonicContact OD1-NZ 3.16Å; D247-K250 PolarHBondContact OD1-NZ 2.93Å; D247-D251 PolarHBondContact O-N 3.29Å
248	K	68.8	Low	70.1	Confident	70 Å²	70	57.4 Å²	57.4	30%	0.304	29%	0.288	S	S	.	.	H	α-helix	trans	-71.9	-29.9	173.7	-70.8	174.8	-175.3	160.9	0	112.7	W221 M224 D245 K250 D251 I252	W221-K248 HydrophobicContact CE3-CD 4.02Å; W221-K248 VanDerWaalsContact CE3-NZ 3.27Å; W221-K248 HydrophobicContact CH2-CD 3.19Å; W221-K248 HydrophobicContact CH2-CG 4.5Å; W221-K248 HydrophobicContact CZ2-CD 4.3Å; W221-K248 HydrophobicContact CZ3-CD 2.99Å; W221-K248 VanDerWaalsContact CZ3-CE 3.46Å; W221-K248 HydrophobicContact CZ3-CG 4.38Å; M224-K248 HydrophobicContact CE-CD 4.19Å; D245-K248 IonicContact OD2-NZ 2.63Å; K248-K250 VanDerWaalsContact C-N 3.32Å; K248-K250 PolarHBondContact O-N 3.3Å; K248-D251 PolarHBondContact O-N 3.2Å; K248-I252 WeakPolarHBondContact O-CB 3.36Å; K248-I252 WeakPolarHBondContact O-CD1 3.34Å; K248-I252 WeakPolarHBondContact O-CG1 3.35Å; K248-I252 PolarHBondContact O-N 3.02Å
249	V	70.8	Confident	70	Confident	5 Å²	5	60.7 Å²	60.7	3%	0.03	31%	0.307	C	S	.	.	H	α-helix	trans	-58.5	-44.8	168.2	163.8	0	0	0	0	110.9	L237 A240 L241 D245 M246 D247 I252 F253 L269	L237-V249 HydrophobicContact CD1-CB 4.28Å; L237-V249 HydrophobicContact CD1-CG1 3.85Å; L237-V249 HydrophobicContact CD1-CG2 4.11Å; A240-V249 HydrophobicContact CB-CG2 3.84Å; L241-V249 HydrophobicContact CD2-CG2 4.34Å; L241-V249 HydrophobicContact CG-CG2 4.49Å; D245-V249 WeakPolarHBondContact O-CG2 3.38Å; D245-V249 PolarHBondContact O-N 2.94Å; M246-V249 WeakPolarHBondContact O-CB 3.47Å; M246-V249 PolarHBondContact O-N 3.44Å; D247-V249 VanDerWaalsContact C-N 3.33Å; D247-V249 PolarHBondContact O-N 3.27Å; V249-I252 PolarHBondContact O-N 3.47Å; V249-F253 WeakPolarHBondContact O-CB 3.46Å; V249-F253 PolarHBondContact O-N 3.31Å; V249-L269 HydrophobicContact CG1-CD1 4.12Å; V249-L269 HydrophobicContact CG1-CD2 3.43Å; V249-L269 VanDerWaalsContact CG1-CD2 3.43Å; V249-L269 HydrophobicContact CG1-CG 4.42Å
250	K	69.9	Low	69.6	Low	116 Å²	116	61.9 Å²	61.9	50%	0.504	31%	0.314	S	S	.	.	H	α-helix	trans	-64.1	-44.9	175.8	-69	167.5	-170	162	0	111.6	M246 D247 K248 I252 F253 L254	M246-K250 WeakPolarHBondContact O-CG 3.24Å; M246-K250 PolarHBondContact O-N 3.39Å; D247-K250 WeakPolarHBondContact O-CB 3.3Å; D247-K250 PolarHBondContact O-N 3.39Å; D247-K250 VanDerWaalsContact O-N 3.17Å; D247-K250 IonicContact OD1-NZ 3.16Å; D247-K250 PolarHBondContact OD1-NZ 2.93Å; K248-K250 VanDerWaalsContact C-N 3.32Å; K248-K250 PolarHBondContact O-N 3.3Å; K250-I252 VanDerWaalsContact C-N 3.33Å; K250-I252 PolarHBondContact O-N 2.86Å; K250-F253 PolarHBondContact O-N 3.28Å; K250-L254 WeakPolarHBondContact O-CG 3.33Å; K250-L254 PolarHBondContact O-N 3.15Å
251	D	74.6	Confident	69.2	Low	91 Å²	91	63 Å²	63	49%	0.487	32%	0.321	S	S	.	.	H	α-helix	trans	-61.1	-43.5	178.8	-69.6	-17.2	0	0	0	111.4	D247 K248 F253 L254 N255	D247-D251 PolarHBondContact O-N 3.29Å; K248-D251 PolarHBondContact O-N 3.2Å; D251-F253 VanDerWaalsContact C-N 3.32Å; D251-F253 PolarHBondContact O-N 2.99Å; D251-L254 PolarHBondContact O-N 3.41Å; D251-N255 VanDerWaalsContact O-CB 3.28Å; D251-N255 WeakPolarHBondContact O-CB 3.21Å; D251-N255 PolarHBondContact O-N 3.45Å; D251-N255 PolarHBondContact O-ND2 2.94Å
252	I	73.1	Confident	68.8	Low	4 Å²	4	65 Å²	65	2%	0.021	33%	0.329	C	S	.	.	H	α-helix	trans	-63.9	-40.5	177	-66.5	168.7	0	0	0	110.6	M224 L228 H233 A236 L237 A240 K248 V249 K250 C256 M265	M224-I252 HydrophobicContact CG-CD1 4.24Å; M224-I252 HydrophobicContact SD-CD1 3.99Å; L228-I252 HydrophobicContact CD1-CG1 4.4Å; L228-I252 HydrophobicContact CD2-CG1 4.03Å; H233-I252 HydrophobicContact CB-CG2 4.39Å; A236-I252 HydrophobicContact CB-CD1 4.23Å; L237-I252 HydrophobicContact CB-CG2 4.23Å; A240-I252 HydrophobicContact CB-CD1 3.7Å; K248-I252 WeakPolarHBondContact O-CB 3.36Å; K248-I252 WeakPolarHBondContact O-CD1 3.34Å; K248-I252 WeakPolarHBondContact O-CG1 3.35Å; K248-I252 PolarHBondContact O-N 3.02Å; V249-I252 PolarHBondContact O-N 3.47Å; K250-I252 VanDerWaalsContact C-N 3.33Å; K250-I252 PolarHBondContact O-N 2.86Å; I252-C256 PolarHBondContact O-SG 3.33Å; I252-M265 HydrophobicContact CG2-CE 3.88Å
253	F	68.3	Low	68.5	Low	48 Å²	48	65 Å²	65	21%	0.211	33%	0.328	C	S	.	.	H	α-helix	trans	-66.9	-39.4	178.7	-175.4	-98.3	0	0	0	112.8	V249 K250 D251 Q262 M265 A266 L269	V249-F253 WeakPolarHBondContact O-CB 3.46Å; V249-F253 PolarHBondContact O-N 3.31Å; K250-F253 PolarHBondContact O-N 3.28Å; D251-F253 VanDerWaalsContact C-N 3.32Å; D251-F253 PolarHBondContact O-N 2.99Å; F253-Q262 HydrophobicContact CD2-CG 4.15Å; F253-Q262 HydrophobicContact CE1-CG 4.21Å; F253-Q262 HydrophobicContact CE2-CG 3.48Å; F253-Q262 VanDerWaalsContact CE2-CG 3.48Å; F253-Q262 HydrophobicContact CZ-CG 3.51Å; F253-M265 HydrophobicContact CD2-CB 4.22Å; F253-M265 HydrophobicContact CE2-CB 4.46Å; F253-A266 HydrophobicContact CE2-CB 4.18Å; F253-L269 HydrophobicContact CD2-CD1 4.07Å
254	L	73.7	Confident	68.1	Low	129 Å²	129	65.1 Å²	65.1	68%	0.675	33%	0.327	S	S	*	.	H	α-helix	trans	-74.8	-30.6	178.8	-69.5	174.3	0	0	0	112.9	K250 D251 C256	K250-L254 WeakPolarHBondContact O-CG 3.33Å; K250-L254 PolarHBondContact O-N 3.15Å; D251-L254 PolarHBondContact O-N 3.41Å; L254-C256 PolarHBondContact O-N 2.88Å
255	N	75.7	Confident	67.9	Low	106 Å²	106	64 Å²	64	57%	0.567	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	2.4	178.9	-70.5	-33.4	0	0	0	113.9	D251	D251-N255 VanDerWaalsContact O-CB 3.28Å; D251-N255 WeakPolarHBondContact O-CB 3.21Å; D251-N255 PolarHBondContact O-N 3.45Å; D251-N255 PolarHBondContact O-ND2 2.94Å
256	C	63.2	Low	67.6	Low	10 Å²	10	62.2 Å²	62.2	7%	0.068	31%	0.313	C	S	.	.			trans	-88.4	112	178.6	-71.8	0	0	0	0	112.1	H233 I252 L254 M265	H233-C256 WeakPolarHBondContact CB-SG 3.44Å; I252-C256 PolarHBondContact O-SG 3.33Å; L254-C256 PolarHBondContact O-N 2.88Å; C256-M265 HydrophobicContact CB-SD 4.48Å; C256-M265 VanDerWaalsContact SG-CE 3.58Å; C256-M265 PolarHBondContact SG-SD 3.19Å
257	D	66.3	Low	67.4	Low	159 Å²	159	61.6 Å²	61.6	85%	0.85	31%	0.309	S	S	*	.			trans	-75.8	-28.4	175.7	-65.6	-30.8	0	0	0	113.1	I259	D257-I259 PolarHBondContact O-N 3.48Å
258	E	67.4	Low	67.1	Low	124 Å²	124	57.8 Å²	57.8	58%	0.579	29%	0.289	S	S	*	.			trans	-82.5	109.7	-178.4	-72.7	-162	169.4	0	0	111.9	V260 V261 Q262	E258-V260 PolarHBondContact O-N 3.08Å; E258-V261 HydrophobicContact CB-CB 4.17Å; E258-V261 HydrophobicContact CB-CG2 3.98Å; E258-V261 PolarHBondContact O-N 2.91Å; E258-V261 VanDerWaalsContact O-N 3.08Å; E258-V261 WeakPolarHBondContact OE2-CG2 3.5Å; E258-Q262 PolarHBondContact O-N 3.32Å
259	I	69.8	Low	66.8	Low	97 Å²	97	54.9 Å²	54.9	50%	0.497	28%	0.276	S	S	.	.	H	α-helix	trans	-54.1	-30.6	175.6	-48.5	175.9	0	0	0	111.3	D257 K263 F857	D257-I259 PolarHBondContact O-N 3.48Å; I259-K263 WeakPolarHBondContact O-CG 3.31Å; I259-K263 PolarHBondContact O-N 3.47Å; I259-F857 HydrophobicContact CB-CE1 3.88Å; I259-F857 HydrophobicContact CB-CZ 3.87Å; I259-F857 HydrophobicContact CG2-CE1 3.74Å; I259-F857 HydrophobicContact CG2-CZ 3.6Å
260	V	65.1	Low	66.3	Low	28 Å²	28	55 Å²	55	17%	0.17	28%	0.278	C	S	.	.	H	α-helix	trans	-66.9	-49.2	178.4	-165.1	0	0	0	0	112.2	E258 Q262 K263 Q264 L841 F857	E258-V260 PolarHBondContact O-N 3.08Å; V260-Q262 VanDerWaalsContact C-N 3.32Å; V260-K263 PolarHBondContact O-N 3.44Å; V260-Q264 WeakPolarHBondContact O-CG 3.33Å; V260-Q264 PolarHBondContact O-N 3.39Å; V260-L841 HydrophobicContact CG1-CD2 4.06Å; V260-F857 HydrophobicContact CB-CD2 3.68Å; V260-F857 HydrophobicContact CB-CE2 3.58Å; V260-F857 HydrophobicContact CB-CZ 4.3Å; V260-F857 HydrophobicContact CG1-CD2 3.57Å; V260-F857 HydrophobicContact CG1-CE2 3.68Å; V260-F857 HydrophobicContact CG2-CB 4.16Å; V260-F857 HydrophobicContact CG2-CD1 4.12Å; V260-F857 HydrophobicContact CG2-CD2 3.14Å; V260-F857 HydrophobicContact CG2-CE1 4.3Å; V260-F857 HydrophobicContact CG2-CE2 3.41Å; V260-F857 VanDerWaalsContact CG2-CE2 3.41Å; V260-F857 HydrophobicContact CG2-CG 3.53Å; V260-F857 HydrophobicContact CG2-CZ 3.95Å
261	V	66.3	Low	65.7	Low	24 Å²	24	50.5 Å²	50.5	15%	0.145	26%	0.258	C	S	.	.	H	α-helix	trans	-67.3	-39.9	177.9	180	0	0	0	0	109.1	E258 K263 Q264 M265	E258-V261 HydrophobicContact CB-CB 4.17Å; E258-V261 HydrophobicContact CB-CG2 3.98Å; E258-V261 PolarHBondContact O-N 2.91Å; E258-V261 VanDerWaalsContact O-N 3.08Å; E258-V261 WeakPolarHBondContact OE2-CG2 3.5Å; V261-K263 PolarHBondContact O-N 2.94Å; V261-Q264 CarbonylContact O-C 3.53Å; V261-Q264 PolarHBondContact O-N 2.93Å; V261-Q264 VanDerWaalsContact O-N 3.15Å; V261-M265 HydrophobicContact CG1-CE 4.12Å; V261-M265 HydrophobicContact CG1-CG 4.15Å; V261-M265 HydrophobicContact CG1-SD 4.2Å; V261-M265 WeakPolarHBondContact O-CB 3.35Å; V261-M265 WeakPolarHBondContact O-CG 3.37Å; V261-M265 PolarHBondContact O-N 3.3Å
262	Q	63.7	Low	64.9	Low	60 Å²	60	46.9 Å²	46.9	28%	0.28	24%	0.238	S	C	.	.	H	α-helix	trans	-59.9	-42.7	176.7	-166.5	-177.9	23	0	0	112.6	F253 E258 V260 M265 A266	F253-Q262 HydrophobicContact CD2-CG 4.15Å; F253-Q262 HydrophobicContact CE1-CG 4.21Å; F253-Q262 HydrophobicContact CE2-CG 3.48Å; F253-Q262 VanDerWaalsContact CE2-CG 3.48Å; F253-Q262 HydrophobicContact CZ-CG 3.51Å; E258-Q262 PolarHBondContact O-N 3.32Å; V260-Q262 VanDerWaalsContact C-N 3.32Å; Q262-M265 WeakPolarHBondContact O-CB 3.32Å; Q262-M265 PolarHBondContact O-N 3.07Å; Q262-A266 WeakPolarHBondContact O-CB 3.37Å; Q262-A266 PolarHBondContact O-N 2.91Å
263	K	61.8	Low	64.2	Low	61 Å²	61	47.5 Å²	47.5	27%	0.265	24%	0.241	S	C	.	.	H	α-helix	trans	-66.8	-40.3	174.3	-71.5	-173.9	-173.3	-179.1	0	112	I259 V260 V261 M265 A266 F267 I855 F857	I259-K263 WeakPolarHBondContact O-CG 3.31Å; I259-K263 PolarHBondContact O-N 3.47Å; V260-K263 PolarHBondContact O-N 3.44Å; V261-K263 PolarHBondContact O-N 2.94Å; K263-M265 VanDerWaalsContact C-N 3.35Å; K263-A266 WeakPolarHBondContact O-CB 3.39Å; K263-A266 PolarHBondContact O-N 3.46Å; K263-F267 WeakPolarHBondContact O-CD2 3.19Å; K263-F267 PolarHBondContact O-N 3.04Å; K263-I855 HydrophobicContact CB-CD1 4.3Å; K263-I855 HydrophobicContact CD-CD1 3.67Å; K263-I855 HydrophobicContact CD-CG2 4.44Å; K263-F857 HydrophobicContact CD-CE2 4.22Å; K263-F857 HydrophobicContact CD-CZ 3.84Å
264	Q	61.2	Low	63.3	Low	22 Å²	22	48.2 Å²	48.2	10%	0.103	25%	0.249	C	C	.	.	H	α-helix	trans	-64.9	-38.6	175.4	-71.6	177.5	3.1	0	0	112.6	V260 V261 F267 L268	V260-Q264 WeakPolarHBondContact O-CG 3.33Å; V260-Q264 PolarHBondContact O-N 3.39Å; V261-Q264 CarbonylContact O-C 3.53Å; V261-Q264 PolarHBondContact O-N 2.93Å; V261-Q264 VanDerWaalsContact O-N 3.15Å; Q264-F267 PolarHBondContact O-N 2.92Å; Q264-L268 PolarHBondContact O-N 3.01Å
265	M	63.4	Low	61.9	Low	0 Å²	0	45 Å²	45	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-63.7	-44.4	172.3	-75.1	-176	153.8	0	0	111.7	H233 F234 L237 I252 F253 C256 V261 Q262 K263 F267 L268 L269	H233-M265 HydrophobicContact CB-CE 3.23Å; H233-M265 WeakPolarHBondContact O-CE 3.19Å; F234-M265 HydrophobicContact CD2-CG 4.32Å; L237-M265 HydrophobicContact CB-CE 3.95Å; L237-M265 HydrophobicContact CD2-CB 3.6Å; L237-M265 HydrophobicContact CD2-CE 4.15Å; L237-M265 HydrophobicContact CD2-CG 3.54Å; L237-M265 HydrophobicContact CD2-SD 4.14Å; I252-M265 HydrophobicContact CG2-CE 3.88Å; F253-M265 HydrophobicContact CD2-CB 4.22Å; F253-M265 HydrophobicContact CE2-CB 4.46Å; C256-M265 HydrophobicContact CB-SD 4.48Å; C256-M265 VanDerWaalsContact SG-CE 3.58Å; C256-M265 PolarHBondContact SG-SD 3.19Å; V261-M265 HydrophobicContact CG1-CE 4.12Å; V261-M265 HydrophobicContact CG1-CG 4.15Å; V261-M265 HydrophobicContact CG1-SD 4.2Å; V261-M265 WeakPolarHBondContact O-CB 3.35Å; V261-M265 WeakPolarHBondContact O-CG 3.37Å; V261-M265 PolarHBondContact O-N 3.3Å; Q262-M265 WeakPolarHBondContact O-CB 3.32Å; Q262-M265 PolarHBondContact O-N 3.07Å; K263-M265 VanDerWaalsContact C-N 3.35Å; M265-F267 PolarHBondContact O-N 2.72Å; M265-L268 WeakPolarHBondContact O-CB 3.36Å; M265-L268 PolarHBondContact O-N 2.77Å; M265-L268 VanDerWaalsContact O-N 3.07Å; M265-L269 WeakPolarHBondContact O-CB 3.49Å; M265-L269 WeakPolarHBondContact O-CG 3.29Å; M265-L269 PolarHBondContact O-N 2.89Å
266	A	61.8	Low	60	Low	8 Å²	8	45.1 Å²	45.1	7%	0.066	23%	0.229	C	C	.	.	H	α-helix	trans	-58.2	-40	174.5	0	0	0	0	0	111	F253 Q262 K263 L269 A270 I276	F253-A266 HydrophobicContact CE2-CB 4.18Å; Q262-A266 WeakPolarHBondContact O-CB 3.37Å; Q262-A266 PolarHBondContact O-N 2.91Å; K263-A266 WeakPolarHBondContact O-CB 3.39Å; K263-A266 PolarHBondContact O-N 3.46Å; A266-L269 PolarHBondContact O-N 3.28Å; A266-A270 WeakPolarHBondContact O-CB 3.01Å; A266-A270 PolarHBondContact O-N 3.46Å; A266-I276 HydrophobicContact CB-CD1 3.44Å; A266-I276 VanDerWaalsContact CB-CD1 3.44Å; A266-I276 HydrophobicContact CB-CG1 4.2Å
267	F	61.7	Low	58.6	Low	34 Å²	34	50.5 Å²	50.5	15%	0.149	26%	0.257	C	S	.	.	H	α-helix	trans	-67.9	-31.6	173.9	-73.7	-60.6	0	0	0	114.3	K263 Q264 M265 A270 R271 F275 V853 I855	K263-F267 WeakPolarHBondContact O-CD2 3.19Å; K263-F267 PolarHBondContact O-N 3.04Å; Q264-F267 PolarHBondContact O-N 2.92Å; M265-F267 PolarHBondContact O-N 2.72Å; F267-A270 VanDerWaalsContact O-CB 3.29Å; F267-A270 WeakPolarHBondContact O-CB 3.46Å; F267-R271 WeakPolarHBondContact O-CG 3.44Å; F267-F275 HydrophobicContact CD1-CZ 4.49Å; F267-V853 HydrophobicContact CD1-CB 3.72Å; F267-V853 HydrophobicContact CD1-CG1 4.39Å; F267-V853 HydrophobicContact CD1-CG2 4Å; F267-V853 HydrophobicContact CD2-CB 3.89Å; F267-V853 HydrophobicContact CD2-CG1 4.25Å; F267-V853 WeakPolarHBondContact CD2-O 3.48Å; F267-V853 HydrophobicContact CE1-CB 3.51Å; F267-V853 HydrophobicContact CE1-CG1 3.71Å; F267-V853 HydrophobicContact CE1-CG2 3.77Å; F267-V853 HydrophobicContact CE2-CB 3.69Å; F267-V853 HydrophobicContact CE2-CG1 3.55Å; F267-V853 HydrophobicContact CG-CB 3.93Å; F267-V853 HydrophobicContact CZ-CB 3.51Å; F267-V853 HydrophobicContact CZ-CG1 3.24Å; F267-V853 HydrophobicContact CZ-CG2 4.21Å; F267-I855 HydrophobicContact CE2-CD1 3.59Å; F267-I855 HydrophobicContact CE2-CG1 3.99Å; F267-I855 HydrophobicContact CZ-CD1 3.97Å
268	L	63.5	Low	57.5	Low	17 Å²	17	46.1 Å²	46.1	9%	0.089	23%	0.233	C	C	.	.	H	α-helix	trans	-69.4	-46.4	172.7	-177	67.2	0	0	0	110.5	F234 L237 R238 L241 Q264 M265 A270 R271 H272 L733	F234-L268 HydrophobicContact CE2-CB 4.24Å; F234-L268 HydrophobicContact CE2-CD2 4.1Å; F234-L268 HydrophobicContact CZ-CD2 4.13Å; L237-L268 HydrophobicContact CD2-CD2 4.04Å; L237-L268 HydrophobicContact CG-CD2 4.28Å; R238-L268 HydrophobicContact CG-CD2 3.96Å; L241-L268 HydrophobicContact CD1-CD2 3.7Å; L241-L268 HydrophobicContact CD1-CG 3.89Å; Q264-L268 PolarHBondContact O-N 3.01Å; M265-L268 WeakPolarHBondContact O-CB 3.36Å; M265-L268 PolarHBondContact O-N 2.77Å; M265-L268 VanDerWaalsContact O-N 3.07Å; L268-A270 VanDerWaalsContact C-N 3.32Å; L268-A270 PolarHBondContact O-N 2.95Å; L268-R271 WeakPolarHBondContact O-CB 3.4Å; L268-R271 PolarHBondContact O-N 3.44Å; L268-R271 VanDerWaalsContact O-N 3.13Å; L268-H272 PolarHBondContact O-CD2 3.43Å; L268-H272 PolarHBondContact O-N 3.25Å; L268-L733 HydrophobicContact CD1-CD1 4.11Å
269	L	61.9	Low	56.1	Low	9 Å²	9	43.5 Å²	43.5	5%	0.047	23%	0.227	C	C	.	.	H	α-helix	trans	-61.5	-40.7	177.5	-75.9	174.5	0	0	0	112.1	L237 L241 V249 F253 M265 A266 R271 H272 Q273 V274	L237-L269 HydrophobicContact CD1-CD1 4.49Å; L237-L269 HydrophobicContact CD1-CD2 4.18Å; L237-L269 HydrophobicContact CD1-CG 4.47Å; L237-L269 HydrophobicContact CD2-CD1 4.37Å; L237-L269 HydrophobicContact CD2-CG 4.14Å; L241-L269 HydrophobicContact CD2-CD2 4.03Å; V249-L269 HydrophobicContact CG1-CD1 4.12Å; V249-L269 HydrophobicContact CG1-CD2 3.43Å; V249-L269 VanDerWaalsContact CG1-CD2 3.43Å; V249-L269 HydrophobicContact CG1-CG 4.42Å; F253-L269 HydrophobicContact CD2-CD1 4.07Å; M265-L269 WeakPolarHBondContact O-CB 3.49Å; M265-L269 WeakPolarHBondContact O-CG 3.29Å; M265-L269 PolarHBondContact O-N 2.89Å; A266-L269 PolarHBondContact O-N 3.28Å; L269-R271 PolarHBondContact O-N 3.32Å; L269-R271 VanDerWaalsContact O-N 3.14Å; L269-H272 CarbonylContact O-C 3.56Å; L269-H272 VanDerWaalsContact O-CA 3.31Å; L269-H272 WeakPolarHBondContact O-CA 3.41Å; L269-H272 PolarHBondContact O-N 3.15Å; L269-Q273 PolarHBondContact O-N 3.38Å; L269-Q273 VanDerWaalsContact O-N 3.14Å; L269-V274 CarbonylContact C-O 3.59Å; L269-V274 HydrophobicContact CB-CB 4.01Å; L269-V274 HydrophobicContact CB-CG1 4.36Å; L269-V274 PolarHBondContact O-N 3.47Å
270	A	59.8	Low	54.6	Low	7 Å²	7	44.2 Å²	44.2	6%	0.058	23%	0.231	C	C	.	.	H	α-helix	trans	-46	-42.7	170.7	0	0	0	0	0	112.9	A266 F267 L268 H272 Q273 V274 F275	A266-A270 WeakPolarHBondContact O-CB 3.01Å; A266-A270 PolarHBondContact O-N 3.46Å; F267-A270 VanDerWaalsContact O-CB 3.29Å; F267-A270 WeakPolarHBondContact O-CB 3.46Å; L268-A270 VanDerWaalsContact C-N 3.32Å; L268-A270 PolarHBondContact O-N 2.95Å; A270-H272 VanDerWaalsContact C-N 3.35Å; A270-Q273 WeakPolarHBondContact O-CA 3.41Å; A270-Q273 PolarHBondContact O-N 3.34Å; A270-V274 WeakPolarHBondContact CA-O 3.26Å; A270-V274 PolarHBondContact N-O 3.33Å; A270-F275 VanDerWaalsContact CA-CD2 3.45Å; A270-F275 HydrophobicContact CB-CB 4.19Å; A270-F275 HydrophobicContact CB-CD1 4.44Å; A270-F275 HydrophobicContact CB-CD2 2.96Å; A270-F275 HydrophobicContact CB-CE2 3.11Å; A270-F275 HydrophobicContact CB-CG 3.65Å; A270-F275 HydrophobicContact CB-CZ 3.88Å; A270-F275 WeakPolarHBondContact O-CD2 3.19Å
271	R	57.6	Low	53.2	Low	23 Å²	23	49.9 Å²	49.9	9%	0.087	26%	0.261	C	S	.	.	H	α-helix	trans	-80.9	-21.3	-178.1	-62.9	178.5	72.4	134	13.1	113.9	F267 L268 L269 H728 N735 A850 T851	F267-R271 WeakPolarHBondContact O-CG 3.44Å; L268-R271 WeakPolarHBondContact O-CB 3.4Å; L268-R271 PolarHBondContact O-N 3.44Å; L268-R271 VanDerWaalsContact O-N 3.13Å; L269-R271 PolarHBondContact O-N 3.32Å; L269-R271 VanDerWaalsContact O-N 3.14Å; R271-H728 PolarHBondContact NH2-CD2 3.01Å; R271-H728 PolarHBondContact NH2-NE2 2.91Å; R271-N735 PolarHBondContact O-ND2 3.4Å; R271-A850 PolarHBondContact NH1-O 3.24Å; R271-A850 VanDerWaalsContact NH2-CA 3.32Å; R271-A850 VanDerWaalsContact NH2-CB 3.26Å; R271-T851 PolarHBondContact NH1-O 3.4Å; R271-T851 PolarHBondContact NH1-OG1 3.24Å; R271-T851 PolarHBondContact NH2-OG1 3.25Å
272	H	58.1	Low	52.2	Low	15 Å²	15	51.4 Å²	51.4	7%	0.069	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	18.5	163.6	-69.9	-82.8	0	0	0	111.6	L241 L268 L269 A270	L241-H272 HydrophobicContact CD2-CB 4.16Å; L268-H272 PolarHBondContact O-CD2 3.43Å; L268-H272 PolarHBondContact O-N 3.25Å; L269-H272 CarbonylContact O-C 3.56Å; L269-H272 VanDerWaalsContact O-CA 3.31Å; L269-H272 WeakPolarHBondContact O-CA 3.41Å; L269-H272 PolarHBondContact O-N 3.15Å; A270-H272 VanDerWaalsContact C-N 3.35Å
273	Q	58.2	Low	51.2	Low	17 Å²	17	55.3 Å²	55.3	8%	0.079	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.9	22.5	176.5	-57.6	176.1	-61.5	0	0	116.3	L269 A270 A430 S737	L269-Q273 PolarHBondContact O-N 3.38Å; L269-Q273 VanDerWaalsContact O-N 3.14Å; A270-Q273 WeakPolarHBondContact O-CA 3.41Å; A270-Q273 PolarHBondContact O-N 3.34Å; Q273-A430 PolarHBondContact OE1-O 3.32Å; Q273-S737 PolarHBondContact OE1-OG 3.14Å
274	V	50	Low	50.7	Low	63 Å²	63	55.3 Å²	55.3	38%	0.382	29%	0.293	S	S	.	.			trans	-109.7	79.3	169.6	-179.6	0	0	0	0	108.7	M246 L269 A270	M246-V274 HydrophobicContact CE-CG2 3.87Å; L269-V274 CarbonylContact C-O 3.59Å; L269-V274 HydrophobicContact CB-CB 4.01Å; L269-V274 HydrophobicContact CB-CG1 4.36Å; L269-V274 PolarHBondContact O-N 3.47Å; A270-V274 WeakPolarHBondContact CA-O 3.26Å; A270-V274 PolarHBondContact N-O 3.33Å
275	F	43.1	Very low	50.2	Low	61 Å²	61	60.5 Å²	60.5	27%	0.268	32%	0.319	S	S	.	.			trans	-97.8	143.1	-166.4	-148.2	-79.1	0	0	0	113.1	F267 A270 I278	F267-F275 HydrophobicContact CD1-CZ 4.49Å; A270-F275 VanDerWaalsContact CA-CD2 3.45Å; A270-F275 HydrophobicContact CB-CB 4.19Å; A270-F275 HydrophobicContact CB-CD1 4.44Å; A270-F275 HydrophobicContact CB-CD2 2.96Å; A270-F275 HydrophobicContact CB-CE2 3.11Å; A270-F275 HydrophobicContact CB-CG 3.65Å; A270-F275 HydrophobicContact CB-CZ 3.88Å; A270-F275 WeakPolarHBondContact O-CD2 3.19Å; F275-I278 HydrophobicContact CE1-CB 4.23Å; F275-I278 HydrophobicContact CE1-CD1 3.54Å; F275-I278 HydrophobicContact CE1-CG1 3.45Å; F275-I278 VanDerWaalsContact CE1-CG1 3.45Å; F275-I278 HydrophobicContact CE2-CD1 4.01Å; F275-I278 HydrophobicContact CZ-CD1 3.15Å; F275-I278 HydrophobicContact CZ-CG1 3.41Å; F275-I278 VanDerWaalsContact CZ-CG1 3.41Å
276	I	36.1	Very low	49.6	Very low	108 Å²	108	67.8 Å²	67.8	55%	0.554	35%	0.353	S	S	*	.			trans	-106.1	121.7	165.8	-61.9	-178.5	0	0	0	106.6	A266 I278	A266-I276 HydrophobicContact CB-CD1 3.44Å; A266-I276 VanDerWaalsContact CB-CD1 3.44Å; A266-I276 HydrophobicContact CB-CG1 4.2Å; I276-I278 PolarHBondContact O-N 3.45Å
277	D	34.2	Very low	49.2	Very low	123 Å²	123	68.7 Å²	68.7	66%	0.658	36%	0.358	S	S	*	.			trans	-30.2	121.4	-175.7	-61.6	-33.3	0	0	0	114.9	P279	D277-P279 WeakPolarHBondContact O-CD 3.32Å
278	I	43.2	Very low	49	Very low	68 Å²	68	69.7 Å²	69.7	35%	0.349	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-75.7	123.5	162.6	-76.6	145.9	0	0	0	105.5	F275 I276 D280	F275-I278 HydrophobicContact CE1-CB 4.23Å; F275-I278 HydrophobicContact CE1-CD1 3.54Å; F275-I278 HydrophobicContact CE1-CG1 3.45Å; F275-I278 VanDerWaalsContact CE1-CG1 3.45Å; F275-I278 HydrophobicContact CE2-CD1 4.01Å; F275-I278 HydrophobicContact CZ-CD1 3.15Å; F275-I278 HydrophobicContact CZ-CG1 3.41Å; F275-I278 VanDerWaalsContact CZ-CG1 3.41Å; I276-I278 PolarHBondContact O-N 3.45Å; I278-D280 PolarHBondContact O-N 3.14Å
279	P	38.8	Very low	48.8	Very low	69 Å²	69	70.5 Å²	70.5	45%	0.448	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-61.9	135.3	170.9	22.2	-28.4	0	0	0	110.4	D277 L789	D277-P279 WeakPolarHBondContact O-CD 3.32Å; P279-L789 HydrophobicContact CG-CD1 3.88Å
280	D	36.8	Very low	48.6	Very low	111 Å²	111	70.4 Å²	70.4	59%	0.594	37%	0.368	S	S	*	.	S	Bend	trans	-47.4	154.4	174.4	-65.4	-46.2	0	0	0	112.6	I278	I278-D280 PolarHBondContact O-N 3.14Å
281	D	36.9	Very low	48.7	Very low	147 Å²	147	77.3 Å²	77.3	79%	0.786	40%	0.399	S	S	*	.			trans	99.9	67.9	175.1	-54.5	-24.7	0	0	0	116.7
282	L	43.9	Very low	49	Very low	56 Å²	56	80.4 Å²	80.4	29%	0.293	42%	0.417	S	S	.	.			trans	-114.4	71.5	156.5	-85.2	153.9	0	0	0	111	I284 M775 I777	L282-I284 HydrophobicContact CB-CD1 3.87Å; L282-I284 HydrophobicContact CB-CG1 4.15Å; L282-I284 HydrophobicContact CD2-CD1 3.78Å; L282-I284 HydrophobicContact CD2-CG1 3.9Å; L282-I284 HydrophobicContact CG-CD1 4.35Å; L282-I284 PolarHBondContact O-N 3.28Å; L282-M775 HydrophobicContact CD2-CE 3.92Å; L282-I777 HydrophobicContact CD1-CD1 3.42Å; L282-I777 VanDerWaalsContact CD1-CD1 3.42Å; L282-I777 HydrophobicContact CD2-CD1 3.49Å; L282-I777 VanDerWaalsContact CD2-CD1 3.49Å; L282-I777 HydrophobicContact CG-CD1 4.1Å
283	D	43.6	Very low	49.1	Very low	143 Å²	143	80.3 Å²	80.3	77%	0.765	42%	0.418	S	S	*	.			trans	-71.3	71.8	169.3	-86	-16	0	0	0	111.2
284	I	50.3	Low	49.2	Very low	61 Å²	61	80.6 Å²	80.6	31%	0.313	42%	0.418	S	S	.	.			trans	-82.7	-12.4	-173.9	-59	152.5	0	0	0	113	L282 F325 M775	L282-I284 HydrophobicContact CB-CD1 3.87Å; L282-I284 HydrophobicContact CB-CG1 4.15Å; L282-I284 HydrophobicContact CD2-CD1 3.78Å; L282-I284 HydrophobicContact CD2-CG1 3.9Å; L282-I284 HydrophobicContact CG-CD1 4.35Å; L282-I284 PolarHBondContact O-N 3.28Å; I284-F325 HydrophobicContact CB-CE1 4.36Å; I284-F325 HydrophobicContact CD1-CE1 4.3Å; I284-M775 HydrophobicContact CD1-CE 3.61Å; I284-M775 HydrophobicContact CD1-SD 3.24Å; I284-M775 WeakPolarHBondContact CD1-SD 3.41Å; I284-M775 HydrophobicContact CG1-CE 3.81Å; I284-M775 HydrophobicContact CG1-SD 4.09Å
285	M	52	Low	49.5	Very low	131 Å²	131	85 Å²	85	65%	0.645	43%	0.432	S	S	*	.	S	Bend	trans	-179.9	156.9	166.7	-93.3	-117.4	-88.1	0	0	110.8	K719	M285-K719 PolarHBondContact O-NZ 3.23Å
286	E	50.6	Low	49.7	Very low	153 Å²	153	85.9 Å²	85.9	72%	0.715	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-51.8	147	175.6	-68.8	-174.3	-176.1	0	0	112.8	K288 K719	E286-K288 PolarHBondContact O-N 3.26Å; E286-K719 PolarHBondContact O-NZ 2.9Å
287	P	53.3	Low	50.1	Low	26 Å²	26	89 Å²	89	17%	0.169	46%	0.46	C	S	.	.	P	Polyproline II helix	trans	-60.7	127.4	178.9	25.6	-34.3	0	0	0	110.4	K329	P287-K329 HydrophobicContact CG-CD 4.3Å; P287-K329 HydrophobicContact CG-CG 4.13Å
288	K	56.6	Low	50.4	Low	55 Å²	55	87 Å²	87	24%	0.239	45%	0.453	C	S	.	.	P	Polyproline II helix	trans	-86.5	135.5	176	-71.3	179.2	-177.9	167.9	0	109	E286 V321	E286-K288 PolarHBondContact O-N 3.26Å; K288-V321 HydrophobicContact CB-CG1 4.08Å
289	V	60.7	Low	50.1	Low	35 Å²	35	89.9 Å²	89.9	21%	0.212	47%	0.469	C	S	.	.	P	Polyproline II helix	trans	-78.3	146.3	172	-175.7	0	0	0	0	107.7	E291 D292 L330	V289-E291 HydrophobicContact CG1-CB 4.05Å; V289-E291 HydrophobicContact CG1-CG 4.07Å; V289-E291 PolarHBondContact O-N 3.06Å; V289-D292 PolarHBondContact N-OD2 3.33Å; V289-D292 WeakPolarHBondContact O-CB 3.45Å; V289-D292 PolarHBondContact O-N 3.09Å; V289-L330 HydrophobicContact CG1-CD1 3.92Å; V289-L330 HydrophobicContact CG1-CG 4.48Å
290	P	57.5	Low	50.2	Low	7 Å²	7	94.9 Å²	94.9	5%	0.045	49%	0.488	C	S	.	.	H	α-helix	trans	-51	-28.3	172.4	-28.8	36.4	0	0	0	113.7	D292 V293 Y294 V317 N318 L330	P290-D292 VanDerWaalsContact C-N 3.33Å; P290-D292 PolarHBondContact O-N 2.98Å; P290-V293 WeakPolarHBondContact O-CB 3.32Å; P290-V293 PolarHBondContact O-N 2.92Å; P290-Y294 HydrophobicContact CB-CE2 4.23Å; P290-Y294 WeakPolarHBondContact O-CD2 3.45Å; P290-Y294 PolarHBondContact O-N 3.33Å; P290-V317 HydrophobicContact CB-CG1 4.01Å; P290-N318 HydrophobicContact CG-CB 3.79Å; P290-L330 HydrophobicContact CG-CD1 3.86Å
291	E	61.2	Low	50.5	Low	151 Å²	151	96.4 Å²	96.4	71%	0.706	50%	0.496	S	S	*	.	H	α-helix	trans	-64.4	-34.2	174.7	-60.9	-171.6	167.9	0	0	113	V289 V293 Y294 K295	V289-E291 HydrophobicContact CG1-CB 4.05Å; V289-E291 HydrophobicContact CG1-CG 4.07Å; V289-E291 PolarHBondContact O-N 3.06Å; E291-V293 VanDerWaalsContact C-N 3.27Å; E291-V293 PolarHBondContact O-N 3.27Å; E291-Y294 PolarHBondContact O-N 3.5Å; E291-K295 PolarHBondContact O-N 2.9Å
292	D	64.2	Low	51.1	Low	89 Å²	89	94.5 Å²	94.5	48%	0.476	49%	0.49	S	S	.	.	H	α-helix	trans	-69.5	-27.5	176.5	-62.2	-40.1	0	0	0	112.1	V289 P290 K295	V289-D292 PolarHBondContact N-OD2 3.33Å; V289-D292 WeakPolarHBondContact O-CB 3.45Å; V289-D292 PolarHBondContact O-N 3.09Å; P290-D292 VanDerWaalsContact C-N 3.33Å; P290-D292 PolarHBondContact O-N 2.98Å; D292-K295 WeakPolarHBondContact O-CG 3.39Å
293	V	59.6	Low	51.4	Low	12 Å²	12	95.4 Å²	95.4	7%	0.073	50%	0.498	C	S	.	.	H	α-helix	trans	-74.5	-39.9	174.8	173	0	0	0	0	110.6	P290 E291 K295 V321 Q712 H716	P290-V293 WeakPolarHBondContact O-CB 3.32Å; P290-V293 PolarHBondContact O-N 2.92Å; E291-V293 VanDerWaalsContact C-N 3.27Å; E291-V293 PolarHBondContact O-N 3.27Å; V293-K295 VanDerWaalsContact C-N 3.27Å; V293-K295 PolarHBondContact O-N 2.68Å; V293-V321 HydrophobicContact CG2-CG2 3.92Å; V293-Q712 HydrophobicContact CG1-CB 4.23Å; V293-H716 VanDerWaalsContact CG1-CD2 3.42Å; V293-H716 WeakPolarHBondContact CG1-CD2 3.24Å
294	Y	59.6	Low	51.4	Low	23 Å²	23	96.5 Å²	96.5	9%	0.09	50%	0.503	C	S	.	.	H	α-helix	trans	-63.9	-32.6	-179.8	-59.7	-36.2	0	0	0	111.8	P290 E291 T296 S314 R709	P290-Y294 HydrophobicContact CB-CE2 4.23Å; P290-Y294 WeakPolarHBondContact O-CD2 3.45Å; P290-Y294 PolarHBondContact O-N 3.33Å; E291-Y294 PolarHBondContact O-N 3.5Å; Y294-T296 WeakPolarHBondContact O-CG2 3.22Å; Y294-T296 PolarHBondContact O-N 3.35Å; Y294-S314 PolarHBondContact OH-OG 3.01Å; Y294-S314 VanDerWaalsContact OH-OG 3.13Å; Y294-R709 HydrophobicContact CE1-CB 4.43Å; Y294-R709 HydrophobicContact CE1-CG 3.87Å
295	K	58.3	Low	51.2	Low	156 Å²	156	95.9 Å²	95.9	68%	0.678	51%	0.508	S	S	*	.			trans	41.3	34.2	-177.2	-71.8	-163.2	174.5	177.9	0	113.1	E291 D292 V293	E291-K295 PolarHBondContact O-N 2.9Å; D292-K295 WeakPolarHBondContact O-CG 3.39Å; V293-K295 VanDerWaalsContact C-N 3.27Å; V293-K295 PolarHBondContact O-N 2.68Å
296	T	46.6	Very low	51.4	Low	80 Å²	80	94.3 Å²	94.3	49%	0.491	50%	0.502	S	S	.	.			trans	-98.1	99.8	-177.6	41.5	0	0	0	0	110.1	Y294 V298	Y294-T296 WeakPolarHBondContact O-CG2 3.22Å; Y294-T296 PolarHBondContact O-N 3.35Å; T296-V298 PolarHBondContact O-N 3.25Å
297	N	45	Very low	52.1	Low	172 Å²	172	90.6 Å²	90.6	92%	0.92	49%	0.493	S	S	*	.			trans	-71.5	39.3	157.4	-73.1	-12.1	0	0	0	111.4
298	V	40.7	Very low	52.9	Low	83 Å²	83	91.1 Å²	91.1	50%	0.503	50%	0.499	S	S	.	.			trans	-117.8	123.3	-171.7	-175.7	0	0	0	0	109.8	T296 L696	T296-V298 PolarHBondContact O-N 3.25Å; V298-L696 HydrophobicContact CG1-CD2 4.25Å
299	D	36.8	Very low	53.4	Low	128 Å²	128	92.8 Å²	92.8	68%	0.684	50%	0.504	S	S	*	.			trans	-38.5	126.8	-171.1	-61.1	-57.1	0	0	0	115.1	N301	D299-N301 PolarHBondContact O-N 3.4Å
300	M	39.7	Very low	53.9	Low	173 Å²	173	91.5 Å²	91.5	85%	0.852	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-1	176.7	-69.8	-74.2	-89.9	0	0	115.4
301	N	43.9	Very low	54.6	Low	143 Å²	143	92.5 Å²	92.5	77%	0.765	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-2.1	-167.3	-69.3	-21.7	0	0	0	115.2	D299	D299-N301 PolarHBondContact O-N 3.4Å
302	V	49.6	Very low	55.2	Low	107 Å²	107	85.5 Å²	85.5	65%	0.648	47%	0.47	S	S	*	.	S	Bend	trans	-104.1	-7.2	-177.4	-166.9	0	0	0	0	113.2	N304	V302-N304 PolarHBondContact O-N 3.07Å
303	V	48.9	Very low	55.7	Low	76 Å²	76	81.3 Å²	81.3	46%	0.461	45%	0.447	S	S	.	.			trans	-97.5	31.8	-169.5	-159.6	0	0	0	0	113.4	A305	V303-A305 PolarHBondContact O-N 3.09Å
304	N	45.1	Very low	56.6	Low	165 Å²	165	81.6 Å²	81.6	88%	0.882	45%	0.449	S	S	*	.			trans	-77	6.2	173.4	-85.7	-9.6	0	0	0	113.8	V302	V302-N304 PolarHBondContact O-N 3.07Å
305	A	45.8	Very low	57.4	Low	49 Å²	49	80.5 Å²	80.5	41%	0.405	45%	0.445	S	S	.	.	S	Bend	trans	-99.2	108.5	175.7	0	0	0	0	0	110.9	V303	V303-A305 PolarHBondContact O-N 3.09Å
306	D	56.2	Low	58.3	Low	97 Å²	97	73.1 Å²	73.1	52%	0.519	41%	0.413	S	S	.	.			trans	48.4	75.8	173.4	-77.4	-20.2	0	0	0	118.1	A308 R309 A310 A702	D306-A308 PolarHBondContact O-N 3.14Å; D306-A308 VanDerWaalsContact O-N 3.09Å; D306-R309 PolarHBondContact O-N 2.76Å; D306-A310 PolarHBondContact O-N 2.9Å; D306-A702 HydrophobicContact CB-CB 4.02Å
307	S	65.1	Low	59.9	Low	76 Å²	76	69.3 Å²	69.3	53%	0.531	39%	0.39	S	S	.	.	H	α-helix	trans	-48.2	-35.6	170.2	174.5	0	0	0	0	113.5	R309 A310 N311	S307-R309 PolarHBondContact O-N 2.65Å; S307-A310 PolarHBondContact O-N 3.34Å; S307-N311 WeakPolarHBondContact O-CB 3.27Å; S307-N311 PolarHBondContact O-N 2.88Å; S307-N311 PolarHBondContact O-ND2 2.87Å; S307-N311 PolarHBondContact O-OD1 2.75Å; S307-N311 PolarHBondContact OG-ND2 3.5Å
308	A	69.3	Low	61.6	Low	36 Å²	36	61.3 Å²	61.3	30%	0.298	35%	0.347	S	S	.	.	H	α-helix	trans	-64.6	-41.7	-177.6	0	0	0	0	0	113.8	D306 L312	D306-A308 PolarHBondContact O-N 3.14Å; D306-A308 VanDerWaalsContact O-N 3.09Å; A308-L312 PolarHBondContact O-N 2.92Å; A308-L312 VanDerWaalsContact O-N 3.11Å
309	R	67.4	Low	63.3	Low	90 Å²	90	57.3 Å²	57.3	34%	0.34	32%	0.323	S	S	.	.	H	α-helix	trans	-74.5	-35.2	178.4	-71.8	-176.7	175.6	171.3	0.4	111.7	D306 S307 L312 A313 S703	D306-R309 PolarHBondContact O-N 2.76Å; S307-R309 PolarHBondContact O-N 2.65Å; R309-L312 PolarHBondContact O-N 3.27Å; R309-A313 WeakPolarHBondContact O-CB 3.13Å; R309-A313 PolarHBondContact O-N 3.32Å; R309-S703 PolarHBondContact NH1-OG 2.89Å
310	A	70.6	Confident	65.3	Low	9 Å²	9	51.4 Å²	51.4	7%	0.074	29%	0.291	C	S	.	.	H	α-helix	trans	-62.7	-42.2	172.9	0	0	0	0	0	111.7	D306 S307 A313 S314 F705 R709	D306-A310 PolarHBondContact O-N 2.9Å; S307-A310 PolarHBondContact O-N 3.34Å; A310-A313 PolarHBondContact O-N 3.24Å; A310-S314 PolarHBondContact O-N 2.88Å; A310-S314 PolarHBondContact O-OG 3.33Å; A310-F705 HydrophobicContact CB-CE1 4.38Å; A310-R709 PolarHBondContact O-NH1 3.43Å
311	N	74	Confident	67.1	Low	28 Å²	28	43.2 Å²	43.2	15%	0.15	25%	0.251	C	S	.	.	H	α-helix	trans	-66.6	-42.7	177.8	-64.9	-15.8	0	0	0	111.9	S307 A313 S314 S315 W338 N342	S307-N311 WeakPolarHBondContact O-CB 3.27Å; S307-N311 PolarHBondContact O-N 2.88Å; S307-N311 PolarHBondContact O-ND2 2.87Å; S307-N311 PolarHBondContact O-OD1 2.75Å; S307-N311 PolarHBondContact OG-ND2 3.5Å; N311-A313 VanDerWaalsContact C-N 3.34Å; N311-A313 PolarHBondContact O-N 2.66Å; N311-S314 WeakPolarHBondContact O-CB 3.31Å; N311-S314 PolarHBondContact O-N 2.92Å; N311-S315 PolarHBondContact O-N 3.24Å; N311-W338 HydrophobicContact CB-CH2 4.42Å; N311-W338 HydrophobicContact CB-CZ2 4.22Å; N311-N342 WeakPolarHBondContact CB-OD1 3.39Å
312	L	73.8	Confident	68.6	Low	4 Å²	4	36.4 Å²	36.4	2%	0.021	22%	0.215	C	C	.	.	H	α-helix	trans	-60.1	-44.1	174	173.5	138.8	0	0	0	111.8	A308 R309 S314 S315 F316 A346 M706 H761	A308-L312 PolarHBondContact O-N 2.92Å; A308-L312 VanDerWaalsContact O-N 3.11Å; R309-L312 PolarHBondContact O-N 3.27Å; L312-S314 VanDerWaalsContact C-N 3.29Å; L312-S314 PolarHBondContact O-N 2.85Å; L312-S315 WeakPolarHBondContact CA-OG 2.92Å; L312-S315 PolarHBondContact O-N 3.24Å; L312-S315 VanDerWaalsContact O-N 3.16Å; L312-S315 PolarHBondContact O-OG 2.89Å; L312-F316 HydrophobicContact CD1-CE2 4.24Å; L312-F316 HydrophobicContact CD2-CD2 3.81Å; L312-F316 HydrophobicContact CD2-CE2 3.63Å; L312-F316 HydrophobicContact CG-CD2 4.05Å; L312-F316 HydrophobicContact CG-CE2 3.79Å; L312-F316 WeakPolarHBondContact O-CD2 3.35Å; L312-F316 PolarHBondContact O-N 3.31Å; L312-F316 VanDerWaalsContact O-N 3.14Å; L312-A346 HydrophobicContact CB-CB 4.32Å; L312-A346 HydrophobicContact CD1-CB 3.43Å; L312-A346 VanDerWaalsContact CD1-CB 3.43Å; L312-A346 HydrophobicContact CG-CB 4.44Å; L312-M706 HydrophobicContact CD2-CE 3.16Å; L312-M706 HydrophobicContact CD2-CG 4.16Å; L312-M706 HydrophobicContact CD2-SD 3.48Å; L312-M706 WeakPolarHBondContact CD2-SD 3.36Å; L312-H761 HydrophobicContact CD1-CB 4.49Å
313	A	74.4	Confident	69.7	Low	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-60.4	-41.3	175.6	0	0	0	0	0	111.6	R309 A310 N311 S315 F316 V317 M706 R709	R309-A313 WeakPolarHBondContact O-CB 3.13Å; R309-A313 PolarHBondContact O-N 3.32Å; A310-A313 PolarHBondContact O-N 3.24Å; N311-A313 VanDerWaalsContact C-N 3.34Å; N311-A313 PolarHBondContact O-N 2.66Å; A313-S315 VanDerWaalsContact C-N 3.34Å; A313-S315 PolarHBondContact O-N 3.43Å; A313-F316 PolarHBondContact O-N 2.73Å; A313-V317 VanDerWaalsContact O-CG2 3.3Å; A313-V317 WeakPolarHBondContact O-CG2 2.96Å; A313-V317 PolarHBondContact O-N 2.9Å; A313-M706 HydrophobicContact CB-CB 4.34Å; A313-M706 HydrophobicContact CB-CG 4.1Å; A313-R709 HydrophobicContact CB-CB 3.75Å; A313-R709 HydrophobicContact CB-CG 4.35Å
314	S	76.8	Confident	70.5	Confident	18 Å²	18	28.9 Å²	28.9	13%	0.126	17%	0.174	C	C	.	.	H	α-helix	trans	-63.8	-35.2	175.4	-67	0	0	0	0	113.1	Y294 A310 N311 L312 V317 N318 R709	Y294-S314 PolarHBondContact OH-OG 3.01Å; Y294-S314 VanDerWaalsContact OH-OG 3.13Å; A310-S314 PolarHBondContact O-N 2.88Å; A310-S314 PolarHBondContact O-OG 3.33Å; N311-S314 WeakPolarHBondContact O-CB 3.31Å; N311-S314 PolarHBondContact O-N 2.92Å; L312-S314 VanDerWaalsContact C-N 3.29Å; L312-S314 PolarHBondContact O-N 2.85Å; S314-V317 PolarHBondContact O-N 3.27Å; S314-N318 WeakPolarHBondContact O-CB 3.26Å; S314-N318 PolarHBondContact O-N 3.2Å; S314-R709 PolarHBondContact OG-NH1 3.09Å
315	S	77.7	Confident	71.4	Confident	1 Å²	1	22.2 Å²	22.2	1%	0.007	14%	0.137	C	C	.	.	H	α-helix	trans	-65.6	-39.4	173.7	48.8	0	0	0	0	113	N311 L312 A313 N318 G319	N311-S315 PolarHBondContact O-N 3.24Å; L312-S315 WeakPolarHBondContact CA-OG 2.92Å; L312-S315 PolarHBondContact O-N 3.24Å; L312-S315 VanDerWaalsContact O-N 3.16Å; L312-S315 PolarHBondContact O-OG 2.89Å; A313-S315 VanDerWaalsContact C-N 3.34Å; A313-S315 PolarHBondContact O-N 3.43Å; S315-N318 PolarHBondContact O-N 3.09Å; S315-G319 PolarHBondContact O-N 3.1Å
316	F	77.4	Confident	72.1	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-66.2	-44.3	173.6	-78.7	-66.9	0	0	0	112.1	L312 A313 N318 G319 F320 I710 H761 L764 Y765	L312-F316 HydrophobicContact CD1-CE2 4.24Å; L312-F316 HydrophobicContact CD2-CD2 3.81Å; L312-F316 HydrophobicContact CD2-CE2 3.63Å; L312-F316 HydrophobicContact CG-CD2 4.05Å; L312-F316 HydrophobicContact CG-CE2 3.79Å; L312-F316 WeakPolarHBondContact O-CD2 3.35Å; L312-F316 PolarHBondContact O-N 3.31Å; L312-F316 VanDerWaalsContact O-N 3.14Å; A313-F316 PolarHBondContact O-N 2.73Å; F316-N318 VanDerWaalsContact C-N 3.3Å; F316-N318 PolarHBondContact O-N 3.16Å; F316-G319 PolarHBondContact O-N 3.48Å; F316-F320 HydrophobicContact CB-CD2 4.25Å; F316-F320 HydrophobicContact CB-CE2 4.05Å; F316-F320 HydrophobicContact CD1-CE2 4.12Å; F316-F320 HydrophobicContact CG-CE2 4.49Å; F316-F320 WeakPolarHBondContact O-CD2 3.5Å; F316-F320 WeakPolarHBondContact O-CG 3.36Å; F316-F320 PolarHBondContact O-N 3.44Å; F316-I710 HydrophobicContact CB-CG1 4.29Å; F316-I710 HydrophobicContact CD2-CD1 4.48Å; F316-H761 HydrophobicContact CE2-CB 4.31Å; F316-H761 HydrophobicContact CZ-CB 4.12Å; F316-L764 HydrophobicContact CE1-CB 4.29Å; F316-L764 HydrophobicContact CE1-CD1 4.2Å; F316-L764 HydrophobicContact CE2-CD1 4.4Å; F316-L764 HydrophobicContact CZ-CD1 4.08Å; F316-Y765 HydrophobicContact CE1-CE1 4.48Å; F316-Y765 AromaticContact CE1-CE2 3.85Å; F316-Y765 HydrophobicContact CE1-CE2 3.85Å; F316-Y765 AromaticContact CE1-CZ 3.7Å; F316-Y765 WeakPolarHBondContact CE1-OH 3.17Å; F316-Y765 HydrophobicContact CZ-CE2 4.41Å
317	V	79.2	Confident	72.4	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-58.5	-44.7	177.1	172.5	0	0	0	0	110.7	P290 A313 S314 F320 V321 R709	P290-V317 HydrophobicContact CB-CG1 4.01Å; A313-V317 VanDerWaalsContact O-CG2 3.3Å; A313-V317 WeakPolarHBondContact O-CG2 2.96Å; A313-V317 PolarHBondContact O-N 2.9Å; S314-V317 PolarHBondContact O-N 3.27Å; V317-F320 PolarHBondContact O-N 3.48Å; V317-V321 HydrophobicContact CG1-CG2 3.98Å; V317-V321 WeakPolarHBondContact O-CB 3.49Å; V317-V321 WeakPolarHBondContact O-CG2 3.25Å; V317-V321 PolarHBondContact O-N 3.13Å; V317-R709 HydrophobicContact CG2-CB 4.22Å; V317-R709 WeakPolarHBondContact CG2-O 3.28Å
318	N	80.3	Confident	72.3	Confident	4 Å²	4	17.9 Å²	17.9	2%	0.021	11%	0.107	C	C	.	.	H	α-helix	trans	-62.3	-46.3	178.2	-166.2	34.3	0	0	0	112.2	P290 S314 S315 F316 F320 V321 N322 D328 I331	P290-N318 HydrophobicContact CG-CB 3.79Å; S314-N318 WeakPolarHBondContact O-CB 3.26Å; S314-N318 PolarHBondContact O-N 3.2Å; S315-N318 PolarHBondContact O-N 3.09Å; F316-N318 VanDerWaalsContact C-N 3.3Å; F316-N318 PolarHBondContact O-N 3.16Å; N318-F320 PolarHBondContact O-N 3.03Å; N318-V321 PolarHBondContact O-N 2.87Å; N318-N322 PolarHBondContact O-N 3.36Å; N318-N322 VanDerWaalsContact O-N 3.17Å; N318-N322 PolarHBondContact OD1-ND2 2.84Å; N318-N322 VanDerWaalsContact OD1-ND2 3.09Å; N318-D328 PolarHBondContact ND2-OD2 3.41Å; N318-D328 PolarHBondContact OD1-OD1 3.42Å; N318-I331 WeakPolarHBondContact ND2-CD1 3.38Å; N318-I331 WeakPolarHBondContact ND2-CG1 3.48Å
319	G	77.1	Confident	71.7	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-58.7	-43.7	175.4	0	0	0	0	0	112.9	S315 F316 T323	S315-G319 PolarHBondContact O-N 3.1Å; F316-G319 PolarHBondContact O-N 3.48Å; G319-T323 WeakPolarHBondContact O-CG2 3.49Å; G319-T323 PolarHBondContact O-N 2.88Å
320	F	79.6	Confident	71.3	Confident	4 Å²	4	21 Å²	21	2%	0.018	12%	0.119	C	C	.	.	H	α-helix	trans	-73.1	-36.8	179.7	-70.5	-53	0	0	0	113.7	F316 V317 N318 T323 L356 I710 L714 L717 G718 L767	F316-F320 HydrophobicContact CB-CD2 4.25Å; F316-F320 HydrophobicContact CB-CE2 4.05Å; F316-F320 HydrophobicContact CD1-CE2 4.12Å; F316-F320 HydrophobicContact CG-CE2 4.49Å; F316-F320 WeakPolarHBondContact O-CD2 3.5Å; F316-F320 WeakPolarHBondContact O-CG 3.36Å; F316-F320 PolarHBondContact O-N 3.44Å; V317-F320 PolarHBondContact O-N 3.48Å; N318-F320 PolarHBondContact O-N 3.03Å; F320-T323 PolarHBondContact O-OG1 3.28Å; F320-L356 HydrophobicContact CD1-CD1 4.16Å; F320-L356 HydrophobicContact CE1-CD1 4.14Å; F320-I710 HydrophobicContact CE2-CG2 4.34Å; F320-L714 HydrophobicContact CD1-CD2 4Å; F320-L714 HydrophobicContact CD2-CD2 4.23Å; F320-L714 HydrophobicContact CE1-CD2 3.96Å; F320-L714 HydrophobicContact CE2-CD2 4.19Å; F320-L714 HydrophobicContact CG-CD2 4.16Å; F320-L714 HydrophobicContact CZ-CD2 4.06Å; F320-L717 HydrophobicContact CB-CD1 4.05Å; F320-L717 HydrophobicContact CD1-CD1 3.78Å; F320-L717 HydrophobicContact CG-CD1 4.33Å; F320-L717 WeakPolarHBondContact O-CA 3.4Å; F320-G718 PolarHBondContact O-N 3.34Å; F320-G718 VanDerWaalsContact O-N 3.12Å; F320-L767 HydrophobicContact CE1-CD2 4.42Å
321	V	77.5	Confident	70.9	Confident	1 Å²	1	21 Å²	21	1%	0.006	12%	0.118	C	C	.	.	H	α-helix	trans	-71.2	-38.1	-177.7	171.7	0	0	0	0	111.4	K288 V293 V317 N318 H716 K719	K288-V321 HydrophobicContact CB-CG1 4.08Å; V293-V321 HydrophobicContact CG2-CG2 3.92Å; V317-V321 HydrophobicContact CG1-CG2 3.98Å; V317-V321 WeakPolarHBondContact O-CB 3.49Å; V317-V321 WeakPolarHBondContact O-CG2 3.25Å; V317-V321 PolarHBondContact O-N 3.13Å; N318-V321 PolarHBondContact O-N 2.87Å; V321-H716 HydrophobicContact CG2-CB 4.14Å; V321-K719 PolarHBondContact O-N 3.06Å
322	N	74.7	Confident	70.2	Confident	0 Å²	0	23 Å²	23	0%	0	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.5	21.5	-174.9	-66.6	-34.9	0	0	0	113.4	N318 G324 F325 I357	N318-N322 PolarHBondContact O-N 3.36Å; N318-N322 VanDerWaalsContact O-N 3.17Å; N318-N322 PolarHBondContact OD1-ND2 2.84Å; N318-N322 VanDerWaalsContact OD1-ND2 3.09Å; N322-G324 PolarHBondContact O-N 3.17Å; N322-F325 PolarHBondContact O-N 2.99Å; N322-I357 HydrophobicContact CB-CG1 4.42Å
323	T	71.9	Confident	69.5	Low	0 Å²	0	31 Å²	31	0%	0	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	121.2	176.6	46.3	0	0	0	0	112	G319 F320 F325 L356 L717 G718 M722 I771	G319-T323 WeakPolarHBondContact O-CG2 3.49Å; G319-T323 PolarHBondContact O-N 2.88Å; F320-T323 PolarHBondContact O-OG1 3.28Å; T323-F325 VanDerWaalsContact C-N 3.31Å; T323-F325 VanDerWaalsContact O-CD2 3.25Å; T323-F325 WeakPolarHBondContact O-CD2 3.42Å; T323-F325 PolarHBondContact O-N 3Å; T323-L356 VanDerWaalsContact CA-O 3.31Å; T323-L356 WeakPolarHBondContact CA-O 3.46Å; T323-L356 HydrophobicContact CG2-CB 4.29Å; T323-L356 HydrophobicContact CG2-CD2 4.29Å; T323-L717 HydrophobicContact CG2-CD1 4.06Å; T323-G718 WeakPolarHBondContact OG1-CA 3.29Å; T323-G718 PolarHBondContact OG1-N 3.12Å; T323-M722 WeakPolarHBondContact O-CE 3.21Å; T323-M722 PolarHBondContact OG1-SD 3.42Å; T323-I771 HydrophobicContact CG2-CD1 4.38Å
324	G	67.5	Low	68.8	Low	25 Å²	25	36 Å²	36	26%	0.258	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.4	17	173.3	0	0	0	0	0	115.7	N322 L356 I357	N322-G324 PolarHBondContact O-N 3.17Å; G324-L356 PolarHBondContact N-O 3.31Å; G324-I357 WeakPolarHBondContact CA-O 3.41Å; G324-I357 PolarHBondContact N-O 3.41Å
325	F	63.5	Low	68.1	Low	25 Å²	25	35.5 Å²	35.5	11%	0.11	19%	0.192	C	C	.	.			trans	-104.9	5	178.9	-76.8	-76.1	0	0	0	113.9	I284 N322 T323 V327 G718 K719 T721	I284-F325 HydrophobicContact CB-CE1 4.36Å; I284-F325 HydrophobicContact CD1-CE1 4.3Å; N322-F325 PolarHBondContact O-N 2.99Å; T323-F325 VanDerWaalsContact C-N 3.31Å; T323-F325 VanDerWaalsContact O-CD2 3.25Å; T323-F325 WeakPolarHBondContact O-CD2 3.42Å; T323-F325 PolarHBondContact O-N 3Å; F325-V327 PolarHBondContact O-N 3.28Å; F325-G718 WeakPolarHBondContact CE2-O 3.33Å; F325-K719 HydrophobicContact CD2-CD 4.38Å; F325-K719 HydrophobicContact CE2-CD 4.23Å; F325-K719 HydrophobicContact CE2-CG 4.39Å; F325-K719 HydrophobicContact CZ-CD 4.36Å; F325-T721 HydrophobicContact CZ-CG2 4.27Å
326	C	59.7	Low	67.4	Low	39 Å²	39	40.4 Å²	40.4	26%	0.264	22%	0.218	S	C	.	.			trans	51.4	-7.8	173.9	-63.4	0	0	0	0	118.4	I357 Y358 D361	C326-I357 PolarHBondContact N-O 3.11Å; C326-Y358 HydrophobicContact CB-CD1 4.43Å; C326-Y358 WeakPolarHBondContact O-CE1 3.34Å; C326-D361 PolarHBondContact SG-OD2 2.99Å; C326-D361 VanDerWaalsContact SG-OD2 3.41Å
327	V	62.3	Low	66.9	Low	83 Å²	83	43 Å²	43	50%	0.503	24%	0.237	S	C	.	.			trans	-127.3	119.4	-176.6	-173.8	0	0	0	0	109.5	F325	F325-V327 PolarHBondContact O-N 3.28Å
328	D	63.9	Low	66.4	Low	9 Å²	9	46 Å²	46	5%	0.048	25%	0.248	C	C	.	.			trans	-129.5	149.4	169.3	178.9	29.1	0	0	0	110	N318 L330 I331 T332 I357	N318-D328 PolarHBondContact ND2-OD2 3.41Å; N318-D328 PolarHBondContact OD1-OD1 3.42Å; D328-L330 PolarHBondContact OD1-N 2.89Å; D328-L330 PolarHBondContact OD2-N 3.32Å; D328-I331 WeakPolarHBondContact OD2-CB 3.35Å; D328-I331 PolarHBondContact OD2-N 2.89Å; D328-T332 PolarHBondContact O-OG1 3.33Å; D328-I357 HydrophobicContact CB-CD1 4.07Å
329	K	56.7	Low	65.8	Low	118 Å²	118	45.9 Å²	45.9	51%	0.513	25%	0.247	S	C	.	.	S	Bend	trans	-89.4	-22.4	176.2	-71.1	179.6	176.7	171	0	112.5	P287	P287-K329 HydrophobicContact CG-CD 4.3Å; P287-K329 HydrophobicContact CG-CG 4.13Å
330	L	58.4	Low	65.5	Low	72 Å²	72	52.6 Å²	52.6	38%	0.377	27%	0.274	S	S	.	.	S	Bend	trans	-94.6	-43.8	-171.2	-73.5	170.7	0	0	0	114.1	V289 P290 D328	V289-L330 HydrophobicContact CG1-CD1 3.92Å; V289-L330 HydrophobicContact CG1-CG 4.48Å; P290-L330 HydrophobicContact CG-CD1 3.86Å; D328-L330 PolarHBondContact OD1-N 2.89Å; D328-L330 PolarHBondContact OD2-N 3.32Å
331	I	62	Low	65.2	Low	10 Å²	10	57.7 Å²	57.7	5%	0.051	30%	0.295	C	S	.	.	H	α-helix	trans	-91.3	-20.3	-172.2	-67.1	179.3	0	0	0	112.3	N318 D328 A335 Q354 I357	N318-I331 WeakPolarHBondContact ND2-CD1 3.38Å; N318-I331 WeakPolarHBondContact ND2-CG1 3.48Å; D328-I331 WeakPolarHBondContact OD2-CB 3.35Å; D328-I331 PolarHBondContact OD2-N 2.89Å; I331-A335 HydrophobicContact CG2-CB 4.4Å; I331-A335 WeakPolarHBondContact O-CB 3.49Å; I331-Q354 HydrophobicContact CG2-CG 3.36Å; I331-I357 HydrophobicContact CB-CD1 4.43Å; I331-I357 HydrophobicContact CD1-CD1 4.03Å
332	T	58.9	Low	64.9	Low	71 Å²	71	57.7 Å²	57.7	44%	0.436	30%	0.295	S	S	.	.	H	α-helix	trans	-82.3	-33	-176.3	-17.4	0	0	0	0	112.9	D328	D328-T332 PolarHBondContact O-OG1 3.33Å
333	E	59	Low	64.8	Low	170 Å²	170	65.1 Å²	65.1	79%	0.794	33%	0.328	S	S	*	.	H	α-helix	trans	-100.1	-37.9	-176.5	-63.2	-175.3	175.1	0	0	112.9
334	D	61.4	Low	64.8	Low	106 Å²	106	70.1 Å²	70.1	57%	0.567	36%	0.355	S	S	*	.	H	α-helix	trans	-115.7	12.7	-171.8	-83.9	-24	0	0	0	114.8	N336 S337 W338	D334-N336 VanDerWaalsContact C-N 3.31Å; D334-N336 PolarHBondContact O-N 3.2Å; D334-N336 VanDerWaalsContact O-N 3.13Å; D334-S337 PolarHBondContact O-N 3.27Å; D334-S337 PolarHBondContact O-OG 3.34Å; D334-W338 PolarHBondContact O-N 3.2Å
335	A	61.3	Low	65.2	Low	7 Å²	7	71.9 Å²	71.9	6%	0.058	36%	0.356	C	S	.	.	H	α-helix	trans	-44.5	-50.8	-172.8	0	0	0	0	0	113.9	I331 S337 W338 F339 F372	I331-A335 HydrophobicContact CG2-CB 4.4Å; I331-A335 WeakPolarHBondContact O-CB 3.49Å; A335-S337 VanDerWaalsContact C-N 3.32Å; A335-S337 PolarHBondContact O-N 3.49Å; A335-W338 PolarHBondContact O-N 3.09Å; A335-F339 VanDerWaalsContact C-CD2 3.45Å; A335-F339 HydrophobicContact CB-CD2 4.16Å; A335-F339 HydrophobicContact CB-CE2 3.49Å; A335-F339 VanDerWaalsContact CB-CE2 3.49Å; A335-F339 HydrophobicContact CB-CZ 4.2Å; A335-F339 WeakPolarHBondContact O-CD2 3.43Å; A335-F339 WeakPolarHBondContact O-CE2 2.93Å; A335-F339 WeakPolarHBondContact O-CG 2.94Å; A335-F339 PolarHBondContact O-N 2.83Å; A335-F372 HydrophobicContact CB-CE1 3.88Å; A335-F372 HydrophobicContact CB-CZ 3.55Å
336	N	63.8	Low	65.8	Low	105 Å²	105	71.2 Å²	71.2	56%	0.561	36%	0.355	S	S	*	.	H	α-helix	trans	-58.9	-44.1	-176.5	-73.7	-25.6	0	0	0	111.5	D334 W338 F339 Y340 F372	D334-N336 VanDerWaalsContact C-N 3.31Å; D334-N336 PolarHBondContact O-N 3.2Å; D334-N336 VanDerWaalsContact O-N 3.13Å; N336-W338 VanDerWaalsContact C-N 3.25Å; N336-W338 PolarHBondContact O-N 3.45Å; N336-F339 PolarHBondContact O-N 3.05Å; N336-Y340 WeakPolarHBondContact O-CD2 3.22Å; N336-Y340 PolarHBondContact O-N 3Å; N336-F372 WeakPolarHBondContact OD1-CE1 3.41Å
337	S	66.7	Low	66.8	Low	55 Å²	55	70.5 Å²	70.5	39%	0.385	35%	0.348	S	S	.	.	H	α-helix	trans	-66.4	-31.7	178.6	81.3	0	0	0	0	112.1	D334 A335 K341	D334-S337 PolarHBondContact O-N 3.27Å; D334-S337 PolarHBondContact O-OG 3.34Å; A335-S337 VanDerWaalsContact C-N 3.32Å; A335-S337 PolarHBondContact O-N 3.49Å; S337-K341 WeakPolarHBondContact O-CG 3.37Å
338	W	67.5	Low	67.8	Low	61 Å²	61	66.6 Å²	66.6	23%	0.231	33%	0.325	C	S	.	.	H	α-helix	trans	-77	-38.6	-179.1	-167.5	-104	0	0	0	112.3	N311 D334 A335 N336 Y340 K341	N311-W338 HydrophobicContact CB-CH2 4.42Å; N311-W338 HydrophobicContact CB-CZ2 4.22Å; D334-W338 PolarHBondContact O-N 3.2Å; A335-W338 PolarHBondContact O-N 3.09Å; N336-W338 VanDerWaalsContact C-N 3.25Å; N336-W338 PolarHBondContact O-N 3.45Å; W338-Y340 PolarHBondContact O-N 3.36Å; W338-K341 HydrophobicContact CE3-CD 3.83Å; W338-K341 HydrophobicContact CZ3-CD 4.1Å; W338-K341 WeakPolarHBondContact O-CB 3.41Å; W338-K341 PolarHBondContact O-N 3.06Å
339	F	67.8	Low	68.5	Low	2 Å²	2	66.2 Å²	66.2	1%	0.009	32%	0.323	C	S	.	.	H	α-helix	trans	-61.3	-44.6	176.4	-65.6	-50.6	0	0	0	112.4	A335 N336 K341 N342 A350 A351 Q354 F372 I380	A335-F339 VanDerWaalsContact C-CD2 3.45Å; A335-F339 HydrophobicContact CB-CD2 4.16Å; A335-F339 HydrophobicContact CB-CE2 3.49Å; A335-F339 VanDerWaalsContact CB-CE2 3.49Å; A335-F339 HydrophobicContact CB-CZ 4.2Å; A335-F339 WeakPolarHBondContact O-CD2 3.43Å; A335-F339 WeakPolarHBondContact O-CE2 2.93Å; A335-F339 WeakPolarHBondContact O-CG 2.94Å; A335-F339 PolarHBondContact O-N 2.83Å; N336-F339 PolarHBondContact O-N 3.05Å; F339-K341 PolarHBondContact O-N 3.47Å; F339-N342 PolarHBondContact O-N 2.87Å; F339-N342 VanDerWaalsContact O-N 3.1Å; F339-A350 HydrophobicContact CD1-CB 3.64Å; F339-A350 VanDerWaalsContact CE1-C 3.46Å; F339-A350 HydrophobicContact CE1-CB 3.76Å; F339-A351 HydrophobicContact CE1-CB 4.33Å; F339-Q354 HydrophobicContact CZ-CG 4.4Å; F339-Q354 VanDerWaalsContact CZ-NE2 3.32Å; F339-F372 HydrophobicContact CD2-CD1 4.14Å; F339-F372 AromaticContact CD2-CE1 3.95Å; F339-F372 HydrophobicContact CD2-CE1 3.95Å; F339-F372 AromaticContact CE2-CD1 3.72Å; F339-F372 HydrophobicContact CE2-CD1 3.72Å; F339-F372 AromaticContact CE2-CE1 3.38Å; F339-F372 HydrophobicContact CE2-CE1 3.38Å; F339-F372 HydrophobicContact CE2-CE2 4.43Å; F339-F372 HydrophobicContact CE2-CG 4.38Å; F339-F372 AromaticContact CE2-CZ 3.79Å; F339-F372 HydrophobicContact CE2-CZ 3.79Å; F339-F372 HydrophobicContact CZ-CE1 4.44Å; F339-I380 HydrophobicContact CB-CD1 4.18Å
340	Y	72.3	Confident	69.6	Low	142 Å²	142	60.7 Å²	60.7	56%	0.557	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-12.1	179.3	-67.8	-64.2	0	0	0	114.2	N336 W338 N342 D377	N336-Y340 WeakPolarHBondContact O-CD2 3.22Å; N336-Y340 PolarHBondContact O-N 3Å; W338-Y340 PolarHBondContact O-N 3.36Å; Y340-N342 VanDerWaalsContact C-N 3.29Å; Y340-D377 WeakPolarHBondContact CE1-OD2 3.35Å
341	K	71.7	Confident	70.7	Confident	110 Å²	110	57.2 Å²	57.2	48%	0.478	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-20.3	171.5	-73	170.1	-173.3	172.5	0	112.5	S337 W338 F339	S337-K341 WeakPolarHBondContact O-CG 3.37Å; W338-K341 HydrophobicContact CE3-CD 3.83Å; W338-K341 HydrophobicContact CZ3-CD 4.1Å; W338-K341 WeakPolarHBondContact O-CB 3.41Å; W338-K341 PolarHBondContact O-N 3.06Å; F339-K341 PolarHBondContact O-N 3.47Å
342	N	71.6	Confident	71.7	Confident	1 Å²	1	56.8 Å²	56.8	1%	0.005	28%	0.278	C	S	.	.	S	Bend	trans	-96.1	146.3	-179.5	-71.6	-14.6	0	0	0	110.5	N311 F339 Y340 A346 M347 A350	N311-N342 WeakPolarHBondContact CB-OD1 3.39Å; F339-N342 PolarHBondContact O-N 2.87Å; F339-N342 VanDerWaalsContact O-N 3.1Å; Y340-N342 VanDerWaalsContact C-N 3.29Å; N342-A346 HydrophobicContact CB-CB 3.76Å; N342-M347 HydrophobicContact CB-CG 4.44Å; N342-M347 WeakPolarHBondContact O-CE 3.42Å; N342-M347 WeakPolarHBondContact O-CG 3.32Å; N342-A350 WeakPolarHBondContact ND2-CB 3.33Å
343	K	72.5	Confident	72.7	Confident	157 Å²	157	53.4 Å²	53.4	68%	0.683	26%	0.258	S	S	*	.			trans	-100.5	132.9	-178.9	-66.3	-174.4	177.6	-177.8	0	111.9	H345 A346	K343-H345 PolarHBondContact O-N 3.24Å; K343-H345 VanDerWaalsContact O-N 3.09Å; K343-A346 VanDerWaalsContact O-CB 3.24Å; K343-A346 WeakPolarHBondContact O-CB 3.3Å; K343-A346 PolarHBondContact O-N 3.22Å
344	D	72.3	Confident	73.6	Confident	105 Å²	105	45.6 Å²	45.6	56%	0.561	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	46	-102.8	169.1	-52.6	-33.9	0	0	0	115.2	A346 M347	D344-A346 PolarHBondContact O-N 3.37Å; D344-M347 WeakPolarHBondContact O-CB 3.46Å; D344-M347 PolarHBondContact O-N 2.91Å; D344-M347 VanDerWaalsContact O-N 3.09Å
345	H	76.7	Confident	74.4	Confident	61 Å²	61	40.5 Å²	40.5	28%	0.282	19%	0.194	S	C	.	.	H	α-helix	trans	-64.3	-26.4	179.7	-62.1	-63.6	0	0	0	113	K343 M347 I348 S349	K343-H345 PolarHBondContact O-N 3.24Å; K343-H345 VanDerWaalsContact O-N 3.09Å; H345-M347 PolarHBondContact O-N 3.19Å; H345-I348 WeakPolarHBondContact O-CB 3.44Å; H345-I348 PolarHBondContact O-N 3.38Å; H345-S349 PolarHBondContact O-N 3.03Å
346	A	74.5	Confident	75.2	Confident	11 Å²	11	40.2 Å²	40.2	9%	0.091	19%	0.191	C	C	.	.	H	α-helix	trans	-70.3	-22.8	176.1	0	0	0	0	0	112.6	L312 N342 K343 D344 A350	L312-A346 HydrophobicContact CB-CB 4.32Å; L312-A346 HydrophobicContact CD1-CB 3.43Å; L312-A346 VanDerWaalsContact CD1-CB 3.43Å; L312-A346 HydrophobicContact CG-CB 4.44Å; N342-A346 HydrophobicContact CB-CB 3.76Å; K343-A346 VanDerWaalsContact O-CB 3.24Å; K343-A346 WeakPolarHBondContact O-CB 3.3Å; K343-A346 PolarHBondContact O-N 3.22Å; D344-A346 PolarHBondContact O-N 3.37Å; A346-A350 WeakPolarHBondContact O-CB 3.47Å; A346-A350 PolarHBondContact O-N 3.35Å
347	M	80.9	Confident	76	Confident	24 Å²	24	35.4 Å²	35.4	12%	0.118	17%	0.166	C	C	.	.	H	α-helix	trans	-68.6	-38.6	171.9	-60.9	180	178.5	0	0	111	N342 D344 H345 S349 A350 A351 N379 I380	N342-M347 HydrophobicContact CB-CG 4.44Å; N342-M347 WeakPolarHBondContact O-CE 3.42Å; N342-M347 WeakPolarHBondContact O-CG 3.32Å; D344-M347 WeakPolarHBondContact O-CB 3.46Å; D344-M347 PolarHBondContact O-N 2.91Å; D344-M347 VanDerWaalsContact O-N 3.09Å; H345-M347 PolarHBondContact O-N 3.19Å; M347-S349 PolarHBondContact O-N 3.08Å; M347-A350 PolarHBondContact O-N 3.39Å; M347-A351 WeakPolarHBondContact O-CB 3.49Å; M347-A351 PolarHBondContact O-N 3.37Å; M347-N379 HydrophobicContact CB-CB 4.08Å; M347-N379 HydrophobicContact SD-CB 4.48Å; M347-I380 HydrophobicContact CB-CG1 4.18Å; M347-I380 HydrophobicContact SD-CG1 4.3Å
348	I	83	Confident	76.5	Confident	2 Å²	2	33.4 Å²	33.4	1%	0.01	15%	0.15	C	C	.	.	H	α-helix	trans	-58.4	-49.5	176.7	-56.3	174.3	0	0	0	109.7	H345 A351 A352 N379 G383 I416	H345-I348 WeakPolarHBondContact O-CB 3.44Å; H345-I348 PolarHBondContact O-N 3.38Å; I348-A351 PolarHBondContact O-N 3.35Å; I348-A352 VanDerWaalsContact O-CB 3.32Å; I348-A352 WeakPolarHBondContact O-CB 3.43Å; I348-A352 PolarHBondContact O-N 2.9Å; I348-N379 HydrophobicContact CG1-CB 3.89Å; I348-N379 WeakPolarHBondContact CG1-O 3.5Å; I348-G383 WeakPolarHBondContact O-CA 3.24Å; I348-I416 HydrophobicContact CD1-CG2 3.59Å
349	S	78.8	Confident	76.7	Confident	1 Å²	1	30.9 Å²	30.9	1%	0.007	14%	0.14	C	C	.	.	H	α-helix	trans	-67	-40.3	179.4	-61.4	0	0	0	0	112.8	H345 M347 A351 A352 S353 H761 Y765	H345-S349 PolarHBondContact O-N 3.03Å; M347-S349 PolarHBondContact O-N 3.08Å; S349-A351 VanDerWaalsContact C-N 3.34Å; S349-A351 PolarHBondContact O-N 2.96Å; S349-A352 PolarHBondContact O-N 3.21Å; S349-S353 PolarHBondContact O-N 3.37Å; S349-H761 VanDerWaalsContact OG-CB 3.26Å; S349-H761 WeakPolarHBondContact OG-CB 3.48Å; S349-Y765 PolarHBondContact O-OH 2.78Å
350	A	80.2	Confident	76.8	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.008	16%	0.155	C	C	.	.	H	α-helix	trans	-61.4	-45	176.3	0	0	0	0	0	111.3	F339 N342 A346 M347 S353	F339-A350 HydrophobicContact CD1-CB 3.64Å; F339-A350 VanDerWaalsContact CE1-C 3.46Å; F339-A350 HydrophobicContact CE1-CB 3.76Å; N342-A350 WeakPolarHBondContact ND2-CB 3.33Å; A346-A350 WeakPolarHBondContact O-CB 3.47Å; A346-A350 PolarHBondContact O-N 3.35Å; M347-A350 PolarHBondContact O-N 3.39Å; A350-S353 WeakPolarHBondContact O-CB 3.25Å; A350-S353 PolarHBondContact O-N 3.04Å; A350-S353 PolarHBondContact O-OG 2.93Å
351	A	82.2	Confident	76.8	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-65.3	-41	177	0	0	0	0	0	111.8	F339 M347 I348 S349 S353 Q354	F339-A351 HydrophobicContact CE1-CB 4.33Å; M347-A351 WeakPolarHBondContact O-CB 3.49Å; M347-A351 PolarHBondContact O-N 3.37Å; I348-A351 PolarHBondContact O-N 3.35Å; S349-A351 VanDerWaalsContact C-N 3.34Å; S349-A351 PolarHBondContact O-N 2.96Å; A351-S353 VanDerWaalsContact C-N 3.26Å; A351-S353 PolarHBondContact O-N 3.01Å; A351-Q354 WeakPolarHBondContact O-CB 2.99Å; A351-Q354 PolarHBondContact O-N 3.4Å
352	A	83.4	Confident	76.8	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63.9	-27.2	175.2	0	0	0	0	0	113.7	I348 S349 Q354 G355 L386 Y765	I348-A352 VanDerWaalsContact O-CB 3.32Å; I348-A352 WeakPolarHBondContact O-CB 3.43Å; I348-A352 PolarHBondContact O-N 2.9Å; S349-A352 PolarHBondContact O-N 3.21Å; A352-Q354 PolarHBondContact O-N 3.49Å; A352-G355 PolarHBondContact O-N 3.45Å; A352-L386 HydrophobicContact CB-CB 4.33Å; A352-L386 HydrophobicContact CB-CD2 3.83Å; A352-L386 HydrophobicContact CB-CG 4.17Å; A352-Y765 HydrophobicContact CB-CD2 3.9Å; A352-Y765 HydrophobicContact CB-CE1 4.09Å; A352-Y765 HydrophobicContact CB-CE2 3.32Å; A352-Y765 VanDerWaalsContact CB-CZ 3.44Å
353	S	79.1	Confident	76.8	Confident	1 Å²	1	28.7 Å²	28.7	1%	0.007	14%	0.137	C	C	.	.	H	α-helix	trans	-65	-23.3	176.7	77.3	0	0	0	0	113.6	S349 A350 A351 G355 L356 Y765	S349-S353 PolarHBondContact O-N 3.37Å; A350-S353 WeakPolarHBondContact O-CB 3.25Å; A350-S353 PolarHBondContact O-N 3.04Å; A350-S353 PolarHBondContact O-OG 2.93Å; A351-S353 VanDerWaalsContact C-N 3.26Å; A351-S353 PolarHBondContact O-N 3.01Å; S353-G355 VanDerWaalsContact C-N 3.29Å; S353-G355 PolarHBondContact O-N 3.47Å; S353-L356 WeakPolarHBondContact O-CB 3.37Å; S353-L356 PolarHBondContact O-N 2.93Å; S353-Y765 WeakPolarHBondContact CA-OH 3.47Å; S353-Y765 PolarHBondContact N-OH 2.62Å; S353-Y765 VanDerWaalsContact N-OH 3.1Å
354	Q	78.1	Confident	76.9	Confident	5 Å²	5	25 Å²	25	2%	0.023	13%	0.125	C	C	.	.	H	α-helix	trans	-63.9	-37.9	171.2	-76.1	176	-24.9	0	0	111.8	I331 F339 A351 A352 L356 I357 Y358 F372	I331-Q354 HydrophobicContact CG2-CG 3.36Å; F339-Q354 HydrophobicContact CZ-CG 4.4Å; F339-Q354 VanDerWaalsContact CZ-NE2 3.32Å; A351-Q354 WeakPolarHBondContact O-CB 2.99Å; A351-Q354 PolarHBondContact O-N 3.4Å; A352-Q354 PolarHBondContact O-N 3.49Å; Q354-L356 PolarHBondContact O-N 3.48Å; Q354-I357 WeakPolarHBondContact O-CB 3.35Å; Q354-I357 PolarHBondContact O-N 3.33Å; Q354-I357 VanDerWaalsContact O-N 3.08Å; Q354-Y358 VanDerWaalsContact O-CD2 3.31Å; Q354-Y358 WeakPolarHBondContact O-CD2 3.23Å; Q354-Y358 PolarHBondContact O-N 2.63Å; Q354-F372 VanDerWaalsContact NE2-CZ 3.31Å; Q354-F372 VanDerWaalsContact OE1-CE2 3.23Å
355	G	78.5	Confident	77	Confident	0 Å²	0	20 Å²	20	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-64.8	-27.2	178.8	0	0	0	0	0	113.1	A352 S353 R359	A352-G355 PolarHBondContact O-N 3.45Å; S353-G355 VanDerWaalsContact C-N 3.29Å; S353-G355 PolarHBondContact O-N 3.47Å; G355-R359 PolarHBondContact O-N 3.47Å
356	L	78.1	Confident	77.2	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-68.2	-37.1	172.9	-77.5	176.8	0	0	0	112.5	F320 T323 G324 S353 Q354 R359 V390 Y765 V768 I771	F320-L356 HydrophobicContact CD1-CD1 4.16Å; F320-L356 HydrophobicContact CE1-CD1 4.14Å; T323-L356 VanDerWaalsContact CA-O 3.31Å; T323-L356 WeakPolarHBondContact CA-O 3.46Å; T323-L356 HydrophobicContact CG2-CB 4.29Å; T323-L356 HydrophobicContact CG2-CD2 4.29Å; G324-L356 PolarHBondContact N-O 3.31Å; S353-L356 WeakPolarHBondContact O-CB 3.37Å; S353-L356 PolarHBondContact O-N 2.93Å; Q354-L356 PolarHBondContact O-N 3.48Å; L356-R359 VanDerWaalsContact O-CB 3.3Å; L356-R359 WeakPolarHBondContact O-CB 3.47Å; L356-R359 PolarHBondContact O-N 2.96Å; L356-V390 HydrophobicContact CD2-CG1 4Å; L356-V390 HydrophobicContact CG-CG1 4.25Å; L356-Y765 HydrophobicContact CD1-CD1 4.09Å; L356-Y765 HydrophobicContact CD1-CE1 3.56Å; L356-Y765 HydrophobicContact CD2-CD1 4.46Å; L356-Y765 HydrophobicContact CG-CD1 4.11Å; L356-Y765 HydrophobicContact CG-CE1 3.83Å; L356-V768 HydrophobicContact CD2-CG2 3.49Å; L356-V768 VanDerWaalsContact CD2-CG2 3.49Å; L356-I771 HydrophobicContact CD2-CD1 4.29Å
357	I	80.4	Confident	77.5	Confident	4 Å²	4	21.5 Å²	21.5	2%	0.021	11%	0.11	C	C	.	.	H	α-helix	trans	-66.8	-45	-178.6	-63.4	169.6	0	0	0	109.8	N322 G324 C326 D328 I331 Q354 R359	N322-I357 HydrophobicContact CB-CG1 4.42Å; G324-I357 WeakPolarHBondContact CA-O 3.41Å; G324-I357 PolarHBondContact N-O 3.41Å; C326-I357 PolarHBondContact N-O 3.11Å; D328-I357 HydrophobicContact CB-CD1 4.07Å; I331-I357 HydrophobicContact CB-CD1 4.43Å; I331-I357 HydrophobicContact CD1-CD1 4.03Å; Q354-I357 WeakPolarHBondContact O-CB 3.35Å; Q354-I357 PolarHBondContact O-N 3.33Å; Q354-I357 VanDerWaalsContact O-N 3.08Å; I357-R359 VanDerWaalsContact C-N 3.25Å; I357-R359 PolarHBondContact O-N 3.25Å
358	Y	76.5	Confident	77.4	Confident	14 Å²	14	21.6 Å²	21.6	6%	0.055	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	24.4	177.8	-59	-69.5	0	0	0	113.5	C326 Q354 W360 D361 G365 N368	C326-Y358 HydrophobicContact CB-CD1 4.43Å; C326-Y358 WeakPolarHBondContact O-CE1 3.34Å; Q354-Y358 VanDerWaalsContact O-CD2 3.31Å; Q354-Y358 WeakPolarHBondContact O-CD2 3.23Å; Q354-Y358 PolarHBondContact O-N 2.63Å; Y358-W360 PolarHBondContact O-N 2.92Å; Y358-D361 PolarHBondContact O-N 2.9Å; Y358-D361 VanDerWaalsContact O-N 3.15Å; Y358-G365 VanDerWaalsContact CB-CA 3.47Å; Y358-N368 HydrophobicContact CE2-CB 3.79Å; Y358-N368 PolarHBondContact OH-ND2 3.47Å
359	R	72.6	Confident	77.3	Confident	8 Å²	8	21.5 Å²	21.5	3%	0.03	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	129.3	177.8	-177.6	140.2	176.7	78.9	1.2	109.9	G355 L356 I357 D361 V390 C393 V768	G355-R359 PolarHBondContact O-N 3.47Å; L356-R359 VanDerWaalsContact O-CB 3.3Å; L356-R359 WeakPolarHBondContact O-CB 3.47Å; L356-R359 PolarHBondContact O-N 2.96Å; I357-R359 VanDerWaalsContact C-N 3.25Å; I357-R359 PolarHBondContact O-N 3.25Å; R359-D361 VanDerWaalsContact C-N 3.29Å; R359-D361 PolarHBondContact O-N 3.46Å; R359-V390 PolarHBondContact NH1-O 2.87Å; R359-C393 PolarHBondContact NH1-O 3.45Å; R359-C393 PolarHBondContact NH1-SG 2.93Å; R359-C393 VanDerWaalsContact NH1-SG 3.43Å; R359-C393 PolarHBondContact NH2-O 3.34Å; R359-C393 PolarHBondContact NH2-SG 3.44Å; R359-V768 PolarHBondContact NH2-O 3.1Å
360	W	70	Confident	77.4	Confident	82 Å²	82	24.3 Å²	24.3	31%	0.311	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.6	-12.9	-175.1	-50.3	-46.1	0	0	0	117.4	Y358 V395 M722 P773	Y358-W360 PolarHBondContact O-N 2.92Å; W360-V395 HydrophobicContact CB-CG2 4.13Å; W360-V395 HydrophobicContact CG-CG2 4.48Å; W360-M722 HydrophobicContact CH2-CE 3.71Å; W360-M722 HydrophobicContact CZ3-CE 3.56Å; W360-P773 HydrophobicContact CH2-CB 4.34Å; W360-P773 HydrophobicContact CH2-CG 3.97Å; W360-P773 HydrophobicContact CZ3-CG 4.44Å
361	D	72.1	Confident	77.4	Confident	14 Å²	14	30.8 Å²	30.8	8%	0.075	15%	0.153	C	C	.	.			trans	-103	94.8	176.1	-177.1	-13.7	0	0	0	109.5	C326 Y358 R359 D363 N364 G365 V391	C326-D361 PolarHBondContact SG-OD2 2.99Å; C326-D361 VanDerWaalsContact SG-OD2 3.41Å; Y358-D361 PolarHBondContact O-N 2.9Å; Y358-D361 VanDerWaalsContact O-N 3.15Å; R359-D361 VanDerWaalsContact C-N 3.29Å; R359-D361 PolarHBondContact O-N 3.46Å; D361-D363 PolarHBondContact OD1-N 3.3Å; D361-N364 PolarHBondContact OD1-N 3.41Å; D361-N364 VanDerWaalsContact OD2-CB 3.28Å; D361-N364 WeakPolarHBondContact OD2-CB 3.39Å; D361-N364 PolarHBondContact OD2-ND2 3.41Å; D361-G365 WeakPolarHBondContact O-CA 3.45Å; D361-G365 PolarHBondContact O-N 2.9Å; D361-G365 VanDerWaalsContact O-N 3.13Å; D361-V391 WeakPolarHBondContact O-CG1 3.32Å
362	V	70.6	Confident	77.2	Confident	8 Å²	8	31.7 Å²	31.7	5%	0.048	16%	0.157	C	C	.	.	H	α-helix	trans	-71.2	-37.1	-176.8	179.9	0	0	0	0	110.9	L366 V391 V395 P401	V362-L366 HydrophobicContact CG1-CD1 3.55Å; V362-L366 HydrophobicContact CG1-CG 4.17Å; V362-L366 VanDerWaalsContact O-CB 3.31Å; V362-L366 WeakPolarHBondContact O-CB 3.43Å; V362-L366 WeakPolarHBondContact O-CD1 3.29Å; V362-L366 WeakPolarHBondContact O-CG 3.46Å; V362-L366 PolarHBondContact O-N 2.94Å; V362-V391 HydrophobicContact CG2-CG1 4.35Å; V362-V395 HydrophobicContact CG2-CB 4.01Å; V362-V395 HydrophobicContact CG2-CG1 3.75Å; V362-P401 HydrophobicContact CG1-CG 3.73Å
363	D	73.5	Confident	76.9	Confident	104 Å²	104	32.3 Å²	32.3	56%	0.556	16%	0.161	S	C	*	.	H	α-helix	trans	-73.2	-52.3	-172.6	-69.4	-26.7	0	0	0	112.1	D361 G365 T367	D361-D363 PolarHBondContact OD1-N 3.3Å; D363-G365 VanDerWaalsContact C-N 3.34Å; D363-T367 WeakPolarHBondContact O-CG2 3.46Å
364	N	73.1	Confident	77	Confident	80 Å²	80	41.1 Å²	41.1	43%	0.428	20%	0.195	S	C	.	.	H	α-helix	trans	-76.1	-27.7	178.2	-61.3	-50.9	0	0	0	111.6	D361 T367 N368	D361-N364 PolarHBondContact OD1-N 3.41Å; D361-N364 VanDerWaalsContact OD2-CB 3.28Å; D361-N364 WeakPolarHBondContact OD2-CB 3.39Å; D361-N364 PolarHBondContact OD2-ND2 3.41Å; N364-T367 PolarHBondContact O-OG1 3.42Å; N364-T367 VanDerWaalsContact O-OG1 3.06Å; N364-N368 PolarHBondContact O-ND2 3.04Å
365	G	75.6	Confident	77.1	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-64	-50.5	175.8	0	0	0	0	0	112.5	Y358 D361 D363 T367 N368 I369	Y358-G365 VanDerWaalsContact CB-CA 3.47Å; D361-G365 WeakPolarHBondContact O-CA 3.45Å; D361-G365 PolarHBondContact O-N 2.9Å; D361-G365 VanDerWaalsContact O-N 3.13Å; D363-G365 VanDerWaalsContact C-N 3.34Å; G365-T367 PolarHBondContact O-N 3.22Å; G365-N368 PolarHBondContact O-N 3.27Å; G365-I369 WeakPolarHBondContact O-CD1 3.45Å; G365-I369 VanDerWaalsContact O-CG1 3.23Å; G365-I369 WeakPolarHBondContact O-CG1 3.46Å; G365-I369 PolarHBondContact O-N 3.46Å
366	L	80.1	Confident	76.8	Confident	25 Å²	25	50 Å²	50	13%	0.131	25%	0.245	C	C	.	.	H	α-helix	trans	-63.7	-43.1	-177.5	-72.5	172.6	0	0	0	112.4	V362 N368 I369 D370 V388 P401 L405	V362-L366 HydrophobicContact CG1-CD1 3.55Å; V362-L366 HydrophobicContact CG1-CG 4.17Å; V362-L366 VanDerWaalsContact O-CB 3.31Å; V362-L366 WeakPolarHBondContact O-CB 3.43Å; V362-L366 WeakPolarHBondContact O-CD1 3.29Å; V362-L366 WeakPolarHBondContact O-CG 3.46Å; V362-L366 PolarHBondContact O-N 2.94Å; L366-N368 PolarHBondContact O-N 3.33Å; L366-I369 PolarHBondContact O-N 3.5Å; L366-I369 VanDerWaalsContact O-N 3.16Å; L366-D370 WeakPolarHBondContact O-CB 3.49Å; L366-D370 PolarHBondContact O-N 3.45Å; L366-V388 HydrophobicContact CD2-CG1 4Å; L366-V388 HydrophobicContact CD2-CG2 4.04Å; L366-P401 HydrophobicContact CD1-CB 3.69Å; L366-P401 HydrophobicContact CD1-CG 3.75Å; L366-L405 HydrophobicContact CD2-CD1 4.35Å
367	T	81.7	Confident	77	Confident	78 Å²	78	52.7 Å²	52.7	48%	0.479	26%	0.259	S	S	.	.	H	α-helix	trans	-61.5	-31.1	179.7	58.9	0	0	0	0	113.3	D363 N364 G365	D363-T367 WeakPolarHBondContact O-CG2 3.46Å; N364-T367 PolarHBondContact O-OG1 3.42Å; N364-T367 VanDerWaalsContact O-OG1 3.06Å; G365-T367 PolarHBondContact O-N 3.22Å
368	N	77.7	Confident	77.2	Confident	26 Å²	26	55.2 Å²	55.2	14%	0.139	27%	0.273	C	S	.	.	H	α-helix	trans	-81.9	-36.3	176.3	-72.4	-50.8	0	0	0	112.4	Y358 N364 G365 L366 K371 F372	Y358-N368 HydrophobicContact CE2-CB 3.79Å; Y358-N368 PolarHBondContact OH-ND2 3.47Å; N364-N368 PolarHBondContact O-ND2 3.04Å; G365-N368 PolarHBondContact O-N 3.27Å; L366-N368 PolarHBondContact O-N 3.33Å; N368-K371 PolarHBondContact OD1-NZ 2.95Å; N368-F372 WeakPolarHBondContact O-CD2 3.31Å; N368-F372 WeakPolarHBondContact O-CE2 3.42Å
369	I	80.3	Confident	77.5	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-68.7	-37.7	176.3	-67.1	165.3	0	0	0	111.2	G365 L366 K371 F372 L373 S384 A387 V388 V391	G365-I369 WeakPolarHBondContact O-CD1 3.45Å; G365-I369 VanDerWaalsContact O-CG1 3.23Å; G365-I369 WeakPolarHBondContact O-CG1 3.46Å; G365-I369 PolarHBondContact O-N 3.46Å; L366-I369 PolarHBondContact O-N 3.5Å; L366-I369 VanDerWaalsContact O-N 3.16Å; I369-K371 PolarHBondContact O-N 2.97Å; I369-F372 PolarHBondContact O-N 3.49Å; I369-L373 PolarHBondContact O-N 3.44Å; I369-S384 WeakPolarHBondContact CG2-O 3.27Å; I369-A387 HydrophobicContact CD1-CB 3.75Å; I369-A387 HydrophobicContact CG1-CB 4.05Å; I369-A387 HydrophobicContact CG2-CB 4.45Å; I369-V388 HydrophobicContact CD1-CG2 4.41Å; I369-V388 HydrophobicContact CG2-CG2 3.77Å; I369-V391 HydrophobicContact CD1-CG2 3.67Å
370	D	81.7	Confident	78	Confident	59 Å²	59	55.6 Å²	55.6	32%	0.316	28%	0.277	S	S	.	.	H	α-helix	trans	-58.4	-33.8	-179.3	-84.6	-16.7	0	0	0	112.5	L366 F372 L373 Y374	L366-D370 WeakPolarHBondContact O-CB 3.49Å; L366-D370 PolarHBondContact O-N 3.45Å; D370-F372 PolarHBondContact O-N 3.17Å; D370-L373 PolarHBondContact O-N 3.24Å; D370-Y374 WeakPolarHBondContact O-CD2 3.41Å
371	K	81	Confident	78.7	Confident	138 Å²	138	54.1 Å²	54.1	60%	0.6	27%	0.272	S	S	*	.	H	α-helix	trans	-56.9	-33.3	175.2	-64.5	169.8	-172.8	163.3	0	112.1	N368 I369	N368-K371 PolarHBondContact OD1-NZ 2.95Å; I369-K371 PolarHBondContact O-N 2.97Å
372	F	76.8	Confident	79.2	Confident	18 Å²	18	53.4 Å²	53.4	8%	0.079	27%	0.269	C	S	.	.	H	α-helix	trans	-93.6	-21.3	-176.9	-57.5	-67.9	0	0	0	113.3	A335 N336 F339 Q354 N368 I369 D370 Y374 S375 I380 S384	A335-F372 HydrophobicContact CB-CE1 3.88Å; A335-F372 HydrophobicContact CB-CZ 3.55Å; N336-F372 WeakPolarHBondContact OD1-CE1 3.41Å; F339-F372 HydrophobicContact CD2-CD1 4.14Å; F339-F372 AromaticContact CD2-CE1 3.95Å; F339-F372 HydrophobicContact CD2-CE1 3.95Å; F339-F372 AromaticContact CE2-CD1 3.72Å; F339-F372 HydrophobicContact CE2-CD1 3.72Å; F339-F372 AromaticContact CE2-CE1 3.38Å; F339-F372 HydrophobicContact CE2-CE1 3.38Å; F339-F372 HydrophobicContact CE2-CE2 4.43Å; F339-F372 HydrophobicContact CE2-CG 4.38Å; F339-F372 AromaticContact CE2-CZ 3.79Å; F339-F372 HydrophobicContact CE2-CZ 3.79Å; F339-F372 HydrophobicContact CZ-CE1 4.44Å; Q354-F372 VanDerWaalsContact NE2-CZ 3.31Å; Q354-F372 VanDerWaalsContact OE1-CE2 3.23Å; N368-F372 WeakPolarHBondContact O-CD2 3.31Å; N368-F372 WeakPolarHBondContact O-CE2 3.42Å; I369-F372 PolarHBondContact O-N 3.49Å; D370-F372 PolarHBondContact O-N 3.17Å; F372-Y374 PolarHBondContact O-N 2.99Å; F372-S375 VanDerWaalsContact O-CB 3.28Å; F372-S375 WeakPolarHBondContact O-CB 3.23Å; F372-S375 PolarHBondContact O-N 3.19Å; F372-I380 HydrophobicContact CB-CG2 4.05Å; F372-S384 VanDerWaalsContact CB-OG 3.24Å; F372-S384 WeakPolarHBondContact CB-OG 3.34Å
373	L	78.5	Confident	79.8	Confident	14 Å²	14	53 Å²	53	7%	0.073	27%	0.266	C	S	.	.	H	α-helix	trans	-61.5	-29.5	176.9	-169.1	69.7	0	0	0	112.4	I369 D370 S375 K381 L385	I369-L373 PolarHBondContact O-N 3.44Å; D370-L373 PolarHBondContact O-N 3.24Å; L373-S375 VanDerWaalsContact C-N 3.34Å; L373-K381 HydrophobicContact CD1-CG 4.04Å; L373-L385 HydrophobicContact CD1-CD2 3.79Å; L373-L385 HydrophobicContact CD1-CG 4.16Å
374	Y	80.5	Confident	80.3	Confident	185 Å²	185	48.1 Å²	48.1	73%	0.725	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.9	4.8	177	-60.4	-72.5	0	0	0	114.3	D370 F372	D370-Y374 WeakPolarHBondContact O-CD2 3.41Å; F372-Y374 PolarHBondContact O-N 2.99Å
375	S	79.1	Confident	80.9	Confident	29 Å²	29	44.3 Å²	44.3	20%	0.203	22%	0.22	C	C	.	.			trans	-66.7	145.2	174.2	-171.6	0	0	0	0	111.4	F372 L373 D377	F372-S375 VanDerWaalsContact O-CB 3.28Å; F372-S375 WeakPolarHBondContact O-CB 3.23Å; F372-S375 PolarHBondContact O-N 3.19Å; L373-S375 VanDerWaalsContact C-N 3.34Å; S375-D377 PolarHBondContact O-N 3.49Å
376	N	73.6	Confident	81.3	Confident	162 Å²	162	44.3 Å²	44.3	87%	0.866	22%	0.22	S	C	*	.	S	Bend	trans	-68.9	-19.5	179.1	-68	-41.8	0	0	0	112.9
377	D	82.5	Confident	81.5	Confident	57 Å²	57	43.1 Å²	43.1	31%	0.305	21%	0.213	S	C	.	.			trans	-82.7	119.3	-178.5	-72.2	-28.3	0	0	0	111.6	Y340 S375 N379 I380 K381	Y340-D377 WeakPolarHBondContact CE1-OD2 3.35Å; S375-D377 PolarHBondContact O-N 3.49Å; D377-N379 PolarHBondContact O-N 3.39Å; D377-I380 HydrophobicContact CB-CB 4.23Å; D377-I380 HydrophobicContact CB-CD1 3.95Å; D377-I380 HydrophobicContact CB-CG1 3.95Å; D377-I380 PolarHBondContact O-N 3.34Å; D377-I380 VanDerWaalsContact O-N 3.1Å; D377-K381 PolarHBondContact O-N 3.08Å
378	D	82.8	Confident	81.6	Confident	58 Å²	58	39.6 Å²	39.6	31%	0.31	19%	0.192	S	C	.	.	H	α-helix	trans	-58.3	-31.4	179.4	-71.2	-33.4	0	0	0	113.4	A382 K414	D378-A382 WeakPolarHBondContact O-CB 3.3Å; D378-A382 PolarHBondContact O-N 3.24Å; D378-K414 HydrophobicContact CB-CD 4.46Å; D378-K414 WeakPolarHBondContact OD1-CD 3.19Å; D378-K414 IonicContact OD1-NZ 3.23Å; D378-K414 PolarHBondContact OD1-NZ 3.14Å; D378-K414 VanDerWaalsContact OD2-CD 3.3Å; D378-K414 WeakPolarHBondContact OD2-CD 3.2Å; D378-K414 WeakPolarHBondContact OD2-CE 3.44Å; D378-K414 IonicContact OD2-NZ 2.97Å; D378-K414 PolarHBondContact OD2-NZ 3.2Å
379	N	83.3	Confident	81.7	Confident	26 Å²	26	38.3 Å²	38.3	14%	0.139	19%	0.185	C	C	.	.	H	α-helix	trans	-71.2	-39.4	178.6	-66.7	-36.1	0	0	0	112	M347 I348 D377 G383 I416	M347-N379 HydrophobicContact CB-CB 4.08Å; M347-N379 HydrophobicContact SD-CB 4.48Å; I348-N379 HydrophobicContact CG1-CB 3.89Å; I348-N379 WeakPolarHBondContact CG1-O 3.5Å; D377-N379 PolarHBondContact O-N 3.39Å; N379-G383 PolarHBondContact O-N 3.45Å; N379-I416 WeakPolarHBondContact OD1-CD1 3.48Å
380	I	83.3	Confident	81.9	Confident	4 Å²	4	38.3 Å²	38.3	2%	0.021	19%	0.185	C	C	.	.	H	α-helix	trans	-68.3	-47	176.4	-62.3	178.8	0	0	0	108.5	F339 M347 F372 D377 A382 G383 S384	F339-I380 HydrophobicContact CB-CD1 4.18Å; M347-I380 HydrophobicContact CB-CG1 4.18Å; M347-I380 HydrophobicContact SD-CG1 4.3Å; F372-I380 HydrophobicContact CB-CG2 4.05Å; D377-I380 HydrophobicContact CB-CB 4.23Å; D377-I380 HydrophobicContact CB-CD1 3.95Å; D377-I380 HydrophobicContact CB-CG1 3.95Å; D377-I380 PolarHBondContact O-N 3.34Å; D377-I380 VanDerWaalsContact O-N 3.1Å; I380-A382 VanDerWaalsContact C-N 3.32Å; I380-A382 PolarHBondContact O-N 3.2Å; I380-G383 PolarHBondContact O-N 2.89Å; I380-G383 VanDerWaalsContact O-N 3.12Å; I380-S384 PolarHBondContact O-N 3.03Å; I380-S384 PolarHBondContact O-OG 3.41Å; I380-S384 VanDerWaalsContact O-OG 3.14Å
381	K	84.6	Confident	81.9	Confident	50 Å²	50	35.5 Å²	35.5	22%	0.217	17%	0.17	C	C	.	.	H	α-helix	trans	-56.8	-45	175.8	-172.3	173.2	-176.4	167.2	0	112.2	L373 D377 S384 L385 Y409 L417	L373-K381 HydrophobicContact CD1-CG 4.04Å; D377-K381 PolarHBondContact O-N 3.08Å; K381-S384 PolarHBondContact O-N 3.07Å; K381-L385 WeakPolarHBondContact O-CG 3.24Å; K381-L385 PolarHBondContact O-N 3.38Å; K381-L385 VanDerWaalsContact O-N 3.15Å; K381-Y409 VanDerWaalsContact CE-CE1 3.41Å; K381-Y409 WeakPolarHBondContact CE-OH 3.41Å; K381-Y409 PolarHBondContact NZ-OH 3.13Å; K381-L417 HydrophobicContact CB-CD2 4.2Å; K381-L417 HydrophobicContact CD-CD2 4.22Å; K381-L417 HydrophobicContact CG-CD2 3.91Å
382	A	83.4	Confident	81.6	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-64	-41.7	176.3	0	0	0	0	0	112.3	D378 I380 L385 L386 I416 L417 C420	D378-A382 WeakPolarHBondContact O-CB 3.3Å; D378-A382 PolarHBondContact O-N 3.24Å; I380-A382 VanDerWaalsContact C-N 3.32Å; I380-A382 PolarHBondContact O-N 3.2Å; A382-L385 PolarHBondContact O-N 3.1Å; A382-L386 PolarHBondContact O-N 3.32Å; A382-L386 VanDerWaalsContact O-N 3.11Å; A382-I416 HydrophobicContact CB-CG2 3.64Å; A382-L417 HydrophobicContact CB-CD2 3.88Å; A382-C420 HydrophobicContact CB-CB 4.04Å; A382-C420 WeakPolarHBondContact O-CB 3.27Å
383	G	83.8	Confident	81.3	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-65.4	-36.2	176.4	0	0	0	0	0	113.3	I348 N379 I380 L386 A387	I348-G383 WeakPolarHBondContact O-CA 3.24Å; N379-G383 PolarHBondContact O-N 3.45Å; I380-G383 PolarHBondContact O-N 2.89Å; I380-G383 VanDerWaalsContact O-N 3.12Å; G383-L386 PolarHBondContact O-N 3.02Å; G383-A387 PolarHBondContact O-N 3.11Å
384	S	83.7	Confident	80.7	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62.7	-41.3	172.3	-62.9	0	0	0	0	112.1	I369 F372 I380 K381 L386 A387 V388	I369-S384 WeakPolarHBondContact CG2-O 3.27Å; F372-S384 VanDerWaalsContact CB-OG 3.24Å; F372-S384 WeakPolarHBondContact CB-OG 3.34Å; I380-S384 PolarHBondContact O-N 3.03Å; I380-S384 PolarHBondContact O-OG 3.41Å; I380-S384 VanDerWaalsContact O-OG 3.14Å; K381-S384 PolarHBondContact O-N 3.07Å; S384-L386 VanDerWaalsContact C-N 3.34Å; S384-L386 PolarHBondContact O-N 3.13Å; S384-A387 WeakPolarHBondContact O-CA 3.28Å; S384-A387 VanDerWaalsContact O-CB 3.28Å; S384-A387 WeakPolarHBondContact O-CB 3.49Å; S384-A387 PolarHBondContact O-N 2.93Å; S384-A387 VanDerWaalsContact O-N 3.11Å; S384-V388 WeakPolarHBondContact O-CG2 3.48Å; S384-V388 PolarHBondContact O-N 3.1Å
385	L	85.8	Confident	79.9	Confident	1 Å²	1	20.4 Å²	20.4	1%	0.005	11%	0.112	C	C	.	.	H	α-helix	trans	-63.1	-40.8	174.9	-66.4	172.9	0	0	0	112.2	L373 K381 A382 A387 V388 G389 L406 Y409 L417	L373-L385 HydrophobicContact CD1-CD2 3.79Å; L373-L385 HydrophobicContact CD1-CG 4.16Å; K381-L385 WeakPolarHBondContact O-CG 3.24Å; K381-L385 PolarHBondContact O-N 3.38Å; K381-L385 VanDerWaalsContact O-N 3.15Å; A382-L385 PolarHBondContact O-N 3.1Å; L385-A387 VanDerWaalsContact C-N 3.29Å; L385-A387 PolarHBondContact O-N 3.09Å; L385-V388 PolarHBondContact O-N 3.48Å; L385-G389 PolarHBondContact O-N 3.47Å; L385-L406 HydrophobicContact CB-CD2 3.96Å; L385-L406 HydrophobicContact CD2-CD2 4.11Å; L385-L406 WeakPolarHBondContact O-CD2 3.28Å; L385-Y409 HydrophobicContact CD1-CD1 4Å; L385-Y409 HydrophobicContact CD1-CD2 3.71Å; L385-Y409 HydrophobicContact CD1-CE2 4.38Å; L385-Y409 HydrophobicContact CD1-CG 3.51Å; L385-Y409 HydrophobicContact CD2-CD2 3.3Å; L385-Y409 HydrophobicContact CD2-CE2 3.58Å; L385-Y409 HydrophobicContact CD2-CG 4.04Å; L385-Y409 HydrophobicContact CG-CD2 4.15Å; L385-Y409 HydrophobicContact CG-CG 4.44Å; L385-L417 HydrophobicContact CD1-CD2 3.86Å
386	L	83.9	Confident	79.1	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-63.9	-38.2	173	-174.5	63	0	0	0	111.3	A352 A382 G383 S384 V388 G389 V390 C420 L423 L427 Y765	A352-L386 HydrophobicContact CB-CB 4.33Å; A352-L386 HydrophobicContact CB-CD2 3.83Å; A352-L386 HydrophobicContact CB-CG 4.17Å; A382-L386 PolarHBondContact O-N 3.32Å; A382-L386 VanDerWaalsContact O-N 3.11Å; G383-L386 PolarHBondContact O-N 3.02Å; S384-L386 VanDerWaalsContact C-N 3.34Å; S384-L386 PolarHBondContact O-N 3.13Å; L386-V388 PolarHBondContact O-N 3.13Å; L386-G389 PolarHBondContact O-N 3.4Å; L386-V390 WeakPolarHBondContact O-CG2 3.26Å; L386-V390 PolarHBondContact O-N 3.37Å; L386-C420 HydrophobicContact CB-CB 4.23Å; L386-L423 HydrophobicContact CD1-CB 4.14Å; L386-L423 HydrophobicContact CD1-CD2 3.87Å; L386-L423 HydrophobicContact CD1-CG 3.93Å; L386-L427 HydrophobicContact CD1-CD1 4.32Å; L386-Y765 HydrophobicContact CD2-CD2 3.78Å; L386-Y765 HydrophobicContact CD2-CE2 4.4Å; L386-Y765 HydrophobicContact CD2-CG 4.45Å
387	A	84.4	Confident	78.5	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-60.3	-42.5	175.8	0	0	0	0	0	111.8	I369 G383 S384 L385 G389 V390 V391	I369-A387 HydrophobicContact CD1-CB 3.75Å; I369-A387 HydrophobicContact CG1-CB 4.05Å; I369-A387 HydrophobicContact CG2-CB 4.45Å; G383-A387 PolarHBondContact O-N 3.11Å; S384-A387 WeakPolarHBondContact O-CA 3.28Å; S384-A387 VanDerWaalsContact O-CB 3.28Å; S384-A387 WeakPolarHBondContact O-CB 3.49Å; S384-A387 PolarHBondContact O-N 2.93Å; S384-A387 VanDerWaalsContact O-N 3.11Å; L385-A387 VanDerWaalsContact C-N 3.29Å; L385-A387 PolarHBondContact O-N 3.09Å; A387-G389 VanDerWaalsContact C-N 3.29Å; A387-G389 PolarHBondContact O-N 2.86Å; A387-V390 PolarHBondContact O-N 3.5Å; A387-V390 VanDerWaalsContact O-N 3.11Å; A387-V391 WeakPolarHBondContact O-CG2 3.05Å; A387-V391 PolarHBondContact O-N 3.48Å
388	V	83.5	Confident	77.3	Confident	3 Å²	3	24 Å²	24	2%	0.018	12%	0.119	C	C	.	.	H	α-helix	trans	-55.5	-46.6	174.1	175.4	0	0	0	0	110.4	L366 I369 S384 L385 L386 V390 V391 S392 A402 L405	L366-V388 HydrophobicContact CD2-CG1 4Å; L366-V388 HydrophobicContact CD2-CG2 4.04Å; I369-V388 HydrophobicContact CD1-CG2 4.41Å; I369-V388 HydrophobicContact CG2-CG2 3.77Å; S384-V388 WeakPolarHBondContact O-CG2 3.48Å; S384-V388 PolarHBondContact O-N 3.1Å; L385-V388 PolarHBondContact O-N 3.48Å; L386-V388 PolarHBondContact O-N 3.13Å; V388-V390 VanDerWaalsContact C-N 3.32Å; V388-V390 PolarHBondContact O-N 2.67Å; V388-V391 PolarHBondContact O-N 2.94Å; V388-S392 PolarHBondContact O-N 3.39Å; V388-S392 PolarHBondContact O-OG 2.82Å; V388-A402 HydrophobicContact CG1-CB 4.41Å; V388-L405 HydrophobicContact CG1-CD1 4.39Å
389	G	79.6	Confident	76.2	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-64	-33.6	177.7	0	0	0	0	0	114.3	L385 L386 A387 C393 G424	L385-G389 PolarHBondContact O-N 3.47Å; L386-G389 PolarHBondContact O-N 3.4Å; A387-G389 VanDerWaalsContact C-N 3.29Å; A387-G389 PolarHBondContact O-N 2.86Å; G389-C393 WeakPolarHBondContact O-CB 3.42Å; G389-C393 PolarHBondContact O-N 3.15Å; G389-C393 VanDerWaalsContact O-N 3.12Å; G389-G424 WeakPolarHBondContact CA-O 3.3Å
390	V	83.5	Confident	75.3	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-74.1	-37.1	177.3	169.9	0	0	0	0	112.1	L356 R359 L386 A387 V388 C393 L427 Y765 V768	L356-V390 HydrophobicContact CD2-CG1 4Å; L356-V390 HydrophobicContact CG-CG1 4.25Å; R359-V390 PolarHBondContact NH1-O 2.87Å; L386-V390 WeakPolarHBondContact O-CG2 3.26Å; L386-V390 PolarHBondContact O-N 3.37Å; A387-V390 PolarHBondContact O-N 3.5Å; A387-V390 VanDerWaalsContact O-N 3.11Å; V388-V390 VanDerWaalsContact C-N 3.32Å; V388-V390 PolarHBondContact O-N 2.67Å; V390-C393 PolarHBondContact O-N 2.95Å; V390-L427 HydrophobicContact CG2-CD1 4.32Å; V390-Y765 HydrophobicContact CG2-CD1 4.26Å; V390-Y765 HydrophobicContact CG2-CG 4.41Å; V390-V768 HydrophobicContact CG1-CG1 3.92Å; V390-V768 HydrophobicContact CG1-CG2 3.98Å; V390-V768 HydrophobicContact CG2-CG2 4.36Å
391	V	81.5	Confident	74.5	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-64.9	-48.3	175.1	169.1	0	0	0	0	110.2	D361 V362 I369 A387 V388 C393	D361-V391 WeakPolarHBondContact O-CG1 3.32Å; V362-V391 HydrophobicContact CG2-CG1 4.35Å; I369-V391 HydrophobicContact CD1-CG2 3.67Å; A387-V391 WeakPolarHBondContact O-CG2 3.05Å; A387-V391 PolarHBondContact O-N 3.48Å; V388-V391 PolarHBondContact O-N 2.94Å; V391-C393 PolarHBondContact O-N 3.22Å
392	S	75.5	Confident	73.8	Confident	7 Å²	7	25.9 Å²	25.9	5%	0.049	14%	0.14	C	C	.	.	S	Bend	trans	-76.3	-6.7	-179.3	-56.8	0	0	0	0	114.1	V388 G394 V395	V388-S392 PolarHBondContact O-N 3.39Å; V388-S392 PolarHBondContact O-OG 2.82Å; S392-G394 PolarHBondContact O-N 3.23Å; S392-V395 PolarHBondContact O-N 3.32Å; S392-V395 VanDerWaalsContact O-N 3.14Å
393	C	71.1	Confident	73.3	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	108.6	179.7	169.3	0	0	0	0	110.4	R359 G389 V390 V391 L427 V768	R359-C393 PolarHBondContact NH1-O 3.45Å; R359-C393 PolarHBondContact NH1-SG 2.93Å; R359-C393 VanDerWaalsContact NH1-SG 3.43Å; R359-C393 PolarHBondContact NH2-O 3.34Å; R359-C393 PolarHBondContact NH2-SG 3.44Å; G389-C393 WeakPolarHBondContact O-CB 3.42Å; G389-C393 PolarHBondContact O-N 3.15Å; G389-C393 VanDerWaalsContact O-N 3.12Å; V390-C393 PolarHBondContact O-N 2.95Å; V391-C393 PolarHBondContact O-N 3.22Å; C393-L427 VanDerWaalsContact CB-O 3.23Å; C393-L427 WeakPolarHBondContact CB-O 3.09Å; C393-L427 PolarHBondContact SG-O 2.9Å; C393-V768 HydrophobicContact CB-CG1 4.15Å
394	G	64.6	Low	72.7	Confident	9 Å²	9	30.6 Å²	30.6	9%	0.093	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	93	6.4	-178.8	0	0	0	0	0	115.4	S392	S392-G394 PolarHBondContact O-N 3.23Å
395	V	65.3	Low	72.4	Confident	22 Å²	22	33.1 Å²	33.1	13%	0.133	19%	0.186	C	C	.	.			trans	-121.8	120	174.5	-176	0	0	0	0	109.6	W360 V362 S392	W360-V395 HydrophobicContact CB-CG2 4.13Å; W360-V395 HydrophobicContact CG-CG2 4.48Å; V362-V395 HydrophobicContact CG2-CB 4.01Å; V362-V395 HydrophobicContact CG2-CG1 3.75Å; S392-V395 PolarHBondContact O-N 3.32Å; S392-V395 VanDerWaalsContact O-N 3.14Å
396	H	61.9	Low	72	Confident	65 Å²	65	33.1 Å²	33.1	30%	0.301	19%	0.186	S	C	.	.			trans	-97.5	104.6	169.8	-73	-62.3	0	0	0	108.4	S432 L434	H396-S432 VanDerWaalsContact CE1-CB 3.44Å; H396-S432 WeakPolarHBondContact CE1-CB 3.35Å; H396-L434 VanDerWaalsContact CE1-CD1 3.48Å; H396-L434 WeakPolarHBondContact CE1-CD1 3.38Å
397	H	61.7	Low	71.7	Confident	63 Å²	63	34.1 Å²	34.1	29%	0.292	19%	0.191	S	C	.	.			trans	-97	139.7	173.9	-160.4	-48.9	0	0	0	108.9	C399 D400	H397-C399 PolarHBondContact ND1-N 3.47Å; H397-C399 PolarHBondContact O-N 3.28Å; H397-D400 PolarHBondContact O-N 3.38Å
398	E	55.7	Low	71.5	Confident	195 Å²	195	40.1 Å²	40.1	91%	0.911	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-23.3	178.3	-59.7	-173.4	161.4	0	0	114.4
399	C	59.7	Low	71.2	Confident	102 Å²	102	42.3 Å²	42.3	69%	0.689	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.6	5.1	-179	-68.3	0	0	0	0	113.9	H397 P401	H397-C399 PolarHBondContact ND1-N 3.47Å; H397-C399 PolarHBondContact O-N 3.28Å; C399-P401 VanDerWaalsContact C-CD 3.47Å; C399-P401 VanDerWaalsContact C-N 3.34Å; C399-P401 WeakPolarHBondContact O-CD 3.32Å
400	D	65.4	Low	71	Confident	50 Å²	50	42.4 Å²	42.4	27%	0.267	23%	0.232	S	C	.	.			trans	24.7	60.6	178.3	-80.5	-42.8	0	0	0	115	H397 A402 Q403 A404 Y429	H397-D400 PolarHBondContact O-N 3.38Å; D400-A402 PolarHBondContact O-N 3.1Å; D400-Q403 HydrophobicContact CB-CB 4.26Å; D400-Q403 PolarHBondContact O-N 3.47Å; D400-Q403 VanDerWaalsContact O-N 3.17Å; D400-A404 PolarHBondContact O-N 2.77Å; D400-Y429 PolarHBondContact OD1-OH 2.68Å
401	P	65.6	Low	70.5	Confident	25 Å²	25	49.3 Å²	49.3	16%	0.162	26%	0.264	C	S	.	.	H	α-helix	trans	-63.7	-30.6	-173.3	24.4	-33.4	0	0	0	112.2	V362 L366 C399 L405	V362-P401 HydrophobicContact CG1-CG 3.73Å; L366-P401 HydrophobicContact CD1-CB 3.69Å; L366-P401 HydrophobicContact CD1-CG 3.75Å; C399-P401 VanDerWaalsContact C-CD 3.47Å; C399-P401 VanDerWaalsContact C-N 3.34Å; C399-P401 WeakPolarHBondContact O-CD 3.32Å; P401-L405 WeakPolarHBondContact O-CB 3.27Å; P401-L405 WeakPolarHBondContact O-CG 3.43Å; P401-L405 PolarHBondContact O-N 2.85Å
402	A	69.7	Low	70.2	Confident	2 Å²	2	50 Å²	50	2%	0.017	27%	0.269	C	S	.	.	H	α-helix	trans	-65.4	-41.3	177.9	0	0	0	0	0	112.2	V388 D400 L406 A428 Y429	V388-A402 HydrophobicContact CG1-CB 4.41Å; D400-A402 PolarHBondContact O-N 3.1Å; A402-L406 HydrophobicContact CB-CD1 4.18Å; A402-L406 WeakPolarHBondContact O-CB 3.41Å; A402-L406 WeakPolarHBondContact O-CD1 3.37Å; A402-L406 WeakPolarHBondContact O-CG 3.19Å; A402-L406 PolarHBondContact O-N 3.14Å; A402-A428 HydrophobicContact CB-CB 4.22Å; A402-Y429 HydrophobicContact CB-CE2 4.39Å
403	Q	72.6	Confident	69.9	Low	35 Å²	35	55.3 Å²	55.3	16%	0.164	30%	0.304	C	S	.	.	H	α-helix	trans	-64.4	-51	176.8	-173.8	175	7.3	0	0	110.6	D400 L405 L407 Y429 T440	D400-Q403 HydrophobicContact CB-CB 4.26Å; D400-Q403 PolarHBondContact O-N 3.47Å; D400-Q403 VanDerWaalsContact O-N 3.17Å; Q403-L405 PolarHBondContact O-N 3.28Å; Q403-L407 HydrophobicContact CG-CD1 3.41Å; Q403-L407 VanDerWaalsContact CG-CD1 3.41Å; Q403-L407 HydrophobicContact CG-CG 4.04Å; Q403-L407 VanDerWaalsContact O-CB 3.27Å; Q403-L407 WeakPolarHBondContact O-CB 3.29Å; Q403-L407 WeakPolarHBondContact O-CG 3.42Å; Q403-L407 PolarHBondContact O-N 3.07Å; Q403-L407 VanDerWaalsContact O-N 3.14Å; Q403-Y429 HydrophobicContact CB-CE2 4.36Å; Q403-Y429 WeakPolarHBondContact CB-OH 3.49Å; Q403-Y429 PolarHBondContact N-OH 3Å; Q403-T440 VanDerWaalsContact NE2-CG2 3.32Å
404	A	71.4	Confident	70.3	Confident	63 Å²	63	59.8 Å²	59.8	52%	0.521	32%	0.323	S	S	.	.	H	α-helix	trans	-61.6	-47.2	-176.8	0	0	0	0	0	112.1	D400	D400-A404 PolarHBondContact O-N 2.77Å
405	L	77.2	Confident	71	Confident	54 Å²	54	62 Å²	62	28%	0.283	33%	0.333	S	S	.	.	H	α-helix	trans	-72	-46.3	-177.5	-68.6	172.1	0	0	0	112	L366 V388 P401 Q403 Y409	L366-L405 HydrophobicContact CD2-CD1 4.35Å; V388-L405 HydrophobicContact CG1-CD1 4.39Å; P401-L405 WeakPolarHBondContact O-CB 3.27Å; P401-L405 WeakPolarHBondContact O-CG 3.43Å; P401-L405 PolarHBondContact O-N 2.85Å; Q403-L405 PolarHBondContact O-N 3.28Å; L405-Y409 WeakPolarHBondContact O-CD2 3.26Å
406	L	78.2	Confident	71.9	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-77.4	-35.5	-169.6	-60.9	170.4	0	0	0	112.4	L385 A402 D408 Y409 V410 L425	L385-L406 HydrophobicContact CB-CD2 3.96Å; L385-L406 HydrophobicContact CD2-CD2 4.11Å; L385-L406 WeakPolarHBondContact O-CD2 3.28Å; A402-L406 HydrophobicContact CB-CD1 4.18Å; A402-L406 WeakPolarHBondContact O-CB 3.41Å; A402-L406 WeakPolarHBondContact O-CD1 3.37Å; A402-L406 WeakPolarHBondContact O-CG 3.19Å; A402-L406 PolarHBondContact O-N 3.14Å; L406-D408 VanDerWaalsContact C-N 3.28Å; L406-D408 PolarHBondContact O-N 3.49Å; L406-Y409 PolarHBondContact O-N 3.2Å; L406-V410 WeakPolarHBondContact O-CG2 3.42Å; L406-V410 PolarHBondContact O-N 3.35Å; L406-V410 VanDerWaalsContact O-N 3.09Å; L406-L425 HydrophobicContact CB-CD1 3.93Å; L406-L425 HydrophobicContact CB-CD2 3.63Å; L406-L425 HydrophobicContact CB-CG 3.52Å; L406-L425 HydrophobicContact CD1-CD2 3.81Å; L406-L425 HydrophobicContact CD1-CG 3.77Å; L406-L425 HydrophobicContact CG-CD2 4.33Å; L406-L425 HydrophobicContact CG-CG 4.27Å
407	L	77.4	Confident	72.9	Confident	22 Å²	22	61 Å²	61	12%	0.115	33%	0.328	C	S	.	.	H	α-helix	trans	-59.7	-38.1	-179	-71.1	-178.6	0	0	0	112.3	Q403 Y409 V410 L425 T440 I441	Q403-L407 HydrophobicContact CG-CD1 3.41Å; Q403-L407 VanDerWaalsContact CG-CD1 3.41Å; Q403-L407 HydrophobicContact CG-CG 4.04Å; Q403-L407 VanDerWaalsContact O-CB 3.27Å; Q403-L407 WeakPolarHBondContact O-CB 3.29Å; Q403-L407 WeakPolarHBondContact O-CG 3.42Å; Q403-L407 PolarHBondContact O-N 3.07Å; Q403-L407 VanDerWaalsContact O-N 3.14Å; L407-Y409 VanDerWaalsContact C-N 3.27Å; L407-Y409 PolarHBondContact O-N 3.02Å; L407-V410 PolarHBondContact O-N 3.34Å; L407-L425 HydrophobicContact CD2-CD1 3.96Å; L407-L425 HydrophobicContact CD2-CD2 4.47Å; L407-T440 HydrophobicContact CD1-CG2 4.04Å; L407-I441 HydrophobicContact CD2-CG1 4.46Å
408	D	79.6	Confident	73.9	Confident	126 Å²	126	59.2 Å²	59.2	67%	0.674	32%	0.319	S	S	*	.	H	α-helix	trans	-61.3	-36.3	175.9	-76.1	-8.6	0	0	0	112.2	L406	L406-D408 VanDerWaalsContact C-N 3.28Å; L406-D408 PolarHBondContact O-N 3.49Å
409	Y	77.7	Confident	75.1	Confident	49 Å²	49	50.3 Å²	50.3	19%	0.192	28%	0.278	C	S	.	.	H	α-helix	trans	-84.8	-18.3	-178.2	-69.9	-68.5	0	0	0	114.4	K381 L385 L405 L406 L407 Q411 S412	K381-Y409 VanDerWaalsContact CE-CE1 3.41Å; K381-Y409 WeakPolarHBondContact CE-OH 3.41Å; K381-Y409 PolarHBondContact NZ-OH 3.13Å; L385-Y409 HydrophobicContact CD1-CD1 4Å; L385-Y409 HydrophobicContact CD1-CD2 3.71Å; L385-Y409 HydrophobicContact CD1-CE2 4.38Å; L385-Y409 HydrophobicContact CD1-CG 3.51Å; L385-Y409 HydrophobicContact CD2-CD2 3.3Å; L385-Y409 HydrophobicContact CD2-CE2 3.58Å; L385-Y409 HydrophobicContact CD2-CG 4.04Å; L385-Y409 HydrophobicContact CG-CD2 4.15Å; L385-Y409 HydrophobicContact CG-CG 4.44Å; L405-Y409 WeakPolarHBondContact O-CD2 3.26Å; L406-Y409 PolarHBondContact O-N 3.2Å; L407-Y409 VanDerWaalsContact C-N 3.27Å; L407-Y409 PolarHBondContact O-N 3.02Å; Y409-Q411 PolarHBondContact O-N 3.09Å; Y409-S412 VanDerWaalsContact O-CB 3.28Å; Y409-S412 WeakPolarHBondContact O-CB 3.11Å; Y409-S412 PolarHBondContact O-N 3.35Å; Y409-S412 VanDerWaalsContact O-N 3.14Å; Y409-S412 PolarHBondContact O-OG 2.79Å
410	V	74.8	Confident	76.2	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.006	25%	0.245	C	C	.	.	H	α-helix	trans	-60.8	-36.9	174.2	174.6	0	0	0	0	110.7	L406 L407 S412 R418 T422 L425 S448	L406-V410 WeakPolarHBondContact O-CG2 3.42Å; L406-V410 PolarHBondContact O-N 3.35Å; L406-V410 VanDerWaalsContact O-N 3.09Å; L407-V410 PolarHBondContact O-N 3.34Å; V410-S412 VanDerWaalsContact C-N 3.33Å; V410-S412 PolarHBondContact O-N 3.14Å; V410-R418 WeakPolarHBondContact O-CG 3.47Å; V410-R418 PolarHBondContact O-NE 3.5Å; V410-T422 HydrophobicContact CG1-CG2 4.03Å; V410-T422 HydrophobicContact CG2-CG2 4.13Å; V410-L425 HydrophobicContact CG2-CD1 3.45Å; V410-L425 VanDerWaalsContact CG2-CD1 3.45Å; V410-S448 VanDerWaalsContact CG1-OG 3.26Å; V410-S448 WeakPolarHBondContact CG1-OG 3.38Å
411	Q	74.7	Confident	77.1	Confident	145 Å²	145	43.1 Å²	43.1	68%	0.678	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-8.5	179.7	-60.9	-173.1	-1.4	0	0	113.8	Y409 R418	Y409-Q411 PolarHBondContact O-N 3.09Å; Q411-R418 PolarHBondContact O-NH2 2.77Å
412	S	75.2	Confident	78	Confident	16 Å²	16	41.9 Å²	41.9	11%	0.112	22%	0.224	C	C	.	.			trans	-59.9	147.7	-174.8	72.3	0	0	0	0	112.6	Y409 V410 K414 L417 R418	Y409-S412 VanDerWaalsContact O-CB 3.28Å; Y409-S412 WeakPolarHBondContact O-CB 3.11Å; Y409-S412 PolarHBondContact O-N 3.35Å; Y409-S412 VanDerWaalsContact O-N 3.14Å; Y409-S412 PolarHBondContact O-OG 2.79Å; V410-S412 VanDerWaalsContact C-N 3.33Å; V410-S412 PolarHBondContact O-N 3.14Å; S412-K414 PolarHBondContact O-N 3.09Å; S412-L417 WeakPolarHBondContact OG-CB 3.33Å; S412-R418 PolarHBondContact O-NH2 3Å
413	P	68.7	Low	78.6	Confident	118 Å²	118	41.8 Å²	41.8	77%	0.766	22%	0.224	S	C	*	.	S	Bend	trans	-73.5	-10.3	-174.5	29.2	-36	0	0	0	113.9
414	K	80	Confident	79.1	Confident	94 Å²	94	40.1 Å²	40.1	41%	0.409	22%	0.216	S	C	.	.			trans	-91.7	122.4	-177.7	-58.6	-170.9	-177.9	-174.7	0	110.1	D378 S412 I416 L417 R418	D378-K414 HydrophobicContact CB-CD 4.46Å; D378-K414 WeakPolarHBondContact OD1-CD 3.19Å; D378-K414 IonicContact OD1-NZ 3.23Å; D378-K414 PolarHBondContact OD1-NZ 3.14Å; D378-K414 VanDerWaalsContact OD2-CD 3.3Å; D378-K414 WeakPolarHBondContact OD2-CD 3.2Å; D378-K414 WeakPolarHBondContact OD2-CE 3.44Å; D378-K414 IonicContact OD2-NZ 2.97Å; D378-K414 PolarHBondContact OD2-NZ 3.2Å; S412-K414 PolarHBondContact O-N 3.09Å; K414-I416 VanDerWaalsContact C-N 3.28Å; K414-I416 PolarHBondContact O-N 3.33Å; K414-L417 HydrophobicContact CB-CB 4.36Å; K414-L417 HydrophobicContact CB-CD1 3.99Å; K414-L417 HydrophobicContact CB-CG 4.17Å; K414-L417 HydrophobicContact CD-CD1 4.03Å; K414-L417 HydrophobicContact CG-CD1 4.32Å; K414-L417 PolarHBondContact O-N 2.99Å; K414-R418 PolarHBondContact O-N 2.88Å; K414-R418 VanDerWaalsContact O-N 3.15Å
415	N	79.3	Confident	79.6	Confident	55 Å²	55	37.1 Å²	37.1	29%	0.294	19%	0.191	S	C	.	.	H	α-helix	trans	-57.1	-39.1	-176.7	-65.8	-4.4	0	0	0	113.1	R418 I419 N455 I458	N415-R418 PolarHBondContact O-N 3.44Å; N415-I419 VanDerWaalsContact O-CG1 3.26Å; N415-I419 WeakPolarHBondContact O-CG1 3.45Å; N415-I419 PolarHBondContact O-N 2.71Å; N415-N455 PolarHBondContact ND2-ND2 3.21Å; N415-I458 HydrophobicContact CB-CD1 4.05Å
416	I	83.1	Confident	79.8	Confident	58 Å²	58	34.6 Å²	34.6	30%	0.297	18%	0.177	S	C	.	.	H	α-helix	trans	-67.2	-42	-178	-53.8	177.9	0	0	0	111.2	I348 N379 A382 K414 R418 I419 C420	I348-I416 HydrophobicContact CD1-CG2 3.59Å; N379-I416 WeakPolarHBondContact OD1-CD1 3.48Å; A382-I416 HydrophobicContact CB-CG2 3.64Å; K414-I416 VanDerWaalsContact C-N 3.28Å; K414-I416 PolarHBondContact O-N 3.33Å; I416-R418 VanDerWaalsContact C-N 3.34Å; I416-R418 PolarHBondContact O-N 3.17Å; I416-I419 PolarHBondContact O-N 2.91Å; I416-C420 PolarHBondContact O-N 2.93Å
417	L	83.3	Confident	79.9	Confident	9 Å²	9	34.6 Å²	34.6	5%	0.047	18%	0.177	C	C	.	.	H	α-helix	trans	-64.2	-40.3	176.2	-67.9	175.4	0	0	0	111.2	K381 A382 L385 S412 K414 S421	K381-L417 HydrophobicContact CB-CD2 4.2Å; K381-L417 HydrophobicContact CD-CD2 4.22Å; K381-L417 HydrophobicContact CG-CD2 3.91Å; A382-L417 HydrophobicContact CB-CD2 3.88Å; L385-L417 HydrophobicContact CD1-CD2 3.86Å; S412-L417 WeakPolarHBondContact OG-CB 3.33Å; K414-L417 HydrophobicContact CB-CB 4.36Å; K414-L417 HydrophobicContact CB-CD1 3.99Å; K414-L417 HydrophobicContact CB-CG 4.17Å; K414-L417 HydrophobicContact CD-CD1 4.03Å; K414-L417 HydrophobicContact CG-CD1 4.32Å; K414-L417 PolarHBondContact O-N 2.99Å; L417-S421 VanDerWaalsContact O-CB 3.3Å; L417-S421 WeakPolarHBondContact O-CB 3.28Å; L417-S421 PolarHBondContact O-N 3.46Å; L417-S421 PolarHBondContact O-OG 3.44Å
418	R	81.6	Confident	79.9	Confident	24 Å²	24	33.9 Å²	33.9	9%	0.091	18%	0.175	C	C	.	.	H	α-helix	trans	-64.2	-42.3	176	-172.5	171.9	-64.1	159.8	4.3	112.1	V410 Q411 S412 K414 N415 I416 S421 T422 N454 I458	V410-R418 WeakPolarHBondContact O-CG 3.47Å; V410-R418 PolarHBondContact O-NE 3.5Å; Q411-R418 PolarHBondContact O-NH2 2.77Å; S412-R418 PolarHBondContact O-NH2 3Å; K414-R418 PolarHBondContact O-N 2.88Å; K414-R418 VanDerWaalsContact O-N 3.15Å; N415-R418 PolarHBondContact O-N 3.44Å; I416-R418 VanDerWaalsContact C-N 3.34Å; I416-R418 PolarHBondContact O-N 3.17Å; R418-S421 WeakPolarHBondContact CA-OG 3.34Å; R418-S421 PolarHBondContact O-OG 2.76Å; R418-T422 HydrophobicContact CG-CG2 4.33Å; R418-T422 WeakPolarHBondContact O-CB 3.44Å; R418-T422 WeakPolarHBondContact O-CG2 3.37Å; R418-T422 PolarHBondContact O-N 3.36Å; R418-T422 PolarHBondContact O-OG1 3.47Å; R418-N454 PolarHBondContact NH1-OD1 3.19Å; R418-I458 HydrophobicContact CG-CG2 4.05Å
419	I	82.3	Confident	79.8	Confident	9 Å²	9	28.2 Å²	28.2	5%	0.046	14%	0.144	C	C	.	.	H	α-helix	trans	-61.3	-50.2	177.4	-74.4	169	0	0	0	111.1	N415 I416 T422 L423 E457 I458 I461 Y762	N415-I419 VanDerWaalsContact O-CG1 3.26Å; N415-I419 WeakPolarHBondContact O-CG1 3.45Å; N415-I419 PolarHBondContact O-N 2.71Å; I416-I419 PolarHBondContact O-N 2.91Å; I419-T422 PolarHBondContact O-OG1 2.9Å; I419-L423 WeakPolarHBondContact O-CB 3.48Å; I419-L423 PolarHBondContact O-N 3.36Å; I419-L423 VanDerWaalsContact O-N 3.13Å; I419-E457 HydrophobicContact CD1-CB 4.22Å; I419-I458 HydrophobicContact CD1-CG1 4.17Å; I419-I458 HydrophobicContact CG1-CG1 3.82Å; I419-I461 HydrophobicContact CB-CD1 4.24Å; I419-I461 HydrophobicContact CD1-CD1 4.5Å; I419-I461 HydrophobicContact CG1-CD1 4.08Å; I419-I461 HydrophobicContact CG2-CD1 3.37Å; I419-Y762 HydrophobicContact CG2-CE1 4.23Å; I419-Y762 HydrophobicContact CG2-CE2 4.02Å; I419-Y762 WeakPolarHBondContact CG2-OH 3.4Å
420	C	83.3	Confident	79.5	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-72.2	-35.9	-176.5	-67.7	0	0	0	0	113	A382 L386 I416 G424	A382-C420 HydrophobicContact CB-CB 4.04Å; A382-C420 WeakPolarHBondContact O-CB 3.27Å; L386-C420 HydrophobicContact CB-CB 4.23Å; I416-C420 PolarHBondContact O-N 2.93Å; C420-G424 PolarHBondContact O-N 3.08Å
421	S	83.2	Confident	79.4	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-68.2	-43	176.3	52	0	0	0	0	112.6	L417 R418 G424 L425	L417-S421 VanDerWaalsContact O-CB 3.3Å; L417-S421 WeakPolarHBondContact O-CB 3.28Å; L417-S421 PolarHBondContact O-N 3.46Å; L417-S421 PolarHBondContact O-OG 3.44Å; R418-S421 WeakPolarHBondContact CA-OG 3.34Å; R418-S421 PolarHBondContact O-OG 2.76Å; S421-G424 PolarHBondContact O-N 3.42Å; S421-L425 WeakPolarHBondContact O-CB 3.34Å; S421-L425 WeakPolarHBondContact O-CG 3.48Å; S421-L425 PolarHBondContact O-N 2.84Å
422	T	83.6	Confident	79	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-65	-43.4	177.5	51.8	0	0	0	0	111.9	V410 R418 I419 L425 G426 L445 I462 A465	V410-T422 HydrophobicContact CG1-CG2 4.03Å; V410-T422 HydrophobicContact CG2-CG2 4.13Å; R418-T422 HydrophobicContact CG-CG2 4.33Å; R418-T422 WeakPolarHBondContact O-CB 3.44Å; R418-T422 WeakPolarHBondContact O-CG2 3.37Å; R418-T422 PolarHBondContact O-N 3.36Å; R418-T422 PolarHBondContact O-OG1 3.47Å; I419-T422 PolarHBondContact O-OG1 2.9Å; T422-L425 PolarHBondContact O-N 3.15Å; T422-G426 PolarHBondContact O-N 3.4Å; T422-L445 HydrophobicContact CG2-CD2 3.78Å; T422-I462 HydrophobicContact CG2-CG1 3.95Å; T422-A465 VanDerWaalsContact O-CB 3.24Å; T422-A465 WeakPolarHBondContact O-CB 3.46Å
423	L	83.3	Confident	78.3	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-65.6	-41.5	174.1	-175.4	65.1	0	0	0	112	L386 I419 L425 G426 L427 I461 L464 Y762	L386-L423 HydrophobicContact CD1-CB 4.14Å; L386-L423 HydrophobicContact CD1-CD2 3.87Å; L386-L423 HydrophobicContact CD1-CG 3.93Å; I419-L423 WeakPolarHBondContact O-CB 3.48Å; I419-L423 PolarHBondContact O-N 3.36Å; I419-L423 VanDerWaalsContact O-N 3.13Å; L423-L425 VanDerWaalsContact C-N 3.33Å; L423-L425 PolarHBondContact O-N 3.06Å; L423-G426 PolarHBondContact O-N 3.33Å; L423-L427 HydrophobicContact CD1-CG 4.41Å; L423-L427 HydrophobicContact CG-CD1 4.18Å; L423-L427 HydrophobicContact CG-CG 4.45Å; L423-L427 WeakPolarHBondContact O-CG 3.15Å; L423-L427 PolarHBondContact O-N 2.95Å; L423-I461 HydrophobicContact CB-CG2 3.93Å; L423-L464 HydrophobicContact CD1-CD2 3.43Å; L423-L464 VanDerWaalsContact CD1-CD2 3.43Å; L423-Y762 HydrophobicContact CD2-CD2 3.39Å; L423-Y762 HydrophobicContact CD2-CE2 3.88Å; L423-Y762 HydrophobicContact CD2-CG 4.48Å
424	G	83.2	Confident	78	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-59.7	-41.9	176.7	0	0	0	0	0	112.5	G389 C420 S421 L427 A428	G389-G424 WeakPolarHBondContact CA-O 3.3Å; C420-G424 PolarHBondContact O-N 3.08Å; S421-G424 PolarHBondContact O-N 3.42Å; G424-L427 PolarHBondContact O-N 2.76Å; G424-A428 VanDerWaalsContact O-CB 3.26Å; G424-A428 WeakPolarHBondContact O-CB 3.09Å; G424-A428 PolarHBondContact O-N 2.96Å
425	L	82.7	Confident	77.1	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-63.4	-44.3	173.3	-78.2	166.4	0	0	0	111.7	L406 L407 V410 S421 T422 L423 L427 A428 Y429 I441	L406-L425 HydrophobicContact CB-CD1 3.93Å; L406-L425 HydrophobicContact CB-CD2 3.63Å; L406-L425 HydrophobicContact CB-CG 3.52Å; L406-L425 HydrophobicContact CD1-CD2 3.81Å; L406-L425 HydrophobicContact CD1-CG 3.77Å; L406-L425 HydrophobicContact CG-CD2 4.33Å; L406-L425 HydrophobicContact CG-CG 4.27Å; L407-L425 HydrophobicContact CD2-CD1 3.96Å; L407-L425 HydrophobicContact CD2-CD2 4.47Å; V410-L425 HydrophobicContact CG2-CD1 3.45Å; V410-L425 VanDerWaalsContact CG2-CD1 3.45Å; S421-L425 WeakPolarHBondContact O-CB 3.34Å; S421-L425 WeakPolarHBondContact O-CG 3.48Å; S421-L425 PolarHBondContact O-N 2.84Å; T422-L425 PolarHBondContact O-N 3.15Å; L423-L425 VanDerWaalsContact C-N 3.33Å; L423-L425 PolarHBondContact O-N 3.06Å; L425-L427 VanDerWaalsContact C-N 3.33Å; L425-L427 PolarHBondContact O-N 3.19Å; L425-A428 PolarHBondContact O-N 3.3Å; L425-Y429 HydrophobicContact CD2-CD2 4.12Å; L425-Y429 HydrophobicContact CD2-CE2 3.97Å; L425-Y429 WeakPolarHBondContact O-CB 3.23Å; L425-Y429 PolarHBondContact O-N 3.41Å; L425-I441 HydrophobicContact CD2-CD1 4.26Å
426	G	80.5	Confident	76.2	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-60.5	-40.4	177.4	0	0	0	0	0	113	T422 L423 A430 F468	T422-G426 PolarHBondContact O-N 3.4Å; L423-G426 PolarHBondContact O-N 3.33Å; G426-A430 PolarHBondContact O-N 2.71Å; G426-F468 VanDerWaalsContact O-CB 3.31Å; G426-F468 WeakPolarHBondContact O-CB 3.28Å
427	L	80.2	Confident	75.4	Confident	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-76.1	-39.4	178.1	-64.9	176	0	0	0	112.7	L386 V390 C393 L423 G424 L425 F468 P769	L386-L427 HydrophobicContact CD1-CD1 4.32Å; V390-L427 HydrophobicContact CG2-CD1 4.32Å; C393-L427 VanDerWaalsContact CB-O 3.23Å; C393-L427 WeakPolarHBondContact CB-O 3.09Å; C393-L427 PolarHBondContact SG-O 2.9Å; L423-L427 HydrophobicContact CD1-CG 4.41Å; L423-L427 HydrophobicContact CG-CD1 4.18Å; L423-L427 HydrophobicContact CG-CG 4.45Å; L423-L427 WeakPolarHBondContact O-CG 3.15Å; L423-L427 PolarHBondContact O-N 2.95Å; G424-L427 PolarHBondContact O-N 2.76Å; L425-L427 VanDerWaalsContact C-N 3.33Å; L425-L427 PolarHBondContact O-N 3.19Å; L427-F468 HydrophobicContact CD2-CD2 4.47Å; L427-F468 HydrophobicContact CD2-CE2 4.37Å; L427-P769 HydrophobicContact CD2-CG 4.04Å
428	A	78.6	Confident	74.6	Confident	7 Å²	7	17.7 Å²	17.7	6%	0.058	10%	0.102	C	C	.	.	H	α-helix	trans	-60.7	-47.5	178.2	0	0	0	0	0	111.2	A402 G424 L425	A402-A428 HydrophobicContact CB-CB 4.22Å; G424-A428 VanDerWaalsContact O-CB 3.26Å; G424-A428 WeakPolarHBondContact O-CB 3.09Å; G424-A428 PolarHBondContact O-N 2.96Å; L425-A428 PolarHBondContact O-N 3.3Å
429	Y	75.7	Confident	73.7	Confident	8 Å²	8	23.6 Å²	23.6	3%	0.031	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	22	-174.7	-68.4	-67.2	0	0	0	113.5	D400 A402 Q403 L425 N431 S432 V437 I441	D400-Y429 PolarHBondContact OD1-OH 2.68Å; A402-Y429 HydrophobicContact CB-CE2 4.39Å; Q403-Y429 HydrophobicContact CB-CE2 4.36Å; Q403-Y429 WeakPolarHBondContact CB-OH 3.49Å; Q403-Y429 PolarHBondContact N-OH 3Å; L425-Y429 HydrophobicContact CD2-CD2 4.12Å; L425-Y429 HydrophobicContact CD2-CE2 3.97Å; L425-Y429 WeakPolarHBondContact O-CB 3.23Å; L425-Y429 PolarHBondContact O-N 3.41Å; Y429-N431 PolarHBondContact O-N 3.05Å; Y429-S432 VanDerWaalsContact C-OG 3.27Å; Y429-S432 WeakPolarHBondContact CA-OG 3.47Å; Y429-S432 WeakPolarHBondContact CB-OG 3.17Å; Y429-S432 WeakPolarHBondContact CD1-OG 3.35Å; Y429-S432 PolarHBondContact O-N 3.12Å; Y429-S432 VanDerWaalsContact O-N 3.09Å; Y429-S432 PolarHBondContact O-OG 3.02Å; Y429-V437 HydrophobicContact CD1-CB 4.48Å; Y429-V437 HydrophobicContact CD1-CG1 3.93Å; Y429-V437 HydrophobicContact CD1-CG2 3.63Å; Y429-V437 HydrophobicContact CE1-CG2 3.8Å; Y429-V437 HydrophobicContact CG-CG1 3.87Å; Y429-V437 HydrophobicContact CG-CG2 4.37Å; Y429-I441 HydrophobicContact CD1-CD1 4.48Å; Y429-I441 HydrophobicContact CD2-CD1 3.3Å; Y429-I441 HydrophobicContact CE2-CD1 3.47Å; Y429-I441 VanDerWaalsContact CE2-CD1 3.47Å; Y429-I441 HydrophobicContact CG-CD1 3.87Å
430	A	73	Confident	73.1	Confident	3 Å²	3	25.4 Å²	25.4	3%	0.025	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	124	177.8	0	0	0	0	0	110.4	Q273 G426 S432 F468 P769	Q273-A430 PolarHBondContact OE1-O 3.32Å; G426-A430 PolarHBondContact O-N 2.71Å; A430-S432 PolarHBondContact O-N 3.22Å; A430-F468 VanDerWaalsContact CA-O 3.28Å; A430-F468 WeakPolarHBondContact CA-O 3.08Å; A430-P769 HydrophobicContact CB-CG 4.38Å
431	N	71.7	Confident	72.5	Confident	17 Å²	17	25.4 Å²	25.4	9%	0.091	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	15.7	-177.6	-166.5	44.7	0	0	0	115.7	Y429 K433 F468 V471	Y429-N431 PolarHBondContact O-N 3.05Å; N431-K433 PolarHBondContact O-N 3.32Å; N431-F468 PolarHBondContact N-O 3.05Å; N431-V471 PolarHBondContact OD1-O 2.95Å
432	S	65.5	Low	71.9	Confident	7 Å²	7	25.9 Å²	25.9	5%	0.049	15%	0.145	C	C	.	.			trans	-79.8	87.4	174.5	66.5	0	0	0	0	109.3	H396 Y429 A430 L434	H396-S432 VanDerWaalsContact CE1-CB 3.44Å; H396-S432 WeakPolarHBondContact CE1-CB 3.35Å; Y429-S432 VanDerWaalsContact C-OG 3.27Å; Y429-S432 WeakPolarHBondContact CA-OG 3.47Å; Y429-S432 WeakPolarHBondContact CB-OG 3.17Å; Y429-S432 WeakPolarHBondContact CD1-OG 3.35Å; Y429-S432 PolarHBondContact O-N 3.12Å; Y429-S432 VanDerWaalsContact O-N 3.09Å; Y429-S432 PolarHBondContact O-OG 3.02Å; A430-S432 PolarHBondContact O-N 3.22Å; S432-L434 PolarHBondContact O-N 3.26Å
433	K	62.3	Low	71.2	Confident	47 Å²	47	28.6 Å²	28.6	20%	0.204	16%	0.163	C	C	.	.			trans	-72.3	35.4	178.5	-64.1	176.9	170.6	-171.1	0	113.2	N244 M246 N431	N244-K433 PolarHBondContact ND2-NZ 3.07Å; N244-K433 PolarHBondContact O-NZ 2.93Å; N244-K433 PolarHBondContact OD1-NZ 2.88Å; M246-K433 HydrophobicContact CG-CB 4.14Å; M246-K433 HydrophobicContact CG-CD 3.66Å; N431-K433 PolarHBondContact O-N 3.32Å
434	L	62.2	Low	70.4	Confident	77 Å²	77	31.3 Å²	31.3	40%	0.403	18%	0.176	S	C	.	.			trans	-77.1	126.6	175.1	-84.2	131.3	0	0	0	108.7	H396 S432 S436 V437 E438	H396-L434 VanDerWaalsContact CE1-CD1 3.48Å; H396-L434 WeakPolarHBondContact CE1-CD1 3.38Å; S432-L434 PolarHBondContact O-N 3.26Å; L434-S436 PolarHBondContact O-N 3.07Å; L434-V437 HydrophobicContact CB-CB 4.24Å; L434-V437 HydrophobicContact CB-CG2 3.84Å; L434-V437 WeakPolarHBondContact O-CB 3.5Å; L434-V437 PolarHBondContact O-N 3.36Å; L434-E438 PolarHBondContact O-N 3.3Å
435	A	60.7	Low	69.7	Low	60 Å²	60	31.4 Å²	31.4	50%	0.496	18%	0.176	S	C	.	.	H	α-helix	trans	-55.4	-34.4	177.3	0	0	0	0	0	112.2	V437 E438 E439	A435-V437 VanDerWaalsContact C-N 3.33Å; A435-V437 PolarHBondContact O-N 3.18Å; A435-E438 PolarHBondContact O-N 3.45Å; A435-E439 VanDerWaalsContact O-CB 3.32Å; A435-E439 WeakPolarHBondContact O-CB 3.44Å; A435-E439 VanDerWaalsContact O-CG 3.26Å; A435-E439 WeakPolarHBondContact O-CG 3.49Å; A435-E439 PolarHBondContact O-N 3.18Å
436	S	60.7	Low	69.1	Low	55 Å²	55	32.3 Å²	32.3	39%	0.385	18%	0.182	S	C	.	.	H	α-helix	trans	-62	-37.8	176	54	0	0	0	0	113.3	L434 T440	L434-S436 PolarHBondContact O-N 3.07Å; S436-T440 VanDerWaalsContact O-CB 3.29Å; S436-T440 WeakPolarHBondContact O-CB 3.46Å; S436-T440 PolarHBondContact O-N 3.41Å; S436-T440 PolarHBondContact O-OG1 3.13Å
437	V	67	Low	68.4	Low	2 Å²	2	37.1 Å²	37.1	1%	0.012	21%	0.208	C	C	.	.	H	α-helix	trans	-72.9	-44.5	178.3	174.7	0	0	0	0	109.5	Y429 L434 A435 E439 I441 I469	Y429-V437 HydrophobicContact CD1-CB 4.48Å; Y429-V437 HydrophobicContact CD1-CG1 3.93Å; Y429-V437 HydrophobicContact CD1-CG2 3.63Å; Y429-V437 HydrophobicContact CE1-CG2 3.8Å; Y429-V437 HydrophobicContact CG-CG1 3.87Å; Y429-V437 HydrophobicContact CG-CG2 4.37Å; L434-V437 HydrophobicContact CB-CB 4.24Å; L434-V437 HydrophobicContact CB-CG2 3.84Å; L434-V437 WeakPolarHBondContact O-CB 3.5Å; L434-V437 PolarHBondContact O-N 3.36Å; A435-V437 VanDerWaalsContact C-N 3.33Å; A435-V437 PolarHBondContact O-N 3.18Å; V437-E439 PolarHBondContact O-N 2.93Å; V437-I441 HydrophobicContact CB-CD1 4.36Å; V437-I441 HydrophobicContact CG1-CB 4.46Å; V437-I441 HydrophobicContact CG1-CD1 3.63Å; V437-I441 HydrophobicContact CG1-CG1 4.22Å; V437-I441 WeakPolarHBondContact O-CA 3.31Å; V437-I441 VanDerWaalsContact O-CB 3.25Å; V437-I441 WeakPolarHBondContact O-CB 3.42Å; V437-I441 PolarHBondContact O-N 2.89Å; V437-I469 HydrophobicContact CG1-CG2 4.02Å
438	E	64.8	Low	67.5	Low	56 Å²	56	37.5 Å²	37.5	26%	0.262	21%	0.21	S	C	.	.	H	α-helix	trans	-63.5	-39.2	175.4	-68.8	-168.2	169.1	0	0	112.2	L434 A435 V442 P443 L470	L434-E438 PolarHBondContact O-N 3.3Å; A435-E438 PolarHBondContact O-N 3.45Å; E438-V442 VanDerWaalsContact O-CB 3.24Å; E438-V442 WeakPolarHBondContact O-CB 3.36Å; E438-P443 WeakPolarHBondContact O-CD 3.43Å; E438-L470 HydrophobicContact CG-CD2 4.22Å; E438-L470 WeakPolarHBondContact OE1-CD2 3.44Å
439	E	64.4	Low	66.7	Low	147 Å²	147	37.4 Å²	37.4	69%	0.687	21%	0.208	S	C	*	.	H	α-helix	trans	-76.9	-31.1	-179.5	-73.6	178.3	-175.2	0	0	113.4	A435 V437 P443	A435-E439 VanDerWaalsContact O-CB 3.32Å; A435-E439 WeakPolarHBondContact O-CB 3.44Å; A435-E439 VanDerWaalsContact O-CG 3.26Å; A435-E439 WeakPolarHBondContact O-CG 3.49Å; A435-E439 PolarHBondContact O-N 3.18Å; V437-E439 PolarHBondContact O-N 2.93Å; E439-P443 WeakPolarHBondContact O-CD 3.09Å; E439-P443 WeakPolarHBondContact O-CG 3.49Å
440	T	68.1	Low	66	Low	47 Å²	47	40.9 Å²	40.9	29%	0.288	23%	0.234	S	C	.	.	H	α-helix	trans	-97.8	-45.3	-174.9	-47	0	0	0	0	112.4	Q403 L407 S436 Q444	Q403-T440 VanDerWaalsContact NE2-CG2 3.32Å; L407-T440 HydrophobicContact CD1-CG2 4.04Å; S436-T440 VanDerWaalsContact O-CB 3.29Å; S436-T440 WeakPolarHBondContact O-CB 3.46Å; S436-T440 PolarHBondContact O-N 3.41Å; S436-T440 PolarHBondContact O-OG1 3.13Å; T440-Q444 WeakPolarHBondContact O-CB 3.15Å; T440-Q444 WeakPolarHBondContact O-CG 3.16Å
441	I	70.8	Confident	65.4	Low	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-84.5	-43.2	-170.4	-53.5	-175.1	0	0	0	110.5	L407 L425 Y429 V437 Q444 L445 I469	L407-I441 HydrophobicContact CD2-CG1 4.46Å; L425-I441 HydrophobicContact CD2-CD1 4.26Å; Y429-I441 HydrophobicContact CD1-CD1 4.48Å; Y429-I441 HydrophobicContact CD2-CD1 3.3Å; Y429-I441 HydrophobicContact CE2-CD1 3.47Å; Y429-I441 VanDerWaalsContact CE2-CD1 3.47Å; Y429-I441 HydrophobicContact CG-CD1 3.87Å; V437-I441 HydrophobicContact CB-CD1 4.36Å; V437-I441 HydrophobicContact CG1-CB 4.46Å; V437-I441 HydrophobicContact CG1-CD1 3.63Å; V437-I441 HydrophobicContact CG1-CG1 4.22Å; V437-I441 WeakPolarHBondContact O-CA 3.31Å; V437-I441 VanDerWaalsContact O-CB 3.25Å; V437-I441 WeakPolarHBondContact O-CB 3.42Å; V437-I441 PolarHBondContact O-N 2.89Å; I441-Q444 PolarHBondContact O-N 3.17Å; I441-L445 HydrophobicContact CG2-CD1 3.72Å; I441-L445 HydrophobicContact CG2-CG 4.04Å; I441-L445 WeakPolarHBondContact O-CB 3.4Å; I441-L445 WeakPolarHBondContact O-CG 3.19Å; I441-L445 PolarHBondContact O-N 3.05Å; I441-I469 HydrophobicContact CG2-CD1 3.75Å
442	V	72	Confident	64.5	Low	10 Å²	10	50.2 Å²	50.2	6%	0.061	29%	0.29	C	S	.	.	H	α-helix	trans	-61	-49.4	-178.6	176.4	0	0	0	0	111.2	E438 Q444 L445 V446 L466 L470 I478	E438-V442 VanDerWaalsContact O-CB 3.24Å; E438-V442 WeakPolarHBondContact O-CB 3.36Å; V442-Q444 VanDerWaalsContact C-N 3.26Å; V442-Q444 PolarHBondContact O-N 3.13Å; V442-L445 PolarHBondContact O-N 3.25Å; V442-V446 HydrophobicContact CG1-CG2 4.11Å; V442-V446 WeakPolarHBondContact O-CB 3.44Å; V442-V446 VanDerWaalsContact O-CG2 3.24Å; V442-V446 WeakPolarHBondContact O-CG2 3.45Å; V442-V446 PolarHBondContact O-N 3.16Å; V442-L466 HydrophobicContact CB-CD2 4.36Å; V442-L466 HydrophobicContact CG1-CD2 4.06Å; V442-L466 HydrophobicContact CG2-CD2 4.25Å; V442-L470 HydrophobicContact CG2-CD1 4.23Å; V442-I478 HydrophobicContact CB-CD1 4.45Å; V442-I478 HydrophobicContact CG1-CD1 3.5Å; V442-I478 HydrophobicContact CG1-CG1 3.86Å; V442-I478 HydrophobicContact CG2-CD1 4.24Å
443	P	68.1	Low	64	Low	57 Å²	57	58.9 Å²	58.9	37%	0.37	33%	0.327	S	S	.	.	H	α-helix	trans	-65.4	-32.2	-179.9	-25.6	39.2	0	0	0	112.2	E438 E439 V446 N447	E438-P443 WeakPolarHBondContact O-CD 3.43Å; E439-P443 WeakPolarHBondContact O-CD 3.09Å; E439-P443 WeakPolarHBondContact O-CG 3.49Å; P443-V446 PolarHBondContact O-N 2.98Å; P443-N447 WeakPolarHBondContact O-CB 3.38Å; P443-N447 PolarHBondContact O-N 3.41Å; P443-N447 PolarHBondContact O-ND2 3.17Å; P443-N447 VanDerWaalsContact O-ND2 3.12Å
444	Q	66.6	Low	63.9	Low	58 Å²	58	57.8 Å²	57.8	27%	0.271	32%	0.324	S	S	.	.	H	α-helix	trans	-71.7	-36.7	177.1	-70.9	-175.1	14.4	0	0	112.6	T440 I441 V442 S448	T440-Q444 WeakPolarHBondContact O-CB 3.15Å; T440-Q444 WeakPolarHBondContact O-CG 3.16Å; I441-Q444 PolarHBondContact O-N 3.17Å; V442-Q444 VanDerWaalsContact C-N 3.26Å; V442-Q444 PolarHBondContact O-N 3.13Å; Q444-S448 VanDerWaalsContact O-CB 3.32Å; Q444-S448 WeakPolarHBondContact O-CB 3.22Å; Q444-S448 PolarHBondContact O-N 3.42Å; Q444-S448 PolarHBondContact O-OG 3.12Å
445	L	67.6	Low	64.2	Low	2 Å²	2	57.8 Å²	57.8	1%	0.01	32%	0.324	C	S	.	.	H	α-helix	trans	-68.8	-39.7	172.4	-70.7	178.7	0	0	0	111.6	T422 I441 V442 S448 L449 I462 L466 I469	T422-L445 HydrophobicContact CG2-CD2 3.78Å; I441-L445 HydrophobicContact CG2-CD1 3.72Å; I441-L445 HydrophobicContact CG2-CG 4.04Å; I441-L445 WeakPolarHBondContact O-CB 3.4Å; I441-L445 WeakPolarHBondContact O-CG 3.19Å; I441-L445 PolarHBondContact O-N 3.05Å; V442-L445 PolarHBondContact O-N 3.25Å; L445-S448 CarbonylContact O-C 3.51Å; L445-S448 WeakPolarHBondContact O-CB 3.26Å; L445-S448 PolarHBondContact O-N 3.49Å; L445-L449 PolarHBondContact O-N 3.46Å; L445-I462 HydrophobicContact CB-CG2 4.27Å; L445-L466 HydrophobicContact CB-CD1 4.42Å; L445-L466 HydrophobicContact CB-CD2 3.86Å; L445-L466 HydrophobicContact CB-CG 4.14Å; L445-L466 HydrophobicContact CD1-CD2 3.73Å; L445-L466 HydrophobicContact CD1-CG 4.04Å; L445-L466 HydrophobicContact CG-CD2 4.46Å; L445-I469 HydrophobicContact CD1-CD1 3.77Å
446	V	70.2	Confident	64.5	Low	18 Å²	18	56.5 Å²	56.5	11%	0.109	31%	0.309	C	S	.	.	H	α-helix	trans	-66.9	-41.7	174.9	169.5	0	0	0	0	111.8	V442 P443 S448 L449 S450 L466 L481	V442-V446 HydrophobicContact CG1-CG2 4.11Å; V442-V446 WeakPolarHBondContact O-CB 3.44Å; V442-V446 VanDerWaalsContact O-CG2 3.24Å; V442-V446 WeakPolarHBondContact O-CG2 3.45Å; V442-V446 PolarHBondContact O-N 3.16Å; P443-V446 PolarHBondContact O-N 2.98Å; V446-S448 VanDerWaalsContact C-N 3.25Å; V446-S448 PolarHBondContact O-N 2.84Å; V446-L449 VanDerWaalsContact O-CB 3.28Å; V446-L449 WeakPolarHBondContact O-CB 3.31Å; V446-L449 PolarHBondContact O-N 3.28Å; V446-L449 VanDerWaalsContact O-N 3.1Å; V446-S450 PolarHBondContact O-N 2.97Å; V446-S450 VanDerWaalsContact O-N 3.09Å; V446-S450 PolarHBondContact O-OG 3.43Å; V446-S450 VanDerWaalsContact O-OG 3.13Å; V446-L466 HydrophobicContact CG2-CD1 4.44Å; V446-L481 HydrophobicContact CG1-CD1 4.03Å; V446-L481 HydrophobicContact CG1-CD2 3.54Å; V446-L481 HydrophobicContact CG1-CG 4.44Å; V446-L481 HydrophobicContact CG2-CD2 4.5Å
447	N	66.4	Low	65	Low	102 Å²	102	56.6 Å²	56.6	55%	0.545	30%	0.303	S	S	.	.	H	α-helix	trans	-64.2	-35.9	173.3	-72.5	-21.8	0	0	0	111	P443 L449 S450 N451	P443-N447 WeakPolarHBondContact O-CB 3.38Å; P443-N447 PolarHBondContact O-N 3.41Å; P443-N447 PolarHBondContact O-ND2 3.17Å; P443-N447 VanDerWaalsContact O-ND2 3.12Å; N447-L449 VanDerWaalsContact C-N 3.31Å; N447-S450 PolarHBondContact O-N 3.21Å; N447-N451 PolarHBondContact O-ND2 2.9Å
448	S	61.2	Low	65.6	Low	7 Å²	7	56.5 Å²	56.5	5%	0.049	30%	0.303	C	S	.	.	H	α-helix	trans	-65.8	-35.5	173.3	-62.9	0	0	0	0	111.6	V410 Q444 L445 V446 S450 N451 N454	V410-S448 VanDerWaalsContact CG1-OG 3.26Å; V410-S448 WeakPolarHBondContact CG1-OG 3.38Å; Q444-S448 VanDerWaalsContact O-CB 3.32Å; Q444-S448 WeakPolarHBondContact O-CB 3.22Å; Q444-S448 PolarHBondContact O-N 3.42Å; Q444-S448 PolarHBondContact O-OG 3.12Å; L445-S448 CarbonylContact O-C 3.51Å; L445-S448 WeakPolarHBondContact O-CB 3.26Å; L445-S448 PolarHBondContact O-N 3.49Å; V446-S448 VanDerWaalsContact C-N 3.25Å; V446-S448 PolarHBondContact O-N 2.84Å; S448-S450 VanDerWaalsContact C-N 3.35Å; S448-N451 PolarHBondContact O-N 3.18Å; S448-N454 PolarHBondContact O-ND2 3.44Å
449	L	62.3	Low	66.1	Low	5 Å²	5	54 Å²	54	3%	0.026	29%	0.291	C	S	.	.	H	α-helix	trans	-64.4	-37.8	175.1	-170.6	64.6	0	0	0	112.4	L445 V446 N447 N451 I462 L482 F485	L445-L449 PolarHBondContact O-N 3.46Å; V446-L449 VanDerWaalsContact O-CB 3.28Å; V446-L449 WeakPolarHBondContact O-CB 3.31Å; V446-L449 PolarHBondContact O-N 3.28Å; V446-L449 VanDerWaalsContact O-N 3.1Å; N447-L449 VanDerWaalsContact C-N 3.31Å; L449-N451 PolarHBondContact O-N 2.82Å; L449-I462 HydrophobicContact CB-CG2 4.37Å; L449-I462 HydrophobicContact CD1-CG2 4.42Å; L449-L482 HydrophobicContact CD2-CD2 4.09Å; L449-F485 HydrophobicContact CD1-CD1 3.84Å; L449-F485 HydrophobicContact CD1-CD2 3.89Å; L449-F485 HydrophobicContact CD1-CE1 3.66Å; L449-F485 HydrophobicContact CD1-CE2 3.72Å; L449-F485 HydrophobicContact CD1-CG 3.95Å; L449-F485 HydrophobicContact CD1-CZ 3.61Å; L449-F485 HydrophobicContact CD2-CB 3.93Å; L449-F485 HydrophobicContact CD2-CD1 4.29Å; L449-F485 HydrophobicContact CD2-CD2 3.98Å; L449-F485 HydrophobicContact CD2-CG 3.79Å; L449-F485 HydrophobicContact CG-CD1 4.28Å; L449-F485 HydrophobicContact CG-CD2 3.62Å; L449-F485 HydrophobicContact CG-CE1 4.45Å; L449-F485 HydrophobicContact CG-CE2 3.82Å; L449-F485 HydrophobicContact CG-CG 3.87Å; L449-F485 HydrophobicContact CG-CZ 4.24Å
450	S	59.8	Low	66.7	Low	81 Å²	81	47 Å²	47	57%	0.566	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-6.2	-176.5	-57.7	0	0	0	0	114.4	V446 N447 S448 P452	V446-S450 PolarHBondContact O-N 2.97Å; V446-S450 VanDerWaalsContact O-N 3.09Å; V446-S450 PolarHBondContact O-OG 3.43Å; V446-S450 VanDerWaalsContact O-OG 3.13Å; N447-S450 PolarHBondContact O-N 3.21Å; S448-S450 VanDerWaalsContact C-N 3.35Å; S450-P452 WeakPolarHBondContact O-CD 3.14Å
451	N	61	Low	67.4	Low	85 Å²	85	44.8 Å²	44.8	46%	0.455	25%	0.246	S	C	.	.			trans	-80.5	117	-179.6	-77.7	-44.8	0	0	0	111.5	N447 S448 L449 K453 N454	N447-N451 PolarHBondContact O-ND2 2.9Å; S448-N451 PolarHBondContact O-N 3.18Å; L449-N451 PolarHBondContact O-N 2.82Å; N451-K453 PolarHBondContact O-N 3.28Å; N451-N454 PolarHBondContact O-N 3.08Å; N451-N454 PolarHBondContact O-ND2 3Å
452	P	51.9	Low	67.9	Low	131 Å²	131	44.8 Å²	44.8	85%	0.851	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.8	6.1	-173.8	29.8	-36.6	0	0	0	114.7	S450	S450-P452 WeakPolarHBondContact O-CD 3.14Å
453	K	56	Low	68.4	Low	189 Å²	189	44.3 Å²	44.3	82%	0.822	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.4	7.3	179.6	-66.5	-175.8	-179.9	177.6	0	113.3	N451	N451-K453 PolarHBondContact O-N 3.28Å
454	N	59.4	Low	69.1	Low	24 Å²	24	41.6 Å²	41.6	13%	0.128	23%	0.225	C	C	.	.			trans	-92.1	135.9	-172.5	-69.6	-19.2	0	0	0	112.3	R418 S448 N451 I458	R418-N454 PolarHBondContact NH1-OD1 3.19Å; S448-N454 PolarHBondContact O-ND2 3.44Å; N451-N454 PolarHBondContact O-N 3.08Å; N451-N454 PolarHBondContact O-ND2 3Å; N454-I458 HydrophobicContact CB-CB 4.28Å; N454-I458 HydrophobicContact CB-CD1 4.27Å; N454-I458 HydrophobicContact CB-CG2 4.35Å
455	N	68.3	Low	69.9	Low	78 Å²	78	38.9 Å²	38.9	42%	0.417	21%	0.212	S	C	.	.			trans	-65.6	150.6	167.9	-71.8	-5.6	0	0	0	110.6	N415 E457 I458 S459	N415-N455 PolarHBondContact ND2-ND2 3.21Å; N455-E457 PolarHBondContact O-N 3.5Å; N455-I458 HydrophobicContact CB-CD1 4.47Å; N455-I458 WeakPolarHBondContact O-CB 3.26Å; N455-I458 PolarHBondContact O-N 3.23Å; N455-S459 PolarHBondContact O-N 3.23Å
456	N	68.7	Low	70.6	Confident	32 Å²	32	38.8 Å²	38.8	17%	0.171	21%	0.212	C	C	.	.	H	α-helix	trans	-51	-30.5	173.1	-75.2	-21	0	0	0	113.6	G460 K489 D496	N456-G460 PolarHBondContact O-N 2.96Å; N456-G460 VanDerWaalsContact O-N 3.09Å; N456-K489 PolarHBondContact OD1-NZ 3.18Å; N456-D496 PolarHBondContact ND2-OD2 2.79Å
457	E	71.2	Confident	71.1	Confident	57 Å²	57	37.9 Å²	37.9	27%	0.266	21%	0.206	S	C	.	.	H	α-helix	trans	-58.8	-43	173.3	-71.6	174.6	-178.5	0	0	113.1	I419 N455 I461 N498	I419-E457 HydrophobicContact CD1-CB 4.22Å; N455-E457 PolarHBondContact O-N 3.5Å; E457-I461 WeakPolarHBondContact O-CD1 3.27Å; E457-I461 VanDerWaalsContact O-CG1 3.31Å; E457-I461 WeakPolarHBondContact O-CG1 3.25Å; E457-I461 PolarHBondContact O-N 2.73Å; E457-N498 WeakPolarHBondContact CG-ND2 3.38Å
458	I	78.7	Confident	71.9	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-68.9	-45.7	-178.2	-63.6	167.2	0	0	0	109.4	N415 R418 I419 N454 N455 G460 I461 I462	N415-I458 HydrophobicContact CB-CD1 4.05Å; R418-I458 HydrophobicContact CG-CG2 4.05Å; I419-I458 HydrophobicContact CD1-CG1 4.17Å; I419-I458 HydrophobicContact CG1-CG1 3.82Å; N454-I458 HydrophobicContact CB-CB 4.28Å; N454-I458 HydrophobicContact CB-CD1 4.27Å; N454-I458 HydrophobicContact CB-CG2 4.35Å; N455-I458 HydrophobicContact CB-CD1 4.47Å; N455-I458 WeakPolarHBondContact O-CB 3.26Å; N455-I458 PolarHBondContact O-N 3.23Å; I458-G460 VanDerWaalsContact C-N 3.32Å; I458-G460 PolarHBondContact O-N 3.35Å; I458-I461 PolarHBondContact O-N 3.19Å; I458-I462 HydrophobicContact CG2-CD1 3.58Å; I458-I462 HydrophobicContact CG2-CG1 4.18Å; I458-I462 WeakPolarHBondContact O-CB 3.36Å; I458-I462 VanDerWaalsContact O-CG1 3.27Å; I458-I462 WeakPolarHBondContact O-CG1 3.43Å; I458-I462 PolarHBondContact O-N 2.99Å
459	S	75.9	Confident	72.8	Confident	4 Å²	4	32.8 Å²	32.8	3%	0.028	18%	0.178	C	C	.	.	H	α-helix	trans	-62.5	-39.7	179.7	-53.1	0	0	0	0	112.3	N455 I461 G463 F485	N455-S459 PolarHBondContact O-N 3.23Å; S459-I461 VanDerWaalsContact C-N 3.33Å; S459-I461 PolarHBondContact O-N 3.22Å; S459-G463 PolarHBondContact O-N 2.69Å; S459-F485 WeakPolarHBondContact OG-CZ 3.12Å
460	G	76.6	Confident	73.5	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.01	18%	0.177	C	C	.	.	H	α-helix	trans	-60.4	-41.9	175.4	0	0	0	0	0	112.9	N456 I458 G463 L464 N498	N456-G460 PolarHBondContact O-N 2.96Å; N456-G460 VanDerWaalsContact O-N 3.09Å; I458-G460 VanDerWaalsContact C-N 3.32Å; I458-G460 PolarHBondContact O-N 3.35Å; G460-G463 PolarHBondContact O-N 3.35Å; G460-L464 WeakPolarHBondContact O-CB 2.89Å; G460-L464 PolarHBondContact O-N 3.03Å; G460-L464 VanDerWaalsContact O-N 3.1Å; G460-N498 WeakPolarHBondContact CA-O 3Å
461	I	82	Confident	74.4	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-78.2	-35	-177.5	-65.2	168.7	0	0	0	111.6	I419 L423 E457 I458 S459 G463 L464 A465 Y762	I419-I461 HydrophobicContact CB-CD1 4.24Å; I419-I461 HydrophobicContact CD1-CD1 4.5Å; I419-I461 HydrophobicContact CG1-CD1 4.08Å; I419-I461 HydrophobicContact CG2-CD1 3.37Å; L423-I461 HydrophobicContact CB-CG2 3.93Å; E457-I461 WeakPolarHBondContact O-CD1 3.27Å; E457-I461 VanDerWaalsContact O-CG1 3.31Å; E457-I461 WeakPolarHBondContact O-CG1 3.25Å; E457-I461 PolarHBondContact O-N 2.73Å; I458-I461 PolarHBondContact O-N 3.19Å; S459-I461 VanDerWaalsContact C-N 3.33Å; S459-I461 PolarHBondContact O-N 3.22Å; I461-G463 VanDerWaalsContact C-N 3.33Å; I461-L464 PolarHBondContact O-N 3.35Å; I461-A465 WeakPolarHBondContact O-CB 3.4Å; I461-A465 PolarHBondContact O-N 3.39Å; I461-Y762 HydrophobicContact CD1-CE2 3.95Å; I461-Y762 WeakPolarHBondContact CD1-OH 3.21Å
462	I	81.5	Confident	75	Confident	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-60.4	-45.3	170.5	-70.7	171.3	0	0	0	110.1	T422 L445 L449 I458 L464 A465 L466	T422-I462 HydrophobicContact CG2-CG1 3.95Å; L445-I462 HydrophobicContact CB-CG2 4.27Å; L449-I462 HydrophobicContact CB-CG2 4.37Å; L449-I462 HydrophobicContact CD1-CG2 4.42Å; I458-I462 HydrophobicContact CG2-CD1 3.58Å; I458-I462 HydrophobicContact CG2-CG1 4.18Å; I458-I462 WeakPolarHBondContact O-CB 3.36Å; I458-I462 VanDerWaalsContact O-CG1 3.27Å; I458-I462 WeakPolarHBondContact O-CG1 3.43Å; I458-I462 PolarHBondContact O-N 2.99Å; I462-L464 VanDerWaalsContact C-N 3.34Å; I462-L464 PolarHBondContact O-N 2.85Å; I462-A465 PolarHBondContact O-N 3.38Å; I462-L466 HydrophobicContact CG2-CD1 4.05Å; I462-L466 WeakPolarHBondContact O-CB 3.49Å; I462-L466 WeakPolarHBondContact O-CG 3.31Å; I462-L466 PolarHBondContact O-N 3.17Å
463	G	81.9	Confident	76	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-57.9	-45.3	175.6	0	0	0	0	0	113.1	S459 G460 I461 L466 G467 L502 G505	S459-G463 PolarHBondContact O-N 2.69Å; G460-G463 PolarHBondContact O-N 3.35Å; I461-G463 VanDerWaalsContact C-N 3.33Å; G463-L466 PolarHBondContact O-N 3.01Å; G463-G467 PolarHBondContact O-N 3.39Å; G463-L502 VanDerWaalsContact CA-CD1 3.46Å; G463-G505 WeakPolarHBondContact O-CA 3.15Å
464	L	83.4	Confident	76.5	Confident	0 Å²	0	11 Å²	11	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-67.8	-38.8	177.6	173	151	0	0	0	112.7	L423 G460 I461 I462 G467 F468 L501 L504 T744	L423-L464 HydrophobicContact CD1-CD2 3.43Å; L423-L464 VanDerWaalsContact CD1-CD2 3.43Å; G460-L464 WeakPolarHBondContact O-CB 2.89Å; G460-L464 PolarHBondContact O-N 3.03Å; G460-L464 VanDerWaalsContact O-N 3.1Å; I461-L464 PolarHBondContact O-N 3.35Å; I462-L464 VanDerWaalsContact C-N 3.34Å; I462-L464 PolarHBondContact O-N 2.85Å; L464-G467 WeakPolarHBondContact O-CA 3.37Å; L464-G467 PolarHBondContact O-N 3.09Å; L464-F468 HydrophobicContact CD1-CE2 4.5Å; L464-F468 HydrophobicContact CD2-CD2 3.67Å; L464-F468 HydrophobicContact CD2-CE2 3.51Å; L464-F468 HydrophobicContact CG-CD2 4.07Å; L464-F468 HydrophobicContact CG-CE2 3.81Å; L464-F468 VanDerWaalsContact O-CD2 3.28Å; L464-F468 WeakPolarHBondContact O-CD2 3.3Å; L464-F468 PolarHBondContact O-N 3.1Å; L464-L501 HydrophobicContact CD1-CB 4.27Å; L464-L501 HydrophobicContact CD1-CD2 3.95Å; L464-L504 HydrophobicContact CD1-CD2 4.29Å; L464-T744 HydrophobicContact CD1-CG2 3.63Å; L464-T744 HydrophobicContact CG-CG2 4.44Å
465	A	83.5	Confident	77.2	Confident	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-64.7	-42.9	175.2	0	0	0	0	0	111.8	T422 I461 I462 G467 F468 I469	T422-A465 VanDerWaalsContact O-CB 3.24Å; T422-A465 WeakPolarHBondContact O-CB 3.46Å; I461-A465 WeakPolarHBondContact O-CB 3.4Å; I461-A465 PolarHBondContact O-N 3.39Å; I462-A465 PolarHBondContact O-N 3.38Å; A465-G467 VanDerWaalsContact C-N 3.29Å; A465-G467 PolarHBondContact O-N 3.25Å; A465-F468 PolarHBondContact O-N 3.14Å; A465-I469 WeakPolarHBondContact O-CG1 3.41Å; A465-I469 PolarHBondContact O-N 3.45Å; A465-I469 VanDerWaalsContact O-N 3.07Å
466	L	82.2	Confident	77.5	Confident	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-60.4	-41.5	171.6	-74.6	170.1	0	0	0	111.2	V442 L445 V446 I462 G463 F468 I469 L470 L482	V442-L466 HydrophobicContact CB-CD2 4.36Å; V442-L466 HydrophobicContact CG1-CD2 4.06Å; V442-L466 HydrophobicContact CG2-CD2 4.25Å; L445-L466 HydrophobicContact CB-CD1 4.42Å; L445-L466 HydrophobicContact CB-CD2 3.86Å; L445-L466 HydrophobicContact CB-CG 4.14Å; L445-L466 HydrophobicContact CD1-CD2 3.73Å; L445-L466 HydrophobicContact CD1-CG 4.04Å; L445-L466 HydrophobicContact CG-CD2 4.46Å; V446-L466 HydrophobicContact CG2-CD1 4.44Å; I462-L466 HydrophobicContact CG2-CD1 4.05Å; I462-L466 WeakPolarHBondContact O-CB 3.49Å; I462-L466 WeakPolarHBondContact O-CG 3.31Å; I462-L466 PolarHBondContact O-N 3.17Å; G463-L466 PolarHBondContact O-N 3.01Å; L466-F468 VanDerWaalsContact C-N 3.34Å; L466-F468 PolarHBondContact O-N 2.68Å; L466-I469 PolarHBondContact O-N 3.21Å; L466-L470 WeakPolarHBondContact O-CB 3.39Å; L466-L470 PolarHBondContact O-N 3.15Å; L466-L470 VanDerWaalsContact O-N 3.1Å; L466-L482 HydrophobicContact CD1-CD2 3.9Å
467	G	81.3	Confident	78	Confident	0 Å²	0	15.3 Å²	15.3	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-57.7	-42.1	173.7	0	0	0	0	0	113.3	G463 L464 A465 V471 G505	G463-G467 PolarHBondContact O-N 3.39Å; L464-G467 WeakPolarHBondContact O-CA 3.37Å; L464-G467 PolarHBondContact O-N 3.09Å; A465-G467 VanDerWaalsContact C-N 3.29Å; A465-G467 PolarHBondContact O-N 3.25Å; G467-V471 WeakPolarHBondContact O-CG2 3.44Å; G467-V471 PolarHBondContact O-N 2.73Å; G467-G505 WeakPolarHBondContact CA-O 3.47Å
468	F	82.7	Confident	78.3	Confident	0 Å²	0	13.6 Å²	13.6	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-70.3	-38	177.8	-83.6	-63.5	0	0	0	114	G426 L427 A430 N431 L464 A465 L466 V471 A740 T744	G426-F468 VanDerWaalsContact O-CB 3.31Å; G426-F468 WeakPolarHBondContact O-CB 3.28Å; L427-F468 HydrophobicContact CD2-CD2 4.47Å; L427-F468 HydrophobicContact CD2-CE2 4.37Å; A430-F468 VanDerWaalsContact CA-O 3.28Å; A430-F468 WeakPolarHBondContact CA-O 3.08Å; N431-F468 PolarHBondContact N-O 3.05Å; L464-F468 HydrophobicContact CD1-CE2 4.5Å; L464-F468 HydrophobicContact CD2-CD2 3.67Å; L464-F468 HydrophobicContact CD2-CE2 3.51Å; L464-F468 HydrophobicContact CG-CD2 4.07Å; L464-F468 HydrophobicContact CG-CE2 3.81Å; L464-F468 VanDerWaalsContact O-CD2 3.28Å; L464-F468 WeakPolarHBondContact O-CD2 3.3Å; L464-F468 PolarHBondContact O-N 3.1Å; A465-F468 PolarHBondContact O-N 3.14Å; L466-F468 VanDerWaalsContact C-N 3.34Å; L466-F468 PolarHBondContact O-N 2.68Å; F468-V471 WeakPolarHBondContact O-CG2 3.14Å; F468-A740 HydrophobicContact CD1-CB 4.17Å; F468-A740 HydrophobicContact CE1-CB 3.92Å; F468-T744 HydrophobicContact CE2-CG2 4.14Å; F468-T744 HydrophobicContact CZ-CG2 3.97Å; F468-T744 WeakPolarHBondContact CZ-OG1 3.46Å
469	I	81.3	Confident	78.1	Confident	1 Å²	1	13.6 Å²	13.6	1%	0.005	8%	0.084	C	C	.	.	H	α-helix	trans	-66.3	-43.4	178.6	-64.8	165.9	0	0	0	110	V437 I441 L445 A465 L466	V437-I469 HydrophobicContact CG1-CG2 4.02Å; I441-I469 HydrophobicContact CG2-CD1 3.75Å; L445-I469 HydrophobicContact CD1-CD1 3.77Å; A465-I469 WeakPolarHBondContact O-CG1 3.41Å; A465-I469 PolarHBondContact O-N 3.45Å; A465-I469 VanDerWaalsContact O-N 3.07Å; L466-I469 PolarHBondContact O-N 3.21Å
470	L	77.2	Confident	78.4	Confident	0 Å²	0	16 Å²	16	0%	0	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	19.8	-168.1	-67.5	157.5	0	0	0	113.9	E438 V442 L466 S472 S473 I478 I509	E438-L470 HydrophobicContact CG-CD2 4.22Å; E438-L470 WeakPolarHBondContact OE1-CD2 3.44Å; V442-L470 HydrophobicContact CG2-CD1 4.23Å; L466-L470 WeakPolarHBondContact O-CB 3.39Å; L466-L470 PolarHBondContact O-N 3.15Å; L466-L470 VanDerWaalsContact O-N 3.1Å; L470-S472 PolarHBondContact O-N 3.34Å; L470-S472 VanDerWaalsContact O-N 3.14Å; L470-S473 WeakPolarHBondContact CB-OG 3.44Å; L470-S473 WeakPolarHBondContact O-CB 3.15Å; L470-S473 PolarHBondContact O-N 3.13Å; L470-S473 VanDerWaalsContact O-N 3.07Å; L470-S473 PolarHBondContact O-OG 3.49Å; L470-I478 HydrophobicContact CD1-CB 4.18Å; L470-I478 HydrophobicContact CD1-CD1 3.28Å; L470-I478 HydrophobicContact CD1-CG1 4.26Å; L470-I478 HydrophobicContact CD1-CG2 3.77Å; L470-I478 HydrophobicContact CD2-CD1 3.96Å; L470-I478 HydrophobicContact CG-CD1 4.25Å; L470-I509 HydrophobicContact CB-CG1 4.14Å
471	V	77.3	Confident	78.5	Confident	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	125.2	-179.7	179.6	0	0	0	0	109.6	N431 G467 F468 S473 L511 P736 A740	N431-V471 PolarHBondContact OD1-O 2.95Å; G467-V471 WeakPolarHBondContact O-CG2 3.44Å; G467-V471 PolarHBondContact O-N 2.73Å; F468-V471 WeakPolarHBondContact O-CG2 3.14Å; V471-S473 PolarHBondContact O-N 3.46Å; V471-S473 VanDerWaalsContact O-N 3.09Å; V471-L511 HydrophobicContact CG1-CB 4.21Å; V471-L511 HydrophobicContact CG1-CD2 3.71Å; V471-P736 HydrophobicContact CG1-CB 3.67Å; V471-P736 HydrophobicContact CG1-CG 4.39Å; V471-A740 HydrophobicContact CG1-CB 4.33Å; V471-A740 HydrophobicContact CG2-CB 3.85Å
472	S	74.1	Confident	78.2	Confident	6 Å²	6	19 Å²	19	4%	0.042	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	14.5	176.1	-52	0	0	0	0	116.1	N244 L470 I509 L511 R513 P736	N244-S472 WeakPolarHBondContact ND2-CB 3.26Å; N244-S472 PolarHBondContact ND2-O 2.88Å; L470-S472 PolarHBondContact O-N 3.34Å; L470-S472 VanDerWaalsContact O-N 3.14Å; S472-I509 PolarHBondContact N-O 2.63Å; S472-L511 VanDerWaalsContact CB-O 3.29Å; S472-L511 WeakPolarHBondContact CB-O 3.47Å; S472-L511 PolarHBondContact OG-O 3.26Å; S472-R513 PolarHBondContact O-NE 3.44Å; S472-P736 VanDerWaalsContact OG-CB 3.32Å; S472-P736 WeakPolarHBondContact OG-CB 3.37Å
473	S	72.8	Confident	78	Confident	14 Å²	14	21.7 Å²	21.7	10%	0.098	12%	0.124	C	C	.	.			trans	-79.9	-19.6	173.3	64.9	0	0	0	0	113.1	L470 V471 N475 R513	L470-S473 WeakPolarHBondContact CB-OG 3.44Å; L470-S473 WeakPolarHBondContact O-CB 3.15Å; L470-S473 PolarHBondContact O-N 3.13Å; L470-S473 VanDerWaalsContact O-N 3.07Å; L470-S473 PolarHBondContact O-OG 3.49Å; V471-S473 PolarHBondContact O-N 3.46Å; V471-S473 VanDerWaalsContact O-N 3.09Å; S473-N475 PolarHBondContact O-N 2.91Å; S473-R513 VanDerWaalsContact C-NH1 3.31Å; S473-R513 PolarHBondContact O-NH1 3.03Å
474	A	67.2	Low	77.9	Confident	13 Å²	13	26.4 Å²	26.4	11%	0.107	15%	0.146	C	C	.	.			trans	44.1	40.1	-171.4	0	0	0	0	0	114.5	N476 Y510 A516	A474-N476 PolarHBondContact O-N 2.93Å; A474-Y510 HydrophobicContact CB-CD1 4.42Å; A474-Y510 HydrophobicContact CB-CE1 4.11Å; A474-A516 HydrophobicContact CB-CB 3.88Å
475	N	73.2	Confident	77.5	Confident	53 Å²	53	28.2 Å²	28.2	28%	0.283	15%	0.154	S	C	.	.			trans	-70.4	94.1	174.4	-84.4	-22.5	0	0	0	110.9	S473 S477 I478 A479	S473-N475 PolarHBondContact O-N 2.91Å; N475-S477 PolarHBondContact O-N 3.46Å; N475-S477 VanDerWaalsContact O-N 3.16Å; N475-I478 HydrophobicContact CB-CD1 4.15Å; N475-I478 PolarHBondContact O-N 3.25Å; N475-I478 VanDerWaalsContact O-N 3.17Å; N475-A479 PolarHBondContact O-N 3.02Å
476	N	75.2	Confident	77	Confident	77 Å²	77	28.3 Å²	28.3	41%	0.412	15%	0.154	S	C	.	.	H	α-helix	trans	-56.1	-31.5	-179	-71.2	-20.5	0	0	0	113.5	A474 I478 T480 Y510	A474-N476 PolarHBondContact O-N 2.93Å; N476-I478 VanDerWaalsContact C-N 3.33Å; N476-I478 PolarHBondContact O-N 3.44Å; N476-T480 VanDerWaalsContact O-CB 3.31Å; N476-T480 WeakPolarHBondContact O-CB 3.33Å; N476-T480 PolarHBondContact O-N 3.44Å; N476-T480 PolarHBondContact O-OG1 3.23Å; N476-Y510 PolarHBondContact OD1-OH 3.2Å
477	S	78.5	Confident	76.8	Confident	96 Å²	96	32.7 Å²	32.7	67%	0.671	18%	0.178	S	C	*	.	H	α-helix	trans	-58.9	-44.7	179.1	-53.7	0	0	0	0	112	N475 L481	N475-S477 PolarHBondContact O-N 3.46Å; N475-S477 VanDerWaalsContact O-N 3.16Å; S477-L481 WeakPolarHBondContact O-CB 3.31Å; S477-L481 PolarHBondContact O-N 3.09Å; S477-L481 VanDerWaalsContact O-N 3.14Å
478	I	77.7	Confident	76.5	Confident	20 Å²	20	39.1 Å²	39.1	10%	0.103	21%	0.212	C	C	.	.	H	α-helix	trans	-78.8	-39.5	-174.5	-62.2	162.2	0	0	0	109.6	V442 L470 N475 N476 T480 L481 L482 I509	V442-I478 HydrophobicContact CB-CD1 4.45Å; V442-I478 HydrophobicContact CG1-CD1 3.5Å; V442-I478 HydrophobicContact CG1-CG1 3.86Å; V442-I478 HydrophobicContact CG2-CD1 4.24Å; L470-I478 HydrophobicContact CD1-CB 4.18Å; L470-I478 HydrophobicContact CD1-CD1 3.28Å; L470-I478 HydrophobicContact CD1-CG1 4.26Å; L470-I478 HydrophobicContact CD1-CG2 3.77Å; L470-I478 HydrophobicContact CD2-CD1 3.96Å; L470-I478 HydrophobicContact CG-CD1 4.25Å; N475-I478 HydrophobicContact CB-CD1 4.15Å; N475-I478 PolarHBondContact O-N 3.25Å; N475-I478 VanDerWaalsContact O-N 3.17Å; N476-I478 VanDerWaalsContact C-N 3.33Å; N476-I478 PolarHBondContact O-N 3.44Å; I478-T480 VanDerWaalsContact C-N 3.34Å; I478-T480 PolarHBondContact O-N 2.68Å; I478-L481 WeakPolarHBondContact O-CB 3.47Å; I478-L481 PolarHBondContact O-N 2.91Å; I478-L481 VanDerWaalsContact O-N 3.17Å; I478-L482 WeakPolarHBondContact O-CG 3.35Å; I478-L482 PolarHBondContact O-N 2.89Å; I478-I509 HydrophobicContact CG2-CD1 4.24Å
479	A	75.1	Confident	76	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-61.8	-40.7	173.5	0	0	0	0	0	112.6	N475 L481 L482 W483 Y510 I520	N475-A479 PolarHBondContact O-N 3.02Å; A479-L481 VanDerWaalsContact C-N 3.29Å; A479-L481 PolarHBondContact O-N 2.9Å; A479-L482 PolarHBondContact O-N 3.14Å; A479-W483 WeakPolarHBondContact O-CB 3.32Å; A479-W483 PolarHBondContact O-N 3.24Å; A479-Y510 HydrophobicContact CB-CE2 3.57Å; A479-Y510 VanDerWaalsContact CB-OH 3.25Å; A479-Y510 WeakPolarHBondContact CB-OH 3.23Å; A479-I520 HydrophobicContact CB-CD1 3.55Å
480	T	81.2	Confident	75	Confident	54 Å²	54	46.8 Å²	46.8	33%	0.331	25%	0.247	S	C	.	.	H	α-helix	trans	-63.2	-37.7	174.7	-55.1	0	0	0	0	111.2	N476 I478 W483 Q484	N476-T480 VanDerWaalsContact O-CB 3.31Å; N476-T480 WeakPolarHBondContact O-CB 3.33Å; N476-T480 PolarHBondContact O-N 3.44Å; N476-T480 PolarHBondContact O-OG1 3.23Å; I478-T480 VanDerWaalsContact C-N 3.34Å; I478-T480 PolarHBondContact O-N 2.68Å; T480-W483 HydrophobicContact CG2-CE3 4.11Å; T480-W483 HydrophobicContact CG2-CZ3 4.48Å; T480-W483 PolarHBondContact O-N 3.12Å; T480-Q484 WeakPolarHBondContact O-CB 3.46Å; T480-Q484 VanDerWaalsContact O-CG 3.3Å; T480-Q484 WeakPolarHBondContact O-CG 3.29Å; T480-Q484 PolarHBondContact O-N 3.43Å
481	L	79	Confident	74.2	Confident	63 Å²	63	53.6 Å²	53.6	33%	0.33	28%	0.279	S	S	.	.	H	α-helix	trans	-69.3	-40.2	178.3	-136.1	149.4	0	0	0	111.9	V446 S477 I478 A479 Q484 F485	V446-L481 HydrophobicContact CG1-CD1 4.03Å; V446-L481 HydrophobicContact CG1-CD2 3.54Å; V446-L481 HydrophobicContact CG1-CG 4.44Å; V446-L481 HydrophobicContact CG2-CD2 4.5Å; S477-L481 WeakPolarHBondContact O-CB 3.31Å; S477-L481 PolarHBondContact O-N 3.09Å; S477-L481 VanDerWaalsContact O-N 3.14Å; I478-L481 WeakPolarHBondContact O-CB 3.47Å; I478-L481 PolarHBondContact O-N 2.91Å; I478-L481 VanDerWaalsContact O-N 3.17Å; A479-L481 VanDerWaalsContact C-N 3.29Å; A479-L481 PolarHBondContact O-N 2.9Å; L481-Q484 PolarHBondContact O-N 2.9Å; L481-F485 PolarHBondContact O-N 3.12Å
482	L	76	Confident	73.3	Confident	2 Å²	2	57.3 Å²	57.3	1%	0.01	31%	0.305	C	S	.	.	H	α-helix	trans	-65.5	-39.2	171.9	-66.7	-178.5	0	0	0	111.8	L449 L466 I478 A479 F485 L486 L502 I506 I509	L449-L482 HydrophobicContact CD2-CD2 4.09Å; L466-L482 HydrophobicContact CD1-CD2 3.9Å; I478-L482 WeakPolarHBondContact O-CG 3.35Å; I478-L482 PolarHBondContact O-N 2.89Å; A479-L482 PolarHBondContact O-N 3.14Å; L482-F485 PolarHBondContact O-N 3Å; L482-L486 WeakPolarHBondContact O-CG 3.49Å; L482-L486 PolarHBondContact O-N 3.14Å; L482-L502 HydrophobicContact CD2-CD1 3.81Å; L482-I506 HydrophobicContact CB-CD1 3.86Å; L482-I506 HydrophobicContact CB-CG1 3.7Å; L482-I506 HydrophobicContact CD1-CG1 3.78Å; L482-I506 HydrophobicContact CG-CG1 4.41Å; L482-I509 HydrophobicContact CD1-CD1 3.86Å
483	W	77.4	Confident	72.6	Confident	56 Å²	56	60.2 Å²	60.2	21%	0.212	32%	0.318	C	S	.	.	H	α-helix	trans	-64.6	-43.5	174.2	169.3	75	0	0	0	112.2	A479 T480 F485 L486 L487 S523	A479-W483 WeakPolarHBondContact O-CB 3.32Å; A479-W483 PolarHBondContact O-N 3.24Å; T480-W483 HydrophobicContact CG2-CE3 4.11Å; T480-W483 HydrophobicContact CG2-CZ3 4.48Å; T480-W483 PolarHBondContact O-N 3.12Å; W483-F485 VanDerWaalsContact C-N 3.28Å; W483-F485 PolarHBondContact O-N 3Å; W483-L486 WeakPolarHBondContact O-CA 3.34Å; W483-L486 WeakPolarHBondContact O-CB 3.07Å; W483-L486 PolarHBondContact O-N 3.04Å; W483-L487 PolarHBondContact O-N 2.92Å; W483-S523 PolarHBondContact NE1-O 3.31Å
484	Q	79.2	Confident	71.9	Confident	99 Å²	99	60.1 Å²	60.1	46%	0.463	32%	0.316	S	S	.	.	H	α-helix	trans	-58.4	-42.8	173.3	-77.5	173.8	-9.7	0	0	111.2	T480 L481 L486 L487 D488	T480-Q484 WeakPolarHBondContact O-CB 3.46Å; T480-Q484 VanDerWaalsContact O-CG 3.3Å; T480-Q484 WeakPolarHBondContact O-CG 3.29Å; T480-Q484 PolarHBondContact O-N 3.43Å; L481-Q484 PolarHBondContact O-N 2.9Å; Q484-L486 VanDerWaalsContact C-N 3.27Å; Q484-L486 PolarHBondContact O-N 3.03Å; Q484-L487 WeakPolarHBondContact O-CB 3.15Å; Q484-L487 PolarHBondContact O-N 3.37Å; Q484-L487 VanDerWaalsContact O-N 3.08Å; Q484-D488 PolarHBondContact O-N 2.84Å
485	F	74.5	Confident	71.5	Confident	39 Å²	39	64.1 Å²	64.1	17%	0.171	33%	0.331	C	S	.	.	H	α-helix	trans	-65.2	-29.8	175.5	-175	-95.7	0	0	0	113.1	L449 S459 L481 L482 W483 K489 L502	L449-F485 HydrophobicContact CD1-CD1 3.84Å; L449-F485 HydrophobicContact CD1-CD2 3.89Å; L449-F485 HydrophobicContact CD1-CE1 3.66Å; L449-F485 HydrophobicContact CD1-CE2 3.72Å; L449-F485 HydrophobicContact CD1-CG 3.95Å; L449-F485 HydrophobicContact CD1-CZ 3.61Å; L449-F485 HydrophobicContact CD2-CB 3.93Å; L449-F485 HydrophobicContact CD2-CD1 4.29Å; L449-F485 HydrophobicContact CD2-CD2 3.98Å; L449-F485 HydrophobicContact CD2-CG 3.79Å; L449-F485 HydrophobicContact CG-CD1 4.28Å; L449-F485 HydrophobicContact CG-CD2 3.62Å; L449-F485 HydrophobicContact CG-CE1 4.45Å; L449-F485 HydrophobicContact CG-CE2 3.82Å; L449-F485 HydrophobicContact CG-CG 3.87Å; L449-F485 HydrophobicContact CG-CZ 4.24Å; S459-F485 WeakPolarHBondContact OG-CZ 3.12Å; L481-F485 PolarHBondContact O-N 3.12Å; L482-F485 PolarHBondContact O-N 3Å; W483-F485 VanDerWaalsContact C-N 3.28Å; W483-F485 PolarHBondContact O-N 3Å; F485-K489 HydrophobicContact CE1-CD 4.47Å; F485-K489 VanDerWaalsContact CZ-CE 3.46Å; F485-L502 HydrophobicContact CD1-CD2 3.6Å; F485-L502 HydrophobicContact CE1-CD2 3.97Å
486	L	74.5	Confident	71.1	Confident	1 Å²	1	64.5 Å²	64.5	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-71.1	-32.8	171.4	-75.5	172.1	0	0	0	112.5	L482 W483 Q484 D488 L499 L502 V503 I506 L524 F531	L482-L486 WeakPolarHBondContact O-CG 3.49Å; L482-L486 PolarHBondContact O-N 3.14Å; W483-L486 WeakPolarHBondContact O-CA 3.34Å; W483-L486 WeakPolarHBondContact O-CB 3.07Å; W483-L486 PolarHBondContact O-N 3.04Å; Q484-L486 VanDerWaalsContact C-N 3.27Å; Q484-L486 PolarHBondContact O-N 3.03Å; L486-D488 VanDerWaalsContact C-N 3.33Å; L486-L499 HydrophobicContact CD2-CD2 3.7Å; L486-L502 HydrophobicContact CD2-CD2 3.45Å; L486-L502 VanDerWaalsContact CD2-CD2 3.45Å; L486-L502 HydrophobicContact CD2-CG 4.14Å; L486-L502 HydrophobicContact CG-CD2 3.81Å; L486-L502 HydrophobicContact CG-CG 4.37Å; L486-V503 HydrophobicContact CD1-CG2 4.2Å; L486-V503 HydrophobicContact CD2-CG2 4.39Å; L486-I506 HydrophobicContact CD1-CD1 3.43Å; L486-I506 VanDerWaalsContact CD1-CD1 3.43Å; L486-L524 HydrophobicContact CD1-CD2 4.46Å; L486-F531 HydrophobicContact CD2-CE1 4.11Å; L486-F531 HydrophobicContact CD2-CZ 4.26Å
487	L	77.2	Confident	70.8	Confident	93 Å²	93	61.8 Å²	61.8	49%	0.487	32%	0.32	S	S	.	.	H	α-helix	trans	-67.4	-34.5	179	-167	76.2	0	0	0	112.2	W483 Q484 K489 L527	W483-L487 PolarHBondContact O-N 2.92Å; Q484-L487 WeakPolarHBondContact O-CB 3.15Å; Q484-L487 PolarHBondContact O-N 3.37Å; Q484-L487 VanDerWaalsContact O-N 3.08Å; L487-K489 PolarHBondContact O-N 3.41Å; L487-L527 HydrophobicContact CD1-CD2 4.48Å
488	D	76.1	Confident	70.3	Confident	134 Å²	134	57.8 Å²	57.8	72%	0.717	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-8.4	-177.6	-72.6	-20.2	0	0	0	114	Q484 L486	Q484-D488 PolarHBondContact O-N 2.84Å; L486-D488 VanDerWaalsContact C-N 3.33Å
489	K	71.3	Confident	70	Confident	26 Å²	26	56.9 Å²	56.9	11%	0.113	29%	0.287	C	S	.	.	S	Bend	trans	-92.7	143.5	-175.9	-65	-150.1	-175.9	-162.5	0	114.5	N456 F485 L487 L499	N456-K489 PolarHBondContact OD1-NZ 3.18Å; F485-K489 HydrophobicContact CE1-CD 4.47Å; F485-K489 VanDerWaalsContact CZ-CE 3.46Å; L487-K489 PolarHBondContact O-N 3.41Å; K489-L499 HydrophobicContact CD-CD1 3.64Å; K489-L499 HydrophobicContact CD-CD2 3.52Å; K489-L499 HydrophobicContact CD-CG 4.08Å
490	E	60.9	Low	69.9	Low	137 Å²	137	57.3 Å²	57.3	64%	0.64	29%	0.288	S	S	*	.			trans	-75.7	150.7	179.3	-61.4	-175	174.8	0	0	112.9	S492 E493 L494	E490-S492 PolarHBondContact O-N 3.2Å; E490-E493 PolarHBondContact O-N 2.99Å; E490-L494 PolarHBondContact O-N 3.01Å
491	E	60.3	Low	69.7	Low	142 Å²	142	54.8 Å²	54.8	66%	0.664	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-26.1	-177.5	-66.2	-174.7	166.4	0	0	114.6	P528	E491-P528 HydrophobicContact CG-CG 4.32Å
492	S	57.7	Low	69.7	Low	78 Å²	78	51.8 Å²	51.8	55%	0.545	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-36.2	175.4	43.6	0	0	0	0	112.9	E490 L494 K495	E490-S492 PolarHBondContact O-N 3.2Å; S492-L494 VanDerWaalsContact C-N 3.33Å; S492-K495 PolarHBondContact O-N 3.14Å
493	E	59.2	Low	70	Confident	67 Å²	67	51.7 Å²	51.7	31%	0.313	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-73.8	-29.2	178.6	-59	-167.2	156.6	0	0	110.9	E490 K495 D496 L499	E490-E493 PolarHBondContact O-N 2.99Å; E493-K495 PolarHBondContact O-N 2.85Å; E493-D496 WeakPolarHBondContact O-CB 3.06Å; E493-D496 PolarHBondContact O-N 2.89Å; E493-L499 VanDerWaalsContact C-CD1 3.5Å; E493-L499 HydrophobicContact CB-CD1 3.96Å; E493-L499 WeakPolarHBondContact O-CD1 3.46Å
494	L	59.1	Low	70.2	Confident	12 Å²	12	49 Å²	49	6%	0.063	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-58.9	-17.5	176.4	-63.3	-179.5	0	0	0	113.9	E490 S492 D496 P528 F531	E490-L494 PolarHBondContact O-N 3.01Å; S492-L494 VanDerWaalsContact C-N 3.33Å; L494-D496 VanDerWaalsContact C-N 3.32Å; L494-P528 HydrophobicContact CD1-CG 4.13Å; L494-F531 HydrophobicContact CB-CD2 4.27Å; L494-F531 HydrophobicContact CB-CG 4.5Å; L494-F531 HydrophobicContact CD1-CB 4.31Å; L494-F531 HydrophobicContact CD1-CG 4.36Å; L494-F531 HydrophobicContact CD2-CD1 4.11Å; L494-F531 HydrophobicContact CD2-CE1 4.01Å; L494-F531 HydrophobicContact CD2-CE2 4.41Å; L494-F531 HydrophobicContact CD2-CG 4.34Å; L494-F531 HydrophobicContact CD2-CZ 4.14Å
495	K	57.6	Low	70.2	Confident	97 Å²	97	44.3 Å²	44.3	42%	0.422	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-78.7	-15.3	175.4	-64	-170.9	-179.1	-170.1	0	113.3	S492 E493 R500 F589	S492-K495 PolarHBondContact O-N 3.14Å; E493-K495 PolarHBondContact O-N 2.85Å; K495-R500 PolarHBondContact O-NH2 3.14Å; K495-F589 HydrophobicContact CB-CB 4.39Å; K495-F589 HydrophobicContact CD-CB 4.49Å
496	D	66.4	Low	70.6	Confident	61 Å²	61	42.5 Å²	42.5	33%	0.326	22%	0.216	S	C	.	.	S	Bend	trans	-71.4	136	-177.2	-74.7	-25.7	0	0	0	111.6	N456 E493 L494 N498 L499	N456-D496 PolarHBondContact ND2-OD2 2.79Å; E493-D496 WeakPolarHBondContact O-CB 3.06Å; E493-D496 PolarHBondContact O-N 2.89Å; L494-D496 VanDerWaalsContact C-N 3.32Å; D496-N498 PolarHBondContact O-N 3.13Å; D496-N498 VanDerWaalsContact O-N 3.13Å; D496-L499 PolarHBondContact O-N 3.46Å; D496-L499 VanDerWaalsContact O-N 3.17Å
497	P	67.5	Low	71	Confident	20 Å²	20	42.5 Å²	42.5	13%	0.13	22%	0.216	C	C	.	.	H	α-helix	trans	-60.9	-26.7	-179.7	25.4	-34.9	0	0	0	112.9	L499 R500	P497-L499 VanDerWaalsContact C-N 3.34Å; P497-L499 PolarHBondContact O-N 3.03Å; P497-R500 VanDerWaalsContact O-CB 3.26Å; P497-R500 WeakPolarHBondContact O-CB 3.35Å; P497-R500 PolarHBondContact O-N 3.3Å
498	N	68.6	Low	71.3	Confident	13 Å²	13	38 Å²	38	7%	0.07	19%	0.193	C	C	.	.	H	α-helix	trans	-70	-30.8	-179.1	-59.1	-53	0	0	0	112.9	E457 G460 D496 R500 L501 L502 Q760	E457-N498 WeakPolarHBondContact CG-ND2 3.38Å; G460-N498 WeakPolarHBondContact CA-O 3Å; D496-N498 PolarHBondContact O-N 3.13Å; D496-N498 VanDerWaalsContact O-N 3.13Å; N498-R500 PolarHBondContact O-N 3.4Å; N498-L501 WeakPolarHBondContact O-CB 3.37Å; N498-L501 PolarHBondContact O-N 2.85Å; N498-L502 PolarHBondContact O-N 2.97Å; N498-Q760 PolarHBondContact OD1-NE2 3.07Å
499	L	70.9	Confident	71.6	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-69.9	-24.5	174.6	-94.8	146.5	0	0	0	112	L486 K489 E493 D496 P497 L501 L502 V503	L486-L499 HydrophobicContact CD2-CD2 3.7Å; K489-L499 HydrophobicContact CD-CD1 3.64Å; K489-L499 HydrophobicContact CD-CD2 3.52Å; K489-L499 HydrophobicContact CD-CG 4.08Å; E493-L499 VanDerWaalsContact C-CD1 3.5Å; E493-L499 HydrophobicContact CB-CD1 3.96Å; E493-L499 WeakPolarHBondContact O-CD1 3.46Å; D496-L499 PolarHBondContact O-N 3.46Å; D496-L499 VanDerWaalsContact O-N 3.17Å; P497-L499 VanDerWaalsContact C-N 3.34Å; P497-L499 PolarHBondContact O-N 3.03Å; L499-L501 VanDerWaalsContact C-N 3.31Å; L499-L501 PolarHBondContact O-N 3.36Å; L499-L502 HydrophobicContact CD2-CD2 4Å; L499-L502 WeakPolarHBondContact O-CB 3.32Å; L499-L502 PolarHBondContact O-N 3.3Å; L499-V503 PolarHBondContact O-N 2.97Å
500	R	74	Confident	72.1	Confident	8 Å²	8	30.4 Å²	30.4	3%	0.03	15%	0.153	C	C	.	.	H	α-helix	trans	-67.4	-33.7	172.2	-51.5	178.2	-173.8	140.2	0.7	111.7	K495 P497 N498 L502 V503 L504 F534 M594 F747 D751	K495-R500 PolarHBondContact O-NH2 3.14Å; P497-R500 VanDerWaalsContact O-CB 3.26Å; P497-R500 WeakPolarHBondContact O-CB 3.35Å; P497-R500 PolarHBondContact O-N 3.3Å; N498-R500 PolarHBondContact O-N 3.4Å; R500-L502 VanDerWaalsContact C-N 3.29Å; R500-L502 PolarHBondContact O-N 3.07Å; R500-V503 PolarHBondContact O-N 3.29Å; R500-L504 PolarHBondContact O-N 3.41Å; R500-F534 HydrophobicContact CB-CE1 4.48Å; R500-F534 HydrophobicContact CG-CE1 4.44Å; R500-M594 VanDerWaalsContact CZ-CE 3.48Å; R500-M594 PolarHBondContact NE-SD 3.21Å; R500-M594 VanDerWaalsContact NH1-CE 3.27Å; R500-M594 PolarHBondContact NH1-SD 2.95Å; R500-F747 HydrophobicContact CB-CE1 3.87Å; R500-F747 HydrophobicContact CB-CZ 3.86Å; R500-D751 IonicContact CZ-OD2 3.18Å; R500-D751 IonicContact NH1-OD1 3.2Å; R500-D751 IonicContact NH1-OD2 3.9Å; R500-D751 PolarHBondContact NH1-OD2 2.91Å
501	L	77.2	Confident	73	Confident	2 Å²	2	23.9 Å²	23.9	1%	0.01	12%	0.123	C	C	.	.	H	α-helix	trans	-66.6	-30.9	173.6	-61	174.8	0	0	0	112.3	L464 N498 L499 L504 G505 F747 L763	L464-L501 HydrophobicContact CD1-CB 4.27Å; L464-L501 HydrophobicContact CD1-CD2 3.95Å; N498-L501 WeakPolarHBondContact O-CB 3.37Å; N498-L501 PolarHBondContact O-N 2.85Å; L499-L501 VanDerWaalsContact C-N 3.31Å; L499-L501 PolarHBondContact O-N 3.36Å; L501-L504 HydrophobicContact CD2-CD2 4.46Å; L501-L504 WeakPolarHBondContact O-CB 3.37Å; L501-L504 PolarHBondContact O-N 3.25Å; L501-G505 PolarHBondContact O-N 2.79Å; L501-F747 HydrophobicContact CD2-CD1 4.4Å; L501-L763 HydrophobicContact CD1-CD1 4.17Å
502	L	78.9	Confident	73.5	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-66.8	-44.2	173.8	-179.3	65.3	0	0	0	111.3	G463 L482 F485 L486 N498 L499 R500 L504 G505 I506	G463-L502 VanDerWaalsContact CA-CD1 3.46Å; L482-L502 HydrophobicContact CD2-CD1 3.81Å; F485-L502 HydrophobicContact CD1-CD2 3.6Å; F485-L502 HydrophobicContact CE1-CD2 3.97Å; L486-L502 HydrophobicContact CD2-CD2 3.45Å; L486-L502 VanDerWaalsContact CD2-CD2 3.45Å; L486-L502 HydrophobicContact CD2-CG 4.14Å; L486-L502 HydrophobicContact CG-CD2 3.81Å; L486-L502 HydrophobicContact CG-CG 4.37Å; N498-L502 PolarHBondContact O-N 2.97Å; L499-L502 HydrophobicContact CD2-CD2 4Å; L499-L502 WeakPolarHBondContact O-CB 3.32Å; L499-L502 PolarHBondContact O-N 3.3Å; R500-L502 VanDerWaalsContact C-N 3.29Å; R500-L502 PolarHBondContact O-N 3.07Å; L502-L504 VanDerWaalsContact C-N 3.31Å; L502-L504 PolarHBondContact O-N 2.85Å; L502-G505 WeakPolarHBondContact O-CA 3.38Å; L502-G505 PolarHBondContact O-N 3.34Å; L502-G505 VanDerWaalsContact O-N 3.11Å; L502-I506 PolarHBondContact O-N 3.43Å; L502-I506 VanDerWaalsContact O-N 3.13Å
503	V	81.6	Confident	74.2	Confident	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-64.4	-38.7	175.3	-172.5	0	0	0	0	110.9	L486 L499 R500 G505 I506 A507 F531 A535 L538	L486-V503 HydrophobicContact CD1-CG2 4.2Å; L486-V503 HydrophobicContact CD2-CG2 4.39Å; L499-V503 PolarHBondContact O-N 2.97Å; R500-V503 PolarHBondContact O-N 3.29Å; V503-G505 VanDerWaalsContact C-N 3.29Å; V503-G505 PolarHBondContact O-N 3.35Å; V503-I506 WeakPolarHBondContact O-CB 3.36Å; V503-I506 PolarHBondContact O-N 3.37Å; V503-I506 VanDerWaalsContact O-N 3.17Å; V503-A507 PolarHBondContact O-N 3Å; V503-F531 HydrophobicContact CG2-CE1 3.76Å; V503-F531 HydrophobicContact CG2-CE2 4.22Å; V503-F531 HydrophobicContact CG2-CZ 3.32Å; V503-A535 HydrophobicContact CG1-CB 3.53Å; V503-L538 HydrophobicContact CB-CD2 4.18Å; V503-L538 HydrophobicContact CG1-CB 4.49Å; V503-L538 HydrophobicContact CG1-CD2 3.83Å
504	L	80.7	Confident	74.9	Confident	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-59.1	-41.6	171.4	-176.3	77.7	0	0	0	111.2	L464 R500 L501 L502 I506 A507 L508 L538 F743 T744 F747	L464-L504 HydrophobicContact CD1-CD2 4.29Å; R500-L504 PolarHBondContact O-N 3.41Å; L501-L504 HydrophobicContact CD2-CD2 4.46Å; L501-L504 WeakPolarHBondContact O-CB 3.37Å; L501-L504 PolarHBondContact O-N 3.25Å; L502-L504 VanDerWaalsContact C-N 3.31Å; L502-L504 PolarHBondContact O-N 2.85Å; L504-I506 VanDerWaalsContact C-N 3.31Å; L504-I506 PolarHBondContact O-N 3.28Å; L504-A507 WeakPolarHBondContact O-CB 3.29Å; L504-A507 PolarHBondContact O-N 3.38Å; L504-A507 VanDerWaalsContact O-N 3.13Å; L504-L508 HydrophobicContact CG-CD1 4.44Å; L504-L508 HydrophobicContact CG-CG 4.44Å; L504-L508 VanDerWaalsContact O-CG 3.31Å; L504-L508 WeakPolarHBondContact O-CG 3.16Å; L504-L508 PolarHBondContact O-N 3.26Å; L504-L538 HydrophobicContact CB-CD2 4.24Å; L504-L538 HydrophobicContact CD1-CD1 4.43Å; L504-L538 HydrophobicContact CD1-CD2 4.35Å; L504-F743 HydrophobicContact CD1-CD1 3.59Å; L504-F743 HydrophobicContact CD1-CE1 3.35Å; L504-F743 HydrophobicContact CD1-CZ 4.21Å; L504-T744 HydrophobicContact CD2-CG2 3.79Å; L504-F747 HydrophobicContact CB-CD1 4.37Å; L504-F747 HydrophobicContact CB-CE1 4.23Å; L504-F747 HydrophobicContact CD1-CB 4.15Å; L504-F747 HydrophobicContact CD1-CD1 4.2Å; L504-F747 HydrophobicContact CD1-CD2 4.3Å; L504-F747 HydrophobicContact CD1-CG 3.98Å; L504-F747 HydrophobicContact CD2-CB 4.38Å; L504-F747 HydrophobicContact CD2-CD1 3.95Å; L504-F747 HydrophobicContact CD2-CG 4.36Å; L504-F747 HydrophobicContact CG-CD1 4.41Å
505	G	81.2	Confident	75.5	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-56.1	-43	173.5	0	0	0	0	0	113	G463 G467 L501 L502 V503 L508 I509	G463-G505 WeakPolarHBondContact O-CA 3.15Å; G467-G505 WeakPolarHBondContact CA-O 3.47Å; L501-G505 PolarHBondContact O-N 2.79Å; L502-G505 WeakPolarHBondContact O-CA 3.38Å; L502-G505 PolarHBondContact O-N 3.34Å; L502-G505 VanDerWaalsContact O-N 3.11Å; V503-G505 VanDerWaalsContact C-N 3.29Å; V503-G505 PolarHBondContact O-N 3.35Å; G505-L508 PolarHBondContact O-N 3.29Å; G505-I509 WeakPolarHBondContact O-CG1 3.07Å; G505-I509 PolarHBondContact O-N 3.36Å
506	I	82.8	Confident	76.3	Confident	1 Å²	1	16.5 Å²	16.5	1%	0.005	9%	0.094	C	C	.	.	H	α-helix	trans	-63.1	-45.7	173.9	-61.5	172.8	0	0	0	110.6	L482 L486 L502 V503 L504 L508 I509 Y510 I520 V539	L482-I506 HydrophobicContact CB-CD1 3.86Å; L482-I506 HydrophobicContact CB-CG1 3.7Å; L482-I506 HydrophobicContact CD1-CG1 3.78Å; L482-I506 HydrophobicContact CG-CG1 4.41Å; L486-I506 HydrophobicContact CD1-CD1 3.43Å; L486-I506 VanDerWaalsContact CD1-CD1 3.43Å; L502-I506 PolarHBondContact O-N 3.43Å; L502-I506 VanDerWaalsContact O-N 3.13Å; V503-I506 WeakPolarHBondContact O-CB 3.36Å; V503-I506 PolarHBondContact O-N 3.37Å; V503-I506 VanDerWaalsContact O-N 3.17Å; L504-I506 VanDerWaalsContact C-N 3.31Å; L504-I506 PolarHBondContact O-N 3.28Å; I506-L508 VanDerWaalsContact C-N 3.32Å; I506-L508 PolarHBondContact O-N 3.06Å; I506-I509 PolarHBondContact O-N 3.36Å; I506-Y510 HydrophobicContact CG2-CD2 4.41Å; I506-Y510 HydrophobicContact CG2-CE2 4.43Å; I506-Y510 WeakPolarHBondContact O-CD2 3.41Å; I506-I520 HydrophobicContact CG2-CG2 4.13Å; I506-V539 HydrophobicContact CG2-CG2 4.14Å
507	A	82.1	Confident	76.6	Confident	0 Å²	0	13.6 Å²	13.6	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-60.1	-40	178.1	0	0	0	0	0	112.4	V503 L504 I509 Y510 L511 L538 V539 S542	V503-A507 PolarHBondContact O-N 3Å; L504-A507 WeakPolarHBondContact O-CB 3.29Å; L504-A507 PolarHBondContact O-N 3.38Å; L504-A507 VanDerWaalsContact O-N 3.13Å; A507-I509 VanDerWaalsContact C-N 3.32Å; A507-I509 PolarHBondContact O-N 3.34Å; A507-Y510 CarbonylContact O-C 3.54Å; A507-Y510 PolarHBondContact O-N 3.35Å; A507-Y510 VanDerWaalsContact O-N 3.15Å; A507-L511 PolarHBondContact O-N 3.29Å; A507-L538 HydrophobicContact CB-CD2 4.34Å; A507-L538 HydrophobicContact CB-CG 3.9Å; A507-V539 HydrophobicContact CB-CG2 4.24Å; A507-S542 WeakPolarHBondContact CA-OG 3.42Å; A507-S542 WeakPolarHBondContact CB-OG 3.41Å; A507-S542 VanDerWaalsContact O-CB 3.23Å; A507-S542 WeakPolarHBondContact O-CB 3.36Å; A507-S542 PolarHBondContact O-OG 2.93Å
508	L	82.8	Confident	77.2	Confident	0 Å²	0	16 Å²	16	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-65.2	-31.3	178.4	-69.4	178.6	0	0	0	113.5	L504 G505 I506 Y510 L511 A740 F743	L504-L508 HydrophobicContact CG-CD1 4.44Å; L504-L508 HydrophobicContact CG-CG 4.44Å; L504-L508 VanDerWaalsContact O-CG 3.31Å; L504-L508 WeakPolarHBondContact O-CG 3.16Å; L504-L508 PolarHBondContact O-N 3.26Å; G505-L508 PolarHBondContact O-N 3.29Å; I506-L508 VanDerWaalsContact C-N 3.32Å; I506-L508 PolarHBondContact O-N 3.06Å; L508-Y510 VanDerWaalsContact C-N 3.26Å; L508-Y510 PolarHBondContact O-N 3.27Å; L508-L511 VanDerWaalsContact O-CB 3.26Å; L508-L511 WeakPolarHBondContact O-CB 3.47Å; L508-L511 PolarHBondContact O-N 3.33Å; L508-A740 HydrophobicContact CD1-CB 4.37Å; L508-A740 HydrophobicContact CD2-CB 3.57Å; L508-A740 HydrophobicContact CG-CB 4.48Å; L508-F743 HydrophobicContact CD2-CD1 4.08Å
509	I	83.8	Confident	77.8	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-63.4	-36.6	174.8	-64	168	0	0	0	110.7	L470 S472 I478 L482 G505 I506 A507 L511	L470-I509 HydrophobicContact CB-CG1 4.14Å; S472-I509 PolarHBondContact N-O 2.63Å; I478-I509 HydrophobicContact CG2-CD1 4.24Å; L482-I509 HydrophobicContact CD1-CD1 3.86Å; G505-I509 WeakPolarHBondContact O-CG1 3.07Å; G505-I509 PolarHBondContact O-N 3.36Å; I506-I509 PolarHBondContact O-N 3.36Å; A507-I509 VanDerWaalsContact C-N 3.32Å; A507-I509 PolarHBondContact O-N 3.34Å; I509-L511 VanDerWaalsContact C-N 3.33Å
510	Y	81.1	Confident	78.2	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	10.8	178.8	-69.8	-71.6	0	0	0	114.3	A474 N476 A479 I506 A507 L508 G512 R513 A516 A517 I520 V539	A474-Y510 HydrophobicContact CB-CD1 4.42Å; A474-Y510 HydrophobicContact CB-CE1 4.11Å; N476-Y510 PolarHBondContact OD1-OH 3.2Å; A479-Y510 HydrophobicContact CB-CE2 3.57Å; A479-Y510 VanDerWaalsContact CB-OH 3.25Å; A479-Y510 WeakPolarHBondContact CB-OH 3.23Å; I506-Y510 HydrophobicContact CG2-CD2 4.41Å; I506-Y510 HydrophobicContact CG2-CE2 4.43Å; I506-Y510 WeakPolarHBondContact O-CD2 3.41Å; A507-Y510 CarbonylContact O-C 3.54Å; A507-Y510 PolarHBondContact O-N 3.35Å; A507-Y510 VanDerWaalsContact O-N 3.15Å; L508-Y510 VanDerWaalsContact C-N 3.26Å; L508-Y510 PolarHBondContact O-N 3.27Å; Y510-G512 PolarHBondContact O-N 3.49Å; Y510-G512 VanDerWaalsContact O-N 3.14Å; Y510-R513 PolarHBondContact O-N 2.8Å; Y510-A516 HydrophobicContact CD1-CB 4.26Å; Y510-A516 HydrophobicContact CE1-CB 4.08Å; Y510-A516 VanDerWaalsContact CE1-O 3.31Å; Y510-A516 WeakPolarHBondContact CE1-O 3.24Å; Y510-A517 HydrophobicContact CD1-CB 4.03Å; Y510-A517 HydrophobicContact CG-CB 4.14Å; Y510-I520 HydrophobicContact CE1-CD1 4.04Å; Y510-I520 HydrophobicContact CE2-CB 4.31Å; Y510-I520 HydrophobicContact CE2-CD1 3.36Å; Y510-I520 HydrophobicContact CE2-CG1 4.43Å; Y510-I520 HydrophobicContact CE2-CG2 4.18Å; Y510-I520 WeakPolarHBondContact OH-CD1 3.22Å; Y510-V539 HydrophobicContact CD2-CG1 4.43Å
511	L	79.4	Confident	78.3	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	121.1	-179.5	-176	69.4	0	0	0	111.2	V471 S472 A507 L508 I509 R513 S542 A545 P736 M739 A740	V471-L511 HydrophobicContact CG1-CB 4.21Å; V471-L511 HydrophobicContact CG1-CD2 3.71Å; S472-L511 VanDerWaalsContact CB-O 3.29Å; S472-L511 WeakPolarHBondContact CB-O 3.47Å; S472-L511 PolarHBondContact OG-O 3.26Å; A507-L511 PolarHBondContact O-N 3.29Å; L508-L511 VanDerWaalsContact O-CB 3.26Å; L508-L511 WeakPolarHBondContact O-CB 3.47Å; L508-L511 PolarHBondContact O-N 3.33Å; I509-L511 VanDerWaalsContact C-N 3.33Å; L511-R513 VanDerWaalsContact C-N 3.33Å; L511-R513 PolarHBondContact O-N 2.86Å; L511-S542 WeakPolarHBondContact CD1-O 3.31Å; L511-A545 HydrophobicContact CD1-CB 3.68Å; L511-P736 HydrophobicContact CD2-CB 3.99Å; L511-P736 VanDerWaalsContact CD2-O 3.27Å; L511-P736 WeakPolarHBondContact CD2-O 3.44Å; L511-M739 HydrophobicContact CD1-CE 3.22Å; L511-M739 HydrophobicContact CD2-CB 4.2Å; L511-M739 HydrophobicContact CD2-CE 3.97Å; L511-M739 HydrophobicContact CG-CE 4.25Å; L511-A740 HydrophobicContact CD2-CB 4.34Å
512	G	70.8	Confident	78.4	Confident	34 Å²	34	27.2 Å²	27.2	35%	0.351	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.6	18.2	174.4	0	0	0	0	0	115.5	Y510 S542	Y510-G512 PolarHBondContact O-N 3.49Å; Y510-G512 VanDerWaalsContact O-N 3.14Å; G512-S542 PolarHBondContact N-O 3.04Å; G512-S542 VanDerWaalsContact N-O 3.15Å
513	R	72.4	Confident	78.5	Confident	80 Å²	80	28.5 Å²	28.5	30%	0.302	16%	0.158	S	C	.	.			trans	-126.3	118.3	168.4	-75.1	-174.9	167.5	176.9	2.4	108.7	S472 S473 Y510 L511 A516	S472-R513 PolarHBondContact O-NE 3.44Å; S473-R513 VanDerWaalsContact C-NH1 3.31Å; S473-R513 PolarHBondContact O-NH1 3.03Å; Y510-R513 PolarHBondContact O-N 2.8Å; L511-R513 VanDerWaalsContact C-N 3.33Å; L511-R513 PolarHBondContact O-N 2.86Å; R513-A516 HydrophobicContact CB-CB 4.5Å
514	Q	74.4	Confident	78.4	Confident	25 Å²	25	28.5 Å²	28.5	12%	0.117	16%	0.158	C	C	.	.	S	Bend	trans	-83.1	-60.7	-173	-55.2	176.9	19.1	0	0	110.3	E213 A516 A517 Y544	E213-Q514 VanDerWaalsContact OE2-CB 3.31Å; E213-Q514 WeakPolarHBondContact OE2-CB 3.37Å; E213-Q514 PolarHBondContact OE2-N 2.9Å; Q514-A516 VanDerWaalsContact C-N 3.31Å; Q514-A516 PolarHBondContact O-N 3.03Å; Q514-A517 VanDerWaalsContact O-CB 3.28Å; Q514-A517 WeakPolarHBondContact O-CB 3.14Å; Q514-A517 PolarHBondContact O-N 3.41Å; Q514-Y544 HydrophobicContact CB-CE1 4.12Å; Q514-Y544 HydrophobicContact CG-CD1 3.92Å; Q514-Y544 HydrophobicContact CG-CE1 3.85Å
515	D	72	Confident	78.2	Confident	71 Å²	71	34.6 Å²	34.6	38%	0.38	19%	0.185	S	C	.	.	H	α-helix	trans	-60.6	-38.3	-170.6	-62.1	-13.7	0	0	0	113	E213 A517 D518	E213-D515 WeakPolarHBondContact CB-OD2 3.46Å; D515-A517 PolarHBondContact O-N 3.41Å; D515-D518 PolarHBondContact O-N 2.97Å
516	A	72.7	Confident	78.1	Confident	30 Å²	30	39.8 Å²	39.8	25%	0.248	22%	0.216	C	C	.	.	H	α-helix	trans	-68.6	-21.9	179.9	0	0	0	0	0	112.8	A474 Y510 R513 Q514	A474-A516 HydrophobicContact CB-CB 3.88Å; Y510-A516 HydrophobicContact CD1-CB 4.26Å; Y510-A516 HydrophobicContact CE1-CB 4.08Å; Y510-A516 VanDerWaalsContact CE1-O 3.31Å; Y510-A516 WeakPolarHBondContact CE1-O 3.24Å; R513-A516 HydrophobicContact CB-CB 4.5Å; Q514-A516 VanDerWaalsContact C-N 3.31Å; Q514-A516 PolarHBondContact O-N 3.03Å
517	A	73.8	Confident	77.5	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-77.1	-28.3	179.9	0	0	0	0	0	112.2	Y510 Q514 D515 V519 I520 M521 V539 A543	Y510-A517 HydrophobicContact CD1-CB 4.03Å; Y510-A517 HydrophobicContact CG-CB 4.14Å; Q514-A517 VanDerWaalsContact O-CB 3.28Å; Q514-A517 WeakPolarHBondContact O-CB 3.14Å; Q514-A517 PolarHBondContact O-N 3.41Å; D515-A517 PolarHBondContact O-N 3.41Å; A517-V519 PolarHBondContact O-N 3.49Å; A517-I520 PolarHBondContact O-N 2.81Å; A517-M521 HydrophobicContact CB-CE 4.45Å; A517-M521 WeakPolarHBondContact O-CG 3.37Å; A517-M521 PolarHBondContact O-N 3.2Å; A517-V539 HydrophobicContact CB-CG1 4.02Å; A517-A543 HydrophobicContact CB-CB 3.58Å
518	D	79.2	Confident	77.1	Confident	71 Å²	71	42.7 Å²	42.7	38%	0.38	24%	0.235	S	C	.	.	H	α-helix	trans	-56.6	-46.3	-174.8	-77.1	-20.9	0	0	0	112.9	D515 I520 M521 E522	D515-D518 PolarHBondContact O-N 2.97Å; D518-I520 PolarHBondContact O-N 3.5Å; D518-M521 HydrophobicContact CB-CE 4.3Å; D518-M521 PolarHBondContact O-N 3.43Å; D518-M521 WeakPolarHBondContact OD1-CE 3.27Å; D518-E522 PolarHBondContact O-N 3.14Å
519	V	81.3	Confident	76.1	Confident	101 Å²	101	51.8 Å²	51.8	61%	0.612	27%	0.274	S	S	*	.	H	α-helix	trans	-57.5	-39.8	178.6	-178.9	0	0	0	0	111.1	A517 S523	A517-V519 PolarHBondContact O-N 3.49Å; V519-S523 PolarHBondContact O-N 3.07Å; V519-S523 VanDerWaalsContact O-N 3.16Å
520	I	79.3	Confident	75.2	Confident	7 Å²	7	54.3 Å²	54.3	4%	0.036	29%	0.292	C	S	.	.	H	α-helix	trans	-83.1	-32.2	-178.3	-81.6	155.2	0	0	0	112.5	A479 I506 Y510 A517 D518 E522 S523 L524	A479-I520 HydrophobicContact CB-CD1 3.55Å; I506-I520 HydrophobicContact CG2-CG2 4.13Å; Y510-I520 HydrophobicContact CE1-CD1 4.04Å; Y510-I520 HydrophobicContact CE2-CB 4.31Å; Y510-I520 HydrophobicContact CE2-CD1 3.36Å; Y510-I520 HydrophobicContact CE2-CG1 4.43Å; Y510-I520 HydrophobicContact CE2-CG2 4.18Å; Y510-I520 WeakPolarHBondContact OH-CD1 3.22Å; A517-I520 PolarHBondContact O-N 2.81Å; D518-I520 PolarHBondContact O-N 3.5Å; I520-E522 VanDerWaalsContact C-N 3.27Å; I520-E522 PolarHBondContact O-N 2.93Å; I520-S523 WeakPolarHBondContact CA-OG 3.39Å; I520-S523 PolarHBondContact O-N 3.3Å; I520-S523 VanDerWaalsContact O-N 3.14Å; I520-S523 PolarHBondContact O-OG 3.4Å; I520-L524 HydrophobicContact CG2-CD1 3.71Å; I520-L524 HydrophobicContact CG2-CG 4.09Å; I520-L524 WeakPolarHBondContact O-CB 3.29Å; I520-L524 VanDerWaalsContact O-CG 3.23Å; I520-L524 WeakPolarHBondContact O-CG 3.34Å; I520-L524 PolarHBondContact O-N 3.41Å
521	M	77.6	Confident	74.9	Confident	11 Å²	11	54.6 Å²	54.6	5%	0.054	29%	0.293	C	S	.	.	H	α-helix	trans	-57.2	-43.2	169.3	-70.9	-167.9	-67.9	0	0	111.1	A517 D518 L524 K525 V539 E540	A517-M521 HydrophobicContact CB-CE 4.45Å; A517-M521 WeakPolarHBondContact O-CG 3.37Å; A517-M521 PolarHBondContact O-N 3.2Å; D518-M521 HydrophobicContact CB-CE 4.3Å; D518-M521 PolarHBondContact O-N 3.43Å; D518-M521 WeakPolarHBondContact OD1-CE 3.27Å; M521-L524 PolarHBondContact O-N 2.83Å; M521-K525 WeakPolarHBondContact O-CG 3.44Å; M521-K525 PolarHBondContact O-N 3.21Å; M521-V539 HydrophobicContact CG-CB 4.19Å; M521-V539 HydrophobicContact CG-CG1 3.78Å; M521-E540 HydrophobicContact SD-CB 3.7Å; M521-E540 HydrophobicContact SD-CG 4.21Å
522	E	79.3	Confident	74.7	Confident	141 Å²	141	54.6 Å²	54.6	66%	0.659	29%	0.294	S	S	*	.	H	α-helix	trans	-64.3	-41.9	173.9	-68.9	-166.9	161.6	0	0	112.6	D518 I520 L524 K525	D518-E522 PolarHBondContact O-N 3.14Å; I520-E522 VanDerWaalsContact C-N 3.27Å; I520-E522 PolarHBondContact O-N 2.93Å; E522-L524 VanDerWaalsContact C-N 3.3Å; E522-L524 PolarHBondContact O-N 3.36Å; E522-K525 PolarHBondContact O-N 3.02Å
523	S	81.3	Confident	75	Confident	26 Å²	26	54.5 Å²	54.5	18%	0.182	29%	0.287	C	S	.	.	H	α-helix	trans	-63.3	-34.9	176.6	79.7	0	0	0	0	113.1	W483 V519 I520 V526	W483-S523 PolarHBondContact NE1-O 3.31Å; V519-S523 PolarHBondContact O-N 3.07Å; V519-S523 VanDerWaalsContact O-N 3.16Å; I520-S523 WeakPolarHBondContact CA-OG 3.39Å; I520-S523 PolarHBondContact O-N 3.3Å; I520-S523 VanDerWaalsContact O-N 3.14Å; I520-S523 PolarHBondContact O-OG 3.4Å; S523-V526 WeakPolarHBondContact O-CB 3.44Å; S523-V526 PolarHBondContact O-N 2.86Å
524	L	78.2	Confident	75.4	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-74.9	-27.7	-179.5	-72.4	168.8	0	0	0	112.2	L486 I520 M521 E522 V526 L527 G532 A535 V539	L486-L524 HydrophobicContact CD1-CD2 4.46Å; I520-L524 HydrophobicContact CG2-CD1 3.71Å; I520-L524 HydrophobicContact CG2-CG 4.09Å; I520-L524 WeakPolarHBondContact O-CB 3.29Å; I520-L524 VanDerWaalsContact O-CG 3.23Å; I520-L524 WeakPolarHBondContact O-CG 3.34Å; I520-L524 PolarHBondContact O-N 3.41Å; M521-L524 PolarHBondContact O-N 2.83Å; E522-L524 VanDerWaalsContact C-N 3.3Å; E522-L524 PolarHBondContact O-N 3.36Å; L524-V526 PolarHBondContact O-N 3.42Å; L524-L527 HydrophobicContact CD2-CD1 3.82Å; L524-L527 WeakPolarHBondContact O-CB 3.44Å; L524-L527 PolarHBondContact O-N 3.34Å; L524-G532 WeakPolarHBondContact O-CA 3.35Å; L524-A535 HydrophobicContact CB-CB 4.36Å; L524-A535 HydrophobicContact CD1-CB 4.3Å; L524-A535 HydrophobicContact CD2-CB 4.14Å; L524-V539 HydrophobicContact CD1-CB 4.31Å; L524-V539 HydrophobicContact CD1-CG2 3.54Å
525	K	76	Confident	75.7	Confident	129 Å²	129	49.6 Å²	49.6	56%	0.561	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-18	174.8	-73.4	169.5	-173.8	170.1	0	113.4	M521 E522 L527 S536	M521-K525 WeakPolarHBondContact O-CG 3.44Å; M521-K525 PolarHBondContact O-N 3.21Å; E522-K525 PolarHBondContact O-N 3.02Å; K525-L527 VanDerWaalsContact C-N 3.26Å; K525-L527 PolarHBondContact O-N 3.4Å; K525-S536 WeakPolarHBondContact CE-OG 3.36Å
526	V	80	Confident	76.2	Confident	108 Å²	108	46.7 Å²	46.7	66%	0.655	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-21.1	176.7	-176.1	0	0	0	0	112.1	S523 L524	S523-V526 WeakPolarHBondContact O-CB 3.44Å; S523-V526 PolarHBondContact O-N 2.86Å; L524-V526 PolarHBondContact O-N 3.42Å
527	L	70.7	Confident	76.7	Confident	8 Å²	8	45.6 Å²	45.6	4%	0.042	24%	0.244	C	C	.	.	S	Bend	trans	-65.9	161	176.3	-69.5	162	0	0	0	111.8	L487 L524 K525 K529 F531	L487-L527 HydrophobicContact CD1-CD2 4.48Å; L524-L527 HydrophobicContact CD2-CD1 3.82Å; L524-L527 WeakPolarHBondContact O-CB 3.44Å; L524-L527 PolarHBondContact O-N 3.34Å; K525-L527 VanDerWaalsContact C-N 3.26Å; K525-L527 PolarHBondContact O-N 3.4Å; L527-K529 PolarHBondContact O-N 3.26Å; L527-F531 HydrophobicContact CD1-CD1 4.29Å; L527-F531 HydrophobicContact CD1-CE1 4.47Å
528	P	72.6	Confident	77.2	Confident	54 Å²	54	45.6 Å²	45.6	35%	0.351	24%	0.244	S	C	.	.			trans	-47.6	130.9	178.3	-28.4	34.7	0	0	0	112.2	E491 L494 S530 F531 G532	E491-P528 HydrophobicContact CG-CG 4.32Å; L494-P528 HydrophobicContact CD1-CG 4.13Å; P528-S530 PolarHBondContact O-N 3.48Å; P528-F531 PolarHBondContact O-N 3.39Å; P528-G532 PolarHBondContact O-N 2.96Å
529	K	61.7	Low	77.4	Confident	191 Å²	191	42.2 Å²	42.2	83%	0.83	23%	0.225	S	C	*	.	H	α-helix	trans	-47.4	-33.2	-160.7	-67.7	-177.8	179.5	179.7	0	115.8	L527 S533	L527-K529 PolarHBondContact O-N 3.26Å; K529-S533 WeakPolarHBondContact O-CB 3.03Å; K529-S533 PolarHBondContact O-N 3.11Å; K529-S533 PolarHBondContact O-OG 3.02Å
530	S	66.5	Low	77.5	Confident	54 Å²	54	39 Å²	39	38%	0.378	20%	0.203	S	C	.	.	H	α-helix	trans	-82.9	-25.8	-177.9	-56.1	0	0	0	0	114.3	P528 P591 S592	P528-S530 PolarHBondContact O-N 3.48Å; S530-P591 WeakPolarHBondContact O-CB 3.48Å; S530-P591 WeakPolarHBondContact O-CG 3.32Å; S530-S592 WeakPolarHBondContact CB-OG 3.44Å; S530-S592 PolarHBondContact OG-OG 3.45Å
531	F	73.3	Confident	77.7	Confident	5 Å²	5	38.6 Å²	38.6	2%	0.022	20%	0.202	C	C	.	.	H	α-helix	trans	-95.5	-33.8	176.4	-173	-96	0	0	0	111.4	L486 L494 V503 L527 P528 F534 A535 P591	L486-F531 HydrophobicContact CD2-CE1 4.11Å; L486-F531 HydrophobicContact CD2-CZ 4.26Å; L494-F531 HydrophobicContact CB-CD2 4.27Å; L494-F531 HydrophobicContact CB-CG 4.5Å; L494-F531 HydrophobicContact CD1-CB 4.31Å; L494-F531 HydrophobicContact CD1-CG 4.36Å; L494-F531 HydrophobicContact CD2-CD1 4.11Å; L494-F531 HydrophobicContact CD2-CE1 4.01Å; L494-F531 HydrophobicContact CD2-CE2 4.41Å; L494-F531 HydrophobicContact CD2-CG 4.34Å; L494-F531 HydrophobicContact CD2-CZ 4.14Å; V503-F531 HydrophobicContact CG2-CE1 3.76Å; V503-F531 HydrophobicContact CG2-CE2 4.22Å; V503-F531 HydrophobicContact CG2-CZ 3.32Å; L527-F531 HydrophobicContact CD1-CD1 4.29Å; L527-F531 HydrophobicContact CD1-CE1 4.47Å; P528-F531 PolarHBondContact O-N 3.39Å; F531-F534 HydrophobicContact CE2-CD1 4.49Å; F531-F534 PolarHBondContact O-N 2.65Å; F531-A535 WeakPolarHBondContact O-CB 3.39Å; F531-A535 PolarHBondContact O-N 3.34Å; F531-P591 HydrophobicContact CD2-CB 4.5Å
532	G	75.7	Confident	77.8	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-64.2	-39.3	175.6	0	0	0	0	0	113	L524 P528 A535 S536	L524-G532 WeakPolarHBondContact O-CA 3.35Å; P528-G532 PolarHBondContact O-N 2.96Å; G532-A535 PolarHBondContact O-N 2.89Å; G532-S536 WeakPolarHBondContact O-CB 3.4Å; G532-S536 PolarHBondContact O-N 3Å
533	S	77	Confident	77.9	Confident	31 Å²	31	31.4 Å²	31.4	22%	0.217	17%	0.168	C	C	.	.	H	α-helix	trans	-64.7	-49.3	174.6	64.6	0	0	0	0	111.4	K529 A535 S536 T537 E595	K529-S533 WeakPolarHBondContact O-CB 3.03Å; K529-S533 PolarHBondContact O-N 3.11Å; K529-S533 PolarHBondContact O-OG 3.02Å; S533-A535 VanDerWaalsContact C-N 3.34Å; S533-A535 PolarHBondContact O-N 2.92Å; S533-S536 PolarHBondContact O-N 2.81Å; S533-T537 PolarHBondContact O-N 3.2Å; S533-T537 PolarHBondContact O-OG1 3.24Å; S533-T537 VanDerWaalsContact O-OG1 3.08Å; S533-E595 WeakPolarHBondContact CB-OE1 3.5Å; S533-E595 VanDerWaalsContact CB-OE2 3.3Å; S533-E595 WeakPolarHBondContact CB-OE2 3.08Å; S533-E595 PolarHBondContact OG-OE2 2.61Å
534	F	80.9	Confident	77.8	Confident	3 Å²	3	31.1 Å²	31.1	1%	0.013	16%	0.163	C	C	.	.	H	α-helix	trans	-52.5	-47.6	173.4	171.5	-99.3	0	0	0	113	R500 F531 T537 L538 M594 E595 V598 F747	R500-F534 HydrophobicContact CB-CE1 4.48Å; R500-F534 HydrophobicContact CG-CE1 4.44Å; F531-F534 HydrophobicContact CE2-CD1 4.49Å; F531-F534 PolarHBondContact O-N 2.65Å; F534-T537 PolarHBondContact O-N 3.12Å; F534-L538 WeakPolarHBondContact O-CB 3.44Å; F534-L538 PolarHBondContact O-N 3.32Å; F534-M594 HydrophobicContact CD2-CB 3.91Å; F534-M594 HydrophobicContact CE2-CB 3.68Å; F534-E595 HydrophobicContact CB-CB 4.38Å; F534-E595 HydrophobicContact CD2-CB 4.43Å; F534-V598 HydrophobicContact CD2-CG2 4.24Å; F534-V598 HydrophobicContact CE2-CB 4.41Å; F534-V598 HydrophobicContact CE2-CG2 3.45Å; F534-V598 VanDerWaalsContact CE2-CG2 3.45Å; F534-V598 HydrophobicContact CZ-CG2 4.13Å; F534-F747 AromaticContact CZ-CE2 3.94Å; F534-F747 HydrophobicContact CZ-CE2 3.94Å; F534-F747 AromaticContact CZ-CZ 3.8Å; F534-F747 HydrophobicContact CZ-CZ 3.8Å
535	A	80.8	Confident	77.6	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-67.5	-40.8	179.8	0	0	0	0	0	112.4	V503 L524 F531 G532 S533 L538 V539	V503-A535 HydrophobicContact CG1-CB 3.53Å; L524-A535 HydrophobicContact CB-CB 4.36Å; L524-A535 HydrophobicContact CD1-CB 4.3Å; L524-A535 HydrophobicContact CD2-CB 4.14Å; F531-A535 WeakPolarHBondContact O-CB 3.39Å; F531-A535 PolarHBondContact O-N 3.34Å; G532-A535 PolarHBondContact O-N 2.89Å; S533-A535 VanDerWaalsContact C-N 3.34Å; S533-A535 PolarHBondContact O-N 2.92Å; A535-L538 PolarHBondContact O-N 3.11Å; A535-V539 WeakPolarHBondContact O-CG2 3.27Å; A535-V539 PolarHBondContact O-N 3.24Å
536	S	83.6	Confident	77.4	Confident	10 Å²	10	26.5 Å²	26.5	7%	0.07	15%	0.152	C	C	.	.	H	α-helix	trans	-60.5	-47.5	174.8	-173.5	0	0	0	0	111.2	K525 G532 S533 L538 V539 E540	K525-S536 WeakPolarHBondContact CE-OG 3.36Å; G532-S536 WeakPolarHBondContact O-CB 3.4Å; G532-S536 PolarHBondContact O-N 3Å; S533-S536 PolarHBondContact O-N 2.81Å; S536-L538 VanDerWaalsContact C-N 3.32Å; S536-L538 PolarHBondContact O-N 3.37Å; S536-V539 PolarHBondContact O-N 2.58Å; S536-E540 WeakPolarHBondContact O-CB 3.41Å; S536-E540 PolarHBondContact O-N 3.15Å
537	T	83.2	Confident	77	Confident	7 Å²	7	23.1 Å²	23.1	4%	0.043	13%	0.131	C	C	.	.	H	α-helix	trans	-63.8	-37.7	178.1	-53.6	0	0	0	0	111.6	S533 F534 E540 V541 L556 L559 E595 V598 A599	S533-T537 PolarHBondContact O-N 3.2Å; S533-T537 PolarHBondContact O-OG1 3.24Å; S533-T537 VanDerWaalsContact O-OG1 3.08Å; F534-T537 PolarHBondContact O-N 3.12Å; T537-E540 PolarHBondContact O-N 3.11Å; T537-V541 HydrophobicContact CG2-CG2 4.41Å; T537-V541 WeakPolarHBondContact O-CB 3.49Å; T537-V541 VanDerWaalsContact O-CG2 3.23Å; T537-V541 WeakPolarHBondContact O-CG2 3.38Å; T537-V541 PolarHBondContact O-N 3.22Å; T537-L556 HydrophobicContact CG2-CD2 3.76Å; T537-L559 HydrophobicContact CG2-CD2 3.79Å; T537-E595 PolarHBondContact OG1-OE1 3.2Å; T537-V598 HydrophobicContact CG2-CG1 4.49Å; T537-A599 HydrophobicContact CG2-CB 4.32Å
538	L	82.8	Confident	77	Confident	0 Å²	0	23 Å²	23	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-65.6	-42.4	179.1	-170.5	64	0	0	0	112	V503 L504 A507 F534 A535 S536 V541 S542 V598 F743 F747	V503-L538 HydrophobicContact CB-CD2 4.18Å; V503-L538 HydrophobicContact CG1-CB 4.49Å; V503-L538 HydrophobicContact CG1-CD2 3.83Å; L504-L538 HydrophobicContact CB-CD2 4.24Å; L504-L538 HydrophobicContact CD1-CD1 4.43Å; L504-L538 HydrophobicContact CD1-CD2 4.35Å; A507-L538 HydrophobicContact CB-CD2 4.34Å; A507-L538 HydrophobicContact CB-CG 3.9Å; F534-L538 WeakPolarHBondContact O-CB 3.44Å; F534-L538 PolarHBondContact O-N 3.32Å; A535-L538 PolarHBondContact O-N 3.11Å; S536-L538 VanDerWaalsContact C-N 3.32Å; S536-L538 PolarHBondContact O-N 3.37Å; L538-V541 PolarHBondContact O-N 3.06Å; L538-S542 PolarHBondContact O-N 3.45Å; L538-S542 PolarHBondContact O-OG 3.13Å; L538-V598 HydrophobicContact CB-CG1 4.17Å; L538-V598 HydrophobicContact CD1-CG1 3.48Å; L538-V598 VanDerWaalsContact CD1-CG1 3.48Å; L538-V598 HydrophobicContact CD1-CG2 4.25Å; L538-V598 HydrophobicContact CG-CG1 4.44Å; L538-F743 HydrophobicContact CD1-CE1 4.04Å; L538-F743 HydrophobicContact CD1-CZ 3.59Å; L538-F747 HydrophobicContact CD1-CD2 4.18Å; L538-F747 HydrophobicContact CD1-CE2 3.92Å; L538-F747 HydrophobicContact CD2-CE2 4.01Å; L538-F747 HydrophobicContact CD2-CZ 4.12Å
539	V	84.5	Confident	77.1	Confident	0 Å²	0	23 Å²	23	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-67.9	-40.2	175.8	173.4	0	0	0	0	111.2	I506 A507 Y510 A517 M521 L524 A535 S536 V541 S542 A543	I506-V539 HydrophobicContact CG2-CG2 4.14Å; A507-V539 HydrophobicContact CB-CG2 4.24Å; Y510-V539 HydrophobicContact CD2-CG1 4.43Å; A517-V539 HydrophobicContact CB-CG1 4.02Å; M521-V539 HydrophobicContact CG-CB 4.19Å; M521-V539 HydrophobicContact CG-CG1 3.78Å; L524-V539 HydrophobicContact CD1-CB 4.31Å; L524-V539 HydrophobicContact CD1-CG2 3.54Å; A535-V539 WeakPolarHBondContact O-CG2 3.27Å; A535-V539 PolarHBondContact O-N 3.24Å; S536-V539 PolarHBondContact O-N 2.58Å; V539-V541 VanDerWaalsContact C-N 3.34Å; V539-V541 PolarHBondContact O-N 3.25Å; V539-S542 WeakPolarHBondContact CA-OG 3.3Å; V539-S542 PolarHBondContact O-N 3.32Å; V539-S542 PolarHBondContact O-OG 2.66Å; V539-A543 VanDerWaalsContact O-CB 3.32Å; V539-A543 WeakPolarHBondContact O-CB 3.32Å; V539-A543 PolarHBondContact O-N 2.6Å
540	E	83.7	Confident	78	Confident	32 Å²	32	18.7 Å²	18.7	15%	0.15	12%	0.119	C	C	.	.	H	α-helix	trans	-58.6	-47	175.3	-174.1	168.9	-156.6	0	0	111.2	M521 S536 T537 S542 A543 Y544 K552	M521-E540 HydrophobicContact SD-CB 3.7Å; M521-E540 HydrophobicContact SD-CG 4.21Å; S536-E540 WeakPolarHBondContact O-CB 3.41Å; S536-E540 PolarHBondContact O-N 3.15Å; T537-E540 PolarHBondContact O-N 3.11Å; E540-S542 VanDerWaalsContact C-N 3.34Å; E540-S542 PolarHBondContact O-N 3.29Å; E540-A543 PolarHBondContact O-N 2.88Å; E540-Y544 HydrophobicContact CG-CD2 3.77Å; E540-Y544 HydrophobicContact CG-CE2 3.82Å; E540-Y544 WeakPolarHBondContact O-CD2 3.41Å; E540-Y544 PolarHBondContact O-N 3.32Å; E540-Y544 VanDerWaalsContact O-N 3.08Å; E540-K552 VanDerWaalsContact OE1-CD 3.24Å; E540-K552 WeakPolarHBondContact OE1-CD 3.06Å; E540-K552 IonicContact OE1-NZ 2.76Å; E540-K552 PolarHBondContact OE1-NZ 3.05Å
541	V	82.1	Confident	78.7	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-60.9	-40.7	178.3	163.7	0	0	0	0	112.4	T537 L538 V539 A545 L556 L605 F743	T537-V541 HydrophobicContact CG2-CG2 4.41Å; T537-V541 WeakPolarHBondContact O-CB 3.49Å; T537-V541 VanDerWaalsContact O-CG2 3.23Å; T537-V541 WeakPolarHBondContact O-CG2 3.38Å; T537-V541 PolarHBondContact O-N 3.22Å; L538-V541 PolarHBondContact O-N 3.06Å; V539-V541 VanDerWaalsContact C-N 3.34Å; V539-V541 PolarHBondContact O-N 3.25Å; V541-A545 PolarHBondContact O-N 3.11Å; V541-L556 HydrophobicContact CG2-CD1 4.01Å; V541-L556 HydrophobicContact CG2-CD2 4.09Å; V541-L605 HydrophobicContact CG1-CB 4.38Å; V541-L605 HydrophobicContact CG1-CD2 3.79Å; V541-F743 HydrophobicContact CG1-CE2 4.23Å; V541-F743 HydrophobicContact CG1-CZ 4.16Å
542	S	80.3	Confident	79	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-72	-35.1	176.7	50.5	0	0	0	0	113.1	A507 L511 G512 L538 V539 E540 A545	A507-S542 WeakPolarHBondContact CA-OG 3.42Å; A507-S542 WeakPolarHBondContact CB-OG 3.41Å; A507-S542 VanDerWaalsContact O-CB 3.23Å; A507-S542 WeakPolarHBondContact O-CB 3.36Å; A507-S542 PolarHBondContact O-OG 2.93Å; L511-S542 WeakPolarHBondContact CD1-O 3.31Å; G512-S542 PolarHBondContact N-O 3.04Å; G512-S542 VanDerWaalsContact N-O 3.15Å; L538-S542 PolarHBondContact O-N 3.45Å; L538-S542 PolarHBondContact O-OG 3.13Å; V539-S542 WeakPolarHBondContact CA-OG 3.3Å; V539-S542 PolarHBondContact O-N 3.32Å; V539-S542 PolarHBondContact O-OG 2.66Å; E540-S542 VanDerWaalsContact C-N 3.34Å; E540-S542 PolarHBondContact O-N 3.29Å; S542-A545 WeakPolarHBondContact O-CB 3.42Å; S542-A545 PolarHBondContact O-N 3.15Å
543	A	81.5	Confident	79.2	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-65.8	-41.8	179.8	0	0	0	0	0	111	A517 V539 E540 A545	A517-A543 HydrophobicContact CB-CB 3.58Å; V539-A543 VanDerWaalsContact O-CB 3.32Å; V539-A543 WeakPolarHBondContact O-CB 3.32Å; V539-A543 PolarHBondContact O-N 2.6Å; E540-A543 PolarHBondContact O-N 2.88Å; A543-A545 VanDerWaalsContact C-N 3.33Å; A543-A545 PolarHBondContact O-N 3.43Å
544	Y	77.9	Confident	79.5	Confident	21 Å²	21	28.2 Å²	28.2	8%	0.082	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	12.9	178.6	-64.6	-69.3	0	0	0	114.5	Q514 E540 G546 T547 K552 I606	Q514-Y544 HydrophobicContact CB-CE1 4.12Å; Q514-Y544 HydrophobicContact CG-CD1 3.92Å; Q514-Y544 HydrophobicContact CG-CE1 3.85Å; E540-Y544 HydrophobicContact CG-CD2 3.77Å; E540-Y544 HydrophobicContact CG-CE2 3.82Å; E540-Y544 WeakPolarHBondContact O-CD2 3.41Å; E540-Y544 PolarHBondContact O-N 3.32Å; E540-Y544 VanDerWaalsContact O-N 3.08Å; Y544-G546 PolarHBondContact O-N 3.04Å; Y544-T547 PolarHBondContact O-N 2.96Å; Y544-T547 PolarHBondContact O-OG1 2.99Å; Y544-T547 VanDerWaalsContact O-OG1 3.07Å; Y544-K552 HydrophobicContact CD1-CG 4.15Å; Y544-K552 HydrophobicContact CD2-CB 4.46Å; Y544-K552 HydrophobicContact CD2-CD 3.88Å; Y544-K552 HydrophobicContact CD2-CG 3.82Å; Y544-K552 HydrophobicContact CE1-CG 4.19Å; Y544-K552 HydrophobicContact CE2-CD 3.59Å; Y544-K552 HydrophobicContact CE2-CG 3.89Å; Y544-K552 HydrophobicContact CG-CG 3.98Å; Y544-K552 WeakPolarHBondContact OH-CE 3.2Å; Y544-K552 PolarHBondContact OH-NZ 2.96Å; Y544-I606 WeakPolarHBondContact O-CG1 3.33Å
545	A	75.8	Confident	79.6	Confident	5 Å²	5	32.3 Å²	32.3	4%	0.041	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	123.4	178.6	0	0	0	0	0	111.1	L511 V541 S542 A543 T547 L605 M739	L511-A545 HydrophobicContact CD1-CB 3.68Å; V541-A545 PolarHBondContact O-N 3.11Å; S542-A545 WeakPolarHBondContact O-CB 3.42Å; S542-A545 PolarHBondContact O-N 3.15Å; A543-A545 VanDerWaalsContact C-N 3.33Å; A543-A545 PolarHBondContact O-N 3.43Å; A545-T547 PolarHBondContact O-N 3.11Å; A545-L605 HydrophobicContact CB-CD2 3.72Å; A545-L605 HydrophobicContact CB-CG 3.84Å; A545-M739 HydrophobicContact CB-CE 4.42Å
546	G	69.9	Low	79.6	Confident	27 Å²	27	32.4 Å²	32.4	28%	0.278	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	81	2.7	175.3	0	0	0	0	0	117	Y544 L605	Y544-G546 PolarHBondContact O-N 3.04Å; G546-L605 PolarHBondContact N-O 3.49Å
547	T	72.4	Confident	79.4	Confident	36 Å²	36	34.3 Å²	34.3	22%	0.221	19%	0.188	C	C	.	.	S	Bend	trans	-91.8	-10	-174.6	63.5	0	0	0	0	114.1	Y544 A545 N549	Y544-T547 PolarHBondContact O-N 2.96Å; Y544-T547 PolarHBondContact O-OG1 2.99Å; Y544-T547 VanDerWaalsContact O-OG1 3.07Å; A545-T547 PolarHBondContact O-N 3.11Å; T547-N549 PolarHBondContact O-N 3.15Å; T547-N549 VanDerWaalsContact O-N 3.1Å
548	G	70.9	Confident	79.3	Confident	6 Å²	6	40.9 Å²	40.9	6%	0.062	22%	0.216	C	C	.	.			trans	66.9	7.9	178.4	0	0	0	0	0	115.3	V550 I606	G548-V550 PolarHBondContact O-N 3.14Å; G548-I606 PolarHBondContact N-O 3.41Å
549	N	75.2	Confident	79.1	Confident	53 Å²	53	42.6 Å²	42.6	28%	0.283	23%	0.225	S	C	.	.			trans	-63.8	111.2	-173.5	-170	-19.1	0	0	0	112.4	T547 L551 K552 I553	T547-N549 PolarHBondContact O-N 3.15Å; T547-N549 VanDerWaalsContact O-N 3.1Å; N549-L551 VanDerWaalsContact C-N 3.33Å; N549-L551 PolarHBondContact O-N 3.15Å; N549-L551 WeakPolarHBondContact OD1-CB 3.3Å; N549-L551 PolarHBondContact OD1-N 2.73Å; N549-K552 HydrophobicContact CB-CG 4.47Å; N549-K552 PolarHBondContact O-N 3.34Å; N549-I553 PolarHBondContact O-N 3.48Å
550	V	79.2	Confident	78.3	Confident	102 Å²	102	43.2 Å²	43.2	62%	0.618	23%	0.229	S	C	*	.	H	α-helix	trans	-67.5	-31.3	-176.3	-177	0	0	0	0	112.5	G548 K552 I553 Q554	G548-V550 PolarHBondContact O-N 3.14Å; V550-K552 VanDerWaalsContact C-N 3.33Å; V550-K552 PolarHBondContact O-N 2.76Å; V550-I553 PolarHBondContact O-N 3.4Å; V550-Q554 PolarHBondContact O-N 3.47Å
551	L	82	Confident	77.5	Confident	115 Å²	115	45.2 Å²	45.2	60%	0.602	25%	0.247	S	C	*	.	H	α-helix	trans	-63.3	-43.1	179.7	-65.9	171.8	0	0	0	110.7	N549 Q554 D555	N549-L551 VanDerWaalsContact C-N 3.33Å; N549-L551 PolarHBondContact O-N 3.15Å; N549-L551 WeakPolarHBondContact OD1-CB 3.3Å; N549-L551 PolarHBondContact OD1-N 2.73Å; L551-Q554 WeakPolarHBondContact O-CB 3.49Å; L551-Q554 PolarHBondContact O-N 3.32Å; L551-Q554 VanDerWaalsContact O-N 3.11Å; L551-D555 PolarHBondContact O-N 2.9Å
552	K	78.8	Confident	76.7	Confident	39 Å²	39	47.9 Å²	47.9	17%	0.17	26%	0.263	C	S	.	.	H	α-helix	trans	-67.5	-37.6	176.6	-65.6	-67.4	177.2	168	0	112.1	E540 Y544 N549 V550 Q554 D555 L556 I606	E540-K552 VanDerWaalsContact OE1-CD 3.24Å; E540-K552 WeakPolarHBondContact OE1-CD 3.06Å; E540-K552 IonicContact OE1-NZ 2.76Å; E540-K552 PolarHBondContact OE1-NZ 3.05Å; Y544-K552 HydrophobicContact CD1-CG 4.15Å; Y544-K552 HydrophobicContact CD2-CB 4.46Å; Y544-K552 HydrophobicContact CD2-CD 3.88Å; Y544-K552 HydrophobicContact CD2-CG 3.82Å; Y544-K552 HydrophobicContact CE1-CG 4.19Å; Y544-K552 HydrophobicContact CE2-CD 3.59Å; Y544-K552 HydrophobicContact CE2-CG 3.89Å; Y544-K552 HydrophobicContact CG-CG 3.98Å; Y544-K552 WeakPolarHBondContact OH-CE 3.2Å; Y544-K552 PolarHBondContact OH-NZ 2.96Å; N549-K552 HydrophobicContact CB-CG 4.47Å; N549-K552 PolarHBondContact O-N 3.34Å; V550-K552 VanDerWaalsContact C-N 3.33Å; V550-K552 PolarHBondContact O-N 2.76Å; K552-Q554 VanDerWaalsContact C-N 3.27Å; K552-Q554 PolarHBondContact O-N 3.48Å; K552-D555 PolarHBondContact O-N 3.35Å; K552-L556 WeakPolarHBondContact O-CB 3.11Å; K552-L556 VanDerWaalsContact O-CG 3.25Å; K552-L556 WeakPolarHBondContact O-CG 3.15Å; K552-L556 PolarHBondContact O-N 3.11Å; K552-I606 HydrophobicContact CB-CD1 4.26Å
553	I	81.1	Confident	75.2	Confident	14 Å²	14	57.6 Å²	57.6	7%	0.072	30%	0.3	C	S	.	.	H	α-helix	trans	-60.3	-40.7	171.4	-64.7	170.7	0	0	0	110.5	N549 V550 L556 L557 I603 I606 L620	N549-I553 PolarHBondContact O-N 3.48Å; V550-I553 PolarHBondContact O-N 3.4Å; I553-L556 PolarHBondContact O-N 3.39Å; I553-L557 HydrophobicContact CG2-CD1 4.01Å; I553-L557 HydrophobicContact CG2-CG 4.36Å; I553-L557 WeakPolarHBondContact O-CB 3.08Å; I553-L557 WeakPolarHBondContact O-CG 3.5Å; I553-L557 PolarHBondContact O-N 3.12Å; I553-I603 HydrophobicContact CG2-CG1 4.43Å; I553-I603 HydrophobicContact CG2-CG2 4.22Å; I553-I606 HydrophobicContact CD1-CB 4.5Å; I553-I606 HydrophobicContact CD1-CG2 4.01Å; I553-I606 HydrophobicContact CG1-CB 4.27Å; I553-I606 HydrophobicContact CG1-CD1 4.45Å; I553-I606 HydrophobicContact CG1-CG2 3.95Å; I553-L620 HydrophobicContact CG2-CD1 4.39Å
554	Q	83	Confident	73.7	Confident	122 Å²	122	59.8 Å²	59.8	57%	0.57	31%	0.313	S	S	*	.	H	α-helix	trans	-65.1	-42	177.4	-176.6	176.8	-13.4	0	0	112.4	V550 L551 K552 L557 F558	V550-Q554 PolarHBondContact O-N 3.47Å; L551-Q554 WeakPolarHBondContact O-CB 3.49Å; L551-Q554 PolarHBondContact O-N 3.32Å; L551-Q554 VanDerWaalsContact O-N 3.11Å; K552-Q554 VanDerWaalsContact C-N 3.27Å; K552-Q554 PolarHBondContact O-N 3.48Å; Q554-L557 PolarHBondContact O-N 3.29Å; Q554-F558 PolarHBondContact O-N 3.19Å
555	D	82.8	Confident	71.4	Confident	90 Å²	90	64.8 Å²	64.8	48%	0.481	34%	0.341	S	S	.	.	H	α-helix	trans	-65.4	-42.8	176.9	-68.1	-22.1	0	0	0	111.5	L551 K552 L557 F558 L559	L551-D555 PolarHBondContact O-N 2.9Å; K552-D555 PolarHBondContact O-N 3.35Å; D555-L557 VanDerWaalsContact C-N 3.35Å; D555-L557 PolarHBondContact O-N 3.02Å; D555-F558 WeakPolarHBondContact O-CB 3.39Å; D555-F558 PolarHBondContact O-N 3.38Å; D555-L559 PolarHBondContact O-N 2.8Å
556	L	80.5	Confident	69.8	Low	2 Å²	2	71 Å²	71	1%	0.01	37%	0.367	C	S	.	.	H	α-helix	trans	-64.6	-37.7	174.6	-68.8	175.9	0	0	0	112.1	T537 V541 K552 I553 L559 C560 A599 I603 I606	T537-L556 HydrophobicContact CG2-CD2 3.76Å; V541-L556 HydrophobicContact CG2-CD1 4.01Å; V541-L556 HydrophobicContact CG2-CD2 4.09Å; K552-L556 WeakPolarHBondContact O-CB 3.11Å; K552-L556 VanDerWaalsContact O-CG 3.25Å; K552-L556 WeakPolarHBondContact O-CG 3.15Å; K552-L556 PolarHBondContact O-N 3.11Å; I553-L556 PolarHBondContact O-N 3.39Å; L556-L559 WeakPolarHBondContact O-CB 3.25Å; L556-L559 PolarHBondContact O-N 3.34Å; L556-C560 PolarHBondContact O-N 3.48Å; L556-C560 PolarHBondContact O-SG 2.9Å; L556-A599 HydrophobicContact CB-CB 4.33Å; L556-A599 HydrophobicContact CD2-CB 3.92Å; L556-I603 HydrophobicContact CB-CG1 4.16Å; L556-I603 HydrophobicContact CD1-CG1 4.47Å; L556-I606 HydrophobicContact CD1-CD1 3.58Å
557	L	80.4	Confident	68.1	Low	50 Å²	50	77.6 Å²	77.6	26%	0.262	39%	0.391	S	S	.	.	H	α-helix	trans	-65.4	-40	173.5	-77.2	170.3	0	0	0	111.6	I553 Q554 D555 L559 C560 S561 I603 L620	I553-L557 HydrophobicContact CG2-CD1 4.01Å; I553-L557 HydrophobicContact CG2-CG 4.36Å; I553-L557 WeakPolarHBondContact O-CB 3.08Å; I553-L557 WeakPolarHBondContact O-CG 3.5Å; I553-L557 PolarHBondContact O-N 3.12Å; Q554-L557 PolarHBondContact O-N 3.29Å; D555-L557 VanDerWaalsContact C-N 3.35Å; D555-L557 PolarHBondContact O-N 3.02Å; L557-L559 VanDerWaalsContact C-N 3.32Å; L557-C560 WeakPolarHBondContact O-CB 3.35Å; L557-C560 PolarHBondContact O-N 3.32Å; L557-S561 WeakPolarHBondContact O-CB 3.43Å; L557-S561 PolarHBondContact O-N 3.02Å; L557-I603 HydrophobicContact CD2-CD1 3.61Å; L557-I603 HydrophobicContact CG-CD1 3.95Å; L557-L620 HydrophobicContact CD1-CD1 4.05Å; L557-L620 HydrophobicContact CD1-CD2 4.08Å
558	F	81.5	Confident	66.3	Low	144 Å²	144	83.2 Å²	83.2	63%	0.632	42%	0.415	S	S	*	.	H	α-helix	trans	-60.9	-45.5	174.3	-176.9	-100.3	0	0	0	110.3	Q554 D555 C560 S561 T562	Q554-F558 PolarHBondContact O-N 3.19Å; D555-F558 WeakPolarHBondContact O-CB 3.39Å; D555-F558 PolarHBondContact O-N 3.38Å; F558-C560 VanDerWaalsContact C-N 3.34Å; F558-C560 PolarHBondContact O-N 3.43Å; F558-S561 WeakPolarHBondContact O-CA 3.47Å; F558-S561 WeakPolarHBondContact O-CB 3.4Å; F558-S561 PolarHBondContact O-N 3.29Å; F558-S561 PolarHBondContact O-OG 2.76Å; F558-T562 HydrophobicContact CD1-CG2 4.25Å; F558-T562 HydrophobicContact CE1-CG2 3.89Å; F558-T562 HydrophobicContact CZ-CG2 4.25Å; F558-T562 PolarHBondContact O-N 2.75Å; F558-T562 VanDerWaalsContact O-N 3.12Å
559	L	77.4	Confident	64.5	Low	37 Å²	37	91.3 Å²	91.3	19%	0.194	45%	0.451	C	S	.	.	H	α-helix	trans	-58.7	-43.7	176	-168.6	60.5	0	0	0	112.2	T537 D555 L556 L557 S561 T562 E595 A599	T537-L559 HydrophobicContact CG2-CD2 3.79Å; D555-L559 PolarHBondContact O-N 2.8Å; L556-L559 WeakPolarHBondContact O-CB 3.25Å; L556-L559 PolarHBondContact O-N 3.34Å; L557-L559 VanDerWaalsContact C-N 3.32Å; L559-S561 PolarHBondContact O-N 3.04Å; L559-T562 PolarHBondContact O-N 3.06Å; L559-T562 PolarHBondContact O-OG1 2.99Å; L559-E595 HydrophobicContact CD1-CG 4.38Å; L559-E595 WeakPolarHBondContact CD1-OE1 3.43Å; L559-E595 HydrophobicContact CD2-CG 3.72Å; L559-E595 HydrophobicContact CG-CG 4.21Å; L559-A599 HydrophobicContact CD2-CB 4.26Å
560	C	68.3	Low	62.4	Low	12 Å²	12	95.4 Å²	95.4	8%	0.081	47%	0.466	C	S	.	.	H	α-helix	trans	-62	-27.3	173.7	-67.2	0	0	0	0	113.4	L556 L557 F558 L624	L556-C560 PolarHBondContact O-N 3.48Å; L556-C560 PolarHBondContact O-SG 2.9Å; L557-C560 WeakPolarHBondContact O-CB 3.35Å; L557-C560 PolarHBondContact O-N 3.32Å; F558-C560 VanDerWaalsContact C-N 3.34Å; F558-C560 PolarHBondContact O-N 3.43Å; C560-L624 HydrophobicContact CB-CD1 4.15Å
561	S	66.2	Low	60.1	Low	74 Å²	74	95.3 Å²	95.3	52%	0.517	47%	0.47	S	S	.	.	H	α-helix	trans	-86.2	-19.5	-178.2	79.9	0	0	0	0	113.8	L557 F558 L559 R563	L557-S561 WeakPolarHBondContact O-CB 3.43Å; L557-S561 PolarHBondContact O-N 3.02Å; F558-S561 WeakPolarHBondContact O-CA 3.47Å; F558-S561 WeakPolarHBondContact O-CB 3.4Å; F558-S561 PolarHBondContact O-N 3.29Å; F558-S561 PolarHBondContact O-OG 2.76Å; L559-S561 PolarHBondContact O-N 3.04Å; S561-R563 PolarHBondContact O-N 3.21Å
562	T	64.6	Low	57.4	Low	56 Å²	56	96.2 Å²	96.2	34%	0.344	48%	0.48	S	S	.	.			trans	-67.1	98.4	179	57.7	0	0	0	0	110	F558 L559 T564 Q596	F558-T562 HydrophobicContact CD1-CG2 4.25Å; F558-T562 HydrophobicContact CE1-CG2 3.89Å; F558-T562 HydrophobicContact CZ-CG2 4.25Å; F558-T562 PolarHBondContact O-N 2.75Å; F558-T562 VanDerWaalsContact O-N 3.12Å; L559-T562 PolarHBondContact O-N 3.06Å; L559-T562 PolarHBondContact O-OG1 2.99Å; T562-T564 PolarHBondContact O-N 2.76Å; T562-Q596 PolarHBondContact O-NE2 3.06Å
563	R	50	Low	55.1	Low	204 Å²	204	97.5 Å²	97.5	77%	0.77	51%	0.505	S	S	*	.			trans	-58.5	122.3	171	-65.5	-178.6	-177.5	175.4	1.2	107.4	S561 N565	S561-R563 PolarHBondContact O-N 3.21Å; R563-N565 PolarHBondContact O-N 3.15Å
564	T	49.2	Very low	52.6	Low	47 Å²	47	106.8 Å²	106.8	29%	0.288	55%	0.548	S	S	.	.			trans	-63.1	110.4	169.2	42.6	0	0	0	0	107.4	T562 K566	T562-T564 PolarHBondContact O-N 2.76Å; T564-K566 PolarHBondContact O-N 2.95Å
565	N	30.9	Very low	50.2	Low	126 Å²	126	108.1 Å²	108.1	67%	0.674	55%	0.552	S	S	*	*	G	3₁₀ helix	trans	-58.8	10.2	-174.5	-89	-17.4	0	0	0	115.5	R563 Q567	R563-N565 PolarHBondContact O-N 3.15Å; N565-Q567 VanDerWaalsContact C-N 3.27Å; N565-Q567 PolarHBondContact O-N 3.07Å
566	K	40.9	Very low	47.8	Very low	135 Å²	135	109.9 Å²	109.9	59%	0.587	56%	0.561	S	S	*	*	G	3₁₀ helix	trans	-69.9	-17.3	-179.7	-68.3	-173.9	-178.1	179.8	0	113.5	T564 D590	T564-K566 PolarHBondContact O-N 2.95Å; K566-D590 IonicContact NZ-OD2 2.76Å; K566-D590 PolarHBondContact NZ-OD2 3.22Å
567	Q	35.2	Very low	45.7	Very low	166 Å²	166	118.7 Å²	118.7	78%	0.776	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-82.7	-26.6	-179.4	-69.7	-169.9	2.7	0	0	114.7	N565 Q569 K570	N565-Q567 VanDerWaalsContact C-N 3.27Å; N565-Q567 PolarHBondContact O-N 3.07Å; Q567-Q569 VanDerWaalsContact C-N 3.35Å; Q567-Q569 PolarHBondContact O-N 3.24Å; Q567-K570 PolarHBondContact O-N 3.04Å
568	E	33.7	Very low	43.5	Very low	153 Å²	153	125.1 Å²	125.1	72%	0.715	63%	0.625	S	S	*	*	G	3₁₀ helix	trans	-73.7	-23.2	-177.1	-71.8	-171.8	166.1	0	0	113.7	S571	E568-S571 PolarHBondContact O-OG 3.03Å
569	Q	33.5	Very low	40.9	Very low	176 Å²	176	123 Å²	123	82%	0.822	62%	0.618	S	S	*	*	G	3₁₀ helix	trans	-83.1	-7.1	176.2	-71	-175.8	-1.4	0	0	114.6	Q567 S571	Q567-Q569 VanDerWaalsContact C-N 3.35Å; Q567-Q569 PolarHBondContact O-N 3.24Å; Q569-S571 VanDerWaalsContact C-N 3.31Å; Q569-S571 PolarHBondContact O-N 3.21Å
570	K	31.9	Very low	38.4	Very low	140 Å²	140	127.5 Å²	127.5	61%	0.609	64%	0.636	S	S	*	*	G	3₁₀ helix	trans	-87.6	11.6	-179.5	-74.7	-172.6	179	-177.9	0	114.1	Q567 T572	Q567-K570 PolarHBondContact O-N 3.04Å; K570-T572 VanDerWaalsContact C-N 3.33Å; K570-T572 PolarHBondContact O-N 3.36Å
571	S	29.4	Very low	36.6	Very low	100 Å²	100	134.6 Å²	134.6	70%	0.699	67%	0.665	S	S	*	*	S	Bend	trans	-88.3	34.4	-180	60.9	0	0	0	0	115	E568 Q569	E568-S571 PolarHBondContact O-OG 3.03Å; Q569-S571 VanDerWaalsContact C-N 3.31Å; Q569-S571 PolarHBondContact O-N 3.21Å
572	T	26.9	Very low	34.8	Very low	133 Å²	133	138.9 Å²	138.9	82%	0.816	67%	0.674	S	S	*	*	S	Bend	trans	-158.6	96.4	163.7	42.3	0	0	0	0	110.5	K570	K570-T572 VanDerWaalsContact C-N 3.33Å; K570-T572 PolarHBondContact O-N 3.36Å
573	G	29.7	Very low	32.9	Very low	66 Å²	66	140 Å²	140	68%	0.68	68%	0.675	S	S	*	*			trans	146.7	106.6	167.8	0	0	0	0	0	114.2	K575	G573-K575 PolarHBondContact O-N 3.32Å
574	E	28.6	Very low	32.1	Very low	210 Å²	210	132.9 Å²	132.9	98%	0.981	66%	0.657	S	S	*	*			trans	-64.2	110.2	164.1	-78.1	179.5	135.3	0	0	109.5
575	K	32.9	Very low	31.5	Very low	150 Å²	150	136.5 Å²	136.5	65%	0.652	67%	0.671	S	S	*	*			trans	-119.5	144.6	165.4	-73.8	-171.6	177.8	-176.9	0	111.1	G573	G573-K575 PolarHBondContact O-N 3.32Å
576	D	31.6	Very low	31.6	Very low	127 Å²	127	133.4 Å²	133.4	68%	0.679	66%	0.659	S	S	*	*			trans	-57.1	146	-163.4	-83.7	-47	0	0	0	116.3	K578 E579 K580	D576-K578 PolarHBondContact O-N 2.76Å; D576-E579 PolarHBondContact O-N 2.9Å; D576-E579 VanDerWaalsContact O-N 3.1Å; D576-K580 PolarHBondContact O-N 2.78Å
577	K	37.3	Very low	31.7	Very low	186 Å²	186	130.4 Å²	130.4	81%	0.809	65%	0.649	S	S	*	*	H	α-helix	trans	-57.5	-17.2	179.4	-77	178.4	177.3	174.1	0	115.3
578	K	33.6	Very low	32.3	Very low	185 Å²	185	127.2 Å²	127.2	80%	0.804	63%	0.63	S	S	*	*	H	α-helix	trans	-84.2	-34.6	176.6	-91.2	-177	176.5	177.1	0	112.9	D576 K581	D576-K578 PolarHBondContact O-N 2.76Å; K578-K581 PolarHBondContact O-N 3.4Å
579	E	26.4	Very low	33.1	Very low	101 Å²	101	123.9 Å²	123.9	47%	0.472	61%	0.613	S	S	.	*	H	α-helix	trans	-68.7	-40.1	171.7	-73.9	-174.2	158.4	0	0	109.9	D576 K581 K582 E583	D576-E579 PolarHBondContact O-N 2.9Å; D576-E579 VanDerWaalsContact O-N 3.1Å; E579-K581 PolarHBondContact O-N 3.16Å; E579-K581 VanDerWaalsContact O-N 3.12Å; E579-K582 PolarHBondContact O-N 3.08Å; E579-K582 VanDerWaalsContact O-N 3.08Å; E579-E583 WeakPolarHBondContact O-CB 3.36Å; E579-E583 WeakPolarHBondContact O-CG 2.92Å; E579-E583 PolarHBondContact O-N 3.3Å
580	K	26.6	Very low	34.1	Very low	131 Å²	131	116.9 Å²	116.9	57%	0.57	58%	0.582	S	S	*	*	H	α-helix	trans	-54.8	-32.1	174	-78.4	-175.8	176.2	179.3	0	115	D576 S584	D576-K580 PolarHBondContact O-N 2.78Å; K580-S584 VanDerWaalsContact O-CB 3.25Å; K580-S584 WeakPolarHBondContact O-CB 3.3Å; K580-S584 PolarHBondContact O-N 3.08Å; K580-S584 PolarHBondContact O-OG 3.25Å
581	K	29.4	Very low	35.4	Very low	161 Å²	161	111.1 Å²	111.1	70%	0.7	56%	0.559	S	S	*	*	H	α-helix	trans	-75.9	-38.2	177	-91.7	-173.2	173.8	-173.7	0	112.9	K578 E579 S584 E585	K578-K581 PolarHBondContact O-N 3.4Å; E579-K581 PolarHBondContact O-N 3.16Å; E579-K581 VanDerWaalsContact O-N 3.12Å; K581-S584 WeakPolarHBondContact CA-OG 3.34Å; K581-S584 PolarHBondContact O-OG 2.74Å; K581-E585 PolarHBondContact O-N 3.48Å
582	K	27.5	Very low	36.9	Very low	164 Å²	164	107.9 Å²	107.9	71%	0.713	54%	0.536	S	S	*	.	H	α-helix	trans	-73.9	-37.5	174.7	-76.1	-174.5	173.3	-173.8	0	111.8	E579 S584 E585 S586	E579-K582 PolarHBondContact O-N 3.08Å; E579-K582 VanDerWaalsContact O-N 3.08Å; K582-S584 VanDerWaalsContact C-N 3.31Å; K582-S584 PolarHBondContact O-N 3.12Å; K582-E585 PolarHBondContact O-N 3.19Å; K582-E585 VanDerWaalsContact O-N 3.16Å; K582-S586 PolarHBondContact O-N 3.49Å; K582-S586 PolarHBondContact O-OG 3.41Å
583	E	24.7	Very low	38.8	Very low	78 Å²	78	102.6 Å²	102.6	36%	0.364	50%	0.502	S	S	.	.	H	α-helix	trans	-62.6	-38.5	171.9	-72.9	-179.8	169.3	0	0	111.2	E579 E585 S586 D587	E579-E583 WeakPolarHBondContact O-CB 3.36Å; E579-E583 WeakPolarHBondContact O-CG 2.92Å; E579-E583 PolarHBondContact O-N 3.3Å; E583-E585 PolarHBondContact O-N 3.1Å; E583-S586 WeakPolarHBondContact CA-OG 3.44Å; E583-S586 PolarHBondContact O-N 3Å; E583-S586 PolarHBondContact O-OG 3.36Å; E583-D587 VanDerWaalsContact O-CB 3.32Å; E583-D587 WeakPolarHBondContact O-CB 3.36Å; E583-D587 VanDerWaalsContact O-CG 3.29Å; E583-D587 PolarHBondContact O-N 2.8Å
584	S	33.5	Very low	40.8	Very low	56 Å²	56	100.2 Å²	100.2	39%	0.392	47%	0.474	S	S	.	.	H	α-helix	trans	-69.8	-13	175.2	70.6	0	0	0	0	115	K580 K581 K582 R588	K580-S584 VanDerWaalsContact O-CB 3.25Å; K580-S584 WeakPolarHBondContact O-CB 3.3Å; K580-S584 PolarHBondContact O-N 3.08Å; K580-S584 PolarHBondContact O-OG 3.25Å; K581-S584 WeakPolarHBondContact CA-OG 3.34Å; K581-S584 PolarHBondContact O-OG 2.74Å; K582-S584 VanDerWaalsContact C-N 3.31Å; K582-S584 PolarHBondContact O-N 3.12Å; S584-R588 WeakPolarHBondContact O-CG 3.45Å; S584-R588 PolarHBondContact O-NE 3.47Å
585	E	36.3	Very low	43.1	Very low	122 Å²	122	91.3 Å²	91.3	57%	0.57	43%	0.432	S	S	*	.	H	α-helix	trans	-90.9	-39.6	170.2	-77.3	177.5	173.5	0	0	110.8	K581 K582 E583 R588 F589	K581-E585 PolarHBondContact O-N 3.48Å; K582-E585 PolarHBondContact O-N 3.19Å; K582-E585 VanDerWaalsContact O-N 3.16Å; E583-E585 PolarHBondContact O-N 3.1Å; E585-R588 WeakPolarHBondContact O-CB 3.31Å; E585-R588 PolarHBondContact O-N 3Å; E585-F589 WeakPolarHBondContact O-CD2 3.44Å; E585-F589 WeakPolarHBondContact O-CE2 3.12Å
586	S	34.9	Very low	45.2	Very low	62 Å²	62	84.4 Å²	84.4	43%	0.434	40%	0.402	S	S	.	.	H	α-helix	trans	-69.7	-33.6	175.9	57.1	0	0	0	0	113.5	K582 E583 R588 F589	K582-S586 PolarHBondContact O-N 3.49Å; K582-S586 PolarHBondContact O-OG 3.41Å; E583-S586 WeakPolarHBondContact CA-OG 3.44Å; E583-S586 PolarHBondContact O-N 3Å; E583-S586 PolarHBondContact O-OG 3.36Å; S586-R588 PolarHBondContact O-N 3.4Å; S586-F589 PolarHBondContact O-N 3.16Å
587	D	41.7	Very low	47.4	Very low	71 Å²	71	78.7 Å²	78.7	38%	0.38	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-67.8	-17.3	176.8	-76.3	-8.1	0	0	0	112.2	E583 F589	E583-D587 VanDerWaalsContact O-CB 3.32Å; E583-D587 WeakPolarHBondContact O-CB 3.36Å; E583-D587 VanDerWaalsContact O-CG 3.29Å; E583-D587 PolarHBondContact O-N 2.8Å; D587-F589 PolarHBondContact O-N 3.06Å
588	R	48.9	Very low	49.5	Very low	100 Å²	100	69.9 Å²	69.9	38%	0.377	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-70.9	-19.6	176	-65.6	-179.9	-170.2	-149.8	1.1	113.5	S584 E585 S586 E666	S584-R588 WeakPolarHBondContact O-CG 3.45Å; S584-R588 PolarHBondContact O-NE 3.47Å; E585-R588 WeakPolarHBondContact O-CB 3.31Å; E585-R588 PolarHBondContact O-N 3Å; S586-R588 PolarHBondContact O-N 3.4Å; R588-E666 IonicContact NH1-OE1 3.81Å
589	F	49.3	Very low	51.9	Low	82 Å²	82	61.1 Å²	61.1	36%	0.36	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-104.1	6.6	-171.7	-64.9	-84.1	0	0	0	113.4	K495 E585 S586 D587 P591	K495-F589 HydrophobicContact CB-CB 4.39Å; K495-F589 HydrophobicContact CD-CB 4.49Å; E585-F589 WeakPolarHBondContact O-CD2 3.44Å; E585-F589 WeakPolarHBondContact O-CE2 3.12Å; S586-F589 PolarHBondContact O-N 3.16Å; D587-F589 PolarHBondContact O-N 3.06Å; F589-P591 VanDerWaalsContact O-CD 3.3Å; F589-P591 WeakPolarHBondContact O-CD 3.43Å
590	D	54.4	Low	54.6	Low	30 Å²	30	56.3 Å²	56.3	16%	0.16	27%	0.274	C	S	.	.			trans	-73.9	116.1	178	-91	4.4	0	0	0	110.2	K566 S592 I593	K566-D590 IonicContact NZ-OD2 2.76Å; K566-D590 PolarHBondContact NZ-OD2 3.22Å; D590-S592 PolarHBondContact O-N 2.92Å; D590-I593 HydrophobicContact CB-CD1 3.93Å; D590-I593 HydrophobicContact CB-CG1 4.16Å; D590-I593 WeakPolarHBondContact O-CB 3.25Å; D590-I593 PolarHBondContact O-N 3.09Å
591	P	59.6	Low	57.3	Low	18 Å²	18	50 Å²	50	12%	0.117	25%	0.247	C	C	.	.	H	α-helix	trans	-67.7	-21.6	-173.1	23.8	-30.3	0	0	0	113.7	S530 F531 F589 I593 M594 E595	S530-P591 WeakPolarHBondContact O-CB 3.48Å; S530-P591 WeakPolarHBondContact O-CG 3.32Å; F531-P591 HydrophobicContact CD2-CB 4.5Å; F589-P591 VanDerWaalsContact O-CD 3.3Å; F589-P591 WeakPolarHBondContact O-CD 3.43Å; P591-I593 PolarHBondContact O-N 2.78Å; P591-M594 PolarHBondContact O-N 3.36Å; P591-E595 PolarHBondContact O-N 3.35Å
592	S	61.1	Low	59.8	Low	32 Å²	32	42.4 Å²	42.4	22%	0.224	21%	0.213	C	C	.	.	H	α-helix	trans	-64.2	-26.2	171.7	-59.5	0	0	0	0	113.7	S530 D590	S530-S592 WeakPolarHBondContact CB-OG 3.44Å; S530-S592 PolarHBondContact OG-OG 3.45Å; D590-S592 PolarHBondContact O-N 2.92Å
593	I	66.3	Low	62.5	Low	22 Å²	22	34.6 Å²	34.6	11%	0.113	18%	0.18	C	C	.	.	H	α-helix	trans	-80.2	-30.3	177.6	-62.8	177.8	0	0	0	110.3	D590 P591 H631	D590-I593 HydrophobicContact CB-CD1 3.93Å; D590-I593 HydrophobicContact CB-CG1 4.16Å; D590-I593 WeakPolarHBondContact O-CB 3.25Å; D590-I593 PolarHBondContact O-N 3.09Å; P591-I593 PolarHBondContact O-N 2.78Å; I593-H631 HydrophobicContact CG2-CB 3.56Å; I593-H631 WeakPolarHBondContact CG2-CD2 3.42Å
594	M	71.4	Confident	65.3	Low	16 Å²	16	30.9 Å²	30.9	8%	0.079	16%	0.162	C	C	.	.	H	α-helix	trans	-76.9	-28	176.9	-67.7	-171.1	168.5	0	0	112.9	R500 F534 P591 Q596 A597 V598 D751	R500-M594 VanDerWaalsContact CZ-CE 3.48Å; R500-M594 PolarHBondContact NE-SD 3.21Å; R500-M594 VanDerWaalsContact NH1-CE 3.27Å; R500-M594 PolarHBondContact NH1-SD 2.95Å; F534-M594 HydrophobicContact CD2-CB 3.91Å; F534-M594 HydrophobicContact CE2-CB 3.68Å; P591-M594 PolarHBondContact O-N 3.36Å; M594-Q596 PolarHBondContact O-N 3.02Å; M594-A597 PolarHBondContact O-N 3.07Å; M594-V598 WeakPolarHBondContact O-CG2 3.38Å; M594-V598 PolarHBondContact O-N 3.29Å; M594-D751 WeakPolarHBondContact CE-OD1 3.23Å; M594-D751 VanDerWaalsContact CE-OD2 3.29Å; M594-D751 WeakPolarHBondContact CE-OD2 3.47Å
595	E	77.5	Confident	67.5	Low	24 Å²	24	28.3 Å²	28.3	11%	0.112	14%	0.144	C	C	.	.	H	α-helix	trans	-54.6	-44	171.7	-179.6	176.1	-176.6	0	0	111.1	S533 F534 T537 L559 P591 V598 A599	S533-E595 WeakPolarHBondContact CB-OE1 3.5Å; S533-E595 VanDerWaalsContact CB-OE2 3.3Å; S533-E595 WeakPolarHBondContact CB-OE2 3.08Å; S533-E595 PolarHBondContact OG-OE2 2.61Å; F534-E595 HydrophobicContact CB-CB 4.38Å; F534-E595 HydrophobicContact CD2-CB 4.43Å; T537-E595 PolarHBondContact OG1-OE1 3.2Å; L559-E595 HydrophobicContact CD1-CG 4.38Å; L559-E595 WeakPolarHBondContact CD1-OE1 3.43Å; L559-E595 HydrophobicContact CD2-CG 3.72Å; L559-E595 HydrophobicContact CG-CG 4.21Å; P591-E595 PolarHBondContact O-N 3.35Å; E595-V598 PolarHBondContact O-N 3.05Å; E595-A599 WeakPolarHBondContact O-CB 3.19Å; E595-A599 PolarHBondContact O-N 3.14Å
596	Q	77	Confident	69.7	Low	5 Å²	5	22.6 Å²	22.6	2%	0.023	12%	0.117	C	C	.	.	H	α-helix	trans	-63.4	-43.7	174.4	-62	-178.7	-8.7	0	0	111.7	T562 M594 V598 A599 V600 V632	T562-Q596 PolarHBondContact O-NE2 3.06Å; M594-Q596 PolarHBondContact O-N 3.02Å; Q596-V598 VanDerWaalsContact C-N 3.34Å; Q596-V598 PolarHBondContact O-N 3.2Å; Q596-A599 PolarHBondContact O-N 3.18Å; Q596-V600 VanDerWaalsContact O-CG2 3.31Å; Q596-V600 WeakPolarHBondContact O-CG2 3.48Å; Q596-V600 PolarHBondContact O-N 3.14Å; Q596-V632 HydrophobicContact CB-CG2 3.79Å
597	A	78.6	Confident	71.9	Confident	7 Å²	7	19.6 Å²	19.6	6%	0.058	10%	0.097	C	C	.	.	H	α-helix	trans	-63.9	-38.5	179.4	0	0	0	0	0	112.6	M594 V600 L601 A635 L750	M594-A597 PolarHBondContact O-N 3.07Å; A597-V600 PolarHBondContact O-N 3.07Å; A597-L601 PolarHBondContact O-N 3.23Å; A597-A635 HydrophobicContact CB-CB 4.04Å; A597-L750 HydrophobicContact CB-CD1 4.33Å; A597-L750 HydrophobicContact CB-CD2 4.15Å
598	V	81.6	Confident	73.5	Confident	1 Å²	1	17.1 Å²	17.1	1%	0.006	8%	0.083	C	C	.	.	H	α-helix	trans	-67.5	-41.7	174.7	169.8	0	0	0	0	111.3	F534 T537 L538 M594 E595 Q596 V600 L601 G602 F747 L750	F534-V598 HydrophobicContact CD2-CG2 4.24Å; F534-V598 HydrophobicContact CE2-CB 4.41Å; F534-V598 HydrophobicContact CE2-CG2 3.45Å; F534-V598 VanDerWaalsContact CE2-CG2 3.45Å; F534-V598 HydrophobicContact CZ-CG2 4.13Å; T537-V598 HydrophobicContact CG2-CG1 4.49Å; L538-V598 HydrophobicContact CB-CG1 4.17Å; L538-V598 HydrophobicContact CD1-CG1 3.48Å; L538-V598 VanDerWaalsContact CD1-CG1 3.48Å; L538-V598 HydrophobicContact CD1-CG2 4.25Å; L538-V598 HydrophobicContact CG-CG1 4.44Å; M594-V598 WeakPolarHBondContact O-CG2 3.38Å; M594-V598 PolarHBondContact O-N 3.29Å; E595-V598 PolarHBondContact O-N 3.05Å; Q596-V598 VanDerWaalsContact C-N 3.34Å; Q596-V598 PolarHBondContact O-N 3.2Å; V598-V600 PolarHBondContact O-N 3.14Å; V598-L601 PolarHBondContact O-N 3.47Å; V598-L601 VanDerWaalsContact O-N 3.16Å; V598-G602 PolarHBondContact O-N 3.13Å; V598-F747 HydrophobicContact CG2-CD2 4.27Å; V598-F747 HydrophobicContact CG2-CE2 3.78Å; V598-L750 HydrophobicContact CG2-CD1 4.1Å
599	A	82.9	Confident	74.4	Confident	0 Å²	0	13.3 Å²	13.3	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-58.1	-37.8	176.4	0	0	0	0	0	112.1	T537 L556 L559 E595 Q596 G602 I603	T537-A599 HydrophobicContact CG2-CB 4.32Å; L556-A599 HydrophobicContact CB-CB 4.33Å; L556-A599 HydrophobicContact CD2-CB 3.92Å; L559-A599 HydrophobicContact CD2-CB 4.26Å; E595-A599 WeakPolarHBondContact O-CB 3.19Å; E595-A599 PolarHBondContact O-N 3.14Å; Q596-A599 PolarHBondContact O-N 3.18Å; A599-G602 WeakPolarHBondContact O-CA 3.2Å; A599-G602 PolarHBondContact O-N 3.16Å; A599-I603 WeakPolarHBondContact O-CG1 3.23Å; A599-I603 PolarHBondContact O-N 2.96Å
600	V	84.4	Confident	75.5	Confident	0 Å²	0	11.9 Å²	11.9	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-66.4	-43.6	175.8	-179.5	0	0	0	0	112.6	Q596 A597 V598 G602 I603 A604 L621 L624 V632 A635 V636 A639	Q596-V600 VanDerWaalsContact O-CG2 3.31Å; Q596-V600 WeakPolarHBondContact O-CG2 3.48Å; Q596-V600 PolarHBondContact O-N 3.14Å; A597-V600 PolarHBondContact O-N 3.07Å; V598-V600 PolarHBondContact O-N 3.14Å; V600-G602 PolarHBondContact O-N 3.13Å; V600-I603 PolarHBondContact O-N 3.19Å; V600-A604 PolarHBondContact O-N 3.18Å; V600-L621 HydrophobicContact CG1-CD2 3.61Å; V600-L624 HydrophobicContact CB-CD2 4.21Å; V600-L624 HydrophobicContact CG1-CD2 3.74Å; V600-L624 HydrophobicContact CG2-CD2 3.38Å; V600-V632 HydrophobicContact CG2-CG1 3.85Å; V600-A635 HydrophobicContact CB-CB 4.04Å; V600-A635 HydrophobicContact CG1-CB 4.13Å; V600-V636 HydrophobicContact CG1-CG2 3.82Å; V600-A639 HydrophobicContact CG1-CB 3.99Å
601	L	83.4	Confident	76.4	Confident	0 Å²	0	14.7 Å²	14.7	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-61.9	-34.9	172	-70.5	-176.2	0	0	0	110.9	A597 V598 A604 L605 L638 A639 L642 L750	A597-L601 PolarHBondContact O-N 3.23Å; V598-L601 PolarHBondContact O-N 3.47Å; V598-L601 VanDerWaalsContact O-N 3.16Å; L601-A604 WeakPolarHBondContact O-CB 3.45Å; L601-A604 PolarHBondContact O-N 2.97Å; L601-L605 PolarHBondContact O-N 3.21Å; L601-L638 HydrophobicContact CD2-CB 3.75Å; L601-A639 HydrophobicContact CD2-CB 4.37Å; L601-L642 HydrophobicContact CD2-CD1 4.04Å; L601-L750 HydrophobicContact CD1-CD1 3.6Å; L601-L750 HydrophobicContact CD1-CD2 3.9Å; L601-L750 HydrophobicContact CD1-CG 3.76Å; L601-L750 HydrophobicContact CG-CD2 4.27Å
602	G	81.7	Confident	77.4	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-66.4	-38.3	177.9	0	0	0	0	0	114.5	V598 A599 V600 A604 L605 I606	V598-G602 PolarHBondContact O-N 3.13Å; A599-G602 WeakPolarHBondContact O-CA 3.2Å; A599-G602 PolarHBondContact O-N 3.16Å; V600-G602 PolarHBondContact O-N 3.13Å; G602-A604 PolarHBondContact O-N 2.98Å; G602-L605 PolarHBondContact O-N 3.16Å; G602-L605 VanDerWaalsContact O-N 3.08Å; G602-I606 VanDerWaalsContact O-CG1 3.29Å; G602-I606 WeakPolarHBondContact O-CG1 3.35Å; G602-I606 PolarHBondContact O-N 2.83Å
603	I	83.5	Confident	78.1	Confident	1 Å²	1	18.6 Å²	18.6	1%	0.005	10%	0.104	C	C	.	.	H	α-helix	trans	-57.3	-43.2	172.5	-65.6	164.6	0	0	0	110.2	I553 L556 L557 A599 V600 A607	I553-I603 HydrophobicContact CG2-CG1 4.43Å; I553-I603 HydrophobicContact CG2-CG2 4.22Å; L556-I603 HydrophobicContact CB-CG1 4.16Å; L556-I603 HydrophobicContact CD1-CG1 4.47Å; L557-I603 HydrophobicContact CD2-CD1 3.61Å; L557-I603 HydrophobicContact CG-CD1 3.95Å; A599-I603 WeakPolarHBondContact O-CG1 3.23Å; A599-I603 PolarHBondContact O-N 2.96Å; V600-I603 PolarHBondContact O-N 3.19Å; I603-A607 WeakPolarHBondContact O-CB 3.38Å; I603-A607 PolarHBondContact O-N 2.96Å; I603-A607 VanDerWaalsContact O-N 3.12Å
604	A	82.9	Confident	78.6	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-65.4	-39.5	175.8	0	0	0	0	0	112.7	V600 L601 G602 A607 L608 A639 L642 I643	V600-A604 PolarHBondContact O-N 3.18Å; L601-A604 WeakPolarHBondContact O-CB 3.45Å; L601-A604 PolarHBondContact O-N 2.97Å; G602-A604 PolarHBondContact O-N 2.98Å; A604-A607 PolarHBondContact O-N 2.84Å; A604-L608 WeakPolarHBondContact O-CG 3.45Å; A604-L608 PolarHBondContact O-N 3.01Å; A604-A639 HydrophobicContact CB-CB 3.75Å; A604-A639 VanDerWaalsContact CB-O 3.29Å; A604-A639 WeakPolarHBondContact CB-O 3.31Å; A604-L642 HydrophobicContact CB-CB 4.16Å; A604-I643 HydrophobicContact CB-CD1 4.01Å; A604-I643 HydrophobicContact CB-CG1 3.63Å
605	L	80.8	Confident	79.2	Confident	2 Å²	2	20.1 Å²	20.1	1%	0.01	12%	0.119	C	C	.	.	H	α-helix	trans	-71	-38.2	-177.1	-164.9	68.3	0	0	0	113.7	V541 A545 G546 L601 G602 L608 M739 F743	V541-L605 HydrophobicContact CG1-CB 4.38Å; V541-L605 HydrophobicContact CG1-CD2 3.79Å; A545-L605 HydrophobicContact CB-CD2 3.72Å; A545-L605 HydrophobicContact CB-CG 3.84Å; G546-L605 PolarHBondContact N-O 3.49Å; L601-L605 PolarHBondContact O-N 3.21Å; G602-L605 PolarHBondContact O-N 3.16Å; G602-L605 VanDerWaalsContact O-N 3.08Å; L605-L608 HydrophobicContact CD1-CD1 4.08Å; L605-M739 HydrophobicContact CD1-CE 3.59Å; L605-M739 HydrophobicContact CD1-CG 4.2Å; L605-M739 HydrophobicContact CD1-SD 3.14Å; L605-M739 WeakPolarHBondContact CD1-SD 3.28Å; L605-M739 HydrophobicContact CD2-CE 3.73Å; L605-M739 HydrophobicContact CD2-SD 4.43Å; L605-M739 HydrophobicContact CG-CE 4.16Å; L605-M739 HydrophobicContact CG-SD 4.28Å; L605-F743 HydrophobicContact CD2-CD2 4.01Å; L605-F743 HydrophobicContact CD2-CE2 4.03Å; L605-F743 HydrophobicContact CD2-CG 4.47Å; L605-F743 HydrophobicContact CD2-CZ 4.49Å
606	I	81.1	Confident	79.4	Confident	1 Å²	1	23.4 Å²	23.4	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-71.4	-40.7	175.6	-61.2	166.8	0	0	0	109.6	Y544 G548 K552 I553 L556 G602 L608	Y544-I606 WeakPolarHBondContact O-CG1 3.33Å; G548-I606 PolarHBondContact N-O 3.41Å; K552-I606 HydrophobicContact CB-CD1 4.26Å; I553-I606 HydrophobicContact CD1-CB 4.5Å; I553-I606 HydrophobicContact CD1-CG2 4.01Å; I553-I606 HydrophobicContact CG1-CB 4.27Å; I553-I606 HydrophobicContact CG1-CD1 4.45Å; I553-I606 HydrophobicContact CG1-CG2 3.95Å; L556-I606 HydrophobicContact CD1-CD1 3.58Å; G602-I606 VanDerWaalsContact O-CG1 3.29Å; G602-I606 WeakPolarHBondContact O-CG1 3.35Å; G602-I606 PolarHBondContact O-N 2.83Å; I606-L608 PolarHBondContact O-N 2.9Å
607	A	81.6	Confident	79.6	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-71.3	-13.7	-177.9	0	0	0	0	0	114.8	I603 A604 G609 E610 A614 S617	I603-A607 WeakPolarHBondContact O-CB 3.38Å; I603-A607 PolarHBondContact O-N 2.96Å; I603-A607 VanDerWaalsContact O-N 3.12Å; A604-A607 PolarHBondContact O-N 2.84Å; A607-G609 PolarHBondContact O-N 3.14Å; A607-E610 PolarHBondContact O-N 3.31Å; A607-E610 VanDerWaalsContact O-O 3.1Å; A607-A614 PolarHBondContact O-N 2.77Å; A607-S617 WeakPolarHBondContact CB-OG 3.49Å
608	L	75.1	Confident	79.9	Confident	18 Å²	18	24.9 Å²	24.9	9%	0.094	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-25.4	-179.6	-100.1	177.8	0	0	0	113.4	A604 L605 I606 L642 F727	A604-L608 WeakPolarHBondContact O-CG 3.45Å; A604-L608 PolarHBondContact O-N 3.01Å; L605-L608 HydrophobicContact CD1-CD1 4.08Å; I606-L608 PolarHBondContact O-N 2.9Å; L608-L642 VanDerWaalsContact CD2-O 3.27Å; L608-L642 WeakPolarHBondContact CD2-O 3.3Å; L608-F727 HydrophobicContact CB-CE2 3.8Å; L608-F727 HydrophobicContact CB-CZ 4.11Å; L608-F727 HydrophobicContact CD1-CE2 4.47Å; L608-F727 HydrophobicContact CD2-CE2 4.11Å; L608-F727 HydrophobicContact CG-CE2 4.35Å; L608-F727 WeakPolarHBondContact O-CE2 3.41Å
609	G	68.4	Low	80	Confident	21 Å²	21	32.3 Å²	32.3	22%	0.216	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-26.8	-179.1	0	0	0	0	0	114.8	A607	A607-G609 PolarHBondContact O-N 3.14Å
610	E	72.5	Confident	80.1	Confident	52 Å²	52	35.2 Å²	35.2	24%	0.243	18%	0.184	C	C	.	.			trans	-127.6	136.6	-173.7	-64.7	-174	168.9	0	0	112.6	A607 I612 G613 A614	A607-E610 PolarHBondContact O-N 3.31Å; A607-E610 VanDerWaalsContact O-O 3.1Å; E610-I612 VanDerWaalsContact C-N 3.29Å; E610-I612 PolarHBondContact O-N 3.45Å; E610-G613 PolarHBondContact O-N 3.41Å; E610-A614 WeakPolarHBondContact O-CB 3.11Å; E610-A614 PolarHBondContact O-N 2.89Å
611	D	73.5	Confident	80.1	Confident	89 Å²	89	35.2 Å²	35.2	48%	0.476	18%	0.184	S	C	.	.	H	α-helix	trans	-60.9	-39.4	172.6	-91.4	-49	0	0	0	112.8	S615 R731	D611-S615 WeakPolarHBondContact O-CB 3.49Å; D611-S615 PolarHBondContact O-N 3.08Å; D611-S615 PolarHBondContact O-OG 3.31Å; D611-R731 VanDerWaalsContact CG-NH2 3.28Å; D611-R731 IonicContact OD1-CZ 3.72Å; D611-R731 IonicContact OD1-NH1 3.82Å; D611-R731 PolarHBondContact OD1-NH1 3.37Å; D611-R731 IonicContact OD1-NH2 3.37Å; D611-R731 PolarHBondContact OD1-NH2 3.46Å; D611-R731 IonicContact OD2-CZ 2.72Å; D611-R731 IonicContact OD2-NE 3.47Å; D611-R731 IonicContact OD2-NH1 3.48Å; D611-R731 PolarHBondContact OD2-NH1 3.37Å; D611-R731 IonicContact OD2-NH2 3.18Å; D611-R731 PolarHBondContact OD2-NH2 3.17Å; D611-R731 VanDerWaalsContact OD2-NH2 3.11Å
612	I	79.7	Confident	80.1	Confident	119 Å²	119	36.1 Å²	36.1	61%	0.61	19%	0.193	S	C	*	.	H	α-helix	trans	-66.1	-49.5	178.3	-56.1	171.6	0	0	0	108.8	E610 A614 S615 M616	E610-I612 VanDerWaalsContact C-N 3.29Å; E610-I612 PolarHBondContact O-N 3.45Å; I612-A614 PolarHBondContact O-N 2.93Å; I612-S615 PolarHBondContact O-N 2.68Å; I612-S615 PolarHBondContact O-OG 2.86Å; I612-M616 HydrophobicContact CG2-CG 4.47Å; I612-M616 WeakPolarHBondContact O-CG 3.17Å; I612-M616 PolarHBondContact O-N 3.11Å
613	G	76.8	Confident	80.2	Confident	13 Å²	13	41.6 Å²	41.6	13%	0.134	22%	0.218	C	C	.	.	H	α-helix	trans	-55	-46.4	174.8	0	0	0	0	0	113.3	E610 S615 M616 S617	E610-G613 PolarHBondContact O-N 3.41Å; G613-S615 PolarHBondContact O-N 3.41Å; G613-M616 PolarHBondContact O-N 2.96Å; G613-S617 VanDerWaalsContact O-CB 3.22Å; G613-S617 WeakPolarHBondContact O-CB 3.49Å; G613-S617 PolarHBondContact O-N 3.16Å; G613-S617 PolarHBondContact O-OG 3.26Å
614	A	77.1	Confident	80.1	Confident	14 Å²	14	42.6 Å²	42.6	12%	0.116	22%	0.224	C	C	.	.	H	α-helix	trans	-60.4	-44.7	176	0	0	0	0	0	112.4	A607 E610 I612 S617 F618 I643	A607-A614 PolarHBondContact O-N 2.77Å; E610-A614 WeakPolarHBondContact O-CB 3.11Å; E610-A614 PolarHBondContact O-N 2.89Å; I612-A614 PolarHBondContact O-N 2.93Å; A614-S617 PolarHBondContact O-N 3.2Å; A614-F618 WeakPolarHBondContact O-CB 3.27Å; A614-F618 PolarHBondContact O-N 3.44Å; A614-I643 HydrophobicContact CB-CG2 3.65Å
615	S	82.3	Confident	79.9	Confident	56 Å²	56	44.1 Å²	44.1	39%	0.392	23%	0.232	S	C	.	.	H	α-helix	trans	-67.9	-36.5	179.9	78.1	0	0	0	0	113.2	D611 I612 G613	D611-S615 WeakPolarHBondContact O-CB 3.49Å; D611-S615 PolarHBondContact O-N 3.08Å; D611-S615 PolarHBondContact O-OG 3.31Å; I612-S615 PolarHBondContact O-N 2.68Å; I612-S615 PolarHBondContact O-OG 2.86Å; G613-S615 PolarHBondContact O-N 3.41Å
616	M	82.3	Confident	79.9	Confident	92 Å²	92	53.7 Å²	53.7	45%	0.453	27%	0.268	S	S	.	.	H	α-helix	trans	-71.7	-42.9	175.1	-67.9	-60.3	-177.3	0	0	110.8	I612 G613 F618 R619 L620	I612-M616 HydrophobicContact CG2-CG 4.47Å; I612-M616 WeakPolarHBondContact O-CG 3.17Å; I612-M616 PolarHBondContact O-N 3.11Å; G613-M616 PolarHBondContact O-N 2.96Å; M616-F618 VanDerWaalsContact C-N 3.32Å; M616-F618 PolarHBondContact O-N 3.03Å; M616-R619 WeakPolarHBondContact O-CB 3.47Å; M616-R619 PolarHBondContact O-N 3.09Å; M616-L620 WeakPolarHBondContact O-CG 3.06Å; M616-L620 PolarHBondContact O-N 3.44Å
617	S	82.1	Confident	79.7	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.014	31%	0.305	C	S	.	.	H	α-helix	trans	-61.8	-38.7	176.8	-62.8	0	0	0	0	112.1	A607 G613 A614 R619 L620 L621	A607-S617 WeakPolarHBondContact CB-OG 3.49Å; G613-S617 VanDerWaalsContact O-CB 3.22Å; G613-S617 WeakPolarHBondContact O-CB 3.49Å; G613-S617 PolarHBondContact O-N 3.16Å; G613-S617 PolarHBondContact O-OG 3.26Å; A614-S617 PolarHBondContact O-N 3.2Å; S617-R619 VanDerWaalsContact C-N 3.26Å; S617-R619 PolarHBondContact O-N 2.99Å; S617-L620 PolarHBondContact O-N 2.69Å; S617-L621 WeakPolarHBondContact O-CB 3.39Å; S617-L621 VanDerWaalsContact O-CG 3.24Å; S617-L621 WeakPolarHBondContact O-CG 3.42Å; S617-L621 PolarHBondContact O-N 3.15Å
618	F	84.7	Confident	79.1	Confident	41 Å²	41	64 Å²	64	18%	0.18	31%	0.314	C	S	.	.	H	α-helix	trans	-54.5	-41.8	171.4	177.3	-103.7	0	0	0	112.5	A614 M616 G622 L640 N651 V652 M655	A614-F618 WeakPolarHBondContact O-CB 3.27Å; A614-F618 PolarHBondContact O-N 3.44Å; M616-F618 VanDerWaalsContact C-N 3.32Å; M616-F618 PolarHBondContact O-N 3.03Å; F618-G622 PolarHBondContact O-N 3.22Å; F618-G622 VanDerWaalsContact O-N 3.16Å; F618-L640 HydrophobicContact CD2-CD2 3.51Å; F618-L640 HydrophobicContact CE2-CD2 3.93Å; F618-N651 HydrophobicContact CE1-CB 4.37Å; F618-N651 HydrophobicContact CZ-CB 4.1Å; F618-V652 HydrophobicContact CD2-CG2 3.88Å; F618-V652 HydrophobicContact CE2-CB 4.26Å; F618-V652 HydrophobicContact CE2-CG2 3.71Å; F618-M655 HydrophobicContact CE1-CE 4.06Å; F618-M655 HydrophobicContact CE2-CE 3.78Å; F618-M655 HydrophobicContact CE2-SD 4.01Å; F618-M655 HydrophobicContact CZ-CE 3.42Å; F618-M655 VanDerWaalsContact CZ-CE 3.42Å; F618-M655 HydrophobicContact CZ-SD 4.24Å
619	R	84.2	Confident	79.2	Confident	158 Å²	158	65.3 Å²	65.3	60%	0.596	32%	0.319	S	S	*	.	H	α-helix	trans	-70.9	-43.5	176.9	-64	175.8	-179.1	165.7	1.2	111.8	M616 S617 G622 H623	M616-R619 WeakPolarHBondContact O-CB 3.47Å; M616-R619 PolarHBondContact O-N 3.09Å; S617-R619 VanDerWaalsContact C-N 3.26Å; S617-R619 PolarHBondContact O-N 2.99Å; R619-G622 WeakPolarHBondContact O-CA 3.26Å; R619-G622 PolarHBondContact O-N 3.23Å; R619-G622 VanDerWaalsContact O-N 3.13Å; R619-H623 PolarHBondContact O-CD2 3.17Å; R619-H623 PolarHBondContact O-N 3.03Å; R619-H623 VanDerWaalsContact O-N 3.14Å
620	L	84.2	Confident	79.6	Confident	60 Å²	60	67.4 Å²	67.4	31%	0.314	33%	0.329	S	S	.	.	H	α-helix	trans	-60	-46.7	178	-70.3	167.5	0	0	0	111.5	I553 L557 M616 S617 G622 H623 L624	I553-L620 HydrophobicContact CG2-CD1 4.39Å; L557-L620 HydrophobicContact CD1-CD1 4.05Å; L557-L620 HydrophobicContact CD1-CD2 4.08Å; M616-L620 WeakPolarHBondContact O-CG 3.06Å; M616-L620 PolarHBondContact O-N 3.44Å; S617-L620 PolarHBondContact O-N 2.69Å; L620-G622 VanDerWaalsContact C-N 3.27Å; L620-G622 PolarHBondContact O-N 3Å; L620-H623 WeakPolarHBondContact O-CB 3.4Å; L620-H623 PolarHBondContact O-N 3.22Å; L620-L624 WeakPolarHBondContact O-CB 3.29Å; L620-L624 PolarHBondContact O-N 2.87Å
621	L	83.9	Confident	79.7	Confident	1 Å²	1	66.6 Å²	66.6	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-59.1	-39.1	173.9	-70.4	175.6	0	0	0	111.4	V600 S617 H623 L624 I625 V636 A639 L640 I643	V600-L621 HydrophobicContact CG1-CD2 3.61Å; S617-L621 WeakPolarHBondContact O-CB 3.39Å; S617-L621 VanDerWaalsContact O-CG 3.24Å; S617-L621 WeakPolarHBondContact O-CG 3.42Å; S617-L621 PolarHBondContact O-N 3.15Å; L621-H623 VanDerWaalsContact C-N 3.29Å; L621-H623 PolarHBondContact O-N 2.94Å; L621-L624 HydrophobicContact CD2-CD2 4.14Å; L621-L624 WeakPolarHBondContact O-CB 3.4Å; L621-L624 PolarHBondContact O-N 2.94Å; L621-I625 WeakPolarHBondContact O-CD1 3.46Å; L621-I625 VanDerWaalsContact O-CG1 3.31Å; L621-I625 WeakPolarHBondContact O-CG1 3.21Å; L621-I625 PolarHBondContact O-N 3.12Å; L621-V636 HydrophobicContact CB-CG1 3.88Å; L621-V636 HydrophobicContact CD2-CG1 4.17Å; L621-V636 HydrophobicContact CD2-CG2 4.18Å; L621-V636 HydrophobicContact CG-CG1 4.47Å; L621-A639 HydrophobicContact CD1-CB 3.87Å; L621-A639 HydrophobicContact CD2-CB 4.01Å; L621-L640 HydrophobicContact CB-CD2 4.24Å; L621-L640 HydrophobicContact CD1-CD2 3.75Å; L621-L640 HydrophobicContact CD1-CG 4.05Å; L621-I643 HydrophobicContact CD1-CD1 3.5Å; L621-I643 VanDerWaalsContact CD1-CD1 3.5Å
622	G	83.4	Confident	80.1	Confident	19 Å²	19	62.3 Å²	62.3	20%	0.196	30%	0.302	C	S	.	.	H	α-helix	trans	-59.4	-34.7	173.5	0	0	0	0	0	114.2	F618 R619 L620	F618-G622 PolarHBondContact O-N 3.22Å; F618-G622 VanDerWaalsContact O-N 3.16Å; R619-G622 WeakPolarHBondContact O-CA 3.26Å; R619-G622 PolarHBondContact O-N 3.23Å; R619-G622 VanDerWaalsContact O-N 3.13Å; L620-G622 VanDerWaalsContact C-N 3.27Å; L620-G622 PolarHBondContact O-N 3Å
623	H	83.3	Confident	80.1	Confident	114 Å²	114	59.8 Å²	59.8	53%	0.528	29%	0.285	S	S	.	.	H	α-helix	trans	-75.7	-40.7	173.4	-73.4	-69.4	0	0	0	112.2	R619 L620 L621 I625 R626 Y627	R619-H623 PolarHBondContact O-CD2 3.17Å; R619-H623 PolarHBondContact O-N 3.03Å; R619-H623 VanDerWaalsContact O-N 3.14Å; L620-H623 WeakPolarHBondContact O-CB 3.4Å; L620-H623 PolarHBondContact O-N 3.22Å; L621-H623 VanDerWaalsContact C-N 3.29Å; L621-H623 PolarHBondContact O-N 2.94Å; H623-I625 PolarHBondContact O-N 3.1Å; H623-R626 PolarHBondContact O-N 2.91Å; H623-Y627 PolarHBondContact O-N 3.42Å
624	L	82	Confident	80.2	Confident	22 Å²	22	61.1 Å²	61.1	12%	0.115	29%	0.286	C	S	.	.	H	α-helix	trans	-61.2	-32.3	-179.6	-172.9	67.3	0	0	0	112.3	C560 V600 L620 L621 R626 G628 V632 V636	C560-L624 HydrophobicContact CB-CD1 4.15Å; V600-L624 HydrophobicContact CB-CD2 4.21Å; V600-L624 HydrophobicContact CG1-CD2 3.74Å; V600-L624 HydrophobicContact CG2-CD2 3.38Å; L620-L624 WeakPolarHBondContact O-CB 3.29Å; L620-L624 PolarHBondContact O-N 2.87Å; L621-L624 HydrophobicContact CD2-CD2 4.14Å; L621-L624 WeakPolarHBondContact O-CB 3.4Å; L621-L624 PolarHBondContact O-N 2.94Å; L624-R626 VanDerWaalsContact C-N 3.28Å; L624-R626 PolarHBondContact O-N 3.33Å; L624-G628 VanDerWaalsContact O-CA 3.23Å; L624-G628 WeakPolarHBondContact O-CA 3.47Å; L624-G628 PolarHBondContact O-N 3.27Å; L624-V632 HydrophobicContact CD1-CG1 3.44Å; L624-V632 VanDerWaalsContact CD1-CG1 3.44Å; L624-V632 HydrophobicContact CD2-CG1 3.53Å; L624-V632 HydrophobicContact CG-CG1 3.3Å; L624-V636 HydrophobicContact CB-CG2 4.42Å; L624-V636 HydrophobicContact CD2-CG2 3.69Å; L624-V636 HydrophobicContact CG-CG2 4.13Å
625	I	79.2	Confident	80.5	Confident	33 Å²	33	60.5 Å²	60.5	17%	0.169	28%	0.281	C	S	.	.	H	α-helix	trans	-62.6	-33.9	174	-68.3	153.3	0	0	0	112.6	L621 H623 V636 M655 F659	L621-I625 WeakPolarHBondContact O-CD1 3.46Å; L621-I625 VanDerWaalsContact O-CG1 3.31Å; L621-I625 WeakPolarHBondContact O-CG1 3.21Å; L621-I625 PolarHBondContact O-N 3.12Å; H623-I625 PolarHBondContact O-N 3.1Å; I625-V636 HydrophobicContact CD1-CB 4.33Å; I625-V636 HydrophobicContact CD1-CG1 3.41Å; I625-V636 VanDerWaalsContact CD1-CG1 3.41Å; I625-V636 HydrophobicContact CG1-CB 3.87Å; I625-V636 HydrophobicContact CG1-CG1 3.47Å; I625-V636 VanDerWaalsContact CG1-CG1 3.47Å; I625-V636 HydrophobicContact CG1-CG2 4.01Å; I625-M655 HydrophobicContact CD1-SD 4.29Å; I625-F659 HydrophobicContact CD1-CE1 4.08Å; I625-F659 HydrophobicContact CD1-CE2 3.63Å; I625-F659 HydrophobicContact CD1-CZ 3.22Å; I625-F659 HydrophobicContact CG1-CZ 4.21Å; I625-F659 HydrophobicContact CG2-CE1 3.98Å; I625-F659 HydrophobicContact CG2-CZ 4.24Å
626	R	79.5	Confident	80.6	Confident	202 Å²	202	57.8 Å²	57.8	76%	0.762	26%	0.262	S	S	*	.	H	α-helix	trans	-78.5	-32.8	-176.4	-62.9	-175.5	-178.1	-162.2	0.6	112.9	H623 L624	H623-R626 PolarHBondContact O-N 2.91Å; L624-R626 VanDerWaalsContact C-N 3.28Å; L624-R626 PolarHBondContact O-N 3.33Å
627	Y	77	Confident	80.8	Confident	200 Å²	200	53.5 Å²	53.5	78%	0.784	24%	0.241	S	C	*	.	H	α-helix	trans	-115.2	-12.5	-171.5	-63.5	-68.6	0	0	0	114.3	H623	H623-Y627 PolarHBondContact O-N 3.42Å
628	G	69	Low	80.9	Confident	18 Å²	18	53.4 Å²	53.4	19%	0.186	24%	0.24	C	C	.	.	S	Bend	trans	-74.6	152.4	-175.6	0	0	0	0	0	113.6	L624	L624-G628 VanDerWaalsContact O-CA 3.23Å; L624-G628 WeakPolarHBondContact O-CA 3.47Å; L624-G628 PolarHBondContact O-N 3.27Å
629	E	78.4	Confident	80.9	Confident	46 Å²	46	51.4 Å²	51.4	22%	0.215	23%	0.231	C	C	.	.			trans	-59.3	159.7	169.7	-70	-171	-168.4	0	0	111.3	H631 V632 R633	E629-H631 PolarHBondContact O-N 2.75Å; E629-V632 HydrophobicContact CB-CG2 4.32Å; E629-V632 WeakPolarHBondContact O-CB 3.32Å; E629-V632 PolarHBondContact O-N 2.92Å; E629-V632 VanDerWaalsContact O-N 3.09Å; E629-R633 PolarHBondContact O-N 3.48Å
630	P	75.7	Confident	81	Confident	64 Å²	64	44 Å²	44	42%	0.416	20%	0.203	S	C	.	.	H	α-helix	trans	-55.2	-29	-179.6	19.7	-32.7	0	0	0	113.7	R634	P630-R634 WeakPolarHBondContact O-CD 3.24Å; P630-R634 VanDerWaalsContact O-CG 3.23Å; P630-R634 WeakPolarHBondContact O-CG 3.26Å; P630-R634 PolarHBondContact O-N 3.13Å; P630-R634 VanDerWaalsContact O-N 3.14Å
631	H	74.8	Confident	80.9	Confident	35 Å²	35	41.1 Å²	41.1	16%	0.162	19%	0.189	C	C	.	.	H	α-helix	trans	-73.9	-42.7	177.8	-60.6	-88.6	0	0	0	112.5	I593 E629 R633 R634 A635	I593-H631 HydrophobicContact CG2-CB 3.56Å; I593-H631 WeakPolarHBondContact CG2-CD2 3.42Å; E629-H631 PolarHBondContact O-N 2.75Å; H631-R633 VanDerWaalsContact C-N 3.32Å; H631-R633 PolarHBondContact O-N 2.82Å; H631-R634 WeakPolarHBondContact O-CB 3.2Å; H631-R634 PolarHBondContact O-N 3.32Å; H631-R634 VanDerWaalsContact O-N 3.14Å; H631-A635 PolarHBondContact O-N 3.11Å
632	V	81.7	Confident	80.9	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-58.7	-46.3	170.7	176.8	0	0	0	0	109.9	Q596 V600 L624 E629 R634 A635 V636	Q596-V632 HydrophobicContact CB-CG2 3.79Å; V600-V632 HydrophobicContact CG2-CG1 3.85Å; L624-V632 HydrophobicContact CD1-CG1 3.44Å; L624-V632 VanDerWaalsContact CD1-CG1 3.44Å; L624-V632 HydrophobicContact CD2-CG1 3.53Å; L624-V632 HydrophobicContact CG-CG1 3.3Å; E629-V632 HydrophobicContact CB-CG2 4.32Å; E629-V632 WeakPolarHBondContact O-CB 3.32Å; E629-V632 PolarHBondContact O-N 2.92Å; E629-V632 VanDerWaalsContact O-N 3.09Å; V632-R634 PolarHBondContact O-N 3.14Å; V632-A635 PolarHBondContact O-N 3.2Å; V632-V636 WeakPolarHBondContact O-CG2 3.48Å; V632-V636 PolarHBondContact O-N 2.97Å; V632-V636 VanDerWaalsContact O-N 3.13Å
633	R	80.9	Confident	80.9	Confident	66 Å²	66	41.4 Å²	41.4	25%	0.249	19%	0.185	C	C	.	.	H	α-helix	trans	-59	-31	176	-80.4	-178.3	52.5	-151.2	-9.6	113.6	E629 H631 P637 D662 D664 I667	E629-R633 PolarHBondContact O-N 3.48Å; H631-R633 VanDerWaalsContact C-N 3.32Å; H631-R633 PolarHBondContact O-N 2.82Å; R633-P637 WeakPolarHBondContact O-CD 3.49Å; R633-D662 IonicContact CZ-OD2 3.11Å; R633-D662 IonicContact NH2-OD1 3.97Å; R633-D662 IonicContact NH2-OD2 3.66Å; R633-D662 PolarHBondContact NH2-OD2 3.01Å; R633-D664 IonicContact CZ-OD2 3.88Å; R633-D664 IonicContact NH1-OD2 2.76Å; R633-D664 IonicContact NH2-OD2 3.76Å; R633-D664 PolarHBondContact NH2-OD2 3.45Å; R633-I667 HydrophobicContact CB-CD1 3.79Å
634	R	78.5	Confident	80.5	Confident	41 Å²	41	36.1 Å²	36.1	16%	0.155	16%	0.161	C	C	.	.	H	α-helix	trans	-74.1	-32.6	175.3	-69.5	163	-167.7	-173.6	4.7	112.7	P630 H631 V632 E666 I667 N670	P630-R634 WeakPolarHBondContact O-CD 3.24Å; P630-R634 VanDerWaalsContact O-CG 3.23Å; P630-R634 WeakPolarHBondContact O-CG 3.26Å; P630-R634 PolarHBondContact O-N 3.13Å; P630-R634 VanDerWaalsContact O-N 3.14Å; H631-R634 WeakPolarHBondContact O-CB 3.2Å; H631-R634 PolarHBondContact O-N 3.32Å; H631-R634 VanDerWaalsContact O-N 3.14Å; V632-R634 PolarHBondContact O-N 3.14Å; R634-E666 WeakPolarHBondContact CD-OE2 3.34Å; R634-E666 HydrophobicContact CG-CB 4.05Å; R634-E666 IonicContact CZ-OE1 2.97Å; R634-E666 IonicContact CZ-OE2 3.51Å; R634-E666 IonicContact NE-OE2 3.51Å; R634-E666 PolarHBondContact NE-OE2 3.36Å; R634-E666 IonicContact NH1-OE1 3.78Å; R634-E666 PolarHBondContact NH1-OE1 2.86Å; R634-E666 IonicContact NH1-OE2 2.69Å; R634-E666 PolarHBondContact NH1-OE2 3.5Å; R634-E666 IonicContact NH2-OE1 3.78Å; R634-E666 IonicContact NH2-OE2 2.84Å; R634-I667 HydrophobicContact CG-CG1 3.77Å; R634-N670 PolarHBondContact O-ND2 2.95Å
635	A	83.3	Confident	80.4	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-78.2	-30.9	179.9	0	0	0	0	0	113.2	A597 V600 H631 V632 L638 A639 L750	A597-A635 HydrophobicContact CB-CB 4.04Å; V600-A635 HydrophobicContact CB-CB 4.04Å; V600-A635 HydrophobicContact CG1-CB 4.13Å; H631-A635 PolarHBondContact O-N 3.11Å; V632-A635 PolarHBondContact O-N 3.2Å; A635-L638 WeakPolarHBondContact O-CB 3.28Å; A635-L638 PolarHBondContact O-N 3.11Å; A635-L638 VanDerWaalsContact O-N 3.14Å; A635-A639 PolarHBondContact O-N 3.36Å; A635-L750 HydrophobicContact CB-CD2 3.75Å
636	V	84.7	Confident	80.1	Confident	0 Å²	0	34 Å²	34	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-58	-44.9	-175.3	175.4	0	0	0	0	113.9	V600 L621 L624 I625 V632 L638 A639 L640	V600-V636 HydrophobicContact CG1-CG2 3.82Å; L621-V636 HydrophobicContact CB-CG1 3.88Å; L621-V636 HydrophobicContact CD2-CG1 4.17Å; L621-V636 HydrophobicContact CD2-CG2 4.18Å; L621-V636 HydrophobicContact CG-CG1 4.47Å; L624-V636 HydrophobicContact CB-CG2 4.42Å; L624-V636 HydrophobicContact CD2-CG2 3.69Å; L624-V636 HydrophobicContact CG-CG2 4.13Å; I625-V636 HydrophobicContact CD1-CB 4.33Å; I625-V636 HydrophobicContact CD1-CG1 3.41Å; I625-V636 VanDerWaalsContact CD1-CG1 3.41Å; I625-V636 HydrophobicContact CG1-CB 3.87Å; I625-V636 HydrophobicContact CG1-CG1 3.47Å; I625-V636 VanDerWaalsContact CG1-CG1 3.47Å; I625-V636 HydrophobicContact CG1-CG2 4.01Å; V632-V636 WeakPolarHBondContact O-CG2 3.48Å; V632-V636 PolarHBondContact O-N 2.97Å; V632-V636 VanDerWaalsContact O-N 3.13Å; V636-L638 VanDerWaalsContact C-N 3.27Å; V636-L638 PolarHBondContact O-N 2.89Å; V636-A639 WeakPolarHBondContact O-CB 3.47Å; V636-A639 PolarHBondContact O-N 3.3Å; V636-L640 HydrophobicContact CG1-CD1 4.06Å; V636-L640 HydrophobicContact CG1-CG 4.2Å; V636-L640 WeakPolarHBondContact O-CG 3.48Å; V636-L640 PolarHBondContact O-N 3.07Å
637	P	86.2	Confident	80	Confident	1 Å²	1	25.9 Å²	25.9	1%	0.006	12%	0.123	C	C	.	.	H	α-helix	trans	-58.5	-38.1	177.2	-25.2	33.8	0	0	0	113.2	R633 L640 G641 L656 F659 I667 N670 A671 A674	R633-P637 WeakPolarHBondContact O-CD 3.49Å; P637-L640 PolarHBondContact O-N 3.49Å; P637-G641 PolarHBondContact O-N 2.51Å; P637-L656 HydrophobicContact CB-CD2 3.84Å; P637-F659 HydrophobicContact CG-CD2 4.37Å; P637-I667 HydrophobicContact CG-CG2 4.17Å; P637-N670 HydrophobicContact CB-CB 4.33Å; P637-A671 HydrophobicContact CB-CB 4.09Å; P637-A671 HydrophobicContact CG-CB 4.46Å; P637-A674 WeakPolarHBondContact O-CB 3.42Å
638	L	83.9	Confident	79.8	Confident	0 Å²	0	18 Å²	18	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-68	-41.5	176.1	-62.5	174.6	0	0	0	111.5	L601 A635 V636 L640 G641 L642 N670 F673 F749 L750	L601-L638 HydrophobicContact CD2-CB 3.75Å; A635-L638 WeakPolarHBondContact O-CB 3.28Å; A635-L638 PolarHBondContact O-N 3.11Å; A635-L638 VanDerWaalsContact O-N 3.14Å; V636-L638 VanDerWaalsContact C-N 3.27Å; V636-L638 PolarHBondContact O-N 2.89Å; L638-L640 VanDerWaalsContact C-N 3.33Å; L638-L640 PolarHBondContact O-N 3.29Å; L638-G641 WeakPolarHBondContact O-CA 3.38Å; L638-G641 PolarHBondContact O-N 2.72Å; L638-G641 VanDerWaalsContact O-N 3.11Å; L638-L642 PolarHBondContact O-N 3.25Å; L638-N670 HydrophobicContact CD1-CB 4.43Å; L638-N670 HydrophobicContact CD2-CB 4.1Å; L638-N670 HydrophobicContact CG-CB 3.97Å; L638-F673 HydrophobicContact CD2-CD1 3.77Å; L638-F749 HydrophobicContact CD1-CB 3.63Å; L638-F749 HydrophobicContact CD2-CB 3.9Å; L638-F749 HydrophobicContact CD2-CG 4.46Å; L638-F749 HydrophobicContact CG-CB 4.45Å; L638-L750 HydrophobicContact CD1-CD2 4.15Å
639	A	85.5	Confident	80.2	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-60.4	-41.7	174.4	0	0	0	0	0	111.7	V600 L601 A604 L621 A635 V636 G641 L642 I643	V600-A639 HydrophobicContact CG1-CB 3.99Å; L601-A639 HydrophobicContact CD2-CB 4.37Å; A604-A639 HydrophobicContact CB-CB 3.75Å; A604-A639 VanDerWaalsContact CB-O 3.29Å; A604-A639 WeakPolarHBondContact CB-O 3.31Å; L621-A639 HydrophobicContact CD1-CB 3.87Å; L621-A639 HydrophobicContact CD2-CB 4.01Å; A635-A639 PolarHBondContact O-N 3.36Å; V636-A639 WeakPolarHBondContact O-CB 3.47Å; V636-A639 PolarHBondContact O-N 3.3Å; A639-G641 VanDerWaalsContact C-N 3.35Å; A639-L642 PolarHBondContact O-N 3.17Å; A639-I643 WeakPolarHBondContact O-CG1 3.29Å; A639-I643 PolarHBondContact O-N 3.29Å
640	L	85	Confident	80.3	Confident	2 Å²	2	23.2 Å²	23.2	1%	0.01	12%	0.118	C	C	.	.	H	α-helix	trans	-63.4	-39.5	172.7	-70.7	172.8	0	0	0	112.2	F618 L621 V636 P637 L638 S644 V652 M655 L656 F659	F618-L640 HydrophobicContact CD2-CD2 3.51Å; F618-L640 HydrophobicContact CE2-CD2 3.93Å; L621-L640 HydrophobicContact CB-CD2 4.24Å; L621-L640 HydrophobicContact CD1-CD2 3.75Å; L621-L640 HydrophobicContact CD1-CG 4.05Å; V636-L640 HydrophobicContact CG1-CD1 4.06Å; V636-L640 HydrophobicContact CG1-CG 4.2Å; V636-L640 WeakPolarHBondContact O-CG 3.48Å; V636-L640 PolarHBondContact O-N 3.07Å; P637-L640 PolarHBondContact O-N 3.49Å; L638-L640 VanDerWaalsContact C-N 3.33Å; L638-L640 PolarHBondContact O-N 3.29Å; L640-S644 PolarHBondContact O-OG 3.27Å; L640-S644 VanDerWaalsContact O-OG 3.09Å; L640-V652 HydrophobicContact CB-CG1 4.11Å; L640-M655 HydrophobicContact CD1-SD 3.7Å; L640-L656 HydrophobicContact CB-CD2 4.28Å; L640-L656 HydrophobicContact CD1-CD2 4.26Å; L640-F659 HydrophobicContact CD1-CE2 3.89Å
641	G	83.8	Confident	80.7	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-62.1	-41.9	174	0	0	0	0	0	112.8	P637 L638 A639 S644 V645	P637-G641 PolarHBondContact O-N 2.51Å; L638-G641 WeakPolarHBondContact O-CA 3.38Å; L638-G641 PolarHBondContact O-N 2.72Å; L638-G641 VanDerWaalsContact O-N 3.11Å; A639-G641 VanDerWaalsContact C-N 3.35Å; G641-S644 CarbonylContact O-C 3.2Å; G641-S644 PolarHBondContact O-N 3.3Å; G641-V645 WeakPolarHBondContact O-CG2 3.41Å; G641-V645 PolarHBondContact O-N 3.04Å
642	L	82.8	Confident	81.2	Confident	1 Å²	1	23.9 Å²	23.9	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-67.1	-41.1	178.4	-80.1	176.6	0	0	0	113.1	L601 A604 L608 L638 A639 S644 V645 L742 C746	L601-L642 HydrophobicContact CD2-CD1 4.04Å; A604-L642 HydrophobicContact CB-CB 4.16Å; L608-L642 VanDerWaalsContact CD2-O 3.27Å; L608-L642 WeakPolarHBondContact CD2-O 3.3Å; L638-L642 PolarHBondContact O-N 3.25Å; A639-L642 PolarHBondContact O-N 3.17Å; L642-S644 PolarHBondContact O-N 3.24Å; L642-V645 WeakPolarHBondContact O-CG2 3.32Å; L642-L742 HydrophobicContact CD2-CB 4.28Å; L642-C746 HydrophobicContact CD1-CB 3.89Å; L642-C746 HydrophobicContact CD2-CB 4.35Å; L642-C746 WeakPolarHBondContact CD2-SG 3.22Å; L642-C746 HydrophobicContact CG-CB 4.25Å; L642-C746 VanDerWaalsContact CG-SG 3.55Å
643	I	82.9	Confident	81.3	Confident	24 Å²	24	24 Å²	24	12%	0.123	12%	0.12	C	C	.	.	H	α-helix	trans	-60.9	-32.7	178.6	-69.6	165.5	0	0	0	111.4	A604 A614 L621 A639	A604-I643 HydrophobicContact CB-CD1 4.01Å; A604-I643 HydrophobicContact CB-CG1 3.63Å; A614-I643 HydrophobicContact CB-CG2 3.65Å; L621-I643 HydrophobicContact CD1-CD1 3.5Å; L621-I643 VanDerWaalsContact CD1-CD1 3.5Å; A639-I643 WeakPolarHBondContact O-CG1 3.29Å; A639-I643 PolarHBondContact O-N 3.29Å
644	S	76.4	Confident	81.5	Confident	4 Å²	4	24.7 Å²	24.7	3%	0.028	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.8	43.4	-173.6	58.2	0	0	0	0	113.8	L640 G641 L642 S646 N647 I678	L640-S644 PolarHBondContact O-OG 3.27Å; L640-S644 VanDerWaalsContact O-OG 3.09Å; G641-S644 CarbonylContact O-C 3.2Å; G641-S644 PolarHBondContact O-N 3.3Å; L642-S644 PolarHBondContact O-N 3.24Å; S644-S646 PolarHBondContact O-N 2.94Å; S644-N647 PolarHBondContact O-N 3.21Å; S644-N647 VanDerWaalsContact O-N 3.16Å; S644-I678 WeakPolarHBondContact O-CA 3.38Å; S644-I678 WeakPolarHBondContact OG-CD1 3.39Å; S644-I678 WeakPolarHBondContact OG-CG1 3.26Å
645	V	78.4	Confident	81.8	Confident	8 Å²	8	24.7 Å²	24.7	5%	0.048	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	126	175.5	178.6	0	0	0	0	110.1	G641 L642 N647 L724 L742	G641-V645 WeakPolarHBondContact O-CG2 3.41Å; G641-V645 PolarHBondContact O-N 3.04Å; L642-V645 WeakPolarHBondContact O-CG2 3.32Å; V645-N647 PolarHBondContact O-N 3.16Å; V645-L724 HydrophobicContact CG1-CB 3.63Å; V645-L742 HydrophobicContact CG1-CD1 4.36Å; V645-L742 HydrophobicContact CG1-CD2 4.42Å; V645-L742 HydrophobicContact CG2-CD1 4.32Å
646	S	73.2	Confident	81.9	Confident	2 Å²	2	24.7 Å²	24.7	1%	0.014	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	15.8	-177.4	-65.4	0	0	0	0	115.6	S644 L677 I678 A680 T682 L724	S644-S646 PolarHBondContact O-N 2.94Å; S646-L677 PolarHBondContact N-O 3.41Å; S646-I678 CarbonylContact C-O 3.41Å; S646-I678 WeakPolarHBondContact CA-O 3.24Å; S646-A680 PolarHBondContact OG-O 3.27Å; S646-T682 VanDerWaalsContact O-CG2 3.31Å; S646-T682 WeakPolarHBondContact O-CG2 3.26Å; S646-L724 PolarHBondContact OG-N 3.01Å
647	N	77.6	Confident	81.9	Confident	32 Å²	32	26 Å²	26	17%	0.171	14%	0.136	C	C	.	.			trans	-120.2	95.4	174.1	-174.4	3.8	0	0	0	110.9	S644 V645 Q649 H828	S644-N647 PolarHBondContact O-N 3.21Å; S644-N647 VanDerWaalsContact O-N 3.16Å; V645-N647 PolarHBondContact O-N 3.16Å; N647-Q649 VanDerWaalsContact C-N 3.25Å; N647-Q649 PolarHBondContact O-N 3.26Å; N647-H828 HydrophobicContact CB-CB 4.32Å; N647-H828 PolarHBondContact ND2-ND1 3.45Å
648	P	73.7	Confident	81.9	Confident	35 Å²	35	33.1 Å²	33.1	23%	0.227	17%	0.167	C	C	.	.			trans	-76.7	75.2	-178	31.8	-35.3	0	0	0	111.9	L650 I678 T682	P648-L650 PolarHBondContact O-N 3.36Å; P648-I678 HydrophobicContact CB-CG2 4.15Å; P648-T682 HydrophobicContact CG-CG2 4.42Å
649	Q	76.8	Confident	81.8	Confident	83 Å²	83	34.7 Å²	34.7	39%	0.388	17%	0.174	S	C	.	.			trans	-68.4	127.5	168.7	-66.6	-172	-13.3	0	0	110.1	N647 N651 V652 L653	N647-Q649 VanDerWaalsContact C-N 3.25Å; N647-Q649 PolarHBondContact O-N 3.26Å; Q649-N651 PolarHBondContact O-N 3.15Å; Q649-V652 HydrophobicContact CB-CG2 4.02Å; Q649-V652 PolarHBondContact O-N 3.49Å; Q649-L653 PolarHBondContact O-N 3.15Å; Q649-L653 VanDerWaalsContact O-N 3.08Å
650	L	81.3	Confident	81.5	Confident	89 Å²	89	34.7 Å²	34.7	47%	0.466	17%	0.174	S	C	.	.	H	α-helix	trans	-58.5	-36.3	-177.1	-64.2	-179	0	0	0	112.6	P648 L653 E654	P648-L650 PolarHBondContact O-N 3.36Å; L650-L653 PolarHBondContact O-N 2.82Å; L650-E654 WeakPolarHBondContact O-CG 3.45Å; L650-E654 PolarHBondContact O-N 3.48Å
651	N	84	Confident	81.4	Confident	110 Å²	110	39.3 Å²	39.3	59%	0.588	20%	0.195	S	C	*	.	H	α-helix	trans	-64.9	-42.3	-179.5	-63.4	-11.6	0	0	0	112.2	F618 Q649 M655	F618-N651 HydrophobicContact CE1-CB 4.37Å; F618-N651 HydrophobicContact CZ-CB 4.1Å; Q649-N651 PolarHBondContact O-N 3.15Å; N651-M655 PolarHBondContact O-N 2.88Å
652	V	84.5	Confident	81.2	Confident	3 Å²	3	41.8 Å²	41.8	2%	0.018	21%	0.209	C	C	.	.	H	α-helix	trans	-71	-40.9	178.6	-171.4	0	0	0	0	110.2	F618 L640 Q649 E654 M655 L656 I678	F618-V652 HydrophobicContact CD2-CG2 3.88Å; F618-V652 HydrophobicContact CE2-CB 4.26Å; F618-V652 HydrophobicContact CE2-CG2 3.71Å; L640-V652 HydrophobicContact CB-CG1 4.11Å; Q649-V652 HydrophobicContact CB-CG2 4.02Å; Q649-V652 PolarHBondContact O-N 3.49Å; V652-E654 PolarHBondContact O-N 3.22Å; V652-M655 PolarHBondContact O-N 3.06Å; V652-L656 HydrophobicContact CG1-CD1 4Å; V652-L656 HydrophobicContact CG1-CG 4.38Å; V652-L656 WeakPolarHBondContact O-CG 3.23Å; V652-L656 PolarHBondContact O-N 3.31Å; V652-I678 HydrophobicContact CB-CD1 4.29Å; V652-I678 HydrophobicContact CG1-CD1 3.48Å; V652-I678 VanDerWaalsContact CG1-CD1 3.48Å
653	L	84.4	Confident	80.8	Confident	4 Å²	4	50.6 Å²	50.6	2%	0.021	25%	0.249	C	C	.	.	H	α-helix	trans	-58.1	-48	176	-174.6	75.8	0	0	0	112	Q649 L650 M655 L656 T657 L675 R686 L687	Q649-L653 PolarHBondContact O-N 3.15Å; Q649-L653 VanDerWaalsContact O-N 3.08Å; L650-L653 PolarHBondContact O-N 2.82Å; L653-M655 PolarHBondContact O-N 2.94Å; L653-L656 PolarHBondContact O-N 3.41Å; L653-T657 WeakPolarHBondContact O-CB 2.96Å; L653-T657 WeakPolarHBondContact O-CG2 3.33Å; L653-T657 PolarHBondContact O-N 2.77Å; L653-T657 PolarHBondContact O-OG1 3.49Å; L653-L675 HydrophobicContact CD1-CD2 3.63Å; L653-R686 HydrophobicContact CD2-CG 4.18Å; L653-L687 HydrophobicContact CD1-CB 4.35Å; L653-L687 HydrophobicContact CD1-CD1 3.46Å; L653-L687 VanDerWaalsContact CD1-CD1 3.46Å; L653-L687 HydrophobicContact CD1-CG 4.43Å
654	E	85	Confident	80.6	Confident	80 Å²	80	52.3 Å²	52.3	37%	0.374	26%	0.259	S	S	.	.	H	α-helix	trans	-67.1	-27.2	179.2	-73.3	-178.6	-174.2	0	0	112.9	L650 V652 T657 K658 R686	L650-E654 WeakPolarHBondContact O-CG 3.45Å; L650-E654 PolarHBondContact O-N 3.48Å; V652-E654 PolarHBondContact O-N 3.22Å; E654-T657 WeakPolarHBondContact CA-OG1 3.39Å; E654-T657 PolarHBondContact O-OG1 3.31Å; E654-T657 VanDerWaalsContact O-OG1 3.05Å; E654-K658 WeakPolarHBondContact O-CD 3.36Å; E654-K658 WeakPolarHBondContact O-CG 3.09Å; E654-R686 IonicContact OE1-CZ 3.71Å; E654-R686 IonicContact OE1-NH1 3.71Å; E654-R686 IonicContact OE1-NH2 2.81Å; E654-R686 PolarHBondContact OE1-NH2 3.13Å
655	M	84.9	Confident	80.8	Confident	41 Å²	41	55 Å²	55	20%	0.202	28%	0.275	C	S	.	.	H	α-helix	trans	-75.5	-47.5	175.8	-162.1	-173.1	-83.5	0	0	111.3	F618 I625 L640 N651 V652 L653 T657 K658 F659	F618-M655 HydrophobicContact CE1-CE 4.06Å; F618-M655 HydrophobicContact CE2-CE 3.78Å; F618-M655 HydrophobicContact CE2-SD 4.01Å; F618-M655 HydrophobicContact CZ-CE 3.42Å; F618-M655 VanDerWaalsContact CZ-CE 3.42Å; F618-M655 HydrophobicContact CZ-SD 4.24Å; I625-M655 HydrophobicContact CD1-SD 4.29Å; L640-M655 HydrophobicContact CD1-SD 3.7Å; N651-M655 PolarHBondContact O-N 2.88Å; V652-M655 PolarHBondContact O-N 3.06Å; L653-M655 PolarHBondContact O-N 2.94Å; M655-T657 VanDerWaalsContact C-N 3.34Å; M655-T657 PolarHBondContact O-N 3Å; M655-K658 WeakPolarHBondContact O-CB 3.38Å; M655-K658 PolarHBondContact O-N 3.42Å; M655-F659 HydrophobicContact CB-CE2 4.34Å; M655-F659 HydrophobicContact CG-CD2 4.33Å; M655-F659 HydrophobicContact CG-CE1 4.48Å; M655-F659 HydrophobicContact CG-CE2 3.36Å; M655-F659 HydrophobicContact CG-CZ 3.41Å; M655-F659 VanDerWaalsContact CG-CZ 3.41Å; M655-F659 VanDerWaalsContact O-CD2 3.31Å; M655-F659 WeakPolarHBondContact O-CD2 3.28Å; M655-F659 WeakPolarHBondContact O-CG 3.43Å; M655-F659 PolarHBondContact O-N 3.25Å; M655-F659 HydrophobicContact SD-CE2 3.77Å; M655-F659 HydrophobicContact SD-CZ 3.85Å
656	L	84.8	Confident	80.8	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-66.4	-33.1	179.4	-73.4	172.5	0	0	0	113.6	P637 L640 V652 L653 K658 F659 S660 A674 L675 I678	P637-L656 HydrophobicContact CB-CD2 3.84Å; L640-L656 HydrophobicContact CB-CD2 4.28Å; L640-L656 HydrophobicContact CD1-CD2 4.26Å; V652-L656 HydrophobicContact CG1-CD1 4Å; V652-L656 HydrophobicContact CG1-CG 4.38Å; V652-L656 WeakPolarHBondContact O-CG 3.23Å; V652-L656 PolarHBondContact O-N 3.31Å; L653-L656 PolarHBondContact O-N 3.41Å; L656-K658 VanDerWaalsContact C-N 3.31Å; L656-K658 PolarHBondContact O-N 2.88Å; L656-F659 HydrophobicContact CD2-CD2 4.29Å; L656-F659 PolarHBondContact O-N 2.96Å; L656-S660 PolarHBondContact O-N 3.01Å; L656-S660 PolarHBondContact O-OG 2.84Å; L656-A674 HydrophobicContact CD1-CB 4.01Å; L656-A674 HydrophobicContact CD2-CB 3.89Å; L656-L675 HydrophobicContact CB-CD2 3.62Å; L656-L675 HydrophobicContact CB-CG 3.9Å; L656-L675 HydrophobicContact CD1-CD2 4.06Å; L656-L675 HydrophobicContact CD1-CG 4.35Å; L656-I678 HydrophobicContact CD1-CD1 3.2Å; L656-I678 HydrophobicContact CD1-CG1 4.43Å
657	T	85.2	Confident	81.4	Confident	28 Å²	28	55.5 Å²	55.5	17%	0.172	28%	0.277	C	S	.	.	H	α-helix	trans	-66	-35.6	175.3	48.9	0	0	0	0	111.9	L653 E654 M655 S660 H661 L675 T690	L653-T657 WeakPolarHBondContact O-CB 2.96Å; L653-T657 WeakPolarHBondContact O-CG2 3.33Å; L653-T657 PolarHBondContact O-N 2.77Å; L653-T657 PolarHBondContact O-OG1 3.49Å; E654-T657 WeakPolarHBondContact CA-OG1 3.39Å; E654-T657 PolarHBondContact O-OG1 3.31Å; E654-T657 VanDerWaalsContact O-OG1 3.05Å; M655-T657 VanDerWaalsContact C-N 3.34Å; M655-T657 PolarHBondContact O-N 3Å; T657-S660 PolarHBondContact O-N 3.46Å; T657-H661 PolarHBondContact O-CD2 2.76Å; T657-H661 VanDerWaalsContact O-CD2 3.32Å; T657-L675 HydrophobicContact CG2-CD1 4.32Å; T657-L675 HydrophobicContact CG2-CD2 4.22Å; T657-T690 HydrophobicContact CG2-CG2 3.44Å; T657-T690 VanDerWaalsContact CG2-CG2 3.44Å
658	K	85	Confident	81.6	Confident	150 Å²	150	54.1 Å²	54.1	65%	0.652	27%	0.27	S	S	*	.	H	α-helix	trans	-64.8	-40.1	171.4	-68.6	169.8	-173.9	172.1	0	111.7	E654 M655 L656 S660 H661	E654-K658 WeakPolarHBondContact O-CD 3.36Å; E654-K658 WeakPolarHBondContact O-CG 3.09Å; M655-K658 WeakPolarHBondContact O-CB 3.38Å; M655-K658 PolarHBondContact O-N 3.42Å; L656-K658 VanDerWaalsContact C-N 3.31Å; L656-K658 PolarHBondContact O-N 2.88Å; K658-S660 VanDerWaalsContact C-N 3.33Å; K658-H661 PolarHBondContact O-N 2.83Å
659	F	82.2	Confident	82.1	Confident	33 Å²	33	52.9 Å²	52.9	15%	0.145	26%	0.261	C	S	.	.	H	α-helix	trans	-71.2	-27.1	177.4	-57.7	-36.8	0	0	0	113.7	I625 P637 L640 M655 L656 H661 D662 I667 A671	I625-F659 HydrophobicContact CD1-CE1 4.08Å; I625-F659 HydrophobicContact CD1-CE2 3.63Å; I625-F659 HydrophobicContact CD1-CZ 3.22Å; I625-F659 HydrophobicContact CG1-CZ 4.21Å; I625-F659 HydrophobicContact CG2-CE1 3.98Å; I625-F659 HydrophobicContact CG2-CZ 4.24Å; P637-F659 HydrophobicContact CG-CD2 4.37Å; L640-F659 HydrophobicContact CD1-CE2 3.89Å; M655-F659 HydrophobicContact CB-CE2 4.34Å; M655-F659 HydrophobicContact CG-CD2 4.33Å; M655-F659 HydrophobicContact CG-CE1 4.48Å; M655-F659 HydrophobicContact CG-CE2 3.36Å; M655-F659 HydrophobicContact CG-CZ 3.41Å; M655-F659 VanDerWaalsContact CG-CZ 3.41Å; M655-F659 VanDerWaalsContact O-CD2 3.31Å; M655-F659 WeakPolarHBondContact O-CD2 3.28Å; M655-F659 WeakPolarHBondContact O-CG 3.43Å; M655-F659 PolarHBondContact O-N 3.25Å; M655-F659 HydrophobicContact SD-CE2 3.77Å; M655-F659 HydrophobicContact SD-CZ 3.85Å; L656-F659 HydrophobicContact CD2-CD2 4.29Å; L656-F659 PolarHBondContact O-N 2.96Å; F659-H661 PolarHBondContact O-N 3.49Å; F659-D662 VanDerWaalsContact O-CB 3.28Å; F659-D662 WeakPolarHBondContact O-CB 3.31Å; F659-D662 PolarHBondContact O-N 3.1Å; F659-D662 VanDerWaalsContact O-N 3.09Å; F659-I667 HydrophobicContact CB-CG2 4.32Å; F659-A671 HydrophobicContact CB-CB 3.84Å
660	S	79.9	Confident	82.5	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-64.5	-22.1	176.4	-57	0	0	0	0	112.5	L656 T657 K658 L675 H698	L656-S660 PolarHBondContact O-N 3.01Å; L656-S660 PolarHBondContact O-OG 2.84Å; T657-S660 PolarHBondContact O-N 3.46Å; K658-S660 VanDerWaalsContact C-N 3.33Å; S660-L675 WeakPolarHBondContact OG-CD1 3.45Å; S660-H698 PolarHBondContact O-NE2 2.79Å
661	H	82.2	Confident	82.8	Confident	98 Å²	98	44.7 Å²	44.7	45%	0.454	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	7.9	175.9	-68.5	-64.4	0	0	0	114	T657 K658 F659 Y697	T657-H661 PolarHBondContact O-CD2 2.76Å; T657-H661 VanDerWaalsContact O-CD2 3.32Å; K658-H661 PolarHBondContact O-N 2.83Å; F659-H661 PolarHBondContact O-N 3.49Å; H661-Y697 AromaticContact ND1-CD1 3.9Å; H661-Y697 AromaticContact ND1-CE1 3.87Å
662	D	80	Confident	82.9	Confident	53 Å²	53	39.5 Å²	39.5	28%	0.283	19%	0.192	S	C	.	.			trans	-64.5	152.6	179.3	-157.5	-6.3	0	0	0	111.3	R633 F659 D664 I667	R633-D662 IonicContact CZ-OD2 3.11Å; R633-D662 IonicContact NH2-OD1 3.97Å; R633-D662 IonicContact NH2-OD2 3.66Å; R633-D662 PolarHBondContact NH2-OD2 3.01Å; F659-D662 VanDerWaalsContact O-CB 3.28Å; F659-D662 WeakPolarHBondContact O-CB 3.31Å; F659-D662 PolarHBondContact O-N 3.1Å; F659-D662 VanDerWaalsContact O-N 3.09Å; D662-D664 PolarHBondContact O-N 3.21Å; D662-I667 HydrophobicContact CB-CG2 4.27Å
663	Q	74.2	Confident	82.9	Confident	185 Å²	185	39.5 Å²	39.5	86%	0.864	19%	0.192	S	C	*	.	S	Bend	trans	-70	-26.3	-179.6	-63.5	-177	4	0	0	111.9	V665	Q663-V665 PolarHBondContact O-N 3.37Å
664	D	79.2	Confident	83	Confident	60 Å²	60	39.3 Å²	39.3	32%	0.321	19%	0.191	S	C	.	.			trans	-78.4	109.6	177.7	-71.7	-43.7	0	0	0	110.5	R633 D662 E666 I667 A668	R633-D664 IonicContact CZ-OD2 3.88Å; R633-D664 IonicContact NH1-OD2 2.76Å; R633-D664 IonicContact NH2-OD2 3.76Å; R633-D664 PolarHBondContact NH2-OD2 3.45Å; D662-D664 PolarHBondContact O-N 3.21Å; D664-E666 VanDerWaalsContact C-N 3.25Å; D664-E666 PolarHBondContact O-N 3.41Å; D664-I667 HydrophobicContact CB-CB 4.21Å; D664-I667 HydrophobicContact CB-CD1 3.77Å; D664-I667 HydrophobicContact CB-CG1 3.94Å; D664-I667 PolarHBondContact O-N 3.38Å; D664-I667 VanDerWaalsContact O-N 3.1Å; D664-A668 PolarHBondContact O-N 3.08Å; D664-A668 VanDerWaalsContact O-N 3.13Å
665	V	80.5	Confident	83.1	Confident	60 Å²	60	35.5 Å²	35.5	36%	0.364	17%	0.173	S	C	.	.	H	α-helix	trans	-57.9	-36.4	-174.9	-170.8	0	0	0	0	112.6	Q663 A668 Y669	Q663-V665 PolarHBondContact O-N 3.37Å; V665-A668 WeakPolarHBondContact O-CB 3.47Å; V665-A668 PolarHBondContact O-N 3.05Å; V665-Y669 HydrophobicContact CG1-CD1 4.42Å; V665-Y669 HydrophobicContact CG1-CD2 4.29Å; V665-Y669 HydrophobicContact CG1-CE1 3.7Å; V665-Y669 HydrophobicContact CG1-CE2 3.56Å; V665-Y669 WeakPolarHBondContact CG1-OH 3.23Å; V665-Y669 WeakPolarHBondContact O-CD2 3.31Å; V665-Y669 VanDerWaalsContact O-CG 3.28Å; V665-Y669 PolarHBondContact O-N 3.38Å
666	E	78.8	Confident	83	Confident	18 Å²	18	33.5 Å²	33.5	8%	0.084	16%	0.164	C	C	.	.	H	α-helix	trans	-68	-37.6	178.7	-64.5	-174.5	-145.9	0	0	113	R588 R634 D664 A668 Y669 N670 Y753	R588-E666 IonicContact NH1-OE1 3.81Å; R634-E666 WeakPolarHBondContact CD-OE2 3.34Å; R634-E666 HydrophobicContact CG-CB 4.05Å; R634-E666 IonicContact CZ-OE1 2.97Å; R634-E666 IonicContact CZ-OE2 3.51Å; R634-E666 IonicContact NE-OE2 3.51Å; R634-E666 PolarHBondContact NE-OE2 3.36Å; R634-E666 IonicContact NH1-OE1 3.78Å; R634-E666 PolarHBondContact NH1-OE1 2.86Å; R634-E666 IonicContact NH1-OE2 2.69Å; R634-E666 PolarHBondContact NH1-OE2 3.5Å; R634-E666 IonicContact NH2-OE1 3.78Å; R634-E666 IonicContact NH2-OE2 2.84Å; D664-E666 VanDerWaalsContact C-N 3.25Å; D664-E666 PolarHBondContact O-N 3.41Å; E666-A668 VanDerWaalsContact C-N 3.31Å; E666-Y669 PolarHBondContact O-N 2.86Å; E666-N670 PolarHBondContact O-N 2.92Å; E666-N670 VanDerWaalsContact O-N 3.08Å; E666-Y753 HydrophobicContact CG-CD2 3.96Å; E666-Y753 HydrophobicContact CG-CE2 3.39Å; E666-Y753 WeakPolarHBondContact OE1-CD2 3.44Å; E666-Y753 VanDerWaalsContact OE1-CE2 3.24Å; E666-Y753 WeakPolarHBondContact OE1-CE2 3.43Å
667	I	84.2	Confident	83	Confident	4 Å²	4	33.5 Å²	33.5	2%	0.021	16%	0.164	C	C	.	.	H	α-helix	trans	-66.7	-40.6	175.7	-62.1	178.7	0	0	0	109.2	R633 R634 P637 F659 D662 D664 N670 A671	R633-I667 HydrophobicContact CB-CD1 3.79Å; R634-I667 HydrophobicContact CG-CG1 3.77Å; P637-I667 HydrophobicContact CG-CG2 4.17Å; F659-I667 HydrophobicContact CB-CG2 4.32Å; D662-I667 HydrophobicContact CB-CG2 4.27Å; D664-I667 HydrophobicContact CB-CB 4.21Å; D664-I667 HydrophobicContact CB-CD1 3.77Å; D664-I667 HydrophobicContact CB-CG1 3.94Å; D664-I667 PolarHBondContact O-N 3.38Å; D664-I667 VanDerWaalsContact O-N 3.1Å; I667-N670 PolarHBondContact O-N 3.36Å; I667-A671 VanDerWaalsContact O-CB 3.27Å; I667-A671 WeakPolarHBondContact O-CB 3.24Å; I667-A671 PolarHBondContact O-N 2.63Å
668	A	83.1	Confident	83	Confident	3 Å²	3	32.2 Å²	32.2	3%	0.025	16%	0.155	C	C	.	.	H	α-helix	trans	-62	-45.1	175.8	0	0	0	0	0	111.9	D664 V665 E666 N670 A671 I672	D664-A668 PolarHBondContact O-N 3.08Å; D664-A668 VanDerWaalsContact O-N 3.13Å; V665-A668 WeakPolarHBondContact O-CB 3.47Å; V665-A668 PolarHBondContact O-N 3.05Å; E666-A668 VanDerWaalsContact C-N 3.31Å; A668-N670 PolarHBondContact O-N 3.2Å; A668-A671 PolarHBondContact O-N 2.93Å; A668-I672 WeakPolarHBondContact O-CB 3.48Å; A668-I672 WeakPolarHBondContact O-CD1 3.27Å; A668-I672 WeakPolarHBondContact O-CG1 3.43Å; A668-I672 PolarHBondContact O-N 2.93Å
669	Y	84.4	Confident	82.7	Confident	8 Å²	8	25 Å²	25	3%	0.031	12%	0.124	C	C	.	.	H	α-helix	trans	-56.5	-49.2	174.8	-65.3	-28.1	0	0	0	111.7	V665 E666 A671 I672 F673 D701 S703 C704 M707 V752	V665-Y669 HydrophobicContact CG1-CD1 4.42Å; V665-Y669 HydrophobicContact CG1-CD2 4.29Å; V665-Y669 HydrophobicContact CG1-CE1 3.7Å; V665-Y669 HydrophobicContact CG1-CE2 3.56Å; V665-Y669 WeakPolarHBondContact CG1-OH 3.23Å; V665-Y669 WeakPolarHBondContact O-CD2 3.31Å; V665-Y669 VanDerWaalsContact O-CG 3.28Å; V665-Y669 PolarHBondContact O-N 3.38Å; E666-Y669 PolarHBondContact O-N 2.86Å; Y669-A671 PolarHBondContact O-N 2.98Å; Y669-I672 PolarHBondContact O-N 3.49Å; Y669-F673 PolarHBondContact O-N 3.39Å; Y669-D701 PolarHBondContact OH-OD2 3.34Å; Y669-S703 WeakPolarHBondContact OH-CB 3.3Å; Y669-C704 HydrophobicContact CD1-CB 4.37Å; Y669-C704 VanDerWaalsContact CD1-SG 3.59Å; Y669-C704 HydrophobicContact CE1-CB 3.9Å; Y669-C704 VanDerWaalsContact CE1-N 3.32Å; Y669-C704 WeakPolarHBondContact CE1-SG 3.49Å; Y669-M707 VanDerWaalsContact O-CE 3.23Å; Y669-M707 WeakPolarHBondContact O-CE 3.42Å; Y669-V752 HydrophobicContact CD2-CB 4.44Å; Y669-V752 HydrophobicContact CD2-CG1 3.9Å; Y669-V752 HydrophobicContact CG-CG1 4.39Å
670	N	85	Confident	82.6	Confident	1 Å²	1	23.5 Å²	23.5	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-67.3	-37.4	-178.6	-73.2	-3.7	0	0	0	112.5	R634 P637 L638 E666 I667 A668 F673 A674 F749 V752	R634-N670 PolarHBondContact O-ND2 2.95Å; P637-N670 HydrophobicContact CB-CB 4.33Å; L638-N670 HydrophobicContact CD1-CB 4.43Å; L638-N670 HydrophobicContact CD2-CB 4.1Å; L638-N670 HydrophobicContact CG-CB 3.97Å; E666-N670 PolarHBondContact O-N 2.92Å; E666-N670 VanDerWaalsContact O-N 3.08Å; I667-N670 PolarHBondContact O-N 3.36Å; A668-N670 PolarHBondContact O-N 3.2Å; N670-F673 PolarHBondContact O-N 3.39Å; N670-A674 VanDerWaalsContact O-CB 3.3Å; N670-A674 WeakPolarHBondContact O-CB 3.49Å; N670-A674 PolarHBondContact O-N 3.27Å; N670-F749 PolarHBondContact ND2-O 3.44Å; N670-F749 PolarHBondContact OD1-O 3.26Å; N670-V752 WeakPolarHBondContact OD1-CG2 3.4Å
671	A	86.6	Confident	82.3	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-66.8	-41.4	175.8	0	0	0	0	0	112.4	P637 F659 I667 A668 Y669 A674 L675	P637-A671 HydrophobicContact CB-CB 4.09Å; P637-A671 HydrophobicContact CG-CB 4.46Å; F659-A671 HydrophobicContact CB-CB 3.84Å; I667-A671 VanDerWaalsContact O-CB 3.27Å; I667-A671 WeakPolarHBondContact O-CB 3.24Å; I667-A671 PolarHBondContact O-N 2.63Å; A668-A671 PolarHBondContact O-N 2.93Å; Y669-A671 PolarHBondContact O-N 2.98Å; A671-A674 PolarHBondContact O-N 3.19Å; A671-L675 WeakPolarHBondContact O-CG 3.33Å; A671-L675 PolarHBondContact O-N 3.1Å
672	I	86.8	Confident	81.9	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-65.1	-41.6	177	-66.4	161.1	0	0	0	110.7	A668 Y669 L675 G676 M707 V708 A711	A668-I672 WeakPolarHBondContact O-CB 3.48Å; A668-I672 WeakPolarHBondContact O-CD1 3.27Å; A668-I672 WeakPolarHBondContact O-CG1 3.43Å; A668-I672 PolarHBondContact O-N 2.93Å; Y669-I672 PolarHBondContact O-N 3.49Å; I672-L675 WeakPolarHBondContact O-CB 3.39Å; I672-L675 PolarHBondContact O-N 3.4Å; I672-G676 PolarHBondContact O-N 3.43Å; I672-G676 VanDerWaalsContact O-N 3.17Å; I672-M707 HydrophobicContact CB-CG 3.93Å; I672-M707 HydrophobicContact CG2-CB 4.2Å; I672-M707 HydrophobicContact CG2-CG 3.67Å; I672-V708 HydrophobicContact CD1-CG2 3.85Å; I672-V708 HydrophobicContact CG1-CG2 4.32Å; I672-V708 HydrophobicContact CG2-CB 4.2Å; I672-V708 HydrophobicContact CG2-CG2 3.68Å; I672-A711 HydrophobicContact CG2-CB 4.11Å; I672-A711 WeakPolarHBondContact O-CB 3.32Å
673	F	84.9	Confident	81.7	Confident	3 Å²	3	21.5 Å²	21.5	1%	0.013	11%	0.112	C	C	.	.	H	α-helix	trans	-64.7	-44.6	175.1	-176.8	-109.3	0	0	0	112.3	L638 Y669 N670 L675 G676 L677 M707 L714 F749	L638-F673 HydrophobicContact CD2-CD1 3.77Å; Y669-F673 PolarHBondContact O-N 3.39Å; N670-F673 PolarHBondContact O-N 3.39Å; F673-L675 VanDerWaalsContact C-N 3.29Å; F673-L675 PolarHBondContact O-N 2.8Å; F673-G676 CarbonylContact O-C 3.5Å; F673-G676 WeakPolarHBondContact O-CA 3.31Å; F673-G676 PolarHBondContact O-N 3.2Å; F673-L677 HydrophobicContact CD1-CD1 4Å; F673-L677 HydrophobicContact CD1-CG 4.19Å; F673-L677 HydrophobicContact CE1-CD1 3.46Å; F673-L677 VanDerWaalsContact CE1-CD1 3.46Å; F673-L677 HydrophobicContact CE1-CD2 4Å; F673-L677 HydrophobicContact CE1-CG 3.68Å; F673-L677 HydrophobicContact CE2-CD2 4.47Å; F673-L677 HydrophobicContact CZ-CD1 4.09Å; F673-L677 HydrophobicContact CZ-CD2 3.72Å; F673-L677 HydrophobicContact CZ-CG 3.86Å; F673-L677 PolarHBondContact O-N 3.04Å; F673-M707 HydrophobicContact CB-CE 3.77Å; F673-M707 HydrophobicContact CB-CG 4.45Å; F673-M707 HydrophobicContact CB-SD 3.77Å; F673-M707 HydrophobicContact CD2-SD 4.13Å; F673-M707 HydrophobicContact CG-CE 4.49Å; F673-M707 HydrophobicContact CG-SD 4.34Å; F673-L714 HydrophobicContact CD2-CD1 4.41Å; F673-L714 HydrophobicContact CE2-CD1 3.84Å; F673-F749 HydrophobicContact CB-CD1 4.44Å; F673-F749 HydrophobicContact CB-CE1 4.25Å; F673-F749 HydrophobicContact CB-CZ 4.45Å; F673-F749 HydrophobicContact CD1-CD1 4.24Å; F673-F749 AromaticContact CD1-CD2 3.46Å; F673-F749 HydrophobicContact CD1-CD2 3.46Å; F673-F749 VanDerWaalsContact CD1-CD2 3.46Å; F673-F749 HydrophobicContact CD1-CE1 4.26Å; F673-F749 AromaticContact CD1-CE2 3.54Å; F673-F749 HydrophobicContact CD1-CE2 3.54Å; F673-F749 AromaticContact CD1-CG 3.86Å; F673-F749 HydrophobicContact CD1-CG 3.86Å; F673-F749 AromaticContact CD1-CZ 3.91Å; F673-F749 HydrophobicContact CD1-CZ 3.91Å; F673-F749 HydrophobicContact CD2-CD2 4.33Å; F673-F749 AromaticContact CD2-CE1 3.88Å; F673-F749 HydrophobicContact CD2-CE1 3.88Å; F673-F749 AromaticContact CD2-CE2 3.59Å; F673-F749 HydrophobicContact CD2-CE2 3.59Å; F673-F749 AromaticContact CD2-CZ 3.26Å; F673-F749 HydrophobicContact CD2-CZ 3.26Å; F673-F749 AromaticContact CE1-CD2 3.24Å; F673-F749 HydrophobicContact CE1-CD2 3.24Å; F673-F749 AromaticContact CE1-CE2 3.18Å; F673-F749 HydrophobicContact CE1-CE2 3.18Å; F673-F749 HydrophobicContact CE1-CG 4.11Å; F673-F749 AromaticContact CE1-CZ 3.93Å; F673-F749 HydrophobicContact CE1-CZ 3.93Å; F673-F749 HydrophobicContact CE2-CD2 4.18Å; F673-F749 HydrophobicContact CE2-CE1 4.34Å; F673-F749 AromaticContact CE2-CE2 3.25Å; F673-F749 HydrophobicContact CE2-CE2 3.25Å; F673-F749 AromaticContact CE2-CZ 3.32Å; F673-F749 HydrophobicContact CE2-CZ 3.32Å; F673-F749 HydrophobicContact CG-CD1 4.17Å; F673-F749 HydrophobicContact CG-CD2 4.02Å; F673-F749 AromaticContact CG-CE1 3.85Å; F673-F749 HydrophobicContact CG-CE1 3.85Å; F673-F749 AromaticContact CG-CE2 3.74Å; F673-F749 HydrophobicContact CG-CE2 3.74Å; F673-F749 HydrophobicContact CG-CG 4.26Å; F673-F749 AromaticContact CG-CZ 3.59Å; F673-F749 HydrophobicContact CG-CZ 3.59Å; F673-F749 AromaticContact CZ-CD2 3.66Å; F673-F749 HydrophobicContact CZ-CD2 3.66Å; F673-F749 AromaticContact CZ-CE2 3.05Å; F673-F749 HydrophobicContact CZ-CE2 3.05Å; F673-F749 AromaticContact CZ-CZ 3.68Å; F673-F749 HydrophobicContact CZ-CZ 3.68Å
674	A	86.2	Confident	81.9	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-59.8	-38.3	175.9	0	0	0	0	0	112.4	P637 L656 N670 A671 G676 L677 I678	P637-A674 WeakPolarHBondContact O-CB 3.42Å; L656-A674 HydrophobicContact CD1-CB 4.01Å; L656-A674 HydrophobicContact CD2-CB 3.89Å; N670-A674 VanDerWaalsContact O-CB 3.3Å; N670-A674 WeakPolarHBondContact O-CB 3.49Å; N670-A674 PolarHBondContact O-N 3.27Å; A671-A674 PolarHBondContact O-N 3.19Å; A674-G676 VanDerWaalsContact C-N 3.27Å; A674-G676 PolarHBondContact O-N 3.25Å; A674-L677 PolarHBondContact O-N 3.28Å; A674-I678 WeakPolarHBondContact O-CG1 3.48Å; A674-I678 PolarHBondContact O-N 3.29Å
675	L	86.5	Confident	81.9	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-59	-39	170.9	-76.4	174.1	0	0	0	111.8	L653 L656 T657 S660 A671 I672 F673 G679 L687 L691 L694	L653-L675 HydrophobicContact CD1-CD2 3.63Å; L656-L675 HydrophobicContact CB-CD2 3.62Å; L656-L675 HydrophobicContact CB-CG 3.9Å; L656-L675 HydrophobicContact CD1-CD2 4.06Å; L656-L675 HydrophobicContact CD1-CG 4.35Å; T657-L675 HydrophobicContact CG2-CD1 4.32Å; T657-L675 HydrophobicContact CG2-CD2 4.22Å; S660-L675 WeakPolarHBondContact OG-CD1 3.45Å; A671-L675 WeakPolarHBondContact O-CG 3.33Å; A671-L675 PolarHBondContact O-N 3.1Å; I672-L675 WeakPolarHBondContact O-CB 3.39Å; I672-L675 PolarHBondContact O-N 3.4Å; F673-L675 VanDerWaalsContact C-N 3.29Å; F673-L675 PolarHBondContact O-N 2.8Å; L675-G679 PolarHBondContact O-N 2.9Å; L675-L687 HydrophobicContact CB-CD1 4.07Å; L675-L687 HydrophobicContact CD2-CD1 3.88Å; L675-L687 HydrophobicContact CG-CD1 4.49Å; L675-L687 WeakPolarHBondContact O-CD2 3.32Å; L675-L691 HydrophobicContact CB-CD2 4.32Å; L675-L694 HydrophobicContact CD1-CD1 3.77Å
676	G	83.8	Confident	81.9	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-63.5	-44.4	173.6	0	0	0	0	0	113.4	I672 F673 A674 G679 A680	I672-G676 PolarHBondContact O-N 3.43Å; I672-G676 VanDerWaalsContact O-N 3.17Å; F673-G676 CarbonylContact O-C 3.5Å; F673-G676 WeakPolarHBondContact O-CA 3.31Å; F673-G676 PolarHBondContact O-N 3.2Å; A674-G676 VanDerWaalsContact C-N 3.27Å; A674-G676 PolarHBondContact O-N 3.25Å; G676-G679 PolarHBondContact O-N 3.23Å; G676-A680 PolarHBondContact O-N 3.16Å; G676-A680 VanDerWaalsContact O-N 3.1Å
677	L	84.3	Confident	82.1	Confident	0 Å²	0	17 Å²	17	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-64.2	-43.4	178.6	-71.1	-178.8	0	0	0	113	S646 F673 A674 G679 A680 L724	S646-L677 PolarHBondContact N-O 3.41Å; F673-L677 HydrophobicContact CD1-CD1 4Å; F673-L677 HydrophobicContact CD1-CG 4.19Å; F673-L677 HydrophobicContact CE1-CD1 3.46Å; F673-L677 VanDerWaalsContact CE1-CD1 3.46Å; F673-L677 HydrophobicContact CE1-CD2 4Å; F673-L677 HydrophobicContact CE1-CG 3.68Å; F673-L677 HydrophobicContact CE2-CD2 4.47Å; F673-L677 HydrophobicContact CZ-CD1 4.09Å; F673-L677 HydrophobicContact CZ-CD2 3.72Å; F673-L677 HydrophobicContact CZ-CG 3.86Å; F673-L677 PolarHBondContact O-N 3.04Å; A674-L677 PolarHBondContact O-N 3.28Å; L677-G679 VanDerWaalsContact C-N 3.28Å; L677-G679 PolarHBondContact O-N 3.4Å; L677-A680 VanDerWaalsContact O-CB 3.31Å; L677-A680 WeakPolarHBondContact O-CB 3.33Å; L677-A680 PolarHBondContact O-N 3.09Å; L677-L724 HydrophobicContact CD2-CD1 4.07Å
678	I	84.9	Confident	81.9	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-65	-37.6	178.4	-67.9	177	0	0	0	111.2	S644 S646 P648 V652 L656 A674 A680	S644-I678 WeakPolarHBondContact O-CA 3.38Å; S644-I678 WeakPolarHBondContact OG-CD1 3.39Å; S644-I678 WeakPolarHBondContact OG-CG1 3.26Å; S646-I678 CarbonylContact C-O 3.41Å; S646-I678 WeakPolarHBondContact CA-O 3.24Å; P648-I678 HydrophobicContact CB-CG2 4.15Å; V652-I678 HydrophobicContact CB-CD1 4.29Å; V652-I678 HydrophobicContact CG1-CD1 3.48Å; V652-I678 VanDerWaalsContact CG1-CD1 3.48Å; L656-I678 HydrophobicContact CD1-CD1 3.2Å; L656-I678 HydrophobicContact CD1-CG1 4.43Å; A674-I678 WeakPolarHBondContact O-CG1 3.48Å; A674-I678 PolarHBondContact O-N 3.29Å; I678-A680 VanDerWaalsContact C-N 3.3Å
679	G	78.5	Confident	82	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-78.8	-9.4	179	0	0	0	0	0	115.4	L675 G676 L677 G681 T682	L675-G679 PolarHBondContact O-N 2.9Å; G676-G679 PolarHBondContact O-N 3.23Å; L677-G679 VanDerWaalsContact C-N 3.28Å; L677-G679 PolarHBondContact O-N 3.4Å; G679-G681 PolarHBondContact O-N 3.09Å; G679-G681 VanDerWaalsContact O-N 3.1Å; G679-T682 PolarHBondContact O-N 3.23Å; G679-T682 PolarHBondContact O-OG1 2.85Å
680	A	80.1	Confident	81.9	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	117.7	-165.7	0	0	0	0	0	111.7	S646 G676 L677 I678 T682 L714 L724	S646-A680 PolarHBondContact OG-O 3.27Å; G676-A680 PolarHBondContact O-N 3.16Å; G676-A680 VanDerWaalsContact O-N 3.1Å; L677-A680 VanDerWaalsContact O-CB 3.31Å; L677-A680 WeakPolarHBondContact O-CB 3.33Å; L677-A680 PolarHBondContact O-N 3.09Å; I678-A680 VanDerWaalsContact C-N 3.3Å; A680-T682 PolarHBondContact O-N 3.47Å; A680-L714 VanDerWaalsContact CA-O 3.31Å; A680-L714 WeakPolarHBondContact CA-O 3.34Å; A680-L724 HydrophobicContact CB-CB 4.3Å; A680-L724 HydrophobicContact CB-CD1 3.38Å; A680-L724 HydrophobicContact CB-CG 3.82Å
681	G	74.4	Confident	81.8	Confident	1 Å²	1	20.8 Å²	20.8	1%	0.01	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	-7.3	177.4	0	0	0	0	0	117.2	G679 L714 G720 M722	G679-G681 PolarHBondContact O-N 3.09Å; G679-G681 VanDerWaalsContact O-N 3.1Å; G681-L714 PolarHBondContact N-O 3.42Å; G681-G720 CarbonylContact O-C 3.46Å; G681-G720 VanDerWaalsContact O-CA 3.31Å; G681-G720 WeakPolarHBondContact O-CA 3.46Å; G681-G720 VanDerWaalsContact O-O 3.06Å; G681-M722 WeakPolarHBondContact CA-O 3.15Å
682	T	73.3	Confident	81.5	Confident	31 Å²	31	25.1 Å²	25.1	19%	0.19	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-12.3	-172.2	61.4	0	0	0	0	113.5	S646 P648 G679 A680 N684	S646-T682 VanDerWaalsContact O-CG2 3.31Å; S646-T682 WeakPolarHBondContact O-CG2 3.26Å; P648-T682 HydrophobicContact CG-CG2 4.42Å; G679-T682 PolarHBondContact O-N 3.23Å; G679-T682 PolarHBondContact O-OG1 2.85Å; A680-T682 PolarHBondContact O-N 3.47Å; T682-N684 PolarHBondContact O-N 2.95Å; T682-N684 VanDerWaalsContact O-N 3.11Å
683	N	75.3	Confident	81.4	Confident	78 Å²	78	31.3 Å²	31.3	42%	0.417	17%	0.167	S	C	.	.			trans	44	43.9	-177	-169.2	13.9	0	0	0	112.8	A685 T715 H716	N683-A685 PolarHBondContact O-N 3.33Å; N683-T715 PolarHBondContact N-O 3.26Å; N683-H716 PolarHBondContact OD1-CE1 2.98Å; N683-H716 PolarHBondContact OD1-ND1 2.98Å
684	N	79.2	Confident	81.1	Confident	45 Å²	45	31.2 Å²	31.2	24%	0.241	17%	0.167	C	C	.	.			trans	-72	116.8	-177.8	-175.3	-10.9	0	0	0	110.6	T682 R686 L687 G688	T682-N684 PolarHBondContact O-N 2.95Å; T682-N684 VanDerWaalsContact O-N 3.11Å; N684-R686 VanDerWaalsContact C-N 3.27Å; N684-R686 PolarHBondContact O-N 3.47Å; N684-R686 PolarHBondContact OD1-N 3.44Å; N684-R686 VanDerWaalsContact OD1-N 3.12Å; N684-L687 HydrophobicContact CB-CB 4.2Å; N684-L687 PolarHBondContact O-N 2.94Å; N684-L687 VanDerWaalsContact O-N 3.13Å; N684-G688 PolarHBondContact O-N 3.25Å
685	A	79.3	Confident	80.5	Confident	76 Å²	76	32 Å²	32	63%	0.628	17%	0.173	S	C	*	.	H	α-helix	trans	-56.2	-37	-178.3	0	0	0	0	0	113.4	N683 G688 T689	N683-A685 PolarHBondContact O-N 3.33Å; A685-G688 PolarHBondContact O-N 3.35Å; A685-T689 WeakPolarHBondContact O-CG2 3.05Å; A685-T689 PolarHBondContact O-N 3.44Å; A685-T689 PolarHBondContact O-OG1 3.12Å
686	R	80.6	Confident	80.1	Confident	107 Å²	107	37 Å²	37	40%	0.404	20%	0.199	S	C	.	.	H	α-helix	trans	-69.7	-37.1	179.6	-174.1	176.6	178.2	-174.7	-5.8	112.1	L653 E654 N684 T689 T690	L653-R686 HydrophobicContact CD2-CG 4.18Å; E654-R686 IonicContact OE1-CZ 3.71Å; E654-R686 IonicContact OE1-NH1 3.71Å; E654-R686 IonicContact OE1-NH2 2.81Å; E654-R686 PolarHBondContact OE1-NH2 3.13Å; N684-R686 VanDerWaalsContact C-N 3.27Å; N684-R686 PolarHBondContact O-N 3.47Å; N684-R686 PolarHBondContact OD1-N 3.44Å; N684-R686 VanDerWaalsContact OD1-N 3.12Å; R686-T689 WeakPolarHBondContact CA-OG1 3.44Å; R686-T689 PolarHBondContact O-OG1 3.03Å; R686-T690 WeakPolarHBondContact O-CB 3.45Å; R686-T690 PolarHBondContact O-N 2.72Å; R686-T690 PolarHBondContact O-OG1 2.76Å
687	L	82.4	Confident	79.8	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-70.6	-42.2	174.9	178.3	66.9	0	0	0	110.4	L653 L675 N684 T689 T690 L691 T715	L653-L687 HydrophobicContact CD1-CB 4.35Å; L653-L687 HydrophobicContact CD1-CD1 3.46Å; L653-L687 VanDerWaalsContact CD1-CD1 3.46Å; L653-L687 HydrophobicContact CD1-CG 4.43Å; L675-L687 HydrophobicContact CB-CD1 4.07Å; L675-L687 HydrophobicContact CD2-CD1 3.88Å; L675-L687 HydrophobicContact CG-CD1 4.49Å; L675-L687 WeakPolarHBondContact O-CD2 3.32Å; N684-L687 HydrophobicContact CB-CB 4.2Å; N684-L687 PolarHBondContact O-N 2.94Å; N684-L687 VanDerWaalsContact O-N 3.13Å; L687-T689 PolarHBondContact O-N 3.1Å; L687-T690 PolarHBondContact O-N 3.29Å; L687-T690 VanDerWaalsContact O-N 3.08Å; L687-L691 HydrophobicContact CD1-CD1 4.39Å; L687-L691 HydrophobicContact CD1-CG 4.26Å; L687-L691 HydrophobicContact CG-CD1 4.14Å; L687-L691 HydrophobicContact CG-CG 4.42Å; L687-L691 PolarHBondContact O-N 2.83Å; L687-T715 HydrophobicContact CD2-CG2 3.43Å; L687-T715 VanDerWaalsContact CD2-CG2 3.43Å; L687-T715 HydrophobicContact CG-CG2 4.03Å
688	G	80	Confident	79.2	Confident	16 Å²	16	45.3 Å²	45.3	17%	0.165	23%	0.232	C	C	.	.	H	α-helix	trans	-62.5	-35.7	176.4	0	0	0	0	0	113.8	N684 A685 R692	N684-G688 PolarHBondContact O-N 3.25Å; A685-G688 PolarHBondContact O-N 3.35Å; G688-R692 WeakPolarHBondContact O-CG 3.46Å; G688-R692 PolarHBondContact O-N 3.12Å; G688-R692 PolarHBondContact O-NE 2.88Å
689	T	84.8	Confident	78.3	Confident	56 Å²	56	47.1 Å²	47.1	34%	0.344	25%	0.247	S	C	.	.	H	α-helix	trans	-67.1	-40.3	170.4	51.6	0	0	0	0	111.7	A685 R686 L687 R692 Q693	A685-T689 WeakPolarHBondContact O-CG2 3.05Å; A685-T689 PolarHBondContact O-N 3.44Å; A685-T689 PolarHBondContact O-OG1 3.12Å; R686-T689 WeakPolarHBondContact CA-OG1 3.44Å; R686-T689 PolarHBondContact O-OG1 3.03Å; L687-T689 PolarHBondContact O-N 3.1Å; T689-R692 PolarHBondContact O-N 3.21Å; T689-Q693 WeakPolarHBondContact O-CG 3.41Å; T689-Q693 PolarHBondContact O-N 2.62Å
690	T	83.9	Confident	77.8	Confident	23 Å²	23	58.8 Å²	58.8	14%	0.141	29%	0.291	C	S	.	.	H	α-helix	trans	-68.2	-44.4	-177.8	-53.3	0	0	0	0	112.1	T657 R686 L687 R692 Q693 L694	T657-T690 HydrophobicContact CG2-CG2 3.44Å; T657-T690 VanDerWaalsContact CG2-CG2 3.44Å; R686-T690 WeakPolarHBondContact O-CB 3.45Å; R686-T690 PolarHBondContact O-N 2.72Å; R686-T690 PolarHBondContact O-OG1 2.76Å; L687-T690 PolarHBondContact O-N 3.29Å; L687-T690 VanDerWaalsContact O-N 3.08Å; T690-R692 VanDerWaalsContact C-N 3.27Å; T690-R692 PolarHBondContact O-N 3.32Å; T690-Q693 PolarHBondContact O-N 2.75Å; T690-Q693 VanDerWaalsContact O-N 3.13Å; T690-L694 HydrophobicContact CG2-CD1 4.3Å; T690-L694 WeakPolarHBondContact O-CG 3.47Å; T690-L694 PolarHBondContact O-N 2.59Å
691	L	82.5	Confident	77.5	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-61.5	-35.6	174.7	-70.7	173.4	0	0	0	112	L675 L687 L694 A695 V708 A711 Q712 T715	L675-L691 HydrophobicContact CB-CD2 4.32Å; L687-L691 HydrophobicContact CD1-CD1 4.39Å; L687-L691 HydrophobicContact CD1-CG 4.26Å; L687-L691 HydrophobicContact CG-CD1 4.14Å; L687-L691 HydrophobicContact CG-CG 4.42Å; L687-L691 PolarHBondContact O-N 2.83Å; L691-L694 HydrophobicContact CD2-CD1 4.43Å; L691-L694 PolarHBondContact O-N 3.08Å; L691-A695 WeakPolarHBondContact O-CB 3.31Å; L691-A695 PolarHBondContact O-N 3.38Å; L691-V708 WeakPolarHBondContact O-CG1 3.21Å; L691-A711 HydrophobicContact CD1-CB 4.28Å; L691-A711 HydrophobicContact CD2-CB 3.97Å; L691-Q712 HydrophobicContact CB-CG 3.86Å; L691-Q712 HydrophobicContact CD1-CG 4Å; L691-T715 HydrophobicContact CD1-CG2 3.58Å
692	R	81.1	Confident	77.5	Confident	91 Å²	91	61.7 Å²	61.7	34%	0.343	31%	0.309	S	S	.	.	H	α-helix	trans	-65.9	-39.9	173.5	-75.9	-176.8	-67.3	156.5	-3.3	112.4	G688 T689 T690 A695 L696	G688-R692 WeakPolarHBondContact O-CG 3.46Å; G688-R692 PolarHBondContact O-N 3.12Å; G688-R692 PolarHBondContact O-NE 2.88Å; T689-R692 PolarHBondContact O-N 3.21Å; T690-R692 VanDerWaalsContact C-N 3.27Å; T690-R692 PolarHBondContact O-N 3.32Å; R692-A695 WeakPolarHBondContact O-CB 3.31Å; R692-A695 PolarHBondContact O-N 3.27Å; R692-L696 WeakPolarHBondContact O-CG 3.33Å; R692-L696 PolarHBondContact O-N 3.35Å
693	Q	83.2	Confident	77.7	Confident	129 Å²	129	60.8 Å²	60.8	60%	0.603	30%	0.304	S	S	*	.	H	α-helix	trans	-65.8	-40.8	174.5	-71	175.5	-10.3	0	0	111.9	T689 T690 A695 L696 Y697	T689-Q693 WeakPolarHBondContact O-CG 3.41Å; T689-Q693 PolarHBondContact O-N 2.62Å; T690-Q693 PolarHBondContact O-N 2.75Å; T690-Q693 VanDerWaalsContact O-N 3.13Å; Q693-A695 VanDerWaalsContact C-N 3.34Å; Q693-L696 PolarHBondContact O-N 3.07Å; Q693-Y697 PolarHBondContact O-N 3.39Å
694	L	79.6	Confident	77.8	Confident	2 Å²	2	57.2 Å²	57.2	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-63.9	-38.3	174.5	-70.6	171.3	0	0	0	112	L675 T690 L691 L696 Y697 H698 V708	L675-L694 HydrophobicContact CD1-CD1 3.77Å; T690-L694 HydrophobicContact CG2-CD1 4.3Å; T690-L694 WeakPolarHBondContact O-CG 3.47Å; T690-L694 PolarHBondContact O-N 2.59Å; L691-L694 HydrophobicContact CD2-CD1 4.43Å; L691-L694 PolarHBondContact O-N 3.08Å; L694-L696 VanDerWaalsContact C-N 3.31Å; L694-L696 PolarHBondContact O-N 3.2Å; L694-Y697 PolarHBondContact O-N 2.8Å; L694-H698 PolarHBondContact O-CD2 2.79Å; L694-H698 PolarHBondContact O-N 2.82Å; L694-V708 HydrophobicContact CB-CG2 4.42Å
695	A	74	Confident	77.8	Confident	15 Å²	15	56.7 Å²	56.7	12%	0.124	28%	0.28	C	S	.	.	H	α-helix	trans	-60.2	-40.9	174.8	0	0	0	0	0	112	L691 R692 Q693 A699 V708	L691-A695 WeakPolarHBondContact O-CB 3.31Å; L691-A695 PolarHBondContact O-N 3.38Å; R692-A695 WeakPolarHBondContact O-CB 3.31Å; R692-A695 PolarHBondContact O-N 3.27Å; Q693-A695 VanDerWaalsContact C-N 3.34Å; A695-A699 PolarHBondContact O-N 3.18Å; A695-V708 HydrophobicContact CB-CG1 3.79Å
696	L	77.5	Confident	77.6	Confident	105 Å²	105	53.4 Å²	53.4	55%	0.55	25%	0.252	S	S	.	.	H	α-helix	trans	-67.8	-40	176.5	-68.7	170.5	0	0	0	112	V298 R692 Q693 L694	V298-L696 HydrophobicContact CG1-CD2 4.25Å; R692-L696 WeakPolarHBondContact O-CG 3.33Å; R692-L696 PolarHBondContact O-N 3.35Å; Q693-L696 PolarHBondContact O-N 3.07Å; L694-L696 VanDerWaalsContact C-N 3.31Å; L694-L696 PolarHBondContact O-N 3.2Å
697	Y	77.7	Confident	77.7	Confident	151 Å²	151	48.8 Å²	48.8	59%	0.592	24%	0.235	S	C	*	.	H	α-helix	trans	-67.5	-43.8	179.4	-175.2	-99	0	0	0	112.4	H661 Q693 L694 A699	H661-Y697 AromaticContact ND1-CD1 3.9Å; H661-Y697 AromaticContact ND1-CE1 3.87Å; Q693-Y697 PolarHBondContact O-N 3.39Å; L694-Y697 PolarHBondContact O-N 2.8Å; Y697-A699 PolarHBondContact O-N 2.94Å
698	H	71.6	Confident	77.7	Confident	24 Å²	24	48.8 Å²	48.8	11%	0.111	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	15.7	-177.6	-68.2	-70.7	0	0	0	114.6	S660 L694 R700 D701 C704	S660-H698 PolarHBondContact O-NE2 2.79Å; L694-H698 PolarHBondContact O-CD2 2.79Å; L694-H698 PolarHBondContact O-N 2.82Å; H698-R700 PolarHBondContact O-N 3.28Å; H698-D701 PolarHBondContact O-N 3.48Å; H698-C704 HydrophobicContact CB-CB 3.67Å
699	A	64.6	Low	77.6	Confident	38 Å²	38	49.5 Å²	49.5	31%	0.314	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-18.8	-178.5	0	0	0	0	0	114.4	A695 Y697	A695-A699 PolarHBondContact O-N 3.18Å; Y697-A699 PolarHBondContact O-N 2.94Å
700	R	68.6	Low	77.5	Confident	245 Å²	245	47 Å²	47	93%	0.925	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-24.2	178.2	-64.1	-176.3	-178.8	-179.4	0.9	114.5	H698	H698-R700 PolarHBondContact O-N 3.28Å
701	D	74.7	Confident	77.5	Confident	49 Å²	49	45.9 Å²	45.9	26%	0.262	21%	0.21	S	C	.	.			trans	-104.5	109.1	178.9	-179.9	18.4	0	0	0	110.3	Y669 H698 S703 C704 F705	Y669-D701 PolarHBondContact OH-OD2 3.34Å; H698-D701 PolarHBondContact O-N 3.48Å; D701-S703 PolarHBondContact O-N 2.69Å; D701-S703 PolarHBondContact OD1-N 3.17Å; D701-C704 HydrophobicContact CB-CB 4.09Å; D701-C704 PolarHBondContact O-N 3.04Å; D701-C704 PolarHBondContact OD2-N 3.2Å; D701-C704 PolarHBondContact OD2-SG 2.88Å; D701-F705 VanDerWaalsContact O-CB 3.27Å; D701-F705 WeakPolarHBondContact O-CB 3.46Å; D701-F705 PolarHBondContact O-N 2.88Å
702	A	74.6	Confident	77.5	Confident	14 Å²	14	46.4 Å²	46.4	12%	0.116	21%	0.213	C	C	.	.	H	α-helix	trans	-60.2	-30.7	-178	0	0	0	0	0	112.9	D306 M706	D306-A702 HydrophobicContact CB-CB 4.02Å; A702-M706 WeakPolarHBondContact O-CB 3.46Å; A702-M706 PolarHBondContact O-N 3.2Å
703	S	76.8	Confident	77.4	Confident	12 Å²	12	42.1 Å²	42.1	8%	0.084	20%	0.197	C	C	.	.	H	α-helix	trans	-73.4	-47.8	179.6	-50	0	0	0	0	111.4	R309 Y669 D701 F705 M706 M707 L757	R309-S703 PolarHBondContact NH1-OG 2.89Å; Y669-S703 WeakPolarHBondContact OH-CB 3.3Å; D701-S703 PolarHBondContact O-N 2.69Å; D701-S703 PolarHBondContact OD1-N 3.17Å; S703-F705 PolarHBondContact O-N 2.78Å; S703-M706 PolarHBondContact O-N 2.73Å; S703-M707 PolarHBondContact O-N 3.42Å; S703-M707 VanDerWaalsContact O-N 3.12Å; S703-L757 WeakPolarHBondContact OG-CD1 3.32Å
704	C	77.6	Confident	77.3	Confident	2 Å²	2	36 Å²	36	1%	0.014	17%	0.168	C	C	.	.	H	α-helix	trans	-59	-43.4	173.5	-89.9	0	0	0	0	109.7	Y669 H698 D701 M706 M707 V708	Y669-C704 HydrophobicContact CD1-CB 4.37Å; Y669-C704 VanDerWaalsContact CD1-SG 3.59Å; Y669-C704 HydrophobicContact CE1-CB 3.9Å; Y669-C704 VanDerWaalsContact CE1-N 3.32Å; Y669-C704 WeakPolarHBondContact CE1-SG 3.49Å; H698-C704 HydrophobicContact CB-CB 3.67Å; D701-C704 HydrophobicContact CB-CB 4.09Å; D701-C704 PolarHBondContact O-N 3.04Å; D701-C704 PolarHBondContact OD2-N 3.2Å; D701-C704 PolarHBondContact OD2-SG 2.88Å; C704-M706 PolarHBondContact O-N 2.63Å; C704-M707 WeakPolarHBondContact O-CB 3Å; C704-M707 PolarHBondContact O-N 2.67Å; C704-M707 VanDerWaalsContact O-N 3.11Å; C704-V708 WeakPolarHBondContact O-CG2 3.46Å; C704-V708 PolarHBondContact O-N 3.4Å
705	F	78.4	Confident	77.3	Confident	35 Å²	35	36.1 Å²	36.1	15%	0.154	17%	0.169	C	C	.	.	H	α-helix	trans	-63.4	-42.1	-177.8	-174.1	-112.4	0	0	0	112.7	A310 D701 S703 M707 V708 R709	A310-F705 HydrophobicContact CB-CE1 4.38Å; D701-F705 VanDerWaalsContact O-CB 3.27Å; D701-F705 WeakPolarHBondContact O-CB 3.46Å; D701-F705 PolarHBondContact O-N 2.88Å; S703-F705 PolarHBondContact O-N 2.78Å; F705-M707 VanDerWaalsContact C-N 3.31Å; F705-M707 PolarHBondContact O-N 2.95Å; F705-V708 PolarHBondContact O-N 2.92Å; F705-R709 VanDerWaalsContact CZ-CZ 3.46Å; F705-R709 WeakPolarHBondContact O-CG 3.45Å; F705-R709 PolarHBondContact O-N 3.11Å; F705-R709 VanDerWaalsContact O-N 3.13Å
706	M	75.9	Confident	77.5	Confident	7 Å²	7	36.9 Å²	36.9	3%	0.034	17%	0.17	C	C	.	.	H	α-helix	trans	-57.1	-45.1	170.5	171.3	-178	160.1	0	0	111.2	L312 A313 A702 S703 C704 R709 I710	L312-M706 HydrophobicContact CD2-CE 3.16Å; L312-M706 HydrophobicContact CD2-CG 4.16Å; L312-M706 HydrophobicContact CD2-SD 3.48Å; L312-M706 WeakPolarHBondContact CD2-SD 3.36Å; A313-M706 HydrophobicContact CB-CB 4.34Å; A313-M706 HydrophobicContact CB-CG 4.1Å; A702-M706 WeakPolarHBondContact O-CB 3.46Å; A702-M706 PolarHBondContact O-N 3.2Å; S703-M706 PolarHBondContact O-N 2.73Å; C704-M706 PolarHBondContact O-N 2.63Å; M706-R709 PolarHBondContact O-N 3.39Å; M706-I710 HydrophobicContact CE-CD1 3.79Å; M706-I710 HydrophobicContact CG-CD1 4.02Å; M706-I710 WeakPolarHBondContact O-CG1 3.31Å; M706-I710 PolarHBondContact O-N 3.22Å
707	M	81.2	Confident	77.4	Confident	10 Å²	10	31.9 Å²	31.9	5%	0.049	14%	0.144	C	C	.	.	H	α-helix	trans	-63.3	-43.6	178.9	-170.3	70.8	103.2	0	0	112.6	Y669 I672 F673 S703 C704 F705 R709 I710 A711 F749	Y669-M707 VanDerWaalsContact O-CE 3.23Å; Y669-M707 WeakPolarHBondContact O-CE 3.42Å; I672-M707 HydrophobicContact CB-CG 3.93Å; I672-M707 HydrophobicContact CG2-CB 4.2Å; I672-M707 HydrophobicContact CG2-CG 3.67Å; F673-M707 HydrophobicContact CB-CE 3.77Å; F673-M707 HydrophobicContact CB-CG 4.45Å; F673-M707 HydrophobicContact CB-SD 3.77Å; F673-M707 HydrophobicContact CD2-SD 4.13Å; F673-M707 HydrophobicContact CG-CE 4.49Å; F673-M707 HydrophobicContact CG-SD 4.34Å; S703-M707 PolarHBondContact O-N 3.42Å; S703-M707 VanDerWaalsContact O-N 3.12Å; C704-M707 WeakPolarHBondContact O-CB 3Å; C704-M707 PolarHBondContact O-N 2.67Å; C704-M707 VanDerWaalsContact O-N 3.11Å; F705-M707 VanDerWaalsContact C-N 3.31Å; F705-M707 PolarHBondContact O-N 2.95Å; M707-R709 VanDerWaalsContact C-N 3.28Å; M707-R709 PolarHBondContact O-N 3.29Å; M707-I710 PolarHBondContact O-N 3.22Å; M707-A711 WeakPolarHBondContact O-CB 3.31Å; M707-A711 PolarHBondContact O-N 3.4Å; M707-F749 HydrophobicContact CE-CD1 3.62Å; M707-F749 HydrophobicContact CE-CE1 3.22Å; M707-F749 HydrophobicContact CE-CZ 4.29Å; M707-F749 HydrophobicContact SD-CE1 3.79Å; M707-F749 HydrophobicContact SD-CZ 4.37Å
708	V	83.3	Confident	77.1	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-61.1	-40	178.6	176.2	0	0	0	0	110.9	I672 L691 L694 A695 C704 F705 A711 Q712	I672-V708 HydrophobicContact CD1-CG2 3.85Å; I672-V708 HydrophobicContact CG1-CG2 4.32Å; I672-V708 HydrophobicContact CG2-CB 4.2Å; I672-V708 HydrophobicContact CG2-CG2 3.68Å; L691-V708 WeakPolarHBondContact O-CG1 3.21Å; L694-V708 HydrophobicContact CB-CG2 4.42Å; A695-V708 HydrophobicContact CB-CG1 3.79Å; C704-V708 WeakPolarHBondContact O-CG2 3.46Å; C704-V708 PolarHBondContact O-N 3.4Å; F705-V708 PolarHBondContact O-N 2.92Å; V708-A711 PolarHBondContact O-N 3.44Å; V708-Q712 WeakPolarHBondContact O-CG 3.32Å; V708-Q712 PolarHBondContact O-N 3.24Å
709	R	79	Confident	77	Confident	31 Å²	31	24.8 Å²	24.8	12%	0.117	12%	0.116	C	C	.	.	H	α-helix	trans	-66.7	-43.9	176.5	-74.3	-178.5	175.2	-164	-2.9	112.1	Y294 A310 A313 S314 V317 F705 M706 M707 A711 Q712 G713	Y294-R709 HydrophobicContact CE1-CB 4.43Å; Y294-R709 HydrophobicContact CE1-CG 3.87Å; A310-R709 PolarHBondContact O-NH1 3.43Å; A313-R709 HydrophobicContact CB-CB 3.75Å; A313-R709 HydrophobicContact CB-CG 4.35Å; S314-R709 PolarHBondContact OG-NH1 3.09Å; V317-R709 HydrophobicContact CG2-CB 4.22Å; V317-R709 WeakPolarHBondContact CG2-O 3.28Å; F705-R709 VanDerWaalsContact CZ-CZ 3.46Å; F705-R709 WeakPolarHBondContact O-CG 3.45Å; F705-R709 PolarHBondContact O-N 3.11Å; F705-R709 VanDerWaalsContact O-N 3.13Å; M706-R709 PolarHBondContact O-N 3.39Å; M707-R709 VanDerWaalsContact C-N 3.28Å; M707-R709 PolarHBondContact O-N 3.29Å; R709-A711 VanDerWaalsContact C-N 3.28Å; R709-A711 PolarHBondContact O-N 2.96Å; R709-Q712 WeakPolarHBondContact O-CB 3.39Å; R709-Q712 PolarHBondContact O-N 3.35Å; R709-Q712 VanDerWaalsContact O-N 3.15Å; R709-G713 PolarHBondContact O-N 3.13Å
710	I	81.9	Confident	77.3	Confident	3 Å²	3	23.3 Å²	23.3	2%	0.015	10%	0.104	C	C	.	.	H	α-helix	trans	-57.9	-45	173.8	-68.4	167.5	0	0	0	110.2	F316 F320 M706 M707 Q712 G713 L714 L764	F316-I710 HydrophobicContact CB-CG1 4.29Å; F316-I710 HydrophobicContact CD2-CD1 4.48Å; F320-I710 HydrophobicContact CE2-CG2 4.34Å; M706-I710 HydrophobicContact CE-CD1 3.79Å; M706-I710 HydrophobicContact CG-CD1 4.02Å; M706-I710 WeakPolarHBondContact O-CG1 3.31Å; M706-I710 PolarHBondContact O-N 3.22Å; M707-I710 PolarHBondContact O-N 3.22Å; I710-Q712 VanDerWaalsContact C-N 3.35Å; I710-Q712 PolarHBondContact O-N 3.21Å; I710-G713 PolarHBondContact O-N 3.37Å; I710-G713 VanDerWaalsContact O-N 3.15Å; I710-L714 HydrophobicContact CG2-CD1 4.33Å; I710-L714 WeakPolarHBondContact O-CG 3.34Å; I710-L714 PolarHBondContact O-N 2.78Å; I710-L764 HydrophobicContact CD1-CD1 4Å
711	A	83.8	Confident	77.4	Confident	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-59.5	-43.3	175.9	0	0	0	0	0	112	I672 L691 M707 V708 R709 G713 L714 T715	I672-A711 HydrophobicContact CG2-CB 4.11Å; I672-A711 WeakPolarHBondContact O-CB 3.32Å; L691-A711 HydrophobicContact CD1-CB 4.28Å; L691-A711 HydrophobicContact CD2-CB 3.97Å; M707-A711 WeakPolarHBondContact O-CB 3.31Å; M707-A711 PolarHBondContact O-N 3.4Å; V708-A711 PolarHBondContact O-N 3.44Å; R709-A711 VanDerWaalsContact C-N 3.28Å; R709-A711 PolarHBondContact O-N 2.96Å; A711-G713 PolarHBondContact O-N 3.4Å; A711-L714 PolarHBondContact O-N 3.49Å; A711-T715 WeakPolarHBondContact O-CG2 3.09Å; A711-T715 PolarHBondContact O-N 2.94Å
712	Q	82	Confident	77.4	Confident	12 Å²	12	10.3 Å²	10.3	6%	0.056	5%	0.053	C	C	.	.	H	α-helix	trans	-60.7	-42.8	173.9	-72.1	170.9	-10.3	0	0	112.1	V293 L691 V708 R709 I710 L714 T715 H716	V293-Q712 HydrophobicContact CG1-CB 4.23Å; L691-Q712 HydrophobicContact CB-CG 3.86Å; L691-Q712 HydrophobicContact CD1-CG 4Å; V708-Q712 WeakPolarHBondContact O-CG 3.32Å; V708-Q712 PolarHBondContact O-N 3.24Å; R709-Q712 WeakPolarHBondContact O-CB 3.39Å; R709-Q712 PolarHBondContact O-N 3.35Å; R709-Q712 VanDerWaalsContact O-N 3.15Å; I710-Q712 VanDerWaalsContact C-N 3.35Å; I710-Q712 PolarHBondContact O-N 3.21Å; Q712-L714 PolarHBondContact O-N 3.22Å; Q712-T715 PolarHBondContact O-N 3.35Å; Q712-T715 PolarHBondContact O-OG1 3.33Å; Q712-H716 PolarHBondContact O-CD2 2.81Å; Q712-H716 PolarHBondContact O-N 2.96Å
713	G	79.1	Confident	77.4	Confident	0 Å²	0	10.1 Å²	10.1	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-57.2	-46.9	173.7	0	0	0	0	0	112.2	R709 I710 A711 T715 H716 L717	R709-G713 PolarHBondContact O-N 3.13Å; I710-G713 PolarHBondContact O-N 3.37Å; I710-G713 VanDerWaalsContact O-N 3.15Å; A711-G713 PolarHBondContact O-N 3.4Å; G713-T715 PolarHBondContact O-N 3.19Å; G713-H716 CarbonylContact O-C 3.54Å; G713-H716 PolarHBondContact O-N 2.9Å; G713-L717 PolarHBondContact O-N 3.32Å
714	L	81.2	Confident	77.4	Confident	1 Å²	1	9.6 Å²	9.6	1%	0.005	5%	0.047	C	C	.	.	H	α-helix	trans	-62.4	-39.9	176.5	-67.4	175.7	0	0	0	112.4	F320 F673 A680 G681 I710 A711 Q712 H716 L717 L767	F320-L714 HydrophobicContact CD1-CD2 4Å; F320-L714 HydrophobicContact CD2-CD2 4.23Å; F320-L714 HydrophobicContact CE1-CD2 3.96Å; F320-L714 HydrophobicContact CE2-CD2 4.19Å; F320-L714 HydrophobicContact CG-CD2 4.16Å; F320-L714 HydrophobicContact CZ-CD2 4.06Å; F673-L714 HydrophobicContact CD2-CD1 4.41Å; F673-L714 HydrophobicContact CE2-CD1 3.84Å; A680-L714 VanDerWaalsContact CA-O 3.31Å; A680-L714 WeakPolarHBondContact CA-O 3.34Å; G681-L714 PolarHBondContact N-O 3.42Å; I710-L714 HydrophobicContact CG2-CD1 4.33Å; I710-L714 WeakPolarHBondContact O-CG 3.34Å; I710-L714 PolarHBondContact O-N 2.78Å; A711-L714 PolarHBondContact O-N 3.49Å; Q712-L714 PolarHBondContact O-N 3.22Å; L714-H716 PolarHBondContact O-N 3.02Å; L714-L717 VanDerWaalsContact O-CB 3.28Å; L714-L717 WeakPolarHBondContact O-CB 3.2Å; L714-L717 PolarHBondContact O-N 3.43Å; L714-L717 VanDerWaalsContact O-N 3.13Å; L714-L767 HydrophobicContact CD2-CD2 3.62Å
715	T	80.6	Confident	77.1	Confident	4 Å²	4	10.4 Å²	10.4	3%	0.025	5%	0.053	C	C	.	.	H	α-helix	trans	-61.7	-26.4	177.7	61.7	0	0	0	0	113.9	N683 L687 L691 A711 Q712 G713	N683-T715 PolarHBondContact N-O 3.26Å; L687-T715 HydrophobicContact CD2-CG2 3.43Å; L687-T715 VanDerWaalsContact CD2-CG2 3.43Å; L687-T715 HydrophobicContact CG-CG2 4.03Å; L691-T715 HydrophobicContact CD1-CG2 3.58Å; A711-T715 WeakPolarHBondContact O-CG2 3.09Å; A711-T715 PolarHBondContact O-N 2.94Å; Q712-T715 PolarHBondContact O-N 3.35Å; Q712-T715 PolarHBondContact O-OG1 3.33Å; G713-T715 PolarHBondContact O-N 3.19Å
716	H	77.9	Confident	76.6	Confident	31 Å²	31	9 Å²	9	14%	0.144	5%	0.047	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.9	19.4	179.4	-67.5	-68.2	0	0	0	113.2	V293 V321 N683 Q712 G713 L714 G718 K719	V293-H716 VanDerWaalsContact CG1-CD2 3.42Å; V293-H716 WeakPolarHBondContact CG1-CD2 3.24Å; V321-H716 HydrophobicContact CG2-CB 4.14Å; N683-H716 PolarHBondContact OD1-CE1 2.98Å; N683-H716 PolarHBondContact OD1-ND1 2.98Å; Q712-H716 PolarHBondContact O-CD2 2.81Å; Q712-H716 PolarHBondContact O-N 2.96Å; G713-H716 CarbonylContact O-C 3.54Å; G713-H716 PolarHBondContact O-N 2.9Å; L714-H716 PolarHBondContact O-N 3.02Å; H716-G718 PolarHBondContact O-N 3.05Å; H716-K719 WeakPolarHBondContact O-CA 3.25Å; H716-K719 PolarHBondContact O-N 3.47Å
717	L	75.8	Confident	76.2	Confident	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.051	C	C	.	.	G	3₁₀ helix	trans	-48.2	125.7	179.2	-170.2	75.9	0	0	0	111.6	F320 T323 G713 L714 K719 G720 M722 L724 I771	F320-L717 HydrophobicContact CB-CD1 4.05Å; F320-L717 HydrophobicContact CD1-CD1 3.78Å; F320-L717 HydrophobicContact CG-CD1 4.33Å; F320-L717 WeakPolarHBondContact O-CA 3.4Å; T323-L717 HydrophobicContact CG2-CD1 4.06Å; G713-L717 PolarHBondContact O-N 3.32Å; L714-L717 VanDerWaalsContact O-CB 3.28Å; L714-L717 WeakPolarHBondContact O-CB 3.2Å; L714-L717 PolarHBondContact O-N 3.43Å; L714-L717 VanDerWaalsContact O-N 3.13Å; L717-K719 PolarHBondContact O-N 3.39Å; L717-G720 WeakPolarHBondContact O-CA 3.24Å; L717-G720 PolarHBondContact O-N 3.36Å; L717-M722 HydrophobicContact CD2-CB 3.93Å; L717-M722 HydrophobicContact CG-CB 4.01Å; L717-L724 HydrophobicContact CD2-CD2 4.07Å; L717-L724 HydrophobicContact CD2-CG 4.1Å; L717-I771 HydrophobicContact CD1-CD1 4.19Å; L717-I771 HydrophobicContact CD2-CG1 4.26Å; L717-I771 HydrophobicContact CD2-CG2 4.17Å
718	G	70.1	Confident	75.4	Confident	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.049	C	C	.	.	G	3₁₀ helix	trans	52.8	36.9	-177.2	0	0	0	0	0	113.4	F320 T323 F325 H716 G720 T721	F320-G718 PolarHBondContact O-N 3.34Å; F320-G718 VanDerWaalsContact O-N 3.12Å; T323-G718 WeakPolarHBondContact OG1-CA 3.29Å; T323-G718 PolarHBondContact OG1-N 3.12Å; F325-G718 WeakPolarHBondContact CE2-O 3.33Å; H716-G718 PolarHBondContact O-N 3.05Å; G718-G720 PolarHBondContact O-N 3.11Å; G718-T721 WeakPolarHBondContact O-CB 3.34Å; G718-T721 PolarHBondContact O-N 3.48Å; G718-T721 PolarHBondContact O-OG1 3.17Å
719	K	70.3	Confident	74	Confident	27 Å²	27	10.1 Å²	10.1	12%	0.117	5%	0.053	C	C	.	.	G	3₁₀ helix	trans	58.6	13.9	-174	-55.6	167.4	-177	164.2	0	114.5	M285 E286 V321 F325 H716 L717	M285-K719 PolarHBondContact O-NZ 3.23Å; E286-K719 PolarHBondContact O-NZ 2.9Å; V321-K719 PolarHBondContact O-N 3.06Å; F325-K719 HydrophobicContact CD2-CD 4.38Å; F325-K719 HydrophobicContact CE2-CD 4.23Å; F325-K719 HydrophobicContact CE2-CG 4.39Å; F325-K719 HydrophobicContact CZ-CD 4.36Å; H716-K719 WeakPolarHBondContact O-CA 3.25Å; H716-K719 PolarHBondContact O-N 3.47Å; L717-K719 PolarHBondContact O-N 3.39Å
720	G	71.5	Confident	72.8	Confident	7 Å²	7	11.9 Å²	11.9	7%	0.072	6%	0.063	C	C	.	.	G	3₁₀ helix	trans	100.7	7.2	-174.7	0	0	0	0	0	114.7	G681 L717 G718	G681-G720 CarbonylContact O-C 3.46Å; G681-G720 VanDerWaalsContact O-CA 3.31Å; G681-G720 WeakPolarHBondContact O-CA 3.46Å; G681-G720 VanDerWaalsContact O-O 3.06Å; L717-G720 WeakPolarHBondContact O-CA 3.24Å; L717-G720 PolarHBondContact O-N 3.36Å; G718-G720 PolarHBondContact O-N 3.11Å
721	T	69	Low	71.8	Confident	14 Å²	14	15.2 Å²	15.2	9%	0.086	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-8.4	179.6	69.3	0	0	0	0	113.6	F325 G718 P773 R774 L825	F325-T721 HydrophobicContact CZ-CG2 4.27Å; G718-T721 WeakPolarHBondContact O-CB 3.34Å; G718-T721 PolarHBondContact O-N 3.48Å; G718-T721 PolarHBondContact O-OG1 3.17Å; T721-P773 CarbonylContact O-C 3.54Å; T721-R774 WeakPolarHBondContact O-CB 3.46Å; T721-R774 PolarHBondContact O-N 2.81Å; T721-L825 HydrophobicContact CG2-CD2 4.27Å
722	M	75.2	Confident	70.7	Confident	6 Å²	6	19.5 Å²	19.5	3%	0.03	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	149.5	-176.9	-66.4	-173.9	170.3	0	0	111.7	T323 W360 G681 L717 I771 N772	T323-M722 WeakPolarHBondContact O-CE 3.21Å; T323-M722 PolarHBondContact OG1-SD 3.42Å; W360-M722 HydrophobicContact CH2-CE 3.71Å; W360-M722 HydrophobicContact CZ3-CE 3.56Å; G681-M722 WeakPolarHBondContact CA-O 3.15Å; L717-M722 HydrophobicContact CD2-CB 3.93Å; L717-M722 HydrophobicContact CG-CB 4.01Å; M722-I771 HydrophobicContact CB-CG2 4.03Å; M722-I771 HydrophobicContact CG-CG2 4.19Å; M722-I771 HydrophobicContact SD-CG2 3.32Å; M722-I771 WeakPolarHBondContact SD-CG2 3.42Å; M722-N772 CarbonylContact C-O 3.46Å; M722-N772 VanDerWaalsContact CA-O 3.22Å; M722-N772 WeakPolarHBondContact CA-O 3.12Å
723	T	75.8	Confident	69.9	Low	11 Å²	11	19 Å²	19	7%	0.067	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	156.3	178.4	41.6	0	0	0	0	111.5	A770 N772 R774	T723-A770 VanDerWaalsContact O-O 3.13Å; T723-N772 PolarHBondContact N-O 3.08Å; T723-N772 PolarHBondContact O-N 3.22Å; T723-N772 PolarHBondContact OG1-O 3.47Å; T723-R774 HydrophobicContact CG2-CB 4.09Å; T723-R774 VanDerWaalsContact CG2-CD 3.43Å; T723-R774 HydrophobicContact CG2-CG 4.19Å
724	L	76.7	Confident	69.5	Low	0 Å²	0	21 Å²	21	0%	0	10%	0.103	C	C	.	.			trans	-100.7	3.5	175.5	-66.8	176	0	0	0	113.1	V645 S646 L677 A680 L717 L742 L767 A770 I771	V645-L724 HydrophobicContact CG1-CB 3.63Å; S646-L724 PolarHBondContact OG-N 3.01Å; L677-L724 HydrophobicContact CD2-CD1 4.07Å; A680-L724 HydrophobicContact CB-CB 4.3Å; A680-L724 HydrophobicContact CB-CD1 3.38Å; A680-L724 HydrophobicContact CB-CG 3.82Å; L717-L724 HydrophobicContact CD2-CD2 4.07Å; L717-L724 HydrophobicContact CD2-CG 4.1Å; L724-L742 HydrophobicContact CB-CD2 4.33Å; L724-L742 WeakPolarHBondContact O-CD1 3.14Å; L724-L767 HydrophobicContact CD1-CD1 4.08Å; L724-L767 HydrophobicContact CD1-CD2 3.88Å; L724-L767 HydrophobicContact CD1-CG 4.26Å; L724-L767 HydrophobicContact CD2-CD1 3.91Å; L724-L767 HydrophobicContact CD2-CD2 4.04Å; L724-L767 HydrophobicContact CD2-CG 3.73Å; L724-A770 WeakPolarHBondContact CA-O 3.31Å; L724-A770 HydrophobicContact CD2-CB 4.06Å; L724-I771 HydrophobicContact CD2-CG1 3.73Å
725	S	70.4	Confident	69	Low	20 Å²	20	21 Å²	21	14%	0.14	10%	0.103	C	C	.	.			trans	-63	125.6	-173.6	54.3	0	0	0	0	111.2	F727	S725-F727 VanDerWaalsContact C-N 3.26Å; S725-F727 PolarHBondContact O-N 3.5Å
726	P	68.7	Low	68.7	Low	4 Å²	4	21.3 Å²	21.3	3%	0.026	11%	0.106	C	C	.	.	S	Bend	trans	-76.7	-16.9	179.2	30.5	-32.6	0	0	0	112.5	L734 N735 A738 M739 L742	P726-L734 HydrophobicContact CB-CD1 4.14Å; P726-N735 PolarHBondContact O-N 3.27Å; P726-A738 HydrophobicContact CB-CB 4.22Å; P726-M739 HydrophobicContact CB-CB 4.22Å; P726-M739 HydrophobicContact CB-CG 4.46Å; P726-L742 HydrophobicContact CB-CD1 4.07Å; P726-L742 HydrophobicContact CG-CD1 3.82Å
727	F	67.6	Low	68.6	Low	27 Å²	27	19.9 Å²	19.9	12%	0.118	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	136.4	178.8	-71.6	-82.3	0	0	0	112.1	L608 S725 R731 L733 L734	L608-F727 HydrophobicContact CB-CE2 3.8Å; L608-F727 HydrophobicContact CB-CZ 4.11Å; L608-F727 HydrophobicContact CD1-CE2 4.47Å; L608-F727 HydrophobicContact CD2-CE2 4.11Å; L608-F727 HydrophobicContact CG-CE2 4.35Å; L608-F727 WeakPolarHBondContact O-CE2 3.41Å; S725-F727 VanDerWaalsContact C-N 3.26Å; S725-F727 PolarHBondContact O-N 3.5Å; F727-R731 HydrophobicContact CD1-CB 4.29Å; F727-R731 VanDerWaalsContact CD1-O 3.25Å; F727-R731 WeakPolarHBondContact CD1-O 3.24Å; F727-L733 WeakPolarHBondContact CA-O 3.49Å; F727-L734 HydrophobicContact CD1-CD1 4.36Å; F727-L734 HydrophobicContact CE1-CB 4.21Å; F727-L734 HydrophobicContact CE1-CD1 3.9Å; F727-L734 HydrophobicContact CE2-CD1 4.04Å; F727-L734 HydrophobicContact CZ-CD1 3.72Å
728	H	63.4	Low	68.6	Low	3 Å²	3	19.9 Å²	19.9	1%	0.014	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	154.6	172.2	-61.9	111.2	0	0	0	109.7	R271 L733 N772 A850	R271-H728 PolarHBondContact NH2-CD2 3.01Å; R271-H728 PolarHBondContact NH2-NE2 2.91Å; H728-L733 PolarHBondContact N-O 2.99Å; H728-L733 WeakPolarHBondContact O-CB 3.4Å; H728-L733 PolarHBondContact O-N 3.18Å; H728-L733 VanDerWaalsContact O-N 3.14Å; H728-N772 PolarHBondContact CE1-ND2 3.32Å; H728-N772 VanDerWaalsContact CE1-ND2 3.32Å; H728-N772 PolarHBondContact NE2-ND2 2.91Å; H728-A850 HydrophobicContact CB-CB 3.64Å; H728-A850 WeakPolarHBondContact CD2-CB 3.45Å
729	S	54.3	Low	69	Low	12 Å²	12	20 Å²	20	8%	0.084	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	79.1	174.6	-146.2	0	0	0	0	114.9	R238 R731 Q732 S849	R238-S729 PolarHBondContact NH1-OG 3.26Å; R238-S729 PolarHBondContact NH2-O 3.4Å; R238-S729 PolarHBondContact NH2-OG 3.19Å; R238-S729 VanDerWaalsContact NH2-OG 3.12Å; S729-R731 VanDerWaalsContact C-N 3.27Å; S729-R731 PolarHBondContact O-N 3.02Å; S729-Q732 PolarHBondContact O-N 3.34Å; S729-S849 WeakPolarHBondContact CA-OG 3.48Å; S729-S849 PolarHBondContact N-O 3.38Å; S729-S849 PolarHBondContact N-OG 2.93Å; S729-S849 VanDerWaalsContact N-OG 3.11Å
730	E	54	Low	69.5	Low	68 Å²	68	18.7 Å²	18.7	32%	0.318	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	35.8	175.2	-64.8	179.9	165.3	0	0	113.7	Q732 R831 S848 S849	E730-Q732 PolarHBondContact O-N 3.11Å; E730-R831 IonicContact OE1-CZ 3.64Å; E730-R831 IonicContact OE1-NH1 2.68Å; E730-R831 PolarHBondContact OE1-NH1 3.25Å; E730-S848 PolarHBondContact N-O 3.32Å; E730-S848 VanDerWaalsContact N-O 3.15Å; E730-S849 PolarHBondContact N-OG 3.29Å
731	R	60.2	Low	69.9	Low	73 Å²	73	18.4 Å²	18.4	28%	0.275	9%	0.09	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.2	10	-177.9	-53.8	-172.7	-172.4	-172.5	17.4	115.6	D611 F727 S729	D611-R731 VanDerWaalsContact CG-NH2 3.28Å; D611-R731 IonicContact OD1-CZ 3.72Å; D611-R731 IonicContact OD1-NH1 3.82Å; D611-R731 PolarHBondContact OD1-NH1 3.37Å; D611-R731 IonicContact OD1-NH2 3.37Å; D611-R731 PolarHBondContact OD1-NH2 3.46Å; D611-R731 IonicContact OD2-CZ 2.72Å; D611-R731 IonicContact OD2-NE 3.47Å; D611-R731 IonicContact OD2-NH1 3.48Å; D611-R731 PolarHBondContact OD2-NH1 3.37Å; D611-R731 IonicContact OD2-NH2 3.18Å; D611-R731 PolarHBondContact OD2-NH2 3.17Å; D611-R731 VanDerWaalsContact OD2-NH2 3.11Å; F727-R731 HydrophobicContact CD1-CB 4.29Å; F727-R731 VanDerWaalsContact CD1-O 3.25Å; F727-R731 WeakPolarHBondContact CD1-O 3.24Å; S729-R731 VanDerWaalsContact C-N 3.27Å; S729-R731 PolarHBondContact O-N 3.02Å
732	Q	61.4	Low	70.5	Confident	89 Å²	89	17.8 Å²	17.8	42%	0.416	9%	0.087	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-46.6	178.3	-65.3	-179.3	-10.9	0	0	110.1	M242 S729 E730 L734	M242-Q732 HydrophobicContact CE-CB 3.67Å; M242-Q732 WeakPolarHBondContact CE-O 3.25Å; S729-Q732 PolarHBondContact O-N 3.34Å; E730-Q732 PolarHBondContact O-N 3.11Å; Q732-L734 PolarHBondContact O-N 3.47Å
733	L	65.1	Low	70.8	Confident	1 Å²	1	17.5 Å²	17.5	1%	0.005	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	111.2	-175	-68.9	162.8	0	0	0	110.7	R238 L241 M242 L268 F727 H728	R238-L733 HydrophobicContact CB-CD1 4.47Å; R238-L733 HydrophobicContact CG-CD1 4.13Å; L241-L733 HydrophobicContact CB-CD2 3.98Å; M242-L733 HydrophobicContact CE-CB 4.37Å; M242-L733 HydrophobicContact CE-CD2 3.49Å; M242-L733 VanDerWaalsContact CE-CD2 3.49Å; M242-L733 HydrophobicContact CE-CG 3.76Å; M242-L733 HydrophobicContact CG-CD2 4.2Å; M242-L733 HydrophobicContact SD-CD2 3.71Å; M242-L733 HydrophobicContact SD-CG 4.49Å; L268-L733 HydrophobicContact CD1-CD1 4.11Å; F727-L733 WeakPolarHBondContact CA-O 3.49Å; H728-L733 PolarHBondContact N-O 2.99Å; H728-L733 WeakPolarHBondContact O-CB 3.4Å; H728-L733 PolarHBondContact O-N 3.18Å; H728-L733 VanDerWaalsContact O-N 3.14Å
734	L	69.5	Low	71.1	Confident	42 Å²	42	17 Å²	17	22%	0.22	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	121.6	165.4	-176.7	69.6	0	0	0	108.7	P726 F727 Q732 P736 M739	P726-L734 HydrophobicContact CB-CD1 4.14Å; F727-L734 HydrophobicContact CD1-CD1 4.36Å; F727-L734 HydrophobicContact CE1-CB 4.21Å; F727-L734 HydrophobicContact CE1-CD1 3.9Å; F727-L734 HydrophobicContact CE2-CD1 4.04Å; F727-L734 HydrophobicContact CZ-CD1 3.72Å; Q732-L734 PolarHBondContact O-N 3.47Å; L734-P736 VanDerWaalsContact O-CD 3.29Å; L734-P736 WeakPolarHBondContact O-CD 3.48Å; L734-M739 HydrophobicContact CD1-CB 4.1Å; L734-M739 HydrophobicContact CD1-CG 3.93Å; L734-M739 HydrophobicContact CG-CB 4.49Å
735	N	71.1	Confident	71.3	Confident	1 Å²	1	17.1 Å²	17.1	1%	0.005	8%	0.083	C	C	.	.			trans	-81	113.1	164.2	-179.4	-6	0	0	0	108.3	R271 P726 S737 A738 M739	R271-N735 PolarHBondContact O-ND2 3.4Å; P726-N735 PolarHBondContact O-N 3.27Å; N735-S737 VanDerWaalsContact C-N 3.31Å; N735-S737 VanDerWaalsContact CG-OG 3.28Å; N735-S737 PolarHBondContact ND2-OG 3.16Å; N735-S737 PolarHBondContact O-N 3.45Å; N735-S737 PolarHBondContact OD1-N 3.39Å; N735-S737 VanDerWaalsContact OD1-N 3.09Å; N735-S737 PolarHBondContact OD1-OG 2.67Å; N735-A738 HydrophobicContact CB-CB 4.08Å; N735-A738 PolarHBondContact O-N 2.94Å; N735-M739 PolarHBondContact O-N 2.94Å; N735-M739 VanDerWaalsContact O-N 3.1Å
736	P	73.7	Confident	71.8	Confident	12 Å²	12	16.1 Å²	16.1	8%	0.078	8%	0.076	C	C	.	.	H	α-helix	trans	-70.4	-28.6	-173.2	32.4	-38.8	0	0	0	112.1	V471 S472 L511 L734 A740	V471-P736 HydrophobicContact CG1-CB 3.67Å; V471-P736 HydrophobicContact CG1-CG 4.39Å; S472-P736 VanDerWaalsContact OG-CB 3.32Å; S472-P736 WeakPolarHBondContact OG-CB 3.37Å; L511-P736 HydrophobicContact CD2-CB 3.99Å; L511-P736 VanDerWaalsContact CD2-O 3.27Å; L511-P736 WeakPolarHBondContact CD2-O 3.44Å; L734-P736 VanDerWaalsContact O-CD 3.29Å; L734-P736 WeakPolarHBondContact O-CD 3.48Å; P736-A740 VanDerWaalsContact O-CB 3.27Å; P736-A740 WeakPolarHBondContact O-CB 3.49Å; P736-A740 PolarHBondContact O-N 3.42Å
737	S	77.1	Confident	72.4	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-67	-43.9	175.6	66	0	0	0	0	112.7	Q273 N735 M739 A740 G741	Q273-S737 PolarHBondContact OE1-OG 3.14Å; N735-S737 VanDerWaalsContact C-N 3.31Å; N735-S737 VanDerWaalsContact CG-OG 3.28Å; N735-S737 PolarHBondContact ND2-OG 3.16Å; N735-S737 PolarHBondContact O-N 3.45Å; N735-S737 PolarHBondContact OD1-N 3.39Å; N735-S737 VanDerWaalsContact OD1-N 3.09Å; N735-S737 PolarHBondContact OD1-OG 2.67Å; S737-M739 VanDerWaalsContact C-N 3.34Å; S737-A740 PolarHBondContact O-N 2.89Å; S737-G741 PolarHBondContact O-N 3.15Å
738	A	76.2	Confident	72.9	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-65.7	-41.6	177.8	0	0	0	0	0	110.7	P726 N735 G741 L742 A770	P726-A738 HydrophobicContact CB-CB 4.22Å; N735-A738 HydrophobicContact CB-CB 4.08Å; N735-A738 PolarHBondContact O-N 2.94Å; A738-G741 PolarHBondContact O-N 3.25Å; A738-L742 WeakPolarHBondContact O-CG 3.37Å; A738-L742 PolarHBondContact O-N 3.45Å; A738-A770 HydrophobicContact CB-CB 4.15Å
739	M	78.4	Confident	73.3	Confident	3 Å²	3	15.2 Å²	15.2	2%	0.015	7%	0.072	C	C	.	.	H	α-helix	trans	-62	-50.5	173.9	-151.3	-45.2	-81.8	0	0	110.4	L511 A545 L605 P726 L734 N735 S737 G741 L742 F743	L511-M739 HydrophobicContact CD1-CE 3.22Å; L511-M739 HydrophobicContact CD2-CB 4.2Å; L511-M739 HydrophobicContact CD2-CE 3.97Å; L511-M739 HydrophobicContact CG-CE 4.25Å; A545-M739 HydrophobicContact CB-CE 4.42Å; L605-M739 HydrophobicContact CD1-CE 3.59Å; L605-M739 HydrophobicContact CD1-CG 4.2Å; L605-M739 HydrophobicContact CD1-SD 3.14Å; L605-M739 WeakPolarHBondContact CD1-SD 3.28Å; L605-M739 HydrophobicContact CD2-CE 3.73Å; L605-M739 HydrophobicContact CD2-SD 4.43Å; L605-M739 HydrophobicContact CG-CE 4.16Å; L605-M739 HydrophobicContact CG-SD 4.28Å; P726-M739 HydrophobicContact CB-CB 4.22Å; P726-M739 HydrophobicContact CB-CG 4.46Å; L734-M739 HydrophobicContact CD1-CB 4.1Å; L734-M739 HydrophobicContact CD1-CG 3.93Å; L734-M739 HydrophobicContact CG-CB 4.49Å; N735-M739 PolarHBondContact O-N 2.94Å; N735-M739 VanDerWaalsContact O-N 3.1Å; S737-M739 VanDerWaalsContact C-N 3.34Å; M739-G741 PolarHBondContact O-N 2.97Å; M739-L742 PolarHBondContact O-N 3.15Å; M739-L742 VanDerWaalsContact O-N 3.09Å; M739-F743 HydrophobicContact CE-CB 3.66Å; M739-F743 HydrophobicContact CE-CD1 4.47Å; M739-F743 HydrophobicContact CE-CG 4.08Å; M739-F743 WeakPolarHBondContact O-CB 3.28Å; M739-F743 PolarHBondContact O-N 3.26Å; M739-F743 HydrophobicContact SD-CB 3.82Å
740	A	80	Confident	74.2	Confident	0 Å²	0	15.8 Å²	15.8	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-52.9	-42	177.2	0	0	0	0	0	112.4	F468 V471 L508 L511 P736 S737 T744	F468-A740 HydrophobicContact CD1-CB 4.17Å; F468-A740 HydrophobicContact CE1-CB 3.92Å; V471-A740 HydrophobicContact CG1-CB 4.33Å; V471-A740 HydrophobicContact CG2-CB 3.85Å; L508-A740 HydrophobicContact CD1-CB 4.37Å; L508-A740 HydrophobicContact CD2-CB 3.57Å; L508-A740 HydrophobicContact CG-CB 4.48Å; L511-A740 HydrophobicContact CD2-CB 4.34Å; P736-A740 VanDerWaalsContact O-CB 3.27Å; P736-A740 WeakPolarHBondContact O-CB 3.49Å; P736-A740 PolarHBondContact O-N 3.42Å; S737-A740 PolarHBondContact O-N 2.89Å; A740-T744 WeakPolarHBondContact O-CB 3.45Å; A740-T744 PolarHBondContact O-N 3.48Å; A740-T744 PolarHBondContact O-OG1 3.37Å
741	G	79.2	Confident	75	Confident	0 Å²	0	14.4 Å²	14.4	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-64.7	-45.7	176.4	0	0	0	0	0	113.6	S737 A738 M739 T745 S766	S737-G741 PolarHBondContact O-N 3.15Å; A738-G741 PolarHBondContact O-N 3.25Å; M739-G741 PolarHBondContact O-N 2.97Å; G741-T745 WeakPolarHBondContact O-CG2 3.2Å; G741-T745 PolarHBondContact O-N 3.34Å; G741-T745 PolarHBondContact O-OG1 3.27Å; G741-S766 WeakPolarHBondContact CA-O 3.3Å
742	L	82	Confident	75.2	Confident	1 Å²	1	11.2 Å²	11.2	1%	0.005	6%	0.057	C	C	.	.	H	α-helix	trans	-65.1	-43.2	176.1	-72.5	171	0	0	0	112.6	L642 V645 L724 P726 A738 M739 T745 C746 L767 A770	L642-L742 HydrophobicContact CD2-CB 4.28Å; V645-L742 HydrophobicContact CG1-CD1 4.36Å; V645-L742 HydrophobicContact CG1-CD2 4.42Å; V645-L742 HydrophobicContact CG2-CD1 4.32Å; L724-L742 HydrophobicContact CB-CD2 4.33Å; L724-L742 WeakPolarHBondContact O-CD1 3.14Å; P726-L742 HydrophobicContact CB-CD1 4.07Å; P726-L742 HydrophobicContact CG-CD1 3.82Å; A738-L742 WeakPolarHBondContact O-CG 3.37Å; A738-L742 PolarHBondContact O-N 3.45Å; M739-L742 PolarHBondContact O-N 3.15Å; M739-L742 VanDerWaalsContact O-N 3.09Å; L742-T745 WeakPolarHBondContact CA-OG1 3.22Å; L742-T745 PolarHBondContact O-N 2.7Å; L742-T745 PolarHBondContact O-OG1 3.13Å; L742-C746 WeakPolarHBondContact O-CB 3.49Å; L742-C746 PolarHBondContact O-N 3.1Å; L742-C746 PolarHBondContact O-SG 3.47Å; L742-L767 HydrophobicContact CD2-CD1 3.64Å; L742-A770 HydrophobicContact CD2-CB 4.31Å; L742-A770 HydrophobicContact CG-CB 3.98Å
743	F	82.1	Confident	75.4	Confident	1 Å²	1	11.6 Å²	11.6	0%	0.004	6%	0.055	C	C	.	.	H	α-helix	trans	-65.4	-44	179.2	-175.1	-124.5	0	0	0	111.1	L504 L508 L538 V541 L605 M739 T745 C746 F747	L504-F743 HydrophobicContact CD1-CD1 3.59Å; L504-F743 HydrophobicContact CD1-CE1 3.35Å; L504-F743 HydrophobicContact CD1-CZ 4.21Å; L508-F743 HydrophobicContact CD2-CD1 4.08Å; L538-F743 HydrophobicContact CD1-CE1 4.04Å; L538-F743 HydrophobicContact CD1-CZ 3.59Å; V541-F743 HydrophobicContact CG1-CE2 4.23Å; V541-F743 HydrophobicContact CG1-CZ 4.16Å; L605-F743 HydrophobicContact CD2-CD2 4.01Å; L605-F743 HydrophobicContact CD2-CE2 4.03Å; L605-F743 HydrophobicContact CD2-CG 4.47Å; L605-F743 HydrophobicContact CD2-CZ 4.49Å; M739-F743 HydrophobicContact CE-CB 3.66Å; M739-F743 HydrophobicContact CE-CD1 4.47Å; M739-F743 HydrophobicContact CE-CG 4.08Å; M739-F743 WeakPolarHBondContact O-CB 3.28Å; M739-F743 PolarHBondContact O-N 3.26Å; M739-F743 HydrophobicContact SD-CB 3.82Å; F743-T745 PolarHBondContact O-N 3.17Å; F743-C746 PolarHBondContact O-N 3.05Å; F743-F747 VanDerWaalsContact O-CB 3.27Å; F743-F747 WeakPolarHBondContact O-CB 3.18Å; F743-F747 PolarHBondContact O-N 3.47Å
744	T	81.8	Confident	75.3	Confident	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-60.6	-46.3	176.4	-61.1	0	0	0	0	112	L464 F468 L504 A740 F747 C748	L464-T744 HydrophobicContact CD1-CG2 3.63Å; L464-T744 HydrophobicContact CG-CG2 4.44Å; F468-T744 HydrophobicContact CE2-CG2 4.14Å; F468-T744 HydrophobicContact CZ-CG2 3.97Å; F468-T744 WeakPolarHBondContact CZ-OG1 3.46Å; L504-T744 HydrophobicContact CD2-CG2 3.79Å; A740-T744 WeakPolarHBondContact O-CB 3.45Å; A740-T744 PolarHBondContact O-N 3.48Å; A740-T744 PolarHBondContact O-OG1 3.37Å; T744-F747 PolarHBondContact O-N 3.41Å; T744-C748 WeakPolarHBondContact O-CB 3.49Å; T744-C748 PolarHBondContact O-N 3.5Å; T744-C748 PolarHBondContact O-SG 3.44Å
745	T	81.5	Confident	75.2	Confident	2 Å²	2	11.5 Å²	11.5	1%	0.012	6%	0.058	C	C	.	.	H	α-helix	trans	-63.2	-47	177.8	49.9	0	0	0	0	111.1	G741 L742 F743 F747 C748 F749 L767	G741-T745 WeakPolarHBondContact O-CG2 3.2Å; G741-T745 PolarHBondContact O-N 3.34Å; G741-T745 PolarHBondContact O-OG1 3.27Å; L742-T745 WeakPolarHBondContact CA-OG1 3.22Å; L742-T745 PolarHBondContact O-N 2.7Å; L742-T745 PolarHBondContact O-OG1 3.13Å; F743-T745 PolarHBondContact O-N 3.17Å; T745-F747 VanDerWaalsContact C-N 3.33Å; T745-F747 PolarHBondContact O-N 3.23Å; T745-C748 WeakPolarHBondContact O-CB 3.35Å; T745-C748 PolarHBondContact O-N 2.95Å; T745-C748 VanDerWaalsContact O-N 3.14Å; T745-F749 WeakPolarHBondContact O-CD2 3.09Å; T745-F749 PolarHBondContact O-N 2.9Å; T745-F749 VanDerWaalsContact O-N 3.08Å; T745-L767 HydrophobicContact CG2-CB 4Å; T745-L767 HydrophobicContact CG2-CD1 4.37Å
746	C	80.9	Confident	75.1	Confident	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-62.9	-38.2	178.3	-67.4	0	0	0	0	112.9	L642 L742 F743 F749 L750	L642-C746 HydrophobicContact CD1-CB 3.89Å; L642-C746 HydrophobicContact CD2-CB 4.35Å; L642-C746 WeakPolarHBondContact CD2-SG 3.22Å; L642-C746 HydrophobicContact CG-CB 4.25Å; L642-C746 VanDerWaalsContact CG-SG 3.55Å; L742-C746 WeakPolarHBondContact O-CB 3.49Å; L742-C746 PolarHBondContact O-N 3.1Å; L742-C746 PolarHBondContact O-SG 3.47Å; F743-C746 PolarHBondContact O-N 3.05Å; C746-F749 PolarHBondContact O-N 2.87Å; C746-L750 PolarHBondContact O-N 3.1Å
747	F	80.9	Confident	74.5	Confident	13 Å²	13	12.4 Å²	12.4	6%	0.057	6%	0.062	C	C	.	.	H	α-helix	trans	-64.5	-40.7	173.7	-174.3	-97	0	0	0	111.7	R500 L501 L504 F534 L538 V598 F743 T744 T745 F749 L750	R500-F747 HydrophobicContact CB-CE1 3.87Å; R500-F747 HydrophobicContact CB-CZ 3.86Å; L501-F747 HydrophobicContact CD2-CD1 4.4Å; L504-F747 HydrophobicContact CB-CD1 4.37Å; L504-F747 HydrophobicContact CB-CE1 4.23Å; L504-F747 HydrophobicContact CD1-CB 4.15Å; L504-F747 HydrophobicContact CD1-CD1 4.2Å; L504-F747 HydrophobicContact CD1-CD2 4.3Å; L504-F747 HydrophobicContact CD1-CG 3.98Å; L504-F747 HydrophobicContact CD2-CB 4.38Å; L504-F747 HydrophobicContact CD2-CD1 3.95Å; L504-F747 HydrophobicContact CD2-CG 4.36Å; L504-F747 HydrophobicContact CG-CD1 4.41Å; F534-F747 AromaticContact CZ-CE2 3.94Å; F534-F747 HydrophobicContact CZ-CE2 3.94Å; F534-F747 AromaticContact CZ-CZ 3.8Å; F534-F747 HydrophobicContact CZ-CZ 3.8Å; L538-F747 HydrophobicContact CD1-CD2 4.18Å; L538-F747 HydrophobicContact CD1-CE2 3.92Å; L538-F747 HydrophobicContact CD2-CE2 4.01Å; L538-F747 HydrophobicContact CD2-CZ 4.12Å; V598-F747 HydrophobicContact CG2-CD2 4.27Å; V598-F747 HydrophobicContact CG2-CE2 3.78Å; F743-F747 VanDerWaalsContact O-CB 3.27Å; F743-F747 WeakPolarHBondContact O-CB 3.18Å; F743-F747 PolarHBondContact O-N 3.47Å; T744-F747 PolarHBondContact O-N 3.41Å; T745-F747 VanDerWaalsContact C-N 3.33Å; T745-F747 PolarHBondContact O-N 3.23Å; F747-F749 PolarHBondContact O-N 3.2Å; F747-L750 HydrophobicContact CD2-CD1 4.03Å; F747-L750 HydrophobicContact CE2-CD1 4.45Å; F747-L750 WeakPolarHBondContact O-CB 3.43Å; F747-L750 PolarHBondContact O-N 3.06Å; F747-L750 VanDerWaalsContact O-N 3.07Å
748	C	77.2	Confident	73.9	Confident	2 Å²	2	15.2 Å²	15.2	1%	0.014	8%	0.082	C	C	.	.	H	α-helix	trans	-61.4	-31.7	173.9	-67.7	0	0	0	0	112.6	T744 T745 L750 T755 I756	T744-C748 WeakPolarHBondContact O-CB 3.49Å; T744-C748 PolarHBondContact O-N 3.5Å; T744-C748 PolarHBondContact O-SG 3.44Å; T745-C748 WeakPolarHBondContact O-CB 3.35Å; T745-C748 PolarHBondContact O-N 2.95Å; T745-C748 VanDerWaalsContact O-N 3.14Å; C748-L750 VanDerWaalsContact C-N 3.32Å; C748-T755 PolarHBondContact O-OG1 3.49Å; C748-I756 HydrophobicContact CB-CD1 4.13Å
749	F	73.8	Confident	73.5	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.104	C	C	.	.	G	3₁₀ helix	trans	-77.1	-9.3	175.4	-77.8	-75.6	0	0	0	114.4	L638 N670 F673 M707 T745 C746 F747 D751 V752 I756 L764	L638-F749 HydrophobicContact CD1-CB 3.63Å; L638-F749 HydrophobicContact CD2-CB 3.9Å; L638-F749 HydrophobicContact CD2-CG 4.46Å; L638-F749 HydrophobicContact CG-CB 4.45Å; N670-F749 PolarHBondContact ND2-O 3.44Å; N670-F749 PolarHBondContact OD1-O 3.26Å; F673-F749 HydrophobicContact CB-CD1 4.44Å; F673-F749 HydrophobicContact CB-CE1 4.25Å; F673-F749 HydrophobicContact CB-CZ 4.45Å; F673-F749 HydrophobicContact CD1-CD1 4.24Å; F673-F749 AromaticContact CD1-CD2 3.46Å; F673-F749 HydrophobicContact CD1-CD2 3.46Å; F673-F749 VanDerWaalsContact CD1-CD2 3.46Å; F673-F749 HydrophobicContact CD1-CE1 4.26Å; F673-F749 AromaticContact CD1-CE2 3.54Å; F673-F749 HydrophobicContact CD1-CE2 3.54Å; F673-F749 AromaticContact CD1-CG 3.86Å; F673-F749 HydrophobicContact CD1-CG 3.86Å; F673-F749 AromaticContact CD1-CZ 3.91Å; F673-F749 HydrophobicContact CD1-CZ 3.91Å; F673-F749 HydrophobicContact CD2-CD2 4.33Å; F673-F749 AromaticContact CD2-CE1 3.88Å; F673-F749 HydrophobicContact CD2-CE1 3.88Å; F673-F749 AromaticContact CD2-CE2 3.59Å; F673-F749 HydrophobicContact CD2-CE2 3.59Å; F673-F749 AromaticContact CD2-CZ 3.26Å; F673-F749 HydrophobicContact CD2-CZ 3.26Å; F673-F749 AromaticContact CE1-CD2 3.24Å; F673-F749 HydrophobicContact CE1-CD2 3.24Å; F673-F749 AromaticContact CE1-CE2 3.18Å; F673-F749 HydrophobicContact CE1-CE2 3.18Å; F673-F749 HydrophobicContact CE1-CG 4.11Å; F673-F749 AromaticContact CE1-CZ 3.93Å; F673-F749 HydrophobicContact CE1-CZ 3.93Å; F673-F749 HydrophobicContact CE2-CD2 4.18Å; F673-F749 HydrophobicContact CE2-CE1 4.34Å; F673-F749 AromaticContact CE2-CE2 3.25Å; F673-F749 HydrophobicContact CE2-CE2 3.25Å; F673-F749 AromaticContact CE2-CZ 3.32Å; F673-F749 HydrophobicContact CE2-CZ 3.32Å; F673-F749 HydrophobicContact CG-CD1 4.17Å; F673-F749 HydrophobicContact CG-CD2 4.02Å; F673-F749 AromaticContact CG-CE1 3.85Å; F673-F749 HydrophobicContact CG-CE1 3.85Å; F673-F749 AromaticContact CG-CE2 3.74Å; F673-F749 HydrophobicContact CG-CE2 3.74Å; F673-F749 HydrophobicContact CG-CG 4.26Å; F673-F749 AromaticContact CG-CZ 3.59Å; F673-F749 HydrophobicContact CG-CZ 3.59Å; F673-F749 AromaticContact CZ-CD2 3.66Å; F673-F749 HydrophobicContact CZ-CD2 3.66Å; F673-F749 AromaticContact CZ-CE2 3.05Å; F673-F749 HydrophobicContact CZ-CE2 3.05Å; F673-F749 AromaticContact CZ-CZ 3.68Å; F673-F749 HydrophobicContact CZ-CZ 3.68Å; M707-F749 HydrophobicContact CE-CD1 3.62Å; M707-F749 HydrophobicContact CE-CE1 3.22Å; M707-F749 HydrophobicContact CE-CZ 4.29Å; M707-F749 HydrophobicContact SD-CE1 3.79Å; M707-F749 HydrophobicContact SD-CZ 4.37Å; T745-F749 WeakPolarHBondContact O-CD2 3.09Å; T745-F749 PolarHBondContact O-N 2.9Å; T745-F749 VanDerWaalsContact O-N 3.08Å; C746-F749 PolarHBondContact O-N 2.87Å; F747-F749 PolarHBondContact O-N 3.2Å; F749-D751 PolarHBondContact O-N 3.41Å; F749-V752 HydrophobicContact CD1-CG2 4.35Å; F749-V752 WeakPolarHBondContact O-CG2 3.37Å; F749-I756 HydrophobicContact CB-CD1 4.43Å; F749-I756 HydrophobicContact CD1-CD1 3.34Å; F749-I756 HydrophobicContact CD2-CD1 3.74Å; F749-I756 HydrophobicContact CE1-CD1 3.28Å; F749-I756 HydrophobicContact CE1-CG2 4.27Å; F749-I756 HydrophobicContact CE2-CD1 3.65Å; F749-I756 HydrophobicContact CG-CD1 3.57Å; F749-I756 HydrophobicContact CZ-CD1 3.47Å; F749-I756 VanDerWaalsContact CZ-CD1 3.47Å; F749-L764 HydrophobicContact CE2-CD2 3.62Å; F749-L764 HydrophobicContact CZ-CD2 3.43Å; F749-L764 VanDerWaalsContact CZ-CD2 3.43Å
750	L	73	Confident	73	Confident	24 Å²	24	20.4 Å²	20.4	13%	0.126	11%	0.105	C	C	.	.	G	3₁₀ helix	trans	-63.1	-31.1	170.4	-70.7	-179.5	0	0	0	111.8	A597 V598 L601 A635 L638 C746 F747 C748	A597-L750 HydrophobicContact CB-CD1 4.33Å; A597-L750 HydrophobicContact CB-CD2 4.15Å; V598-L750 HydrophobicContact CG2-CD1 4.1Å; L601-L750 HydrophobicContact CD1-CD1 3.6Å; L601-L750 HydrophobicContact CD1-CD2 3.9Å; L601-L750 HydrophobicContact CD1-CG 3.76Å; L601-L750 HydrophobicContact CG-CD2 4.27Å; A635-L750 HydrophobicContact CB-CD2 3.75Å; L638-L750 HydrophobicContact CD1-CD2 4.15Å; C746-L750 PolarHBondContact O-N 3.1Å; F747-L750 HydrophobicContact CD2-CD1 4.03Å; F747-L750 HydrophobicContact CE2-CD1 4.45Å; F747-L750 WeakPolarHBondContact O-CB 3.43Å; F747-L750 PolarHBondContact O-N 3.06Å; F747-L750 VanDerWaalsContact O-N 3.07Å; C748-L750 VanDerWaalsContact C-N 3.32Å
751	D	69.5	Low	72.6	Confident	38 Å²	38	21.3 Å²	21.3	20%	0.203	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	-120	54	-179.5	-77.4	-44.5	0	0	0	113.1	R500 M594 F749 Y753 S754 T755	R500-D751 IonicContact CZ-OD2 3.18Å; R500-D751 IonicContact NH1-OD1 3.2Å; R500-D751 IonicContact NH1-OD2 3.9Å; R500-D751 PolarHBondContact NH1-OD2 2.91Å; M594-D751 WeakPolarHBondContact CE-OD1 3.23Å; M594-D751 VanDerWaalsContact CE-OD2 3.29Å; M594-D751 WeakPolarHBondContact CE-OD2 3.47Å; F749-D751 PolarHBondContact O-N 3.41Å; D751-Y753 PolarHBondContact O-N 2.88Å; D751-S754 PolarHBondContact O-N 3.2Å; D751-S754 PolarHBondContact O-OG 3.35Å; D751-T755 HydrophobicContact CB-CG2 4.5Å; D751-T755 PolarHBondContact O-N 3.2Å; D751-T755 PolarHBondContact O-OG1 3.28Å
752	V	65.6	Low	72.3	Confident	6 Å²	6	21.9 Å²	21.9	4%	0.036	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-44.7	-40.8	-174.9	-171.3	0	0	0	0	113.7	Y669 N670 F749 I756 L757	Y669-V752 HydrophobicContact CD2-CB 4.44Å; Y669-V752 HydrophobicContact CD2-CG1 3.9Å; Y669-V752 HydrophobicContact CG-CG1 4.39Å; N670-V752 WeakPolarHBondContact OD1-CG2 3.4Å; F749-V752 HydrophobicContact CD1-CG2 4.35Å; F749-V752 WeakPolarHBondContact O-CG2 3.37Å; V752-I756 PolarHBondContact O-N 2.91Å; V752-L757 VanDerWaalsContact O-CB 3.27Å; V752-L757 WeakPolarHBondContact O-CB 3.36Å; V752-L757 PolarHBondContact O-N 3.2Å
753	Y	63.8	Low	72	Confident	97 Å²	97	21.9 Å²	21.9	38%	0.38	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-37.1	-177.1	-81.8	-67	0	0	0	113.9	E666 D751 L757 S758	E666-Y753 HydrophobicContact CG-CD2 3.96Å; E666-Y753 HydrophobicContact CG-CE2 3.39Å; E666-Y753 WeakPolarHBondContact OE1-CD2 3.44Å; E666-Y753 VanDerWaalsContact OE1-CE2 3.24Å; E666-Y753 WeakPolarHBondContact OE1-CE2 3.43Å; D751-Y753 PolarHBondContact O-N 2.88Å; Y753-L757 HydrophobicContact CD1-CD2 3.8Å; Y753-L757 HydrophobicContact CE1-CD2 3.87Å; Y753-S758 WeakPolarHBondContact O-CB 3.42Å
754	S	63.1	Low	71.8	Confident	36 Å²	36	22.2 Å²	22.2	25%	0.252	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-37.3	-171.3	73	0	0	0	0	112.2	D751 S758	D751-S754 PolarHBondContact O-N 3.2Å; D751-S754 PolarHBondContact O-OG 3.35Å; S754-S758 PolarHBondContact O-OG 3.37Å
755	T	67.5	Low	71.5	Confident	5 Å²	5	22.2 Å²	22.2	3%	0.031	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-70	-175.4	53.9	0	0	0	0	110.4	C748 D751 Q760	C748-T755 PolarHBondContact O-OG1 3.49Å; D751-T755 HydrophobicContact CB-CG2 4.5Å; D751-T755 PolarHBondContact O-N 3.2Å; D751-T755 PolarHBondContact O-OG1 3.28Å; T755-Q760 CarbonylContact O-C 3.55Å; T755-Q760 WeakPolarHBondContact O-CA 3.17Å; T755-Q760 WeakPolarHBondContact O-CB 3.47Å; T755-Q760 PolarHBondContact O-N 3.03Å
756	I	69.4	Low	71.3	Confident	6 Å²	6	22.1 Å²	22.1	3%	0.031	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-31.5	-163.9	-62.2	167.3	0	0	0	112.5	C748 F749 V752 H761 L764	C748-I756 HydrophobicContact CB-CD1 4.13Å; F749-I756 HydrophobicContact CB-CD1 4.43Å; F749-I756 HydrophobicContact CD1-CD1 3.34Å; F749-I756 HydrophobicContact CD2-CD1 3.74Å; F749-I756 HydrophobicContact CE1-CD1 3.28Å; F749-I756 HydrophobicContact CE1-CG2 4.27Å; F749-I756 HydrophobicContact CE2-CD1 3.65Å; F749-I756 HydrophobicContact CG-CD1 3.57Å; F749-I756 HydrophobicContact CZ-CD1 3.47Å; F749-I756 VanDerWaalsContact CZ-CD1 3.47Å; V752-I756 PolarHBondContact O-N 2.91Å; I756-H761 PolarHBondContact O-CE1 3.41Å; I756-H761 PolarHBondContact O-ND1 2.92Å; I756-L764 HydrophobicContact CD1-CD2 4.25Å; I756-L764 HydrophobicContact CG2-CD1 4.44Å
757	L	61.9	Low	71.2	Confident	26 Å²	26	22.3 Å²	22.3	14%	0.136	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-20.2	-177.5	-169.7	61.4	0	0	0	113.5	S703 V752 Y753	S703-L757 WeakPolarHBondContact OG-CD1 3.32Å; V752-L757 VanDerWaalsContact O-CB 3.27Å; V752-L757 WeakPolarHBondContact O-CB 3.36Å; V752-L757 PolarHBondContact O-N 3.2Å; Y753-L757 HydrophobicContact CD1-CD2 3.8Å; Y753-L757 HydrophobicContact CE1-CD2 3.87Å
758	S	65.2	Low	71	Confident	60 Å²	60	21.8 Å²	21.8	42%	0.42	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-68.2	-173.1	85.1	0	0	0	0	113.8	Y753 S754	Y753-S758 WeakPolarHBondContact O-CB 3.42Å; S754-S758 PolarHBondContact O-OG 3.37Å
759	K	67	Low	70.9	Confident	105 Å²	105	21.8 Å²	21.8	46%	0.457	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-139.3	-26	-166	-63.1	-176.1	-177.6	177.5	0	114.3
760	Q	67.6	Low	71	Confident	7 Å²	7	21.8 Å²	21.8	3%	0.033	11%	0.111	C	C	.	.			trans	-106.8	48.8	-168.9	-55.1	179.5	-30.5	0	0	112.6	N498 T755 Y762 L763	N498-Q760 PolarHBondContact OD1-NE2 3.07Å; T755-Q760 CarbonylContact O-C 3.55Å; T755-Q760 WeakPolarHBondContact O-CA 3.17Å; T755-Q760 WeakPolarHBondContact O-CB 3.47Å; T755-Q760 PolarHBondContact O-N 3.03Å; Q760-Y762 HydrophobicContact CB-CE1 3.95Å; Q760-Y762 HydrophobicContact CG-CE1 4.1Å; Q760-Y762 WeakPolarHBondContact CG-OH 3.39Å; Q760-Y762 PolarHBondContact O-N 3.34Å; Q760-Y762 VanDerWaalsContact O-N 3.16Å; Q760-L763 HydrophobicContact CB-CD1 3.71Å; Q760-L763 HydrophobicContact CB-CG 4.11Å; Q760-L763 PolarHBondContact O-N 2.71Å
761	H	71.9	Confident	71.1	Confident	19 Å²	19	20.7 Å²	20.7	9%	0.088	11%	0.105	C	C	.	.	G	3₁₀ helix	trans	-58.5	-27.2	175.6	-58.3	-53.4	0	0	0	113	L312 F316 S349 I756 L763 L764	L312-H761 HydrophobicContact CD1-CB 4.49Å; F316-H761 HydrophobicContact CE2-CB 4.31Å; F316-H761 HydrophobicContact CZ-CB 4.12Å; S349-H761 VanDerWaalsContact OG-CB 3.26Å; S349-H761 WeakPolarHBondContact OG-CB 3.48Å; I756-H761 PolarHBondContact O-CE1 3.41Å; I756-H761 PolarHBondContact O-ND1 2.92Å; H761-L763 PolarHBondContact O-N 3.09Å; H761-L764 PolarHBondContact O-N 2.94Å
762	Y	72.3	Confident	71.2	Confident	11 Å²	11	19.7 Å²	19.7	4%	0.043	10%	0.1	C	C	.	.	G	3₁₀ helix	trans	-66	-17.5	-179.5	60.2	-100	0	0	0	113.7	I419 L423 I461 Q760 L764 Y765	I419-Y762 HydrophobicContact CG2-CE1 4.23Å; I419-Y762 HydrophobicContact CG2-CE2 4.02Å; I419-Y762 WeakPolarHBondContact CG2-OH 3.4Å; L423-Y762 HydrophobicContact CD2-CD2 3.39Å; L423-Y762 HydrophobicContact CD2-CE2 3.88Å; L423-Y762 HydrophobicContact CD2-CG 4.48Å; I461-Y762 HydrophobicContact CD1-CE2 3.95Å; I461-Y762 WeakPolarHBondContact CD1-OH 3.21Å; Q760-Y762 HydrophobicContact CB-CE1 3.95Å; Q760-Y762 HydrophobicContact CG-CE1 4.1Å; Q760-Y762 WeakPolarHBondContact CG-OH 3.39Å; Q760-Y762 PolarHBondContact O-N 3.34Å; Q760-Y762 VanDerWaalsContact O-N 3.16Å; Y762-L764 PolarHBondContact O-N 2.99Å; Y762-L764 VanDerWaalsContact O-N 3.15Å; Y762-Y765 WeakPolarHBondContact O-CB 3.41Å; Y762-Y765 VanDerWaalsContact O-CD2 3.26Å; Y762-Y765 WeakPolarHBondContact O-CD2 3.5Å; Y762-Y765 PolarHBondContact O-N 2.85Å
763	L	75.8	Confident	71.3	Confident	2 Å²	2	21.4 Å²	21.4	1%	0.01	11%	0.111	C	C	.	.	G	3₁₀ helix	trans	-64.7	-15.4	175	-69.5	171.8	0	0	0	112.6	L501 Q760 H761 Y765 S766	L501-L763 HydrophobicContact CD1-CD1 4.17Å; Q760-L763 HydrophobicContact CB-CD1 3.71Å; Q760-L763 HydrophobicContact CB-CG 4.11Å; Q760-L763 PolarHBondContact O-N 2.71Å; H761-L763 PolarHBondContact O-N 3.09Å; L763-Y765 PolarHBondContact O-N 3.17Å; L763-S766 VanDerWaalsContact O-CB 3.3Å; L763-S766 WeakPolarHBondContact O-CB 3.04Å; L763-S766 PolarHBondContact O-N 3.47Å; L763-S766 VanDerWaalsContact O-N 3.15Å; L763-S766 PolarHBondContact O-OG 3.26Å
764	L	77.4	Confident	71.4	Confident	7 Å²	7	18.6 Å²	18.6	4%	0.037	10%	0.1	C	C	.	.	G	3₁₀ helix	trans	-66.6	-23.8	170.8	-65.1	176.2	0	0	0	112.8	F316 I710 F749 I756 H761 Y762 S766 L767	F316-L764 HydrophobicContact CE1-CB 4.29Å; F316-L764 HydrophobicContact CE1-CD1 4.2Å; F316-L764 HydrophobicContact CE2-CD1 4.4Å; F316-L764 HydrophobicContact CZ-CD1 4.08Å; I710-L764 HydrophobicContact CD1-CD1 4Å; F749-L764 HydrophobicContact CE2-CD2 3.62Å; F749-L764 HydrophobicContact CZ-CD2 3.43Å; F749-L764 VanDerWaalsContact CZ-CD2 3.43Å; I756-L764 HydrophobicContact CD1-CD2 4.25Å; I756-L764 HydrophobicContact CG2-CD1 4.44Å; H761-L764 PolarHBondContact O-N 2.94Å; Y762-L764 PolarHBondContact O-N 2.99Å; Y762-L764 VanDerWaalsContact O-N 3.15Å; L764-S766 PolarHBondContact O-N 3.48Å; L764-L767 VanDerWaalsContact O-CB 3.29Å; L764-L767 WeakPolarHBondContact O-CB 3.44Å; L764-L767 PolarHBondContact O-N 2.74Å; L764-L767 VanDerWaalsContact O-N 3.12Å
765	Y	76.9	Confident	71.4	Confident	1 Å²	1	17.8 Å²	17.8	0%	0.004	9%	0.092	C	C	.	.	G	3₁₀ helix	trans	-69.1	-10.4	173.6	-64.6	-71.9	0	0	0	112.8	F316 S349 A352 S353 L356 L386 V390 Y762 L763 L767 V768	F316-Y765 HydrophobicContact CE1-CE1 4.48Å; F316-Y765 AromaticContact CE1-CE2 3.85Å; F316-Y765 HydrophobicContact CE1-CE2 3.85Å; F316-Y765 AromaticContact CE1-CZ 3.7Å; F316-Y765 WeakPolarHBondContact CE1-OH 3.17Å; F316-Y765 HydrophobicContact CZ-CE2 4.41Å; S349-Y765 PolarHBondContact O-OH 2.78Å; A352-Y765 HydrophobicContact CB-CD2 3.9Å; A352-Y765 HydrophobicContact CB-CE1 4.09Å; A352-Y765 HydrophobicContact CB-CE2 3.32Å; A352-Y765 VanDerWaalsContact CB-CZ 3.44Å; S353-Y765 WeakPolarHBondContact CA-OH 3.47Å; S353-Y765 PolarHBondContact N-OH 2.62Å; S353-Y765 VanDerWaalsContact N-OH 3.1Å; L356-Y765 HydrophobicContact CD1-CD1 4.09Å; L356-Y765 HydrophobicContact CD1-CE1 3.56Å; L356-Y765 HydrophobicContact CD2-CD1 4.46Å; L356-Y765 HydrophobicContact CG-CD1 4.11Å; L356-Y765 HydrophobicContact CG-CE1 3.83Å; L386-Y765 HydrophobicContact CD2-CD2 3.78Å; L386-Y765 HydrophobicContact CD2-CE2 4.4Å; L386-Y765 HydrophobicContact CD2-CG 4.45Å; V390-Y765 HydrophobicContact CG2-CD1 4.26Å; V390-Y765 HydrophobicContact CG2-CG 4.41Å; Y762-Y765 WeakPolarHBondContact O-CB 3.41Å; Y762-Y765 VanDerWaalsContact O-CD2 3.26Å; Y762-Y765 WeakPolarHBondContact O-CD2 3.5Å; Y762-Y765 PolarHBondContact O-N 2.85Å; L763-Y765 PolarHBondContact O-N 3.17Å; Y765-L767 PolarHBondContact O-N 2.68Å; Y765-L767 VanDerWaalsContact O-N 3.11Å; Y765-V768 HydrophobicContact CD1-CG2 4.23Å; Y765-V768 WeakPolarHBondContact O-CB 3.35Å; Y765-V768 WeakPolarHBondContact O-CG2 3.41Å; Y765-V768 PolarHBondContact O-N 2.86Å
766	S	76	Confident	71.1	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.092	C	C	.	.	G	3₁₀ helix	trans	-62.3	-14.8	168.2	-31.4	0	0	0	0	113.1	G741 L763 L764 V768 P769	G741-S766 WeakPolarHBondContact CA-O 3.3Å; L763-S766 VanDerWaalsContact O-CB 3.3Å; L763-S766 WeakPolarHBondContact O-CB 3.04Å; L763-S766 PolarHBondContact O-N 3.47Å; L763-S766 VanDerWaalsContact O-N 3.15Å; L763-S766 PolarHBondContact O-OG 3.26Å; L764-S766 PolarHBondContact O-N 3.48Å; S766-V768 VanDerWaalsContact C-N 3.26Å; S766-P769 VanDerWaalsContact O-CD 3.32Å; S766-P769 WeakPolarHBondContact O-CD 3.11Å
767	L	79.1	Confident	70.7	Confident	4 Å²	4	18 Å²	18	2%	0.021	9%	0.093	C	C	.	.	G	3₁₀ helix	trans	-72.6	-19.8	174.1	-165.1	60.7	0	0	0	113.1	F320 L714 L724 L742 T745 L764 Y765 A770	F320-L767 HydrophobicContact CE1-CD2 4.42Å; L714-L767 HydrophobicContact CD2-CD2 3.62Å; L724-L767 HydrophobicContact CD1-CD1 4.08Å; L724-L767 HydrophobicContact CD1-CD2 3.88Å; L724-L767 HydrophobicContact CD1-CG 4.26Å; L724-L767 HydrophobicContact CD2-CD1 3.91Å; L724-L767 HydrophobicContact CD2-CD2 4.04Å; L724-L767 HydrophobicContact CD2-CG 3.73Å; L742-L767 HydrophobicContact CD2-CD1 3.64Å; T745-L767 HydrophobicContact CG2-CB 4Å; T745-L767 HydrophobicContact CG2-CD1 4.37Å; L764-L767 VanDerWaalsContact O-CB 3.29Å; L764-L767 WeakPolarHBondContact O-CB 3.44Å; L764-L767 PolarHBondContact O-N 2.74Å; L764-L767 VanDerWaalsContact O-N 3.12Å; Y765-L767 PolarHBondContact O-N 2.68Å; Y765-L767 VanDerWaalsContact O-N 3.11Å; L767-A770 HydrophobicContact CD1-CB 4.34Å; L767-A770 WeakPolarHBondContact O-CA 3.28Å; L767-A770 VanDerWaalsContact O-CB 3.31Å; L767-A770 WeakPolarHBondContact O-CB 3.45Å; L767-A770 PolarHBondContact O-N 3.03Å
768	V	77.6	Confident	70.4	Confident	1 Å²	1	17.1 Å²	17.1	1%	0.006	9%	0.089	C	C	.	.	G	3₁₀ helix	trans	-55.6	-44.4	-171.5	168.1	0	0	0	0	113.7	L356 R359 V390 C393 Y765 S766 A770 I771	L356-V768 HydrophobicContact CD2-CG2 3.49Å; L356-V768 VanDerWaalsContact CD2-CG2 3.49Å; R359-V768 PolarHBondContact NH2-O 3.1Å; V390-V768 HydrophobicContact CG1-CG1 3.92Å; V390-V768 HydrophobicContact CG1-CG2 3.98Å; V390-V768 HydrophobicContact CG2-CG2 4.36Å; C393-V768 HydrophobicContact CB-CG1 4.15Å; Y765-V768 HydrophobicContact CD1-CG2 4.23Å; Y765-V768 WeakPolarHBondContact O-CB 3.35Å; Y765-V768 WeakPolarHBondContact O-CG2 3.41Å; Y765-V768 PolarHBondContact O-N 2.86Å; S766-V768 VanDerWaalsContact C-N 3.26Å; V768-A770 PolarHBondContact O-N 3.31Å; V768-A770 VanDerWaalsContact O-N 3.15Å; V768-I771 PolarHBondContact O-N 3.18Å; V768-I771 VanDerWaalsContact O-N 3.13Å
769	P	73.7	Confident	69.7	Low	3 Å²	3	15.4 Å²	15.4	2%	0.019	7%	0.074	C	C	.	.	G	3₁₀ helix	trans	-60.3	-21.3	174.5	-23.4	34.5	0	0	0	114.4	L427 A430 S766	L427-P769 HydrophobicContact CD2-CG 4.04Å; A430-P769 HydrophobicContact CB-CG 4.38Å; S766-P769 VanDerWaalsContact O-CD 3.32Å; S766-P769 WeakPolarHBondContact O-CD 3.11Å
770	A	76.1	Confident	68.8	Low	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.063	C	C	.	.	G	3₁₀ helix	trans	-84.3	-13.5	179.1	0	0	0	0	0	113.7	T723 L724 A738 L742 L767 V768 N772	T723-A770 VanDerWaalsContact O-O 3.13Å; L724-A770 WeakPolarHBondContact CA-O 3.31Å; L724-A770 HydrophobicContact CD2-CB 4.06Å; A738-A770 HydrophobicContact CB-CB 4.15Å; L742-A770 HydrophobicContact CD2-CB 4.31Å; L742-A770 HydrophobicContact CG-CB 3.98Å; L767-A770 HydrophobicContact CD1-CB 4.34Å; L767-A770 WeakPolarHBondContact O-CA 3.28Å; L767-A770 VanDerWaalsContact O-CB 3.31Å; L767-A770 WeakPolarHBondContact O-CB 3.45Å; L767-A770 PolarHBondContact O-N 3.03Å; V768-A770 PolarHBondContact O-N 3.31Å; V768-A770 VanDerWaalsContact O-N 3.15Å; A770-N772 PolarHBondContact O-N 3.41Å
771	I	76.4	Confident	67.8	Low	1 Å²	1	14.2 Å²	14.2	1%	0.005	7%	0.074	C	C	.	.			trans	-77.1	109.4	-177.6	-58.5	174.3	0	0	0	109.7	T323 L356 L717 M722 L724 V768	T323-I771 HydrophobicContact CG2-CD1 4.38Å; L356-I771 HydrophobicContact CD2-CD1 4.29Å; L717-I771 HydrophobicContact CD1-CD1 4.19Å; L717-I771 HydrophobicContact CD2-CG1 4.26Å; L717-I771 HydrophobicContact CD2-CG2 4.17Å; M722-I771 HydrophobicContact CB-CG2 4.03Å; M722-I771 HydrophobicContact CG-CG2 4.19Å; M722-I771 HydrophobicContact SD-CG2 3.32Å; M722-I771 WeakPolarHBondContact SD-CG2 3.42Å; L724-I771 HydrophobicContact CD2-CG1 3.73Å; V768-I771 PolarHBondContact O-N 3.18Å; V768-I771 VanDerWaalsContact O-N 3.13Å
772	N	70.5	Confident	66.3	Low	16 Å²	16	17.2 Å²	17.2	9%	0.086	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	143.8	177.2	-70.9	-51.5	0	0	0	111.1	M722 T723 H728 A770	M722-N772 CarbonylContact C-O 3.46Å; M722-N772 VanDerWaalsContact CA-O 3.22Å; M722-N772 WeakPolarHBondContact CA-O 3.12Å; T723-N772 PolarHBondContact N-O 3.08Å; T723-N772 PolarHBondContact O-N 3.22Å; T723-N772 PolarHBondContact OG1-O 3.47Å; H728-N772 PolarHBondContact CE1-ND2 3.32Å; H728-N772 VanDerWaalsContact CE1-ND2 3.32Å; H728-N772 PolarHBondContact NE2-ND2 2.91Å; A770-N772 PolarHBondContact O-N 3.41Å
773	P	68.3	Low	65.1	Low	42 Å²	42	23.1 Å²	23.1	27%	0.273	12%	0.123	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	152.4	173.6	30.3	-28	0	0	0	109.6	W360 T721 T851	W360-P773 HydrophobicContact CH2-CB 4.34Å; W360-P773 HydrophobicContact CH2-CG 3.97Å; W360-P773 HydrophobicContact CZ3-CG 4.44Å; T721-P773 CarbonylContact O-C 3.54Å; P773-T851 HydrophobicContact CB-CG2 4.31Å; P773-T851 HydrophobicContact CG-CG2 4.35Å; P773-T851 VanDerWaalsContact O-CB 3.29Å; P773-T851 WeakPolarHBondContact O-CB 3.48Å; P773-T851 VanDerWaalsContact O-CG2 3.26Å; P773-T851 WeakPolarHBondContact O-CG2 3.35Å; P773-T851 PolarHBondContact O-OG1 3.49Å
774	R	65.3	Low	63.6	Low	39 Å²	39	30.2 Å²	30.2	15%	0.147	16%	0.161	C	C	.	.			trans	-117.1	-10.4	-175.7	176.3	177.9	166.5	178.4	5.2	113.8	T721 T723 L826 G827 T851	T721-R774 WeakPolarHBondContact O-CB 3.46Å; T721-R774 PolarHBondContact O-N 2.81Å; T723-R774 HydrophobicContact CG2-CB 4.09Å; T723-R774 VanDerWaalsContact CG2-CD 3.43Å; T723-R774 HydrophobicContact CG2-CG 4.19Å; R774-L826 PolarHBondContact NE-O 2.94Å; R774-L826 PolarHBondContact NH2-O 3Å; R774-G827 VanDerWaalsContact NH2-N 3.17Å; R774-T851 VanDerWaalsContact C-CG2 3.49Å
775	M	63	Low	61.7	Low	18 Å²	18	38.1 Å²	38.1	9%	0.089	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	125.1	-174.6	-173	173.5	165.3	0	0	113.4	L282 I284 I777 P823 L825 T851	L282-M775 HydrophobicContact CD2-CE 3.92Å; I284-M775 HydrophobicContact CD1-CE 3.61Å; I284-M775 HydrophobicContact CD1-SD 3.24Å; I284-M775 WeakPolarHBondContact CD1-SD 3.41Å; I284-M775 HydrophobicContact CG1-CE 3.81Å; I284-M775 HydrophobicContact CG1-SD 4.09Å; M775-I777 HydrophobicContact CB-CG1 4.46Å; M775-I777 HydrophobicContact CE-CD1 3.97Å; M775-I777 HydrophobicContact CE-CG1 3.97Å; M775-I777 HydrophobicContact CG-CD1 4.17Å; M775-I777 HydrophobicContact CG-CG1 3.77Å; M775-I777 PolarHBondContact O-N 3.01Å; M775-I777 HydrophobicContact SD-CD1 4.05Å; M775-I777 HydrophobicContact SD-CG1 4.2Å; M775-P823 HydrophobicContact CE-CB 3.08Å; M775-P823 HydrophobicContact CE-CG 3.32Å; M775-P823 HydrophobicContact CG-CB 3.96Å; M775-P823 HydrophobicContact SD-CB 4.25Å; M775-L825 HydrophobicContact CB-CD2 4.05Å; M775-T851 WeakPolarHBondContact O-CG2 3.46Å
776	L	62.1	Low	59.8	Low	6 Å²	6	47.2 Å²	47.2	3%	0.031	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	118.5	171.4	-169.4	151.8	0	0	0	109.1	T778 V796 T822 P823 V824 L826 A832 F854	L776-T778 HydrophobicContact CD2-CG2 4.33Å; L776-V796 HydrophobicContact CD2-CG2 4.31Å; L776-T822 HydrophobicContact CD2-CG2 3.34Å; L776-P823 VanDerWaalsContact O-CA 3.25Å; L776-P823 WeakPolarHBondContact O-CA 3.49Å; L776-V824 PolarHBondContact N-O 2.84Å; L776-V824 PolarHBondContact O-N 3.21Å; L776-L826 HydrophobicContact CB-CD1 4.43Å; L776-L826 HydrophobicContact CD1-CD1 4Å; L776-A832 HydrophobicContact CD1-CB 3.84Å; L776-F854 HydrophobicContact CD1-CD2 4.29Å; L776-F854 HydrophobicContact CD1-CE2 3.96Å; L776-F854 HydrophobicContact CD2-CD2 4.26Å; L776-F854 HydrophobicContact CG-CD2 4.24Å; L776-F854 HydrophobicContact CG-CE2 4.39Å
777	I	61	Low	58.3	Low	10 Å²	10	51.8 Å²	51.8	5%	0.051	28%	0.277	C	S	.	.			trans	-123.4	135.7	178.7	-50.2	172.7	0	0	0	108.3	L282 M775 F779 Q791 P823 V853 F854	L282-I777 HydrophobicContact CD1-CD1 3.42Å; L282-I777 VanDerWaalsContact CD1-CD1 3.42Å; L282-I777 HydrophobicContact CD2-CD1 3.49Å; L282-I777 VanDerWaalsContact CD2-CD1 3.49Å; L282-I777 HydrophobicContact CG-CD1 4.1Å; M775-I777 HydrophobicContact CB-CG1 4.46Å; M775-I777 HydrophobicContact CE-CD1 3.97Å; M775-I777 HydrophobicContact CE-CG1 3.97Å; M775-I777 HydrophobicContact CG-CD1 4.17Å; M775-I777 HydrophobicContact CG-CG1 3.77Å; M775-I777 PolarHBondContact O-N 3.01Å; M775-I777 HydrophobicContact SD-CD1 4.05Å; M775-I777 HydrophobicContact SD-CG1 4.2Å; I777-F779 HydrophobicContact CB-CD2 4.42Å; I777-F779 HydrophobicContact CB-CE2 3.77Å; I777-F779 HydrophobicContact CB-CZ 4.25Å; I777-F779 HydrophobicContact CG2-CD2 3.91Å; I777-F779 HydrophobicContact CG2-CE1 4.12Å; I777-F779 HydrophobicContact CG2-CE2 3.38Å; I777-F779 HydrophobicContact CG2-CZ 3.53Å; I777-Q791 HydrophobicContact CG2-CG 4.07Å; I777-P823 HydrophobicContact CG1-CB 4.34Å; I777-V853 WeakPolarHBondContact O-CA 3.19Å; I777-F854 PolarHBondContact O-N 3.03Å
778	T	54.5	Low	56.3	Low	7 Å²	7	58.5 Å²	58.5	4%	0.043	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	124.4	174.7	40.5	0	0	0	0	108.7	L776 Q791 H792 V794 T822 F854	L776-T778 HydrophobicContact CD2-CG2 4.33Å; T778-Q791 WeakPolarHBondContact O-CA 3.37Å; T778-H792 PolarHBondContact O-N 3.49Å; T778-H792 VanDerWaalsContact O-N 3.11Å; T778-H792 PolarHBondContact OG1-O 2.7Å; T778-V794 HydrophobicContact CG2-CB 4.42Å; T778-V794 HydrophobicContact CG2-CG2 4.43Å; T778-T822 HydrophobicContact CG2-CG2 3.92Å; T778-T822 WeakPolarHBondContact OG1-CB 2.98Å; T778-T822 PolarHBondContact OG1-OG1 2.91Å; T778-F854 CarbonylContact C-O 3.22Å; T778-F854 VanDerWaalsContact CA-O 3.31Å; T778-F854 WeakPolarHBondContact CA-O 3.31Å; T778-F854 HydrophobicContact CG2-CB 3.77Å
779	F	52.4	Low	54.9	Low	24 Å²	24	60.8 Å²	60.8	11%	0.105	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	148.7	174.1	-61	-93.9	0	0	0	110.2	I777 L789 I790 V853 F854 I855 R856	I777-F779 HydrophobicContact CB-CD2 4.42Å; I777-F779 HydrophobicContact CB-CE2 3.77Å; I777-F779 HydrophobicContact CB-CZ 4.25Å; I777-F779 HydrophobicContact CG2-CD2 3.91Å; I777-F779 HydrophobicContact CG2-CE1 4.12Å; I777-F779 HydrophobicContact CG2-CE2 3.38Å; I777-F779 HydrophobicContact CG2-CZ 3.53Å; F779-L789 HydrophobicContact CB-CB 3.96Å; F779-L789 HydrophobicContact CB-CD2 3.96Å; F779-L789 HydrophobicContact CB-CG 4.41Å; F779-L789 HydrophobicContact CD1-CB 3.56Å; F779-L789 HydrophobicContact CE1-CB 4.28Å; F779-L789 HydrophobicContact CG-CB 3.97Å; F779-L789 HydrophobicContact CG-CD1 4.48Å; F779-I790 CarbonylContact C-O 3.54Å; F779-I790 WeakPolarHBondContact CA-O 3.45Å; F779-V853 HydrophobicContact CD2-CG1 3.34Å; F779-V853 HydrophobicContact CE2-CB 4.44Å; F779-V853 HydrophobicContact CE2-CG1 3.48Å; F779-V853 VanDerWaalsContact CE2-CG1 3.48Å; F779-V853 HydrophobicContact CE2-CG2 4.26Å; F779-F854 PolarHBondContact N-O 3.26Å; F779-I855 HydrophobicContact CB-CG1 4.44Å; F779-I855 CarbonylContact O-C 3.43Å; F779-I855 WeakPolarHBondContact O-CA 3.44Å; F779-R856 PolarHBondContact O-N 3.36Å
780	V	47.2	Very low	53.6	Low	37 Å²	37	64.3 Å²	64.3	22%	0.224	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	138.4	171.1	175.7	0	0	0	0	107	I790 H792 R856	V780-I790 PolarHBondContact N-O 3.13Å; V780-I790 PolarHBondContact O-N 3.4Å; V780-H792 HydrophobicContact CB-CB 4.32Å; V780-H792 HydrophobicContact CG2-CB 3.44Å; V780-H792 VanDerWaalsContact CG2-CB 3.44Å; V780-R856 HydrophobicContact CG2-CB 4.29Å
781	L	47.3	Very low	52.7	Low	51 Å²	51	68 Å²	68	27%	0.267	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	124.4	170.6	-140.8	134	0	0	0	107.7	N783 L789	L781-N783 PolarHBondContact O-N 3.09Å; L781-L789 HydrophobicContact CD1-CD2 4.45Å
782	N	39.8	Very low	51.9	Low	81 Å²	81	72.7 Å²	72.7	43%	0.433	38%	0.378	S	S	.	.			trans	-68.9	129.7	169.2	-97.6	-1.7	0	0	0	108.7	D784 I790	N782-D784 PolarHBondContact O-N 3.35Å; N782-D784 VanDerWaalsContact O-N 3.08Å; N782-I790 WeakPolarHBondContact ND2-CD1 2.94Å
783	N	47.2	Very low	51.6	Low	135 Å²	135	76.6 Å²	76.6	72%	0.722	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-0.9	-175.6	-78	-25.5	0	0	0	115	L781	L781-N783 PolarHBondContact O-N 3.09Å
784	D	42.9	Very low	51.5	Low	151 Å²	151	75.1 Å²	75.1	81%	0.807	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.4	-20	-164	-68	-29.8	0	0	0	116.4	N782	N782-D784 PolarHBondContact O-N 3.35Å; N782-D784 VanDerWaalsContact O-N 3.08Å
785	E	37.5	Very low	51.8	Low	173 Å²	173	77.9 Å²	77.9	81%	0.808	41%	0.406	S	S	*	.	S	Bend	trans	-150.7	139.9	173.5	-66.4	-174.1	164.1	0	0	110.9	A787	E785-A787 PolarHBondContact O-N 3.35Å
786	E	37	Very low	52.1	Low	193 Å²	193	77.1 Å²	77.1	90%	0.902	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	133.6	-177.5	-68.2	173.4	151.6	0	0	112.5
787	A	45.2	Very low	52.6	Low	95 Å²	95	80.6 Å²	80.6	79%	0.785	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.5	26.8	158.1	0	0	0	0	0	121	E785	E785-A787 PolarHBondContact O-N 3.35Å
788	Q	36.9	Very low	53.1	Low	146 Å²	146	80.4 Å²	80.4	68%	0.682	42%	0.415	S	S	*	.			trans	-116.2	112.2	163.2	-71.6	-174.3	-5.5	0	0	112.7	I790	Q788-I790 PolarHBondContact O-N 3.22Å
789	L	48.5	Very low	54	Low	49 Å²	49	80.4 Å²	80.4	26%	0.257	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	109.4	171.1	-70.6	173.9	0	0	0	108.7	P279 F779 L781 I855	P279-L789 HydrophobicContact CG-CD1 3.88Å; F779-L789 HydrophobicContact CB-CB 3.96Å; F779-L789 HydrophobicContact CB-CD2 3.96Å; F779-L789 HydrophobicContact CB-CG 4.41Å; F779-L789 HydrophobicContact CD1-CB 3.56Å; F779-L789 HydrophobicContact CE1-CB 4.28Å; F779-L789 HydrophobicContact CG-CB 3.97Å; F779-L789 HydrophobicContact CG-CD1 4.48Å; L781-L789 HydrophobicContact CD1-CD2 4.45Å; L789-I855 HydrophobicContact CD1-CD1 4.46Å; L789-I855 HydrophobicContact CD2-CD1 3.94Å; L789-I855 HydrophobicContact CD2-CG1 4.2Å
790	I	47.3	Very low	54.9	Low	77 Å²	77	85.7 Å²	85.7	40%	0.395	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	129.8	174.5	-59.9	-175.3	0	0	0	109.2	F779 V780 N782 Q788 H792	F779-I790 CarbonylContact C-O 3.54Å; F779-I790 WeakPolarHBondContact CA-O 3.45Å; V780-I790 PolarHBondContact N-O 3.13Å; V780-I790 PolarHBondContact O-N 3.4Å; N782-I790 WeakPolarHBondContact ND2-CD1 2.94Å; Q788-I790 PolarHBondContact O-N 3.22Å; I790-H792 PolarHBondContact O-N 3.13Å
791	Q	57.3	Low	55.7	Low	77 Å²	77	86 Å²	86	36%	0.36	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	116.6	171	-176.6	179.2	-9.7	0	0	110.1	I777 T778 P823	I777-Q791 HydrophobicContact CG2-CG 4.07Å; T778-Q791 WeakPolarHBondContact O-CA 3.37Å; Q791-P823 VanDerWaalsContact NE2-CD 3.33Å
792	H	57.8	Low	56.5	Low	100 Å²	100	86.3 Å²	86.3	46%	0.463	45%	0.451	S	S	.	.			trans	-109.2	128.3	173.7	-172.1	-68.2	0	0	0	110	T778 V780 I790 V794 T822	T778-H792 PolarHBondContact O-N 3.49Å; T778-H792 VanDerWaalsContact O-N 3.11Å; T778-H792 PolarHBondContact OG1-O 2.7Å; V780-H792 HydrophobicContact CB-CB 4.32Å; V780-H792 HydrophobicContact CG2-CB 3.44Å; V780-H792 VanDerWaalsContact CG2-CB 3.44Å; I790-H792 PolarHBondContact O-N 3.13Å; H792-V794 PolarHBondContact O-N 2.93Å; H792-T822 PolarHBondContact O-OG1 3.11Å
793	N	64.9	Low	57.5	Low	98 Å²	98	89.6 Å²	89.6	52%	0.524	47%	0.469	S	S	.	.			trans	-73.2	116.5	178.2	-63.3	-10.6	0	0	0	109.9	T822	N793-T822 PolarHBondContact OD1-O 3.25Å; N793-T822 VanDerWaalsContact OD1-O 3.1Å
794	V	66.2	Low	58.1	Low	11 Å²	11	88.2 Å²	88.2	7%	0.067	47%	0.465	C	S	.	.			trans	-118.5	140.3	176.5	-177.5	0	0	0	0	108.9	T778 H792 V796 T822 L834	T778-V794 HydrophobicContact CG2-CB 4.42Å; T778-V794 HydrophobicContact CG2-CG2 4.43Å; H792-V794 PolarHBondContact O-N 2.93Å; V794-V796 PolarHBondContact O-N 3.43Å; V794-T822 PolarHBondContact N-OG1 3.01Å; V794-T822 PolarHBondContact O-N 2.87Å; V794-T822 PolarHBondContact O-OG1 3.3Å; V794-L834 HydrophobicContact CB-CD2 4.5Å; V794-L834 HydrophobicContact CG1-CD2 3.69Å
795	N	72.1	Confident	58.7	Low	96 Å²	96	83.6 Å²	83.6	51%	0.513	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	122.5	177.4	-67.6	-16	0	0	0	110.3	Y820 A835	N795-Y820 CarbonylContact C-O 3.52Å; N795-Y820 WeakPolarHBondContact CA-O 3.42Å; N795-A835 HydrophobicContact CB-CB 3.98Å; N795-A835 VanDerWaalsContact O-CB 3.28Å; N795-A835 WeakPolarHBondContact O-CB 3.14Å; N795-A835 PolarHBondContact O-N 3.43Å
796	V	69.6	Low	59.8	Low	3 Å²	3	78.2 Å²	78.2	2%	0.018	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	128.7	-179.7	177.3	0	0	0	0	108.9	L776 V794 V798 T819 Y820 T822 A832 E833 L834	L776-V796 HydrophobicContact CD2-CG2 4.31Å; V794-V796 PolarHBondContact O-N 3.43Å; V796-V798 HydrophobicContact CG1-CG2 3.98Å; V796-T819 CarbonylContact O-C 3.55Å; V796-T819 WeakPolarHBondContact O-CA 3.36Å; V796-Y820 PolarHBondContact N-O 2.98Å; V796-Y820 PolarHBondContact O-N 3.08Å; V796-Y820 VanDerWaalsContact O-O 3.1Å; V796-T822 HydrophobicContact CG2-CG2 3.58Å; V796-A832 HydrophobicContact CG1-CB 3.41Å; V796-A832 VanDerWaalsContact CG1-CB 3.41Å; V796-E833 CarbonylContact C-O 3.6Å; V796-E833 WeakPolarHBondContact CA-O 3.39Å; V796-L834 HydrophobicContact CG2-CD2 4Å
797	R	72.3	Confident	60.8	Low	79 Å²	79	77.2 Å²	77.2	30%	0.298	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	114.4	168.1	-70.5	178.8	-176.7	158	5.9	109	F817 Q818 T819 A832 E833 A835	R797-F817 HydrophobicContact CB-CB 4.07Å; R797-F817 HydrophobicContact CG-CB 4.47Å; R797-F817 HydrophobicContact CG-CD2 4.12Å; R797-F817 HydrophobicContact CG-CG 4.5Å; R797-Q818 CarbonylContact C-O 3.42Å; R797-Q818 WeakPolarHBondContact CA-O 3.45Å; R797-T819 HydrophobicContact CG-CG2 3.71Å; R797-A832 CarbonylContact O-C 3.48Å; R797-A832 WeakPolarHBondContact O-CA 3.5Å; R797-E833 HydrophobicContact CB-CB 4.41Å; R797-E833 PolarHBondContact N-O 3.06Å; R797-E833 PolarHBondContact O-N 3.42Å; R797-A835 HydrophobicContact CG-CB 4.26Å
798	V	72	Confident	61.1	Low	6 Å²	6	78.1 Å²	78.1	4%	0.036	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	133.3	174.3	-176.8	0	0	0	0	109.5	V796 F817 Q818 Y820 V824 L826 E830 R831 A832	V796-V798 HydrophobicContact CG1-CG2 3.98Å; V798-F817 CarbonylContact O-C 3.6Å; V798-F817 WeakPolarHBondContact O-CA 3.39Å; V798-Q818 PolarHBondContact N-O 3.13Å; V798-Q818 PolarHBondContact O-N 2.83Å; V798-Y820 HydrophobicContact CB-CD2 3.79Å; V798-Y820 HydrophobicContact CB-CE2 4Å; V798-Y820 HydrophobicContact CG2-CD2 3.75Å; V798-Y820 HydrophobicContact CG2-CE2 4.42Å; V798-V824 HydrophobicContact CG2-CG1 4.07Å; V798-L826 HydrophobicContact CB-CD2 4.38Å; V798-L826 HydrophobicContact CG1-CD2 3.75Å; V798-L826 HydrophobicContact CG2-CD2 3.65Å; V798-E830 HydrophobicContact CG1-CB 3.91Å; V798-E830 HydrophobicContact CG1-CG 4.34Å; V798-E830 WeakPolarHBondContact CG1-OE2 3.33Å; V798-R831 CarbonylContact C-O 3.37Å; V798-R831 VanDerWaalsContact CA-O 3.24Å; V798-R831 WeakPolarHBondContact CA-O 3.43Å; V798-A832 HydrophobicContact CG2-CB 4.31Å
799	G	71.7	Confident	62	Low	7 Å²	7	74.8 Å²	74.8	7%	0.072	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	-177.4	174.6	0	0	0	0	0	112.6	I814 G816 E830 R831	G799-I814 VanDerWaalsContact CA-CG2 3.46Å; G799-G816 WeakPolarHBondContact CA-O 3.27Å; G799-E830 CarbonylContact O-C 3.53Å; G799-E830 VanDerWaalsContact O-CA 3.32Å; G799-E830 WeakPolarHBondContact O-CA 3.33Å; G799-R831 PolarHBondContact N-O 2.93Å; G799-R831 PolarHBondContact O-N 2.93Å
800	Q	71.8	Confident	62.5	Low	134 Å²	134	79.3 Å²	79.3	63%	0.626	46%	0.458	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.2	134.3	-179.6	-70.8	-178.8	-24.1	0	0	110.9	I814 T815	Q800-I814 WeakPolarHBondContact O-CA 3.4Å; Q800-T815 PolarHBondContact N-O 3.18Å; Q800-T815 VanDerWaalsContact N-O 3.12Å; Q800-T815 PolarHBondContact O-N 3.12Å; Q800-T815 PolarHBondContact O-OG1 3.13Å
801	A	64.4	Low	63	Low	44 Å²	44	79.3 Å²	79.3	36%	0.364	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	131.1	175.8	0	0	0	0	0	110.7	T813 G829 R831	A801-T813 WeakPolarHBondContact CA-O 3.47Å; A801-G829 PolarHBondContact N-O 3.33Å; A801-R831 HydrophobicContact CB-CB 4.25Å
802	V	63.7	Low	63.2	Low	57 Å²	57	81 Å²	81	35%	0.345	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	139.2	173.1	178.6	0	0	0	0	108.2	V804 V805 T813 T815	V802-V804 PolarHBondContact O-N 3.29Å; V802-V805 HydrophobicContact CB-CG2 3.83Å; V802-V805 HydrophobicContact CG1-CG2 3.76Å; V802-T813 PolarHBondContact N-O 3.22Å; V802-T813 CarbonylContact O-C 3.59Å; V802-T813 VanDerWaalsContact O-CA 3.25Å; V802-T813 WeakPolarHBondContact O-CA 3.33Å; V802-T813 VanDerWaalsContact O-O 3.08Å; V802-T815 HydrophobicContact CB-CG2 3.8Å; V802-T815 HydrophobicContact CG1-CG2 4.19Å; V802-T815 HydrophobicContact CG2-CG2 3.4Å; V802-T815 WeakPolarHBondContact CG2-OG1 3.39Å
803	D	60.9	Low	63.5	Low	150 Å²	150	77.4 Å²	77.4	80%	0.802	46%	0.455	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.5	-48.3	-167.8	-62.9	-26.9	0	0	0	113.7
804	V	60.4	Low	63.6	Low	107 Å²	107	73.5 Å²	73.5	65%	0.648	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151	119.8	177.8	-169.9	0	0	0	0	111	V802 P811	V802-V804 PolarHBondContact O-N 3.29Å; V804-P811 HydrophobicContact CG1-CB 3.98Å
805	V	54.7	Low	63.6	Low	54 Å²	54	75.2 Å²	75.2	33%	0.327	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	119	173.3	-147.2	0	0	0	0	108.5	V802 K812 T815	V802-V805 HydrophobicContact CB-CG2 3.83Å; V802-V805 HydrophobicContact CG1-CG2 3.76Å; V805-K812 CarbonylContact C-O 3.56Å; V805-K812 WeakPolarHBondContact CA-O 3.42Å; V805-K812 PolarHBondContact N-O 2.88Å; V805-K812 CarbonylContact O-C 3.6Å; V805-K812 VanDerWaalsContact O-CA 3.26Å; V805-K812 WeakPolarHBondContact O-CA 2.89Å; V805-K812 WeakPolarHBondContact O-CB 3.35Å; V805-K812 PolarHBondContact O-N 3.18Å; V805-T815 HydrophobicContact CB-CG2 4.48Å; V805-T815 HydrophobicContact CG1-CG2 4.26Å; V805-T815 HydrophobicContact CG2-CG2 3.55Å
806	G	60.8	Low	63.2	Low	59 Å²	59	73.8 Å²	73.8	61%	0.608	45%	0.452	S	S	*	.	S	Bend	trans	148.4	-176	175.6	0	0	0	0	0	114.2
807	Q	58.8	Low	63.1	Low	173 Å²	173	79.2 Å²	79.2	81%	0.808	48%	0.476	S	S	*	.	S	Bend	trans	-74.9	142	172.8	-67.9	176.6	-15.2	0	0	109.5	G809 K810	Q807-G809 PolarHBondContact O-N 3.22Å; Q807-K810 CarbonylContact O-C 3.51Å; Q807-K810 PolarHBondContact O-N 2.89Å; Q807-K810 VanDerWaalsContact O-N 3.07Å
808	A	51.2	Low	63.1	Low	113 Å²	113	81.3 Å²	81.3	93%	0.934	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	123.4	172.1	0	0	0	0	0	109.9
809	G	55.2	Low	63.3	Low	77 Å²	77	85.4 Å²	85.4	79%	0.794	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	105	-17.2	-177.4	0	0	0	0	0	116	Q807	Q807-G809 PolarHBondContact O-N 3.22Å
810	K	58.7	Low	63.4	Low	143 Å²	143	90 Å²	90	62%	0.622	53%	0.53	S	S	*	.	S	Bend	trans	-138.7	74.5	168.2	-72.5	-173.9	-178.3	177	0	110.1	Q807 K812	Q807-K810 CarbonylContact O-C 3.51Å; Q807-K810 PolarHBondContact O-N 2.89Å; Q807-K810 VanDerWaalsContact O-N 3.07Å; K810-K812 PolarHBondContact O-N 3.45Å
811	P	58.1	Low	63.4	Low	78 Å²	78	86.7 Å²	86.7	51%	0.506	52%	0.521	S	S	.	.			trans	-62.9	123.1	177.5	28.3	-33.3	0	0	0	108.6	V804	V804-P811 HydrophobicContact CG1-CB 3.98Å
812	K	62.2	Low	63.4	Low	111 Å²	111	84.6 Å²	84.6	48%	0.483	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	147.2	163	-59.4	-177.6	176.1	179.3	0	107.9	V805 K810	V805-K812 CarbonylContact C-O 3.56Å; V805-K812 WeakPolarHBondContact CA-O 3.42Å; V805-K812 PolarHBondContact N-O 2.88Å; V805-K812 CarbonylContact O-C 3.6Å; V805-K812 VanDerWaalsContact O-CA 3.26Å; V805-K812 WeakPolarHBondContact O-CA 2.89Å; V805-K812 WeakPolarHBondContact O-CB 3.35Å; V805-K812 PolarHBondContact O-N 3.18Å; K810-K812 PolarHBondContact O-N 3.45Å
813	T	63.7	Low	63.3	Low	26 Å²	26	84.5 Å²	84.5	16%	0.16	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	5.7	-171.5	35	0	0	0	0	111.7	A801 V802 R831 E833	A801-T813 WeakPolarHBondContact CA-O 3.47Å; V802-T813 PolarHBondContact N-O 3.22Å; V802-T813 CarbonylContact O-C 3.59Å; V802-T813 VanDerWaalsContact O-CA 3.25Å; V802-T813 WeakPolarHBondContact O-CA 3.33Å; V802-T813 VanDerWaalsContact O-O 3.08Å; T813-R831 PolarHBondContact OG1-NE 3.48Å; T813-R831 VanDerWaalsContact OG1-NE 3.15Å; T813-R831 PolarHBondContact OG1-NH1 3.24Å; T813-R831 VanDerWaalsContact OG1-NH1 3.14Å; T813-R831 PolarHBondContact OG1-NH2 3.25Å; T813-E833 PolarHBondContact OG1-OE1 3.26Å
814	I	67.7	Low	63.6	Low	15 Å²	15	78 Å²	78	8%	0.077	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	124.6	179.2	-57.4	-178	0	0	0	108.9	G799 Q800 F817 R831 E833	G799-I814 VanDerWaalsContact CA-CG2 3.46Å; Q800-I814 WeakPolarHBondContact O-CA 3.4Å; I814-F817 HydrophobicContact CG2-CB 4.29Å; I814-R831 HydrophobicContact CD1-CB 4.16Å; I814-R831 HydrophobicContact CD1-CG 3.86Å; I814-R831 HydrophobicContact CG1-CB 3.9Å; I814-R831 HydrophobicContact CG1-CG 3.71Å; I814-E833 HydrophobicContact CD1-CB 3.66Å; I814-E833 HydrophobicContact CD1-CG 3.46Å; I814-E833 VanDerWaalsContact CD1-CG 3.46Å; I814-E833 HydrophobicContact CG1-CG 4.25Å; I814-E833 WeakPolarHBondContact CG1-OE1 3.41Å
815	T	64.7	Low	63.9	Low	48 Å²	48	76.9 Å²	76.9	29%	0.294	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	137.9	159.1	57.8	0	0	0	0	110.4	Q800 V802 V805	Q800-T815 PolarHBondContact N-O 3.18Å; Q800-T815 VanDerWaalsContact N-O 3.12Å; Q800-T815 PolarHBondContact O-N 3.12Å; Q800-T815 PolarHBondContact O-OG1 3.13Å; V802-T815 HydrophobicContact CB-CG2 3.8Å; V802-T815 HydrophobicContact CG1-CG2 4.19Å; V802-T815 HydrophobicContact CG2-CG2 3.4Å; V802-T815 WeakPolarHBondContact CG2-OG1 3.39Å; V805-T815 HydrophobicContact CB-CG2 4.48Å; V805-T815 HydrophobicContact CG1-CG2 4.26Å; V805-T815 HydrophobicContact CG2-CG2 3.55Å
816	G	64.1	Low	64.5	Low	65 Å²	65	75 Å²	75	67%	0.67	45%	0.448	S	S	*	.	E	Extended strand (participates in β ladder)	trans	59.7	86.1	174.3	0	0	0	0	0	113.1	G799	G799-G816 WeakPolarHBondContact CA-O 3.27Å
817	F	67.4	Low	64.7	Low	118 Å²	118	72.8 Å²	72.8	52%	0.518	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	143	-179.1	60.5	-88.8	0	0	0	112.3	R797 V798 I814	R797-F817 HydrophobicContact CB-CB 4.07Å; R797-F817 HydrophobicContact CG-CB 4.47Å; R797-F817 HydrophobicContact CG-CD2 4.12Å; R797-F817 HydrophobicContact CG-CG 4.5Å; V798-F817 CarbonylContact O-C 3.6Å; V798-F817 WeakPolarHBondContact O-CA 3.39Å; I814-F817 HydrophobicContact CG2-CB 4.29Å
818	Q	72.4	Confident	65	Low	122 Å²	122	68.1 Å²	68.1	57%	0.57	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.9	136.9	161.4	-64.1	-173.2	17	0	0	108.5	R797 V798 Y820	R797-Q818 CarbonylContact C-O 3.42Å; R797-Q818 WeakPolarHBondContact CA-O 3.45Å; V798-Q818 PolarHBondContact N-O 3.13Å; V798-Q818 PolarHBondContact O-N 2.83Å; Q818-Y820 HydrophobicContact CB-CD2 4.38Å; Q818-Y820 HydrophobicContact CB-CE2 3.76Å; Q818-Y820 PolarHBondContact OE1-OH 3.03Å
819	T	76.3	Confident	65.6	Low	92 Å²	92	64.5 Å²	64.5	56%	0.564	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.5	117.8	176.4	45.9	0	0	0	0	110.1	V796 R797	V796-T819 CarbonylContact O-C 3.55Å; V796-T819 WeakPolarHBondContact O-CA 3.36Å; R797-T819 HydrophobicContact CG-CG2 3.71Å
820	Y	73.2	Confident	66.2	Low	104 Å²	104	64.1 Å²	64.1	41%	0.408	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	154.6	171.1	-64.7	-77	0	0	0	110.1	N795 V796 V798 Q818 V824	N795-Y820 CarbonylContact C-O 3.52Å; N795-Y820 WeakPolarHBondContact CA-O 3.42Å; V796-Y820 PolarHBondContact N-O 2.98Å; V796-Y820 PolarHBondContact O-N 3.08Å; V796-Y820 VanDerWaalsContact O-O 3.1Å; V798-Y820 HydrophobicContact CB-CD2 3.79Å; V798-Y820 HydrophobicContact CB-CE2 4Å; V798-Y820 HydrophobicContact CG2-CD2 3.75Å; V798-Y820 HydrophobicContact CG2-CE2 4.42Å; Q818-Y820 HydrophobicContact CB-CD2 4.38Å; Q818-Y820 HydrophobicContact CB-CE2 3.76Å; Q818-Y820 PolarHBondContact OE1-OH 3.03Å; Y820-V824 HydrophobicContact CD2-CG1 4.29Å; Y820-V824 HydrophobicContact CG-CG1 4.25Å; Y820-V824 HydrophobicContact CG-CG2 4.45Å
821	S	71.8	Confident	66.4	Low	64 Å²	64	57.8 Å²	57.8	45%	0.448	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	138.2	166.8	53.2	0	0	0	0	109.4	V824	S821-V824 WeakPolarHBondContact O-CG2 3.48Å
822	T	64.8	Low	66.7	Low	0 Å²	0	54.5 Å²	54.5	0%	0	31%	0.306	C	S	.	.	S	Bend	trans	-58.2	140.4	170.1	50.1	0	0	0	0	111.1	L776 T778 H792 N793 V794 V796	L776-T822 HydrophobicContact CD2-CG2 3.34Å; T778-T822 HydrophobicContact CG2-CG2 3.92Å; T778-T822 WeakPolarHBondContact OG1-CB 2.98Å; T778-T822 PolarHBondContact OG1-OG1 2.91Å; H792-T822 PolarHBondContact O-OG1 3.11Å; N793-T822 PolarHBondContact OD1-O 3.25Å; N793-T822 VanDerWaalsContact OD1-O 3.1Å; V794-T822 PolarHBondContact N-OG1 3.01Å; V794-T822 PolarHBondContact O-N 2.87Å; V794-T822 PolarHBondContact O-OG1 3.3Å; V796-T822 HydrophobicContact CG2-CG2 3.58Å
823	P	62.5	Low	66.9	Low	55 Å²	55	51.4 Å²	51.4	36%	0.357	29%	0.293	S	S	.	.	S	Bend	cis	-88.4	142	9	34.6	-29.9	0	0	0	114.2	M775 L776 I777 Q791	M775-P823 HydrophobicContact CE-CB 3.08Å; M775-P823 HydrophobicContact CE-CG 3.32Å; M775-P823 HydrophobicContact CG-CB 3.96Å; M775-P823 HydrophobicContact SD-CB 4.25Å; L776-P823 VanDerWaalsContact O-CA 3.25Å; L776-P823 WeakPolarHBondContact O-CA 3.49Å; I777-P823 HydrophobicContact CG1-CB 4.34Å; Q791-P823 VanDerWaalsContact NE2-CD 3.33Å
824	V	66	Low	66.9	Low	14 Å²	14	53 Å²	53	9%	0.085	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	135.8	-176.4	-170.3	0	0	0	0	111.1	L776 V798 Y820 S821 L826	L776-V824 PolarHBondContact N-O 2.84Å; L776-V824 PolarHBondContact O-N 3.21Å; V798-V824 HydrophobicContact CG2-CG1 4.07Å; Y820-V824 HydrophobicContact CD2-CG1 4.29Å; Y820-V824 HydrophobicContact CG-CG1 4.25Å; Y820-V824 HydrophobicContact CG-CG2 4.45Å; S821-V824 WeakPolarHBondContact O-CG2 3.48Å; V824-L826 HydrophobicContact CG1-CD2 4.37Å
825	L	68.5	Low	66.6	Low	83 Å²	83	53.5 Å²	53.5	44%	0.435	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	113	168.8	-68.9	169.7	0	0	0	109.2	T721 M775	T721-L825 HydrophobicContact CG2-CD2 4.27Å; M775-L825 HydrophobicContact CB-CD2 4.05Å
826	L	66.3	Low	66.2	Low	14 Å²	14	54.1 Å²	54.1	7%	0.073	31%	0.311	C	S	.	.			trans	-86.6	123.6	-175.4	-64.3	175.1	0	0	0	112.6	R774 L776 V798 V824 A832	R774-L826 PolarHBondContact NE-O 2.94Å; R774-L826 PolarHBondContact NH2-O 3Å; L776-L826 HydrophobicContact CB-CD1 4.43Å; L776-L826 HydrophobicContact CD1-CD1 4Å; V798-L826 HydrophobicContact CB-CD2 4.38Å; V798-L826 HydrophobicContact CG1-CD2 3.75Å; V798-L826 HydrophobicContact CG2-CD2 3.65Å; V824-L826 HydrophobicContact CG1-CD2 4.37Å; L826-A832 HydrophobicContact CD1-CB 4Å; L826-A832 HydrophobicContact CD2-CB 3.71Å
827	G	66.1	Low	65.5	Low	13 Å²	13	56.5 Å²	56.5	13%	0.134	31%	0.308	C	S	.	.			trans	-37.5	151.7	165.9	0	0	0	0	0	116	R774 G829 E830	R774-G827 VanDerWaalsContact NH2-N 3.17Å; G827-G829 PolarHBondContact O-N 3.06Å; G827-E830 VanDerWaalsContact CA-OE2 3.31Å; G827-E830 WeakPolarHBondContact CA-OE2 3.49Å; G827-E830 PolarHBondContact N-OE2 3.13Å; G827-E830 PolarHBondContact O-N 3.18Å; G827-E830 VanDerWaalsContact O-N 3.11Å
828	H	63.6	Low	63.9	Low	76 Å²	76	57.7 Å²	57.7	35%	0.352	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	120.5	161	-175.8	-73.4	0	0	0	108.5	N647 E830	N647-H828 HydrophobicContact CB-CB 4.32Å; N647-H828 PolarHBondContact ND2-ND1 3.45Å; H828-E830 VanDerWaalsContact C-N 3.31Å
829	G	64.3	Low	61.9	Low	36 Å²	36	52.9 Å²	52.9	37%	0.371	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.6	5.7	-175.1	0	0	0	0	0	115.2	A801 G827	A801-G829 PolarHBondContact N-O 3.33Å; G827-G829 PolarHBondContact O-N 3.06Å
830	E	67.2	Low	59.5	Low	69 Å²	69	58.5 Å²	58.5	32%	0.322	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	143.3	170.2	-71.8	176.5	-171.2	0	0	110.9	V798 G799 G827 H828 S848	V798-E830 HydrophobicContact CG1-CB 3.91Å; V798-E830 HydrophobicContact CG1-CG 4.34Å; V798-E830 WeakPolarHBondContact CG1-OE2 3.33Å; G799-E830 CarbonylContact O-C 3.53Å; G799-E830 VanDerWaalsContact O-CA 3.32Å; G799-E830 WeakPolarHBondContact O-CA 3.33Å; G827-E830 VanDerWaalsContact CA-OE2 3.31Å; G827-E830 WeakPolarHBondContact CA-OE2 3.49Å; G827-E830 PolarHBondContact N-OE2 3.13Å; G827-E830 PolarHBondContact O-N 3.18Å; G827-E830 VanDerWaalsContact O-N 3.11Å; H828-E830 VanDerWaalsContact C-N 3.31Å; E830-S848 PolarHBondContact O-OG 3.34Å; E830-S848 VanDerWaalsContact O-OG 3.13Å
831	R	63.4	Low	57.4	Low	11 Å²	11	56.4 Å²	56.4	4%	0.042	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	138.7	179.9	-178.6	166.2	-178.7	157.5	-16.7	109.4	E730 V798 G799 A801 T813 I814 E833 F845 W847	E730-R831 IonicContact OE1-CZ 3.64Å; E730-R831 IonicContact OE1-NH1 2.68Å; E730-R831 PolarHBondContact OE1-NH1 3.25Å; V798-R831 CarbonylContact C-O 3.37Å; V798-R831 VanDerWaalsContact CA-O 3.24Å; V798-R831 WeakPolarHBondContact CA-O 3.43Å; G799-R831 PolarHBondContact N-O 2.93Å; G799-R831 PolarHBondContact O-N 2.93Å; A801-R831 HydrophobicContact CB-CB 4.25Å; T813-R831 PolarHBondContact OG1-NE 3.48Å; T813-R831 VanDerWaalsContact OG1-NE 3.15Å; T813-R831 PolarHBondContact OG1-NH1 3.24Å; T813-R831 VanDerWaalsContact OG1-NH1 3.14Å; T813-R831 PolarHBondContact OG1-NH2 3.25Å; I814-R831 HydrophobicContact CD1-CB 4.16Å; I814-R831 HydrophobicContact CD1-CG 3.86Å; I814-R831 HydrophobicContact CG1-CB 3.9Å; I814-R831 HydrophobicContact CG1-CG 3.71Å; R831-E833 IonicContact NE-OE1 3.58Å; R831-E833 IonicContact NH2-OE1 2.97Å; R831-F845 PolarHBondContact NH2-O 3.32Å; R831-W847 WeakPolarHBondContact CG-O 3.48Å
832	A	65.6	Low	55.2	Low	8 Å²	8	57.9 Å²	57.9	7%	0.066	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	126.4	177.3	0	0	0	0	0	110.4	L776 V796 R797 V798 L826 W847	L776-A832 HydrophobicContact CD1-CB 3.84Å; V796-A832 HydrophobicContact CG1-CB 3.41Å; V796-A832 VanDerWaalsContact CG1-CB 3.41Å; R797-A832 CarbonylContact O-C 3.48Å; R797-A832 WeakPolarHBondContact O-CA 3.5Å; V798-A832 HydrophobicContact CG2-CB 4.31Å; L826-A832 HydrophobicContact CD1-CB 4Å; L826-A832 HydrophobicContact CD2-CB 3.71Å; A832-W847 PolarHBondContact N-O 3.18Å; A832-W847 VanDerWaalsContact O-O 3.14Å
833	E	64.6	Low	53.3	Low	46 Å²	46	66.8 Å²	66.8	22%	0.215	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	139.2	171.6	-85	170.5	-162	0	0	110	V796 R797 T813 I814 R831	V796-E833 CarbonylContact C-O 3.6Å; V796-E833 WeakPolarHBondContact CA-O 3.39Å; R797-E833 HydrophobicContact CB-CB 4.41Å; R797-E833 PolarHBondContact N-O 3.06Å; R797-E833 PolarHBondContact O-N 3.42Å; T813-E833 PolarHBondContact OG1-OE1 3.26Å; I814-E833 HydrophobicContact CD1-CB 3.66Å; I814-E833 HydrophobicContact CD1-CG 3.46Å; I814-E833 VanDerWaalsContact CD1-CG 3.46Å; I814-E833 HydrophobicContact CG1-CG 4.25Å; I814-E833 WeakPolarHBondContact CG1-OE1 3.41Å; R831-E833 IonicContact NE-OE1 3.58Å; R831-E833 IonicContact NH2-OE1 2.97Å
834	L	64.7	Low	51.5	Low	60 Å²	60	69.6 Å²	69.6	31%	0.314	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	137.9	175.1	-68.1	165.3	0	0	0	110.5	V794 V796	V794-L834 HydrophobicContact CB-CD2 4.5Å; V794-L834 HydrophobicContact CG1-CD2 3.69Å; V796-L834 HydrophobicContact CG2-CD2 4Å
835	A	61.9	Low	49.8	Very low	26 Å²	26	70.9 Å²	70.9	22%	0.215	37%	0.369	C	S	.	.	S	Bend	trans	-81	-13.9	-176.2	0	0	0	0	0	114.3	N795 R797	N795-A835 HydrophobicContact CB-CB 3.98Å; N795-A835 VanDerWaalsContact O-CB 3.28Å; N795-A835 WeakPolarHBondContact O-CB 3.14Å; N795-A835 PolarHBondContact O-N 3.43Å; R797-A835 HydrophobicContact CG-CB 4.26Å
836	T	56.4	Low	47.8	Very low	61 Å²	61	67.9 Å²	67.9	37%	0.374	36%	0.358	S	S	.	.			trans	-113.5	125.4	-173.4	23.2	0	0	0	0	112.5	D838	T836-D838 VanDerWaalsContact C-N 3.31Å; T836-D838 PolarHBondContact O-N 3.27Å
837	D	48.7	Very low	46.1	Very low	114 Å²	114	70.1 Å²	70.1	61%	0.61	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-16.4	178.9	-83.7	16.9	0	0	0	113.5	C839 R843	D837-C839 PolarHBondContact O-N 3.2Å; D837-C839 VanDerWaalsContact O-N 3.16Å; D837-R843 IonicContact OD2-CZ 3.5Å; D837-R843 IonicContact OD2-NE 2.82Å; D837-R843 IonicContact OD2-NH2 2.86Å; D837-R843 PolarHBondContact OD2-NH2 3.34Å
838	D	33	Very low	44.2	Very low	144 Å²	144	69.7 Å²	69.7	77%	0.77	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-8.9	-177.2	-61.2	-30.3	0	0	0	113	T836 K840	T836-D838 VanDerWaalsContact C-N 3.31Å; T836-D838 PolarHBondContact O-N 3.27Å; D838-K840 PolarHBondContact O-N 3.38Å
839	C	30.2	Very low	42.4	Very low	21 Å²	21	67.9 Å²	67.9	14%	0.142	36%	0.356	C	S	.	.	S	Bend	trans	-84.1	98.7	168	-141.8	0	0	0	0	108.9	D837 L841 R856	D837-C839 PolarHBondContact O-N 3.2Å; D837-C839 VanDerWaalsContact O-N 3.16Å; C839-L841 PolarHBondContact O-N 2.9Å; C839-R856 PolarHBondContact SG-NE 3.02Å; C839-R856 PolarHBondContact SG-NH2 2.78Å
840	K	26.5	Very low	40.6	Very low	209 Å²	209	67.5 Å²	67.5	91%	0.909	35%	0.349	S	S	*	.			trans	-69.3	74.3	171.1	-73.6	-176.8	179.4	177.1	0	110.4	D838	D838-K840 PolarHBondContact O-N 3.38Å
841	L	28.8	Very low	38.8	Very low	60 Å²	60	65.1 Å²	65.1	31%	0.314	34%	0.34	S	S	.	.	S	Bend	trans	-124.2	112	160.8	-83.1	160	0	0	0	106.1	V260 C839 R843	V260-L841 HydrophobicContact CG1-CD2 4.06Å; C839-L841 PolarHBondContact O-N 2.9Å; L841-R843 PolarHBondContact O-N 3.06Å
842	T	27.1	Very low	37.2	Very low	95 Å²	95	65.3 Å²	65.3	58%	0.583	34%	0.342	S	S	*	.			trans	0.2	103.8	173	43.5	0	0	0	0	116.2	N844 F845	T842-N844 PolarHBondContact O-N 3.43Å; T842-F845 HydrophobicContact CG2-CE2 4.16Å; T842-F845 WeakPolarHBondContact OG1-CD2 3.42Å; T842-F845 WeakPolarHBondContact OG1-CE2 3.35Å
843	R	24.1	Very low	35.7	Very low	187 Å²	187	66.1 Å²	66.1	71%	0.706	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	3.9	179.9	-102.8	176	169.9	161.1	-1.1	117.7	D837 L841	D837-R843 IonicContact OD2-CZ 3.5Å; D837-R843 IonicContact OD2-NE 2.82Å; D837-R843 IonicContact OD2-NH2 2.86Å; D837-R843 PolarHBondContact OD2-NH2 3.34Å; L841-R843 PolarHBondContact O-N 3.06Å
844	N	25.3	Very low	34.1	Very low	114 Å²	114	65 Å²	65	61%	0.61	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121	9.6	-170.9	-73	-11	0	0	0	114.8	T842	T842-N844 PolarHBondContact O-N 3.43Å
845	F	29.2	Very low	32.4	Very low	42 Å²	42	62.7 Å²	62.7	18%	0.184	33%	0.329	C	S	.	.			trans	-93	121.9	-170.5	-83.2	-94.4	0	0	0	116.2	F234 E235 R831 T842 W847	F234-F845 HydrophobicContact CB-CE1 4.34Å; F234-F845 HydrophobicContact CD1-CD1 4.33Å; F234-F845 AromaticContact CD1-CE1 3.92Å; F234-F845 HydrophobicContact CD1-CE1 3.92Å; F234-F845 HydrophobicContact CG-CE1 4.49Å; E235-F845 HydrophobicContact CG-CE1 4.04Å; E235-F845 VanDerWaalsContact OE1-CE1 3.23Å; E235-F845 WeakPolarHBondContact OE1-CE1 3.17Å; E235-F845 WeakPolarHBondContact OE1-CZ 3.26Å; E235-F845 VanDerWaalsContact OE2-CE1 3.3Å; E235-F845 WeakPolarHBondContact OE2-CE1 3.32Å; E235-F845 WeakPolarHBondContact OE2-CZ 3.47Å; R831-F845 PolarHBondContact NH2-O 3.32Å; T842-F845 HydrophobicContact CG2-CE2 4.16Å; T842-F845 WeakPolarHBondContact OG1-CD2 3.42Å; T842-F845 WeakPolarHBondContact OG1-CE2 3.35Å; F845-W847 VanDerWaalsContact C-N 3.34Å; F845-W847 VanDerWaalsContact CB-NE1 3.27Å; F845-W847 PolarHBondContact O-N 2.96Å
846	G	26.8	Very low	30.7	Very low	20 Å²	20	65 Å²	65	21%	0.206	33%	0.332	C	S	.	.			trans	-49.2	52.5	166	0	0	0	0	0	119.3	S848	G846-S848 PolarHBondContact O-N 3.31Å
847	W	30.6	Very low	29.3	Very low	60 Å²	60	67.7 Å²	67.7	23%	0.227	34%	0.338	C	S	.	.			trans	-85.4	74.1	-176.7	-64.2	93.9	0	0	0	112.8	F234 R831 A832 F845 S852 F854	F234-W847 HydrophobicContact CE1-CH2 4.11Å; F234-W847 HydrophobicContact CE1-CZ2 4.34Å; F234-W847 AromaticContact CE2-CH2 3.77Å; F234-W847 HydrophobicContact CE2-CH2 3.77Å; F234-W847 HydrophobicContact CE2-CZ2 4.45Å; F234-W847 AromaticContact CZ-CH2 3.47Å; F234-W847 HydrophobicContact CZ-CH2 3.47Å; F234-W847 VanDerWaalsContact CZ-CH2 3.47Å; F234-W847 HydrophobicContact CZ-CZ2 4.13Å; F234-W847 AromaticContact CZ-CZ3 3.92Å; F234-W847 HydrophobicContact CZ-CZ3 3.92Å; R831-W847 WeakPolarHBondContact CG-O 3.48Å; A832-W847 PolarHBondContact N-O 3.18Å; A832-W847 VanDerWaalsContact O-O 3.14Å; F845-W847 VanDerWaalsContact C-N 3.34Å; F845-W847 VanDerWaalsContact CB-NE1 3.27Å; F845-W847 PolarHBondContact O-N 2.96Å; W847-S852 WeakPolarHBondContact CZ3-OG 3.42Å; W847-F854 HydrophobicContact CB-CZ 4.29Å; W847-F854 AromaticContact CD2-CE1 3.97Å; W847-F854 HydrophobicContact CD2-CE1 3.97Å; W847-F854 AromaticContact CD2-CZ 3.49Å; W847-F854 HydrophobicContact CD2-CZ 3.49Å; W847-F854 VanDerWaalsContact CD2-CZ 3.49Å; W847-F854 AromaticContact CE2-CE1 3.85Å; W847-F854 AromaticContact CE2-CZ 3.89Å; W847-F854 HydrophobicContact CE3-CE1 4.26Å; W847-F854 HydrophobicContact CE3-CE2 4.46Å; W847-F854 AromaticContact CE3-CZ 3.66Å; W847-F854 HydrophobicContact CE3-CZ 3.66Å; W847-F854 HydrophobicContact CG-CE1 4.43Å; W847-F854 AromaticContact CG-CZ 3.78Å; W847-F854 HydrophobicContact CG-CZ 3.78Å; W847-F854 HydrophobicContact CH2-CE1 4.37Å; W847-F854 HydrophobicContact CZ2-CE1 4.08Å; W847-F854 HydrophobicContact CZ2-CZ 4.42Å; W847-F854 HydrophobicContact CZ3-CE1 4.45Å; W847-F854 HydrophobicContact CZ3-CZ 4.2Å
848	S	25.8	Very low	28.3	Very low	5 Å²	5	65.4 Å²	65.4	4%	0.035	33%	0.325	C	S	.	.	B	Isolated β-bridge	trans	-120.6	132.6	167.9	-176.6	0	0	0	0	112	E730 E830 G846	E730-S848 PolarHBondContact N-O 3.32Å; E730-S848 VanDerWaalsContact N-O 3.15Å; E830-S848 PolarHBondContact O-OG 3.34Å; E830-S848 VanDerWaalsContact O-OG 3.13Å; G846-S848 PolarHBondContact O-N 3.31Å
849	S	25.9	Very low	28	Very low	38 Å²	38	61.2 Å²	61.2	27%	0.266	30%	0.302	S	S	.	.	S	Bend	trans	64.6	135.6	-176.9	77.1	0	0	0	0	113.9	S729 E730	S729-S849 WeakPolarHBondContact CA-OG 3.48Å; S729-S849 PolarHBondContact N-O 3.38Å; S729-S849 PolarHBondContact N-OG 2.93Å; S729-S849 VanDerWaalsContact N-OG 3.11Å; E730-S849 PolarHBondContact N-OG 3.29Å
850	A	28	Very low	27.9	Very low	27 Å²	27	63.4 Å²	63.4	22%	0.223	31%	0.31	C	S	.	.	S	Bend	trans	85.3	83.8	175.1	0	0	0	0	0	113.9	R271 H728 S852	R271-A850 PolarHBondContact NH1-O 3.24Å; R271-A850 VanDerWaalsContact NH2-CA 3.32Å; R271-A850 VanDerWaalsContact NH2-CB 3.26Å; H728-A850 HydrophobicContact CB-CB 3.64Å; H728-A850 WeakPolarHBondContact CD2-CB 3.45Å; A850-S852 PolarHBondContact O-N 3.22Å
851	T	29	Very low	28	Very low	20 Å²	20	54.9 Å²	54.9	12%	0.123	28%	0.275	C	S	.	.			trans	26.7	71.4	133.8	-9.5	0	0	0	0	117.3	R271 P773 R774 M775	R271-T851 PolarHBondContact NH1-O 3.4Å; R271-T851 PolarHBondContact NH1-OG1 3.24Å; R271-T851 PolarHBondContact NH2-OG1 3.25Å; P773-T851 HydrophobicContact CB-CG2 4.31Å; P773-T851 HydrophobicContact CG-CG2 4.35Å; P773-T851 VanDerWaalsContact O-CB 3.29Å; P773-T851 WeakPolarHBondContact O-CB 3.48Å; P773-T851 VanDerWaalsContact O-CG2 3.26Å; P773-T851 WeakPolarHBondContact O-CG2 3.35Å; P773-T851 PolarHBondContact O-OG1 3.49Å; R774-T851 VanDerWaalsContact C-CG2 3.49Å; M775-T851 WeakPolarHBondContact O-CG2 3.46Å
852	S	29.9	Very low	28	Very low	14 Å²	14	54.6 Å²	54.6	10%	0.098	27%	0.273	C	S	.	.			trans	-96.8	121.7	165.5	39.8	0	0	0	0	109.1	W847 A850 F854	W847-S852 WeakPolarHBondContact CZ3-OG 3.42Å; A850-S852 PolarHBondContact O-N 3.22Å; S852-F854 WeakPolarHBondContact O-CD2 3.34Å; S852-F854 PolarHBondContact O-N 2.88Å; S852-F854 VanDerWaalsContact O-N 3.15Å; S852-F854 WeakPolarHBondContact OG-CE2 3.2Å; S852-F854 VanDerWaalsContact OG-CZ 3.3Å; S852-F854 WeakPolarHBondContact OG-CZ 3.34Å
853	V	34.1	Very low	28	Very low	25 Å²	25	51.9 Å²	51.9	15%	0.152	25%	0.252	C	S	.	.			trans	-65.6	102.9	160.9	173.2	0	0	0	0	106.3	F267 I777 F779 I855	F267-V853 HydrophobicContact CD1-CB 3.72Å; F267-V853 HydrophobicContact CD1-CG1 4.39Å; F267-V853 HydrophobicContact CD1-CG2 4Å; F267-V853 HydrophobicContact CD2-CB 3.89Å; F267-V853 HydrophobicContact CD2-CG1 4.25Å; F267-V853 WeakPolarHBondContact CD2-O 3.48Å; F267-V853 HydrophobicContact CE1-CB 3.51Å; F267-V853 HydrophobicContact CE1-CG1 3.71Å; F267-V853 HydrophobicContact CE1-CG2 3.77Å; F267-V853 HydrophobicContact CE2-CB 3.69Å; F267-V853 HydrophobicContact CE2-CG1 3.55Å; F267-V853 HydrophobicContact CG-CB 3.93Å; F267-V853 HydrophobicContact CZ-CB 3.51Å; F267-V853 HydrophobicContact CZ-CG1 3.24Å; F267-V853 HydrophobicContact CZ-CG2 4.21Å; I777-V853 WeakPolarHBondContact O-CA 3.19Å; F779-V853 HydrophobicContact CD2-CG1 3.34Å; F779-V853 HydrophobicContact CE2-CB 4.44Å; F779-V853 HydrophobicContact CE2-CG1 3.48Å; F779-V853 VanDerWaalsContact CE2-CG1 3.48Å; F779-V853 HydrophobicContact CE2-CG2 4.26Å; V853-I855 HydrophobicContact CG1-CG1 4.22Å; V853-I855 PolarHBondContact O-N 3.41Å
854	F	30.3	Very low	28.3	Very low	24 Å²	24	42.2 Å²	42.2	11%	0.105	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	100.8	179.7	-82.2	-78.3	0	0	0	108.7	L776 I777 T778 F779 W847 S852	L776-F854 HydrophobicContact CD1-CD2 4.29Å; L776-F854 HydrophobicContact CD1-CE2 3.96Å; L776-F854 HydrophobicContact CD2-CD2 4.26Å; L776-F854 HydrophobicContact CG-CD2 4.24Å; L776-F854 HydrophobicContact CG-CE2 4.39Å; I777-F854 PolarHBondContact O-N 3.03Å; T778-F854 CarbonylContact C-O 3.22Å; T778-F854 VanDerWaalsContact CA-O 3.31Å; T778-F854 WeakPolarHBondContact CA-O 3.31Å; T778-F854 HydrophobicContact CG2-CB 3.77Å; F779-F854 PolarHBondContact N-O 3.26Å; W847-F854 HydrophobicContact CB-CZ 4.29Å; W847-F854 AromaticContact CD2-CE1 3.97Å; W847-F854 HydrophobicContact CD2-CE1 3.97Å; W847-F854 AromaticContact CD2-CZ 3.49Å; W847-F854 HydrophobicContact CD2-CZ 3.49Å; W847-F854 VanDerWaalsContact CD2-CZ 3.49Å; W847-F854 AromaticContact CE2-CE1 3.85Å; W847-F854 AromaticContact CE2-CZ 3.89Å; W847-F854 HydrophobicContact CE3-CE1 4.26Å; W847-F854 HydrophobicContact CE3-CE2 4.46Å; W847-F854 AromaticContact CE3-CZ 3.66Å; W847-F854 HydrophobicContact CE3-CZ 3.66Å; W847-F854 HydrophobicContact CG-CE1 4.43Å; W847-F854 AromaticContact CG-CZ 3.78Å; W847-F854 HydrophobicContact CG-CZ 3.78Å; W847-F854 HydrophobicContact CH2-CE1 4.37Å; W847-F854 HydrophobicContact CZ2-CE1 4.08Å; W847-F854 HydrophobicContact CZ2-CZ 4.42Å; W847-F854 HydrophobicContact CZ3-CE1 4.45Å; W847-F854 HydrophobicContact CZ3-CZ 4.2Å; S852-F854 WeakPolarHBondContact O-CD2 3.34Å; S852-F854 PolarHBondContact O-N 2.88Å; S852-F854 VanDerWaalsContact O-N 3.15Å; S852-F854 WeakPolarHBondContact OG-CE2 3.2Å; S852-F854 VanDerWaalsContact OG-CZ 3.3Å; S852-F854 WeakPolarHBondContact OG-CZ 3.34Å
855	I	29.5	Very low	28.5	Very low	10 Å²	10	36.7 Å²	36.7	5%	0.051	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	116.2	168.9	-60.8	177.1	0	0	0	108	K263 F267 F779 L789 V853 F857	K263-I855 HydrophobicContact CB-CD1 4.3Å; K263-I855 HydrophobicContact CD-CD1 3.67Å; K263-I855 HydrophobicContact CD-CG2 4.44Å; F267-I855 HydrophobicContact CE2-CD1 3.59Å; F267-I855 HydrophobicContact CE2-CG1 3.99Å; F267-I855 HydrophobicContact CZ-CD1 3.97Å; F779-I855 HydrophobicContact CB-CG1 4.44Å; F779-I855 CarbonylContact O-C 3.43Å; F779-I855 WeakPolarHBondContact O-CA 3.44Å; L789-I855 HydrophobicContact CD1-CD1 4.46Å; L789-I855 HydrophobicContact CD2-CD1 3.94Å; L789-I855 HydrophobicContact CD2-CG1 4.2Å; V853-I855 HydrophobicContact CG1-CG1 4.22Å; V853-I855 PolarHBondContact O-N 3.41Å; I855-F857 HydrophobicContact CG2-CD2 4.23Å; I855-F857 HydrophobicContact CG2-CE2 3.98Å
856	R	26	Very low	28.5	Very low	76 Å²	76	36.3 Å²	36.3	29%	0.287	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	122.1	169.4	-154.7	-179.9	-176.5	162.7	8.7	107.2	F779 V780 C839	F779-R856 PolarHBondContact O-N 3.36Å; V780-R856 HydrophobicContact CG2-CB 4.29Å; C839-R856 PolarHBondContact SG-NE 3.02Å; C839-R856 PolarHBondContact SG-NH2 2.78Å
857	F	26	Very low	28.6	Very low	116 Å²	116	37.7 Å²	37.7	51%	0.509	19%	0.189	S	C	.	.			trans	-78.8	0	170.8	-74.8	-108.7	0	0	0	110.4	I259 V260 K263 I855	I259-F857 HydrophobicContact CB-CE1 3.88Å; I259-F857 HydrophobicContact CB-CZ 3.87Å; I259-F857 HydrophobicContact CG2-CE1 3.74Å; I259-F857 HydrophobicContact CG2-CZ 3.6Å; V260-F857 HydrophobicContact CB-CD2 3.68Å; V260-F857 HydrophobicContact CB-CE2 3.58Å; V260-F857 HydrophobicContact CB-CZ 4.3Å; V260-F857 HydrophobicContact CG1-CD2 3.57Å; V260-F857 HydrophobicContact CG1-CE2 3.68Å; V260-F857 HydrophobicContact CG2-CB 4.16Å; V260-F857 HydrophobicContact CG2-CD1 4.12Å; V260-F857 HydrophobicContact CG2-CD2 3.14Å; V260-F857 HydrophobicContact CG2-CE1 4.3Å; V260-F857 HydrophobicContact CG2-CE2 3.41Å; V260-F857 VanDerWaalsContact CG2-CE2 3.41Å; V260-F857 HydrophobicContact CG2-CG 3.53Å; V260-F857 HydrophobicContact CG2-CZ 3.95Å; K263-F857 HydrophobicContact CD-CE2 4.22Å; K263-F857 HydrophobicContact CD-CZ 3.84Å; I855-F857 HydrophobicContact CG2-CD2 4.23Å; I855-F857 HydrophobicContact CG2-CE2 3.98Å

Retrieved 857 of 857 residues in 757.5 ms (Link to these results)

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