A0A5K4F402_SCHMA Loading...

RING-type E3 ubiquitin transferase

AlphaFold DB , UniProt , Accession A0A5K4F402, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,113 aa.

						>A0A5K4F402_SCHMA|A0A5K4F402
MTGNSNDKVSPDPKSVFFVPVNTTCANFCRVCRCEGTVSKPLFHPCLCTGSIKYIHQDCLVRWLEYSKRNTCELCNHRFAFTRIYASGTPRFLPLTVLAVGLANSLRRFVLNWIHLSIVFTAWLVVVPLSACRMYRCLFTGSVFSLLTLPLDMVSTKHLLQDCVQGFIIVILALAAFLGYVSLREQLLQGTPAWLERDVHAEARGADPPRPAAGANGRRPLFPDIFNIFGVANGGGLGAAVFGEGNEDPVEPELLNNDEQPHQTVQQELVNPEHIRCYSLNQQQPVINSGISESLESSHESADTVNRGSSYNPQQLAWYMENTGANLDGDIPDEDGRANNDPADADGAPEAMNWKHLLGLDGSLNFLEHVLWLIALNTLFIVIFAFCPYHMGQFTVLGFNLERFINATHMEGFSTSLIGYIIFAFALILMHEIFTILNMPRACYWTGLGYIYIKVALLSLMELGIFPILSGFWIDACTLSLFNATLTQRASVFHYAPVAFTFIHWAIGMLYIFYMASLLVLGRSVLRPGVLRFIYHFNDPDYKPIQDMILQPLPLYIQRLIAIYSVWGILIVLMLWLPTEVIRHFFPNFLPFRISAAYESPLDYSLEMILLQVVLPFLLDNQAKTSLRQIVRWWCLCVSWLLGLRSYLLGDIPFSPGDFIVTENGTEVPYKQRRNTHAQTSNLNSHSGSMSIESSQRILPNELDDISTDLYAPNLSSSSSSYGQITSINNPFREQSQLEHNEQNNDNHANADYDNDDDTDFTRYIPYKRGNFFKLRITGLILILITSLICLSLTVLILPVGIGRLLLLKLSGTGSTSKHDVIALVGGFTVLGIILRLAPCIPHLFSGIPRIVMLIGQSGSLISWSRPLRVFRIWTRLGTTCEITIRRPALPMAPMIDLNRRYGFQSTVHTNIGIYLQNYLRIIINWLRLFCIAVICLGILPTALGLLINFIFIVPFRIGPKKTIIIGFWEHWIFGIMHLKVVILLTLLGPPWWLRNRLELFHEEITHHRQDARCMRLLWAIAPLLVTIGLSLSVPYLLAYYISPLIASDSEVAFRYIYPFLFALFICSVLLTLCIDQIRRLYLHIKDEKYLVGKQLLNFRPSSPSQSLVPTSS
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.4	Very low	31.8	Very low	250 Å²	250	149.2 Å²	149.2	100%	1.232	87%	0.867	S	S	*	*				0	120.3	0	-76.1	174.2	173	0	0	107.7
2	T	29.9	Very low	31.7	Very low	150 Å²	150	148.6 Å²	148.6	92%	0.92	86%	0.858	S	S	*	*			trans	-81.6	144.6	-176.8	41.8	0	0	0	0	112.2
3	G	30.8	Very low	32.1	Very low	72 Å²	72	146.8 Å²	146.8	74%	0.742	86%	0.855	S	S	*	*			trans	119.1	117.3	139.2	0	0	0	0	0	119.1
4	N	29.3	Very low	32	Very low	171 Å²	171	150.1 Å²	150.1	91%	0.914	85%	0.853	S	S	*	*			trans	80.9	105.5	152.4	-70.9	-0.6	0	0	0	121.3
5	S	33.5	Very low	32.2	Very low	118 Å²	118	145.8 Å²	145.8	83%	0.825	84%	0.836	S	S	*	*			trans	-146.5	108.4	146	51.1	0	0	0	0	112.2
6	N	32.9	Very low	32.6	Very low	163 Å²	163	144.1 Å²	144.1	87%	0.872	83%	0.829	S	S	*	*			trans	40.1	123.5	143.2	-66.8	-9	0	0	0	124.2
7	D	30	Very low	32.7	Very low	144 Å²	144	145.8 Å²	145.8	77%	0.77	83%	0.825	S	S	*	*			trans	-51.8	140.3	163.6	-61.9	-59.4	0	0	0	116.6
8	K	31.3	Very low	32.9	Very low	212 Å²	212	147 Å²	147	92%	0.922	82%	0.82	S	S	*	*			trans	-136.4	89.7	150.5	-82.3	-174.8	178.1	175.7	0	108.5
9	V	32.4	Very low	33.2	Very low	134 Å²	134	146 Å²	146	81%	0.812	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-86	122.8	171.4	178.3	0	0	0	0	108.8
10	S	30.8	Very low	33.3	Very low	98 Å²	98	144.1 Å²	144.1	69%	0.685	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-95.5	145.8	170.8	40.7	0	0	0	0	109.4
11	P	33.4	Very low	33.4	Very low	129 Å²	129	143.9 Å²	143.9	84%	0.838	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-84.2	125.8	-167.6	30.7	-32.1	0	0	0	112.9
12	D	30.9	Very low	33.2	Very low	142 Å²	142	139 Å²	139	76%	0.759	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-75.2	133.7	173.2	-101.3	-33.1	0	0	0	112.2	K14	D12-K14 VanDerWaalsContact C-N 3.27Å; D12-K14 PolarHBondContact O-N 2.92Å; D12-K14 VanDerWaalsContact O-N 3.15Å
13	P	36.9	Very low	33.8	Very low	126 Å²	126	138.4 Å²	138.4	82%	0.818	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	28.7	-177.6	33.4	-34.4	0	0	0	114.8
14	K	30.9	Very low	34.3	Very low	193 Å²	193	141.2 Å²	141.2	84%	0.839	79%	0.792	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.4	13.9	-177.4	-79.5	-170.5	178.5	-179.8	0	116	D12 V16	D12-K14 VanDerWaalsContact C-N 3.27Å; D12-K14 PolarHBondContact O-N 2.92Å; D12-K14 VanDerWaalsContact O-N 3.15Å; K14-V16 PolarHBondContact O-N 2.7Å
15	S	34.2	Very low	35.5	Very low	85 Å²	85	138.9 Å²	138.9	59%	0.594	79%	0.787	S	S	*	*			trans	-80.6	91.7	173.1	54.3	0	0	0	0	111.6	F17	S15-F17 PolarHBondContact O-N 2.89Å; S15-F17 VanDerWaalsContact O-N 3.08Å
16	V	39.1	Very low	37.3	Very low	118 Å²	118	136.7 Å²	136.7	72%	0.715	78%	0.776	S	S	*	*			trans	-56.6	107.3	148.2	176.8	0	0	0	0	105.4	K14 F18	K14-V16 PolarHBondContact O-N 2.7Å; V16-F18 PolarHBondContact O-N 3.33Å
17	F	34.9	Very low	39.7	Very low	174 Å²	174	132.5 Å²	132.5	76%	0.763	75%	0.754	S	S	*	*			trans	-65.8	102.2	176.2	-93.6	-90.7	0	0	0	108.5	S15 V19	S15-F17 PolarHBondContact O-N 2.89Å; S15-F17 VanDerWaalsContact O-N 3.08Å; F17-V19 PolarHBondContact O-N 3.33Å
18	F	36.3	Very low	42.5	Very low	167 Å²	167	128.9 Å²	128.9	73%	0.732	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-62.3	116.9	160.5	-77.7	-91.5	0	0	0	107.4	V16 P20	V16-F18 PolarHBondContact O-N 3.33Å; F18-P20 WeakPolarHBondContact O-CD 3.26Å
19	V	38.8	Very low	45.4	Very low	128 Å²	128	118.8 Å²	118.8	78%	0.776	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-70.2	120.1	170.1	179.2	0	0	0	0	106.8	F17 V21	F17-V19 PolarHBondContact O-N 3.33Å; V19-V21 PolarHBondContact O-N 3.24Å
20	P	34.6	Very low	48.2	Very low	108 Å²	108	115 Å²	115	70%	0.701	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-63.6	133.8	179.4	23.6	-30.3	0	0	0	110.3	F18 N22	F18-P20 WeakPolarHBondContact O-CD 3.26Å; P20-N22 PolarHBondContact O-N 3.43Å
21	V	34.6	Very low	51	Low	140 Å²	140	113.4 Å²	113.4	85%	0.848	64%	0.644	S	S	*	*			trans	-70.8	87.2	-175	-177.2	0	0	0	0	109.5	V19	V19-V21 PolarHBondContact O-N 3.24Å
22	N	32.3	Very low	53.8	Low	147 Å²	147	109.8 Å²	109.8	79%	0.786	62%	0.622	S	S	*	*			trans	-89.3	120.9	158	-85.1	-4.7	0	0	0	108	P20 T24	P20-N22 PolarHBondContact O-N 3.43Å; N22-T24 PolarHBondContact O-N 2.91Å
23	T	41.1	Very low	56.5	Low	138 Å²	138	111 Å²	111	85%	0.847	62%	0.616	S	S	*	*	S	Bend	trans	-47.8	101.2	177.9	21.2	0	0	0	0	112.7
24	T	43.3	Very low	59	Low	131 Å²	131	108.3 Å²	108.3	80%	0.804	60%	0.599	S	S	*	*	S	Bend	trans	-174.3	109.2	148.3	26.2	0	0	0	0	108.5	N22	N22-T24 PolarHBondContact O-N 2.91Å
25	C	54.2	Low	61.7	Low	122 Å²	122	105.1 Å²	105.1	82%	0.824	59%	0.587	S	S	*	*			trans	50.3	100.5	177	-60.5	0	0	0	0	116.7	N27	C25-N27 PolarHBondContact O-N 3.42Å
26	A	70.5	Confident	64.1	Low	72 Å²	72	102.7 Å²	102.7	60%	0.595	58%	0.576	S	S	*	*			trans	-53.8	132.1	168.4	0	0	0	0	0	110.9	F28	A26-F28 PolarHBondContact O-N 2.93Å
27	N	83.9	Confident	66.3	Low	74 Å²	74	100.2 Å²	100.2	40%	0.396	56%	0.561	S	S	.	*			trans	-65.6	133	176.8	-66.9	-53.9	0	0	0	109.6	C25 L42 Y54	C25-N27 PolarHBondContact O-N 3.42Å; N27-L42 HydrophobicContact CB-CD1 4.25Å; N27-L42 WeakPolarHBondContact O-CD1 3.49Å; N27-Y54 HydrophobicContact CB-CD1 4.45Å; N27-Y54 HydrophobicContact CB-CD2 3.91Å; N27-Y54 HydrophobicContact CB-CE1 4.45Å; N27-Y54 HydrophobicContact CB-CE2 3.93Å; N27-Y54 HydrophobicContact CB-CG 4.19Å; N27-Y54 WeakPolarHBondContact OD1-CE2 3.13Å
28	F	89.2	Confident	68.5	Low	69 Å²	69	98.5 Å²	98.5	30%	0.303	56%	0.564	S	S	.	*	B	Isolated β-bridge	trans	-116.4	157.2	179.6	55.7	-97.5	0	0	0	111.6	A26 C34	A26-F28 PolarHBondContact O-N 2.93Å; F28-C34 CarbonylContact C-O 3.6Å; F28-C34 WeakPolarHBondContact CA-O 3.46Å
29	C	92	Very high	70.6	Confident	0 Å²	0	95.5 Å²	95.5	0%	0	56%	0.564	C	S	.	*			trans	-70.5	134	178.2	174.1	0	0	0	0	111.6	V31 R33 C34 L42 H56	C29-V31 VanDerWaalsContact C-N 3.26Å; C29-V31 PolarHBondContact O-N 3.27Å; C29-V31 PolarHBondContact SG-N 3.41Å; C29-V31 VanDerWaalsContact SG-N 3.42Å; C29-R33 WeakPolarHBondContact O-CA 3.48Å; C29-R33 PolarHBondContact O-N 3.34Å; C29-C34 PolarHBondContact N-O 3.05Å; C29-L42 VanDerWaalsContact CA-CD2 3.42Å; C29-L42 HydrophobicContact CB-CD2 3.69Å; C29-L42 VanDerWaalsContact N-CD2 3.31Å; C29-H56 WeakPolarHBondContact CB-CE1 3.33Å; C29-H56 VanDerWaalsContact CB-ND1 3.31Å; C29-H56 WeakPolarHBondContact CB-ND1 3.21Å; C29-H56 PolarHBondContact SG-N 3.08Å; C29-H56 VanDerWaalsContact SG-N 3.39Å; C29-H56 PolarHBondContact SG-ND1 3.16Å; C29-H56 VanDerWaalsContact SG-ND1 3.41Å
30	R	89.5	Confident	72.9	Confident	55 Å²	55	94.7 Å²	94.7	21%	0.208	55%	0.55	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51	-42.2	175	174.6	-178.6	-172.2	-163	-1.8	113.8	R33 I52 Y54 E73	R30-R33 PolarHBondContact O-NE 2.87Å; R30-I52 HydrophobicContact CG-CG1 3.8Å; R30-I52 VanDerWaalsContact NE-CG1 3.28Å; R30-Y54 WeakPolarHBondContact CB-O 3.38Å; R30-Y54 PolarHBondContact N-O 3.22Å; R30-E73 IonicContact CZ-OE1 3.14Å; R30-E73 IonicContact NH1-OE1 3.08Å; R30-E73 PolarHBondContact NH1-OE1 2.97Å; R30-E73 VanDerWaalsContact NH1-OE1 3.08Å; R30-E73 IonicContact NH2-OE1 2.58Å; R30-E73 PolarHBondContact NH2-OE1 3.27Å
31	V	90.2	Very high	75.4	Confident	63 Å²	63	92.7 Å²	92.7	38%	0.382	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-61.7	-171.3	179.5	0	0	0	0	110.6	C29 I55 C59	C29-V31 VanDerWaalsContact C-N 3.26Å; C29-V31 PolarHBondContact O-N 3.27Å; C29-V31 PolarHBondContact SG-N 3.41Å; C29-V31 VanDerWaalsContact SG-N 3.42Å; V31-I55 HydrophobicContact CG2-CD1 3.57Å; V31-I55 HydrophobicContact CG2-CG1 4.09Å; V31-C59 HydrophobicContact CB-CB 3.89Å; V31-C59 HydrophobicContact CG1-CB 4.18Å; V31-C59 HydrophobicContact CG2-CB 4.23Å
32	C	91.8	Very high	78	Confident	54 Å²	54	87.8 Å²	87.8	37%	0.365	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-4.2	-174.4	75.8	0	0	0	0	114.9	C34 H56	C32-C34 PolarHBondContact O-N 3.37Å; C32-C34 PolarHBondContact O-SG 3.21Å; C32-C34 VanDerWaalsContact O-SG 3.41Å; C32-H56 PolarHBondContact SG-CE1 3.35Å; C32-H56 PolarHBondContact SG-ND1 2.84Å
33	R	88.9	Confident	80.7	Confident	167 Å²	167	81.8 Å²	81.8	63%	0.63	47%	0.473	S	S	*	.			trans	58.4	11.6	179.9	-52.3	-63.9	178.6	161.8	0.5	116.2	C29 R30	C29-R33 WeakPolarHBondContact O-CA 3.48Å; C29-R33 PolarHBondContact O-N 3.34Å; R30-R33 PolarHBondContact O-NE 2.87Å
34	C	88.7	Confident	83.1	Confident	70 Å²	70	78.2 Å²	78.2	47%	0.473	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-83.7	152.1	172.8	-50.2	0	0	0	0	111.7	F28 C29 C32	F28-C34 CarbonylContact C-O 3.6Å; F28-C34 WeakPolarHBondContact CA-O 3.46Å; C29-C34 PolarHBondContact N-O 3.05Å; C32-C34 PolarHBondContact O-N 3.37Å; C32-C34 PolarHBondContact O-SG 3.21Å; C32-C34 VanDerWaalsContact O-SG 3.41Å
35	E	88.2	Confident	85.2	Confident	126 Å²	126	72.1 Å²	72.1	59%	0.589	41%	0.409	S	S	*	.	B	Isolated β-bridge	trans	-67.1	157.1	167.8	63.4	178.9	178.5	0	0	111.8	T37	E35-T37 PolarHBondContact O-N 3.34Å
36	G	84.5	Confident	86.8	Confident	34 Å²	34	66.8 Å²	66.8	35%	0.351	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-78	122.2	178.2	0	0	0	0	0	110.2	K40 L42	G36-K40 WeakPolarHBondContact CA-O 3.39Å; G36-L42 VanDerWaalsContact CA-CD1 3.43Å
37	T	84	Confident	87.6	Confident	66 Å²	66	67.8 Å²	67.8	41%	0.405	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-95.6	166.1	174.8	53.2	0	0	0	0	110.3	E35 S39 K40	E35-T37 PolarHBondContact O-N 3.34Å; T37-S39 PolarHBondContact O-N 2.67Å; T37-S39 PolarHBondContact OG1-OG 3.05Å; T37-K40 PolarHBondContact N-O 3.3Å; T37-K40 CarbonylContact O-C 3.04Å; T37-K40 PolarHBondContact O-N 3.4Å; T37-K40 VanDerWaalsContact O-N 3.16Å; T37-K40 PolarHBondContact OG1-N 3.08Å; T37-K40 VanDerWaalsContact OG1-N 3.11Å
38	V	81.9	Confident	87.8	Confident	138 Å²	138	65.2 Å²	65.2	84%	0.836	36%	0.355	S	S	*	.	S	Bend	trans	-59.3	-32.6	175.1	-177.9	0	0	0	0	111.3
39	S	81.4	Confident	87.7	Confident	103 Å²	103	67.9 Å²	67.9	72%	0.72	38%	0.377	S	S	*	.	S	Bend	trans	-79.4	-33.3	175.8	55	0	0	0	0	113.4	T37	T37-S39 PolarHBondContact O-N 2.67Å; T37-S39 PolarHBondContact OG1-OG 3.05Å
40	K	85.3	Confident	87.5	Confident	112 Å²	112	70.2 Å²	70.2	49%	0.487	40%	0.402	S	S	.	.	S	Bend	trans	-126.4	81.5	177.3	-66	-175.9	176.7	-178.6	0	110.6	G36 T37 H56	G36-K40 WeakPolarHBondContact CA-O 3.39Å; T37-K40 PolarHBondContact N-O 3.3Å; T37-K40 CarbonylContact O-C 3.04Å; T37-K40 PolarHBondContact O-N 3.4Å; T37-K40 VanDerWaalsContact O-N 3.16Å; T37-K40 PolarHBondContact OG1-N 3.08Å; T37-K40 VanDerWaalsContact OG1-N 3.11Å; K40-H56 PolarHBondContact O-CD2 3.46Å; K40-H56 PolarHBondContact O-NE2 3.11Å
41	P	88.3	Confident	87.2	Confident	65 Å²	65	70.3 Å²	70.3	42%	0.422	41%	0.41	S	S	.	.			trans	-72.9	156.2	179.4	29.3	-34.3	0	0	0	111.8	F43	P41-F43 HydrophobicContact CG-CE2 3.95Å; P41-F43 HydrophobicContact CG-CZ 4.28Å; P41-F43 WeakPolarHBondContact O-CD2 3.39Å
42	L	88.3	Confident	87.1	Confident	37 Å²	37	70.3 Å²	70.3	19%	0.194	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	132.7	175.1	-69.5	144.6	0	0	0	110.9	N27 C29 G36 Y54	N27-L42 HydrophobicContact CB-CD1 4.25Å; N27-L42 WeakPolarHBondContact O-CD1 3.49Å; C29-L42 VanDerWaalsContact CA-CD2 3.42Å; C29-L42 HydrophobicContact CB-CD2 3.69Å; C29-L42 VanDerWaalsContact N-CD2 3.31Å; G36-L42 VanDerWaalsContact CA-CD1 3.43Å; L42-Y54 HydrophobicContact CB-CD1 4.24Å
43	F	90.4	Very high	87	Confident	22 Å²	22	70.8 Å²	70.8	10%	0.096	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	152.7	174.9	-68.8	-95.6	0	0	0	110.9	P41 P45 Y54 I55 Q57 Q1095 L1096 N1098	P41-F43 HydrophobicContact CG-CE2 3.95Å; P41-F43 HydrophobicContact CG-CZ 4.28Å; P41-F43 WeakPolarHBondContact O-CD2 3.39Å; F43-P45 WeakPolarHBondContact O-CD 3.42Å; F43-Y54 CarbonylContact O-C 3.57Å; F43-Y54 VanDerWaalsContact O-CA 3.29Å; F43-Y54 WeakPolarHBondContact O-CA 3.38Å; F43-I55 PolarHBondContact N-O 3.27Å; F43-I55 PolarHBondContact O-N 3.15Å; F43-Q57 HydrophobicContact CD2-CB 4.1Å; F43-Q57 HydrophobicContact CE2-CB 3.93Å; F43-Q1095 HydrophobicContact CZ-CG 4.48Å; F43-L1096 HydrophobicContact CB-CD2 3.69Å; F43-L1096 HydrophobicContact CB-CG 4.31Å; F43-L1096 HydrophobicContact CD1-CB 4.33Å; F43-L1096 VanDerWaalsContact CD1-O 3.3Å; F43-L1096 WeakPolarHBondContact CD1-O 3.31Å; F43-L1096 WeakPolarHBondContact CE1-O 3.4Å; F43-L1096 HydrophobicContact CG-CB 4.42Å; F43-L1096 HydrophobicContact CG-CD2 4.08Å; F43-L1096 HydrophobicContact CG-CG 4.44Å; F43-N1098 WeakPolarHBondContact CA-OD1 3.11Å; F43-N1098 VanDerWaalsContact CB-OD1 3.26Å; F43-N1098 WeakPolarHBondContact CB-OD1 3.13Å; F43-N1098 VanDerWaalsContact CD1-OD1 3.3Å; F43-N1098 WeakPolarHBondContact CD1-OD1 3.49Å
44	H	89.6	Confident	87.1	Confident	62 Å²	62	65 Å²	65	29%	0.287	38%	0.382	S	S	.	.			trans	-117.3	75.9	172.5	64.2	90.9	0	0	0	111.7	C46 K53 N1098 F1099	H44-C46 PolarHBondContact O-N 2.85Å; H44-K53 VanDerWaalsContact CA-O 3.32Å; H44-K53 WeakPolarHBondContact CA-O 3.27Å; H44-K53 HydrophobicContact CB-CG 4.19Å; H44-N1098 VanDerWaalsContact CD2-CG 3.42Å; H44-N1098 PolarHBondContact CD2-ND2 3.47Å; H44-N1098 PolarHBondContact N-OD1 3.16Å; H44-N1098 WeakPolarHBondContact NE2-CB 3.41Å; H44-N1098 PolarHBondContact NE2-ND2 3.25Å; H44-F1099 PolarHBondContact CE1-O 2.93Å; H44-F1099 PolarHBondContact ND1-O 3.35Å; H44-F1099 WeakPolarHBondContact O-CB 3.44Å; H44-F1099 PolarHBondContact O-N 3.41Å
45	P	87.4	Confident	87.2	Confident	3 Å²	3	62.1 Å²	62.1	2%	0.019	36%	0.362	C	S	.	.			trans	-86.5	-5	-167.7	38.9	-43.4	0	0	0	114.8	F43 I55 L60 F79 L1096	F43-P45 WeakPolarHBondContact O-CD 3.42Å; P45-I55 HydrophobicContact CG-CG2 3.74Å; P45-L60 HydrophobicContact CG-CD2 4.13Å; P45-F79 HydrophobicContact CB-CD1 3.81Å; P45-F79 HydrophobicContact CB-CE1 4.22Å; P45-F79 HydrophobicContact CG-CD1 3.88Å; P45-F79 HydrophobicContact CG-CE1 3.79Å; P45-L1096 HydrophobicContact CB-CD1 3.63Å; P45-L1096 HydrophobicContact CB-CD2 3.84Å; P45-L1096 HydrophobicContact CB-CG 3.82Å; P45-L1096 HydrophobicContact CG-CD1 4.42Å; P45-L1096 HydrophobicContact CG-CD2 3.92Å; P45-L1096 HydrophobicContact CG-CG 4.45Å
46	C	89.6	Confident	87.4	Confident	11 Å²	11	56.5 Å²	56.5	7%	0.074	34%	0.336	C	S	.	.	S	Bend	trans	-125.1	169.4	-175.3	66.2	0	0	0	0	112.6	H44 C48 C72 F79	H44-C46 PolarHBondContact O-N 2.85Å; C46-C48 PolarHBondContact O-N 3.29Å; C46-C48 VanDerWaalsContact SG-CB 3.59Å; C46-C72 HydrophobicContact CB-CB 3.84Å; C46-F79 HydrophobicContact CB-CE1 4Å
47	L	85.9	Confident	87.7	Confident	93 Å²	93	57 Å²	57	49%	0.487	33%	0.329	S	S	.	.	S	Bend	trans	-76.1	2.7	176.6	-76.2	168	0	0	0	114.4	C75 H77 F1099	L47-C75 HydrophobicContact CB-CB 4.13Å; L47-H77 HydrophobicContact CD1-CB 4.25Å; L47-H77 HydrophobicContact CG-CB 4.34Å; L47-F1099 HydrophobicContact CD2-CD1 4Å; L47-F1099 HydrophobicContact CD2-CD2 4.31Å; L47-F1099 HydrophobicContact CD2-CE1 3.35Å; L47-F1099 HydrophobicContact CD2-CE2 3.7Å; L47-F1099 HydrophobicContact CD2-CG 4.46Å; L47-F1099 HydrophobicContact CD2-CZ 3.19Å; L47-F1099 HydrophobicContact CG-CD2 4.48Å; L47-F1099 HydrophobicContact CG-CE1 4.4Å; L47-F1099 HydrophobicContact CG-CE2 4.15Å; L47-F1099 HydrophobicContact CG-CZ 4.13Å
48	C	89.7	Confident	88	Confident	19 Å²	19	57.2 Å²	57.2	13%	0.128	33%	0.328	C	S	.	.			trans	-65.8	146.5	-177	-60.9	0	0	0	0	111.2	C46 I52 K53 C72 C75	C46-C48 PolarHBondContact O-N 3.29Å; C46-C48 VanDerWaalsContact SG-CB 3.59Å; C48-I52 HydrophobicContact CB-CG2 3.77Å; C48-K53 HydrophobicContact CB-CB 4.41Å; C48-K53 VanDerWaalsContact O-CB 3.24Å; C48-K53 WeakPolarHBondContact O-CB 3.5Å; C48-C72 VanDerWaalsContact SG-SG 3.65Å; C48-C75 VanDerWaalsContact SG-SG 3.7Å
49	T	86.3	Confident	88.5	Confident	125 Å²	125	51.7 Å²	51.7	77%	0.767	30%	0.295	S	S	*	.			trans	-98.1	161.1	177.4	54.2	0	0	0	0	110.6	I52	T49-I52 WeakPolarHBondContact O-CG2 3.28Å
50	G	86.6	Confident	89	Confident	50 Å²	50	47 Å²	47	52%	0.515	26%	0.262	S	S	.	.	S	Bend	trans	79.4	-156.9	179.3	0	0	0	0	0	114.8	K53	G50-K53 VanDerWaalsContact O-CD 3.3Å; G50-K53 WeakPolarHBondContact O-CD 3.44Å; G50-K53 WeakPolarHBondContact O-CE 3.35Å; G50-K53 VanDerWaalsContact O-CG 3.24Å; G50-K53 WeakPolarHBondContact O-CG 3.28Å
51	S	83.8	Confident	89.2	Confident	56 Å²	56	43.9 Å²	43.9	39%	0.392	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-74.2	-23.9	-177.9	54.9	0	0	0	0	113.5	K53 Y54	S51-K53 PolarHBondContact O-N 3.3Å; S51-K53 VanDerWaalsContact O-N 3.16Å; S51-Y54 PolarHBondContact O-N 3.49Å
52	I	88.5	Confident	89.3	Confident	64 Å²	64	49.3 Å²	49.3	33%	0.328	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-67	-16.4	-178	-159.5	158.5	0	0	0	113.8	R30 C48 T49 Y54 L74	R30-I52 HydrophobicContact CG-CG1 3.8Å; R30-I52 VanDerWaalsContact NE-CG1 3.28Å; C48-I52 HydrophobicContact CB-CG2 3.77Å; T49-I52 WeakPolarHBondContact O-CG2 3.28Å; I52-Y54 VanDerWaalsContact C-N 3.26Å; I52-Y54 PolarHBondContact O-N 3.15Å; I52-L74 HydrophobicContact CD1-CD1 3.38Å; I52-L74 HydrophobicContact CG1-CD1 3.98Å
53	K	89.1	Confident	89.4	Confident	64 Å²	64	52.4 Å²	52.4	28%	0.278	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-69.7	-23.9	176.8	78.9	-169	173.7	178	0	112.7	H44 C48 G50 S51	H44-K53 VanDerWaalsContact CA-O 3.32Å; H44-K53 WeakPolarHBondContact CA-O 3.27Å; H44-K53 HydrophobicContact CB-CG 4.19Å; C48-K53 HydrophobicContact CB-CB 4.41Å; C48-K53 VanDerWaalsContact O-CB 3.24Å; C48-K53 WeakPolarHBondContact O-CB 3.5Å; G50-K53 VanDerWaalsContact O-CD 3.3Å; G50-K53 WeakPolarHBondContact O-CD 3.44Å; G50-K53 WeakPolarHBondContact O-CE 3.35Å; G50-K53 VanDerWaalsContact O-CG 3.24Å; G50-K53 WeakPolarHBondContact O-CG 3.28Å; S51-K53 PolarHBondContact O-N 3.3Å; S51-K53 VanDerWaalsContact O-N 3.16Å
54	Y	90.7	Very high	89.3	Confident	44 Å²	44	52.6 Å²	52.6	17%	0.173	28%	0.275	C	S	.	.			trans	-86.5	126.6	-175.6	-62.3	-75	0	0	0	111.6	N27 R30 L42 F43 S51 I52	N27-Y54 HydrophobicContact CB-CD1 4.45Å; N27-Y54 HydrophobicContact CB-CD2 3.91Å; N27-Y54 HydrophobicContact CB-CE1 4.45Å; N27-Y54 HydrophobicContact CB-CE2 3.93Å; N27-Y54 HydrophobicContact CB-CG 4.19Å; N27-Y54 WeakPolarHBondContact OD1-CE2 3.13Å; R30-Y54 WeakPolarHBondContact CB-O 3.38Å; R30-Y54 PolarHBondContact N-O 3.22Å; L42-Y54 HydrophobicContact CB-CD1 4.24Å; F43-Y54 CarbonylContact O-C 3.57Å; F43-Y54 VanDerWaalsContact O-CA 3.29Å; F43-Y54 WeakPolarHBondContact O-CA 3.38Å; S51-Y54 PolarHBondContact O-N 3.49Å; I52-Y54 VanDerWaalsContact C-N 3.26Å; I52-Y54 PolarHBondContact O-N 3.15Å
55	I	92.4	Very high	89.2	Confident	10 Å²	10	56 Å²	56	5%	0.051	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	143.6	179.2	-164.6	163	0	0	0	111	V31 F43 P45 C59 L60 L1096	V31-I55 HydrophobicContact CG2-CD1 3.57Å; V31-I55 HydrophobicContact CG2-CG1 4.09Å; F43-I55 PolarHBondContact N-O 3.27Å; F43-I55 PolarHBondContact O-N 3.15Å; P45-I55 HydrophobicContact CG-CG2 3.74Å; I55-C59 HydrophobicContact CG1-CB 4.14Å; I55-L60 HydrophobicContact CD1-CB 3.78Å; I55-L60 HydrophobicContact CD1-CD1 3.9Å; I55-L60 HydrophobicContact CD1-CG 4.42Å; I55-L60 HydrophobicContact CG1-CB 4.14Å; I55-L60 HydrophobicContact CG2-CB 4.23Å; I55-L1096 HydrophobicContact CG2-CD2 4.3Å
56	H	92.3	Very high	89.3	Confident	9 Å²	9	65.3 Å²	65.3	4%	0.042	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	146.1	167.4	-63.1	122.4	0	0	0	109.8	C29 C32 K40 D58 C59 L60	C29-H56 WeakPolarHBondContact CB-CE1 3.33Å; C29-H56 VanDerWaalsContact CB-ND1 3.31Å; C29-H56 WeakPolarHBondContact CB-ND1 3.21Å; C29-H56 PolarHBondContact SG-N 3.08Å; C29-H56 VanDerWaalsContact SG-N 3.39Å; C29-H56 PolarHBondContact SG-ND1 3.16Å; C29-H56 VanDerWaalsContact SG-ND1 3.41Å; C32-H56 PolarHBondContact SG-CE1 3.35Å; C32-H56 PolarHBondContact SG-ND1 2.84Å; K40-H56 PolarHBondContact O-CD2 3.46Å; K40-H56 PolarHBondContact O-NE2 3.11Å; H56-D58 VanDerWaalsContact C-N 3.33Å; H56-D58 PolarHBondContact O-N 2.98Å; H56-C59 HydrophobicContact CB-CB 4.02Å; H56-C59 PolarHBondContact O-N 3.4Å; H56-L60 PolarHBondContact O-N 3.05Å
57	Q	90.7	Very high	89.2	Confident	43 Å²	43	66.5 Å²	66.5	20%	0.201	34%	0.336	C	S	.	.	H	α-helix	trans	-54.7	-49.9	174.9	178.2	173.4	-48.2	0	0	111.6	F43 C59 L60 V61 K1094 Q1095 L1096	F43-Q57 HydrophobicContact CD2-CB 4.1Å; F43-Q57 HydrophobicContact CE2-CB 3.93Å; Q57-C59 VanDerWaalsContact C-N 3.33Å; Q57-C59 PolarHBondContact O-N 3.36Å; Q57-L60 PolarHBondContact O-N 3.35Å; Q57-L60 VanDerWaalsContact O-N 3.15Å; Q57-V61 HydrophobicContact CG-CG2 4.45Å; Q57-V61 WeakPolarHBondContact O-CG2 3.31Å; Q57-V61 PolarHBondContact O-N 3.06Å; Q57-K1094 PolarHBondContact NE2-O 3.03Å; Q57-Q1095 VanDerWaalsContact OE1-CG 3.29Å; Q57-L1096 HydrophobicContact CB-CB 4.44Å; Q57-L1096 HydrophobicContact CG-CB 4.09Å
58	D	90.1	Very high	89.2	Confident	71 Å²	71	70.2 Å²	70.2	38%	0.38	35%	0.348	S	S	.	.	H	α-helix	trans	-61.6	-40.7	-179.1	-53.9	-23.5	0	0	0	112.3	H56 L60 V61 R62	H56-D58 VanDerWaalsContact C-N 3.33Å; H56-D58 PolarHBondContact O-N 2.98Å; D58-L60 VanDerWaalsContact C-N 3.32Å; D58-L60 PolarHBondContact O-N 3.32Å; D58-V61 PolarHBondContact O-N 3.36Å; D58-R62 WeakPolarHBondContact O-CG 3.37Å; D58-R62 PolarHBondContact O-N 3.41Å; D58-R62 VanDerWaalsContact O-N 3.1Å
59	C	92.4	Very high	88.9	Confident	23 Å²	23	73.4 Å²	73.4	16%	0.155	36%	0.357	C	S	.	.	H	α-helix	trans	-64	-39	177.1	-68.2	0	0	0	0	111.7	V31 I55 H56 Q57 W63	V31-C59 HydrophobicContact CB-CB 3.89Å; V31-C59 HydrophobicContact CG1-CB 4.18Å; V31-C59 HydrophobicContact CG2-CB 4.23Å; I55-C59 HydrophobicContact CG1-CB 4.14Å; H56-C59 HydrophobicContact CB-CB 4.02Å; H56-C59 PolarHBondContact O-N 3.4Å; Q57-C59 VanDerWaalsContact C-N 3.33Å; Q57-C59 PolarHBondContact O-N 3.36Å; C59-W63 WeakPolarHBondContact O-CB 3.48Å; C59-W63 PolarHBondContact O-N 3.26Å; C59-W63 VanDerWaalsContact O-N 3.14Å
60	L	91.4	Very high	88.8	Confident	3 Å²	3	70.3 Å²	70.3	2%	0.016	34%	0.336	C	S	.	.	H	α-helix	trans	-68.3	-47.4	176.4	-178.2	66.4	0	0	0	110.8	P45 I55 H56 Q57 D58 R62 W63 L64 F79 F81 L1096	P45-L60 HydrophobicContact CG-CD2 4.13Å; I55-L60 HydrophobicContact CD1-CB 3.78Å; I55-L60 HydrophobicContact CD1-CD1 3.9Å; I55-L60 HydrophobicContact CD1-CG 4.42Å; I55-L60 HydrophobicContact CG1-CB 4.14Å; I55-L60 HydrophobicContact CG2-CB 4.23Å; H56-L60 PolarHBondContact O-N 3.05Å; Q57-L60 PolarHBondContact O-N 3.35Å; Q57-L60 VanDerWaalsContact O-N 3.15Å; D58-L60 VanDerWaalsContact C-N 3.32Å; D58-L60 PolarHBondContact O-N 3.32Å; L60-R62 PolarHBondContact O-N 3.47Å; L60-W63 CarbonylContact O-C 3.54Å; L60-W63 WeakPolarHBondContact O-CA 3.26Å; L60-W63 WeakPolarHBondContact O-CB 3.22Å; L60-W63 PolarHBondContact O-N 2.94Å; L60-L64 HydrophobicContact CD1-CD1 4.41Å; L60-L64 HydrophobicContact CD1-CD2 4.14Å; L60-L64 HydrophobicContact CD1-CG 4.13Å; L60-L64 HydrophobicContact CD2-CD1 4.39Å; L60-L64 HydrophobicContact CG-CD1 3.99Å; L60-L64 HydrophobicContact CG-CG 4.13Å; L60-L64 VanDerWaalsContact O-CG 3.31Å; L60-L64 WeakPolarHBondContact O-CG 3.31Å; L60-L64 PolarHBondContact O-N 2.89Å; L60-F79 HydrophobicContact CD1-CD2 4.24Å; L60-F79 HydrophobicContact CD1-CE1 4.1Å; L60-F79 HydrophobicContact CD1-CE2 3.81Å; L60-F79 HydrophobicContact CD1-CZ 3.7Å; L60-F79 HydrophobicContact CD2-CB 4.47Å; L60-F79 HydrophobicContact CD2-CD1 3.99Å; L60-F79 HydrophobicContact CD2-CD2 4.44Å; L60-F79 HydrophobicContact CD2-CE1 4.24Å; L60-F79 HydrophobicContact CD2-CG 4.05Å; L60-F81 HydrophobicContact CD2-CZ 4.21Å; L60-L1096 HydrophobicContact CB-CD2 4.42Å; L60-L1096 HydrophobicContact CD2-CD1 3.51Å; L60-L1096 HydrophobicContact CD2-CD2 3.45Å; L60-L1096 VanDerWaalsContact CD2-CD2 3.45Å; L60-L1096 HydrophobicContact CD2-CG 4.11Å
61	V	89.9	Confident	88.9	Confident	47 Å²	47	69.8 Å²	69.8	29%	0.285	32%	0.323	S	S	.	.	H	α-helix	trans	-57.4	-49	-177.6	172	0	0	0	0	110.8	Q57 D58 W63 L64 E65 F81	Q57-V61 HydrophobicContact CG-CG2 4.45Å; Q57-V61 WeakPolarHBondContact O-CG2 3.31Å; Q57-V61 PolarHBondContact O-N 3.06Å; D58-V61 PolarHBondContact O-N 3.36Å; V61-W63 VanDerWaalsContact C-N 3.28Å; V61-W63 PolarHBondContact O-N 3.48Å; V61-L64 PolarHBondContact O-N 3.4Å; V61-L64 VanDerWaalsContact O-N 3.12Å; V61-E65 VanDerWaalsContact CG1-OE1 3.3Å; V61-E65 WeakPolarHBondContact CG1-OE1 3.49Å; V61-E65 WeakPolarHBondContact O-CG 3.48Å; V61-E65 PolarHBondContact O-N 3.46Å; V61-F81 HydrophobicContact CG2-CE1 4.14Å
62	R	90.9	Very high	89.2	Confident	179 Å²	179	67.2 Å²	67.2	68%	0.675	31%	0.305	S	S	*	.	H	α-helix	trans	-60.4	-36.5	174.6	-69.1	178.7	-174.6	169.7	-0.8	113.1	D58 L60 E65 Y66	D58-R62 WeakPolarHBondContact O-CG 3.37Å; D58-R62 PolarHBondContact O-N 3.41Å; D58-R62 VanDerWaalsContact O-N 3.1Å; L60-R62 PolarHBondContact O-N 3.47Å; R62-E65 PolarHBondContact O-N 3.3Å; R62-Y66 PolarHBondContact O-N 2.76Å
63	W	90	Very high	89.1	Confident	102 Å²	102	67.9 Å²	67.9	39%	0.386	31%	0.307	S	S	.	.	H	α-helix	trans	-67	-39.1	175.8	-173.1	-95.2	0	0	0	112.3	C59 L60 V61 S67 E73	C59-W63 WeakPolarHBondContact O-CB 3.48Å; C59-W63 PolarHBondContact O-N 3.26Å; C59-W63 VanDerWaalsContact O-N 3.14Å; L60-W63 CarbonylContact O-C 3.54Å; L60-W63 WeakPolarHBondContact O-CA 3.26Å; L60-W63 WeakPolarHBondContact O-CB 3.22Å; L60-W63 PolarHBondContact O-N 2.94Å; V61-W63 VanDerWaalsContact C-N 3.28Å; V61-W63 PolarHBondContact O-N 3.48Å; W63-S67 WeakPolarHBondContact O-CB 3.45Å; W63-S67 PolarHBondContact O-N 3.5Å; W63-S67 PolarHBondContact O-OG 2.9Å; W63-E73 WeakPolarHBondContact CZ2-OE2 3.5Å; W63-E73 PolarHBondContact NE1-OE2 3.38Å
64	L	88.7	Confident	89.1	Confident	27 Å²	27	69.4 Å²	69.4	14%	0.141	32%	0.318	C	S	.	.	H	α-helix	trans	-68.9	-37.9	177	-61	174.9	0	0	0	111.4	L60 V61 K68 R69 F79 F81	L60-L64 HydrophobicContact CD1-CD1 4.41Å; L60-L64 HydrophobicContact CD1-CD2 4.14Å; L60-L64 HydrophobicContact CD1-CG 4.13Å; L60-L64 HydrophobicContact CD2-CD1 4.39Å; L60-L64 HydrophobicContact CG-CD1 3.99Å; L60-L64 HydrophobicContact CG-CG 4.13Å; L60-L64 VanDerWaalsContact O-CG 3.31Å; L60-L64 WeakPolarHBondContact O-CG 3.31Å; L60-L64 PolarHBondContact O-N 2.89Å; V61-L64 PolarHBondContact O-N 3.4Å; V61-L64 VanDerWaalsContact O-N 3.12Å; L64-K68 WeakPolarHBondContact O-CA 3.31Å; L64-K68 PolarHBondContact O-N 3.04Å; L64-R69 WeakPolarHBondContact CD2-O 3.48Å; L64-F79 HydrophobicContact CD1-CD2 4.22Å; L64-F79 HydrophobicContact CD2-CD2 3.53Å; L64-F79 HydrophobicContact CD2-CE2 3.6Å; L64-F79 HydrophobicContact CG-CD2 4.48Å; L64-F81 HydrophobicContact CD1-CE2 3.77Å; L64-F81 HydrophobicContact CD1-CZ 3.58Å
65	E	87.1	Confident	89	Confident	133 Å²	133	69.3 Å²	69.3	62%	0.621	32%	0.323	S	S	*	.	H	α-helix	trans	-60.8	-48.4	173.6	-73.5	164.1	-172.9	0	0	111.1	V61 R62	V61-E65 VanDerWaalsContact CG1-OE1 3.3Å; V61-E65 WeakPolarHBondContact CG1-OE1 3.49Å; V61-E65 WeakPolarHBondContact O-CG 3.48Å; V61-E65 PolarHBondContact O-N 3.46Å; R62-E65 PolarHBondContact O-N 3.3Å
66	Y	89.9	Confident	88.7	Confident	198 Å²	198	74.2 Å²	74.2	78%	0.776	35%	0.349	S	S	*	.	H	α-helix	trans	-69.4	-44.7	179.2	-175.3	-97.3	0	0	0	113.2	R62 K68	R62-Y66 PolarHBondContact O-N 2.76Å; Y66-K68 VanDerWaalsContact C-N 3.33Å; Y66-K68 PolarHBondContact O-N 3.09Å
67	S	86.7	Confident	88.4	Confident	36 Å²	36	76.2 Å²	76.2	25%	0.252	36%	0.358	S	S	.	.	H	α-helix	trans	-79.1	-15.4	-176	64.1	0	0	0	0	114.1	W63 R69	W63-S67 WeakPolarHBondContact O-CB 3.45Å; W63-S67 PolarHBondContact O-N 3.5Å; W63-S67 PolarHBondContact O-OG 2.9Å; S67-R69 PolarHBondContact O-N 2.88Å; S67-R69 VanDerWaalsContact O-N 3.09Å; S67-R69 PolarHBondContact OG-N 3.3Å
68	K	86.8	Confident	88.1	Confident	171 Å²	171	82.4 Å²	82.4	74%	0.743	38%	0.38	S	S	*	.			trans	52.7	23.7	-171.7	-58.3	-175.9	178.8	179.5	0	114	L64 Y66	L64-K68 WeakPolarHBondContact O-CA 3.31Å; L64-K68 PolarHBondContact O-N 3.04Å; Y66-K68 VanDerWaalsContact C-N 3.33Å; Y66-K68 PolarHBondContact O-N 3.09Å
69	R	82.2	Confident	88	Confident	86 Å²	86	80.1 Å²	80.1	33%	0.325	37%	0.366	S	S	.	.			trans	-108.2	146.7	177.8	-69.8	-177.8	-178.5	-137.4	-1.4	110.5	L64 S67	L64-R69 WeakPolarHBondContact CD2-O 3.48Å; S67-R69 PolarHBondContact O-N 2.88Å; S67-R69 VanDerWaalsContact O-N 3.09Å; S67-R69 PolarHBondContact OG-N 3.3Å
70	N	85.1	Confident	87.6	Confident	60 Å²	60	81.1 Å²	81.1	32%	0.321	38%	0.377	S	S	.	.	S	Bend	trans	-107.3	6.1	175.6	65.1	41.9	0	0	0	113.8	F79 E321	N70-F79 PolarHBondContact O-N 2.87Å; N70-F79 VanDerWaalsContact O-N 3.08Å; N70-E321 PolarHBondContact ND2-OE1 3.38Å
71	T	88.1	Confident	87.4	Confident	39 Å²	39	84.5 Å²	84.5	24%	0.239	39%	0.391	C	S	.	.	B	Isolated β-bridge	trans	-121.2	155.6	-179.8	54.4	0	0	0	0	111.4	E73 H77 R78 F79	T71-E73 PolarHBondContact O-N 3.12Å; T71-H77 WeakPolarHBondContact CA-O 3.35Å; T71-R78 HydrophobicContact CG2-CB 4.15Å; T71-R78 HydrophobicContact CG2-CG 4.3Å; T71-F79 WeakPolarHBondContact O-CE2 3.48Å
72	C	89.5	Confident	87.1	Confident	2 Å²	2	85 Å²	85	1%	0.014	39%	0.394	C	S	.	.			trans	-67.5	124.6	171.9	-178.1	0	0	0	0	110.4	C46 C48 L74 C75 N76 H77 F79	C46-C72 HydrophobicContact CB-CB 3.84Å; C48-C72 VanDerWaalsContact SG-SG 3.65Å; C72-L74 PolarHBondContact O-N 3.34Å; C72-C75 VanDerWaalsContact CB-SG 3.56Å; C72-C75 PolarHBondContact O-N 3.32Å; C72-C75 VanDerWaalsContact SG-SG 3.65Å; C72-N76 WeakPolarHBondContact O-CA 3.29Å; C72-N76 PolarHBondContact O-N 2.7Å; C72-H77 PolarHBondContact N-O 3.07Å; C72-F79 VanDerWaalsContact CA-CZ 3.41Å; C72-F79 HydrophobicContact CB-CE1 3.93Å; C72-F79 HydrophobicContact CB-CE2 4.23Å; C72-F79 HydrophobicContact CB-CZ 3.55Å
73	E	86.8	Confident	86.8	Confident	78 Å²	78	81.9 Å²	81.9	36%	0.364	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-16.8	179.4	68.3	-160.4	176.2	0	0	115.2	R30 W63 T71	R30-E73 IonicContact CZ-OE1 3.14Å; R30-E73 IonicContact NH1-OE1 3.08Å; R30-E73 PolarHBondContact NH1-OE1 2.97Å; R30-E73 VanDerWaalsContact NH1-OE1 3.08Å; R30-E73 IonicContact NH2-OE1 2.58Å; R30-E73 PolarHBondContact NH2-OE1 3.27Å; W63-E73 WeakPolarHBondContact CZ2-OE2 3.5Å; W63-E73 PolarHBondContact NE1-OE2 3.38Å; T71-E73 PolarHBondContact O-N 3.12Å
74	L	89	Confident	86.5	Confident	97 Å²	97	80.2 Å²	80.2	51%	0.508	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-39.1	-178.5	-63.2	173.5	0	0	0	113.2	I52 C72	I52-L74 HydrophobicContact CD1-CD1 3.38Å; I52-L74 HydrophobicContact CG1-CD1 3.98Å; C72-L74 PolarHBondContact O-N 3.34Å
75	C	88.4	Confident	86.4	Confident	42 Å²	42	81.8 Å²	81.8	28%	0.284	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.7	1.7	-175.6	67	0	0	0	0	114	L47 C48 C72 H77	L47-C75 HydrophobicContact CB-CB 4.13Å; C48-C75 VanDerWaalsContact SG-SG 3.7Å; C72-C75 VanDerWaalsContact CB-SG 3.56Å; C72-C75 PolarHBondContact O-N 3.32Å; C72-C75 VanDerWaalsContact SG-SG 3.65Å; C75-H77 PolarHBondContact O-N 2.87Å; C75-H77 VanDerWaalsContact SG-CB 3.54Å
76	N	86.2	Confident	86.2	Confident	113 Å²	113	77.2 Å²	77.2	60%	0.604	37%	0.37	S	S	*	.			trans	52.9	13.8	-174.8	-71.9	-24.5	0	0	0	115.2	C72 R78	C72-N76 WeakPolarHBondContact O-CA 3.29Å; C72-N76 PolarHBondContact O-N 2.7Å; N76-R78 PolarHBondContact O-N 2.88Å
77	H	86.8	Confident	85.7	Confident	50 Å²	50	74.2 Å²	74.2	23%	0.231	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-69.4	128.2	175.5	-174.9	-78	0	0	0	110.1	L47 T71 C72 C75 F79 F1099	L47-H77 HydrophobicContact CD1-CB 4.25Å; L47-H77 HydrophobicContact CG-CB 4.34Å; T71-H77 WeakPolarHBondContact CA-O 3.35Å; C72-H77 PolarHBondContact N-O 3.07Å; C75-H77 PolarHBondContact O-N 2.87Å; C75-H77 VanDerWaalsContact SG-CB 3.54Å; H77-F79 PolarHBondContact O-N 3.47Å; H77-F1099 AromaticContact CE1-CD2 3.88Å; H77-F1099 AromaticContact NE2-CD2 3.4Å; H77-F1099 WeakPolarHBondContact NE2-CD2 3.47Å; H77-F1099 AromaticContact NE2-CE2 3.63Å
78	R	85	Confident	85.5	Confident	174 Å²	174	76 Å²	76	66%	0.657	40%	0.403	S	S	*	.	B	Isolated β-bridge	trans	-71.6	126.7	178.8	-161.9	177.6	177.8	-164.7	-0.3	111	T71 N76 A80	T71-R78 HydrophobicContact CG2-CB 4.15Å; T71-R78 HydrophobicContact CG2-CG 4.3Å; N76-R78 PolarHBondContact O-N 2.88Å; R78-A80 PolarHBondContact O-N 3.37Å
79	F	87.2	Confident	85.2	Confident	22 Å²	22	70 Å²	70	10%	0.096	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-69.4	132.4	179.8	-60.8	-63.5	0	0	0	110.4	P45 C46 L60 L64 N70 T71 C72 H77 F81 L1096	P45-F79 HydrophobicContact CB-CD1 3.81Å; P45-F79 HydrophobicContact CB-CE1 4.22Å; P45-F79 HydrophobicContact CG-CD1 3.88Å; P45-F79 HydrophobicContact CG-CE1 3.79Å; C46-F79 HydrophobicContact CB-CE1 4Å; L60-F79 HydrophobicContact CD1-CD2 4.24Å; L60-F79 HydrophobicContact CD1-CE1 4.1Å; L60-F79 HydrophobicContact CD1-CE2 3.81Å; L60-F79 HydrophobicContact CD1-CZ 3.7Å; L60-F79 HydrophobicContact CD2-CB 4.47Å; L60-F79 HydrophobicContact CD2-CD1 3.99Å; L60-F79 HydrophobicContact CD2-CD2 4.44Å; L60-F79 HydrophobicContact CD2-CE1 4.24Å; L60-F79 HydrophobicContact CD2-CG 4.05Å; L64-F79 HydrophobicContact CD1-CD2 4.22Å; L64-F79 HydrophobicContact CD2-CD2 3.53Å; L64-F79 HydrophobicContact CD2-CE2 3.6Å; L64-F79 HydrophobicContact CG-CD2 4.48Å; N70-F79 PolarHBondContact O-N 2.87Å; N70-F79 VanDerWaalsContact O-N 3.08Å; T71-F79 WeakPolarHBondContact O-CE2 3.48Å; C72-F79 VanDerWaalsContact CA-CZ 3.41Å; C72-F79 HydrophobicContact CB-CE1 3.93Å; C72-F79 HydrophobicContact CB-CE2 4.23Å; C72-F79 HydrophobicContact CB-CZ 3.55Å; H77-F79 PolarHBondContact O-N 3.47Å; F79-F81 HydrophobicContact CB-CE2 3.87Å; F79-F81 HydrophobicContact CB-CZ 4.49Å; F79-L1096 HydrophobicContact CB-CD1 4.5Å
80	A	84.4	Confident	85.3	Confident	45 Å²	45	68.3 Å²	68.3	37%	0.372	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-102.2	126.9	-179.2	0	0	0	0	0	110.3	R78 L1097	R78-A80 PolarHBondContact O-N 3.37Å; A80-L1097 HydrophobicContact CB-CB 4.22Å; A80-L1097 HydrophobicContact CB-CD1 4.12Å; A80-L1097 WeakPolarHBondContact O-CB 3.3Å; A80-L1097 PolarHBondContact O-N 3.2Å
81	F	86.5	Confident	85.1	Confident	73 Å²	73	76.3 Å²	76.3	32%	0.32	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	131.9	177.3	-68.1	-88.7	0	0	0	110.4	L60 V61 L64 F79 K1094 Q1095 L1096	L60-F81 HydrophobicContact CD2-CZ 4.21Å; V61-F81 HydrophobicContact CG2-CE1 4.14Å; L64-F81 HydrophobicContact CD1-CE2 3.77Å; L64-F81 HydrophobicContact CD1-CZ 3.58Å; F79-F81 HydrophobicContact CB-CE2 3.87Å; F79-F81 HydrophobicContact CB-CZ 4.49Å; F81-K1094 HydrophobicContact CB-CB 4.23Å; F81-K1094 HydrophobicContact CD1-CB 4.31Å; F81-Q1095 CarbonylContact C-O 3.57Å; F81-Q1095 WeakPolarHBondContact CA-O 3.34Å; F81-L1096 HydrophobicContact CD1-CB 4.36Å; F81-L1096 HydrophobicContact CD1-CD1 4.21Å; F81-L1096 HydrophobicContact CE1-CB 4.15Å; F81-L1096 HydrophobicContact CE1-CD1 3.78Å; F81-L1096 HydrophobicContact CE2-CD1 4.41Å; F81-L1096 HydrophobicContact CZ-CD1 3.89Å
82	T	84.1	Confident	84.8	Confident	57 Å²	57	82.6 Å²	82.6	35%	0.35	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	145.4	170.2	40	0	0	0	0	111.4	K1094 Q1095 L1097	T82-K1094 CarbonylContact O-C 3.52Å; T82-K1094 WeakPolarHBondContact O-CA 3.48Å; T82-Q1095 PolarHBondContact N-O 3.47Å; T82-Q1095 PolarHBondContact O-N 3.24Å; T82-Q1095 PolarHBondContact OG1-O 3.2Å; T82-L1097 HydrophobicContact CG2-CD1 3.4Å; T82-L1097 HydrophobicContact CG2-CD2 3.83Å; T82-L1097 HydrophobicContact CG2-CG 3.62Å
83	R	84.4	Confident	84.6	Confident	115 Å²	115	83 Å²	83	43%	0.434	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	126.2	177.7	-62.5	-177.7	-160.1	163	-4.2	110.2	Y85 D1087 L1091	R83-Y85 HydrophobicContact CB-CE2 4.22Å; R83-D1087 WeakPolarHBondContact CD-OD1 3.41Å; R83-D1087 IonicContact CZ-OD1 3.71Å; R83-D1087 IonicContact CZ-OD2 2.96Å; R83-D1087 IonicContact NE-OD1 3.76Å; R83-D1087 IonicContact NE-OD2 3.39Å; R83-D1087 PolarHBondContact NE-OD2 2.75Å; R83-D1087 VanDerWaalsContact NH1-CG 3.29Å; R83-D1087 IonicContact NH1-OD1 3.07Å; R83-D1087 PolarHBondContact NH1-OD1 3.12Å; R83-D1087 IonicContact NH1-OD2 2.69Å; R83-D1087 PolarHBondContact NH1-OD2 3.47Å; R83-D1087 IonicContact NH2-OD2 3.53Å; R83-L1091 HydrophobicContact CB-CD1 3.51Å; R83-L1091 HydrophobicContact CG-CD1 3.86Å
84	I	84.1	Confident	84.6	Confident	67 Å²	67	81.7 Å²	81.7	34%	0.344	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	122.3	171.5	-56.6	163	0	0	0	108.2	V1092 G1093 Q1095	I84-V1092 PolarHBondContact O-N 3.15Å; I84-G1093 PolarHBondContact N-O 2.84Å; I84-Q1095 HydrophobicContact CD1-CB 3.49Å; I84-Q1095 VanDerWaalsContact CD1-CB 3.49Å; I84-Q1095 HydrophobicContact CD1-CG 3.96Å; I84-Q1095 HydrophobicContact CG1-CB 3.79Å
85	Y	86.4	Confident	84.4	Confident	59 Å²	59	84 Å²	84	23%	0.231	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	152.3	174.9	-57.3	-77	0	0	0	111.3	R83 T89 K1086 D1087 Y1090	R83-Y85 HydrophobicContact CB-CE2 4.22Å; Y85-T89 HydrophobicContact CG-CG2 4.44Å; Y85-K1086 HydrophobicContact CD1-CG 4.43Å; Y85-K1086 HydrophobicContact CE1-CD 4.09Å; Y85-K1086 HydrophobicContact CE1-CG 3.86Å; Y85-D1087 PolarHBondContact OH-OD1 3.04Å; Y85-Y1090 VanDerWaalsContact CA-O 3.29Å; Y85-Y1090 WeakPolarHBondContact CA-O 3.24Å
86	A	83.7	Confident	84.3	Confident	38 Å²	38	87 Å²	87	31%	0.314	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-54.7	142.3	178.6	0	0	0	0	0	112.9	G88 T89 Y1090 V1092	A86-G88 PolarHBondContact O-N 3.38Å; A86-T89 PolarHBondContact O-N 3.4Å; A86-T89 PolarHBondContact O-OG1 2.88Å; A86-T89 VanDerWaalsContact O-OG1 3.12Å; A86-Y1090 PolarHBondContact N-O 3.35Å; A86-Y1090 VanDerWaalsContact N-O 3.13Å; A86-V1092 HydrophobicContact CB-CG2 3.64Å
87	S	79.2	Confident	84.4	Confident	135 Å²	135	82.6 Å²	82.6	94%	0.944	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	96.7	176.1	54	0	0	0	0	110.2
88	G	81.3	Confident	84.4	Confident	74 Å²	74	82.6 Å²	82.6	76%	0.763	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	132.5	-0.4	-172.3	0	0	0	0	0	114.5	A86	A86-G88 PolarHBondContact O-N 3.38Å
89	T	81.8	Confident	84.5	Confident	43 Å²	43	77 Å²	77	26%	0.264	43%	0.429	S	S	.	.			trans	-57.1	125.3	173.8	26.2	0	0	0	0	112.5	Y85 A86 Y1090	Y85-T89 HydrophobicContact CG-CG2 4.44Å; A86-T89 PolarHBondContact O-N 3.4Å; A86-T89 PolarHBondContact O-OG1 2.88Å; A86-T89 VanDerWaalsContact O-OG1 3.12Å; T89-Y1090 HydrophobicContact CG2-CD1 3.38Å; T89-Y1090 HydrophobicContact CG2-CD2 4.13Å; T89-Y1090 HydrophobicContact CG2-CE1 4.15Å; T89-Y1090 HydrophobicContact CG2-CG 3.35Å
90	P	83	Confident	84.6	Confident	51 Å²	51	80.2 Å²	80.2	33%	0.331	45%	0.45	S	S	.	.			trans	-65.9	148.9	175.5	27.8	-33.9	0	0	0	110.8	F92	P90-F92 VanDerWaalsContact C-N 3.28Å; P90-F92 WeakPolarHBondContact CB-O 3.38Å; P90-F92 PolarHBondContact O-N 3.08Å
91	R	81.1	Confident	84.6	Confident	229 Å²	229	78.6 Å²	78.6	86%	0.864	44%	0.439	S	S	*	.	S	Bend	trans	-59.3	-39.3	179.3	-74.8	-173.8	176.8	-177.6	0.2	112.2
92	F	83.1	Confident	84.7	Confident	170 Å²	170	79.3 Å²	79.3	75%	0.746	45%	0.445	S	S	*	.	S	Bend	trans	-116.1	139.6	172.9	-57.1	-73.3	0	0	0	109	P90	P90-F92 VanDerWaalsContact C-N 3.28Å; P90-F92 WeakPolarHBondContact CB-O 3.38Å; P90-F92 PolarHBondContact O-N 3.08Å
93	L	84.4	Confident	85	Confident	12 Å²	12	79.2 Å²	79.2	6%	0.063	45%	0.45	C	S	.	.			trans	-61.7	130.8	175.5	-121.2	68.4	0	0	0	109.7	L95 V97 Y1082 I1085 K1086 Y1090	L93-L95 PolarHBondContact O-N 3.33Å; L93-V97 HydrophobicContact CD2-CG1 4.17Å; L93-V97 HydrophobicContact CG-CG1 4.39Å; L93-Y1082 HydrophobicContact CB-CE2 3.91Å; L93-Y1082 PolarHBondContact N-OH 3.29Å; L93-I1085 HydrophobicContact CD2-CB 4.36Å; L93-I1085 HydrophobicContact CD2-CG2 3.7Å; L93-K1086 HydrophobicContact CD1-CB 3.94Å; L93-K1086 HydrophobicContact CD1-CD 4.35Å; L93-K1086 HydrophobicContact CD1-CG 3.83Å; L93-Y1090 HydrophobicContact CD1-CD2 4.04Å; L93-Y1090 HydrophobicContact CD1-CE2 3.67Å; L93-Y1090 HydrophobicContact CG-CE2 4.21Å
94	P	86	Confident	85.2	Confident	50 Å²	50	77.3 Å²	77.3	33%	0.325	45%	0.448	S	S	.	.			trans	-60.2	140.1	175.3	22.1	-30	0	0	0	110.1	T96 V97 L98	P94-T96 PolarHBondContact O-N 2.99Å; P94-T96 VanDerWaalsContact O-N 3.13Å; P94-V97 HydrophobicContact CG-CB 4.01Å; P94-V97 HydrophobicContact CG-CG2 3.76Å; P94-V97 PolarHBondContact O-N 3.48Å; P94-L98 PolarHBondContact O-N 3.47Å
95	L	85.2	Confident	85.3	Confident	144 Å²	144	75.5 Å²	75.5	75%	0.754	44%	0.442	S	S	*	.	H	α-helix	trans	-57.9	-31.7	-172.8	-70.6	173.4	0	0	0	112.8	L93 L98 A99	L93-L95 PolarHBondContact O-N 3.33Å; L95-L98 PolarHBondContact O-N 3.37Å; L95-A99 WeakPolarHBondContact O-CB 3.25Å; L95-A99 PolarHBondContact O-N 2.96Å
96	T	87	Confident	85.3	Confident	105 Å²	105	77.1 Å²	77.1	64%	0.644	45%	0.454	S	S	*	.	H	α-helix	trans	-65.2	-44.7	176.7	52.7	0	0	0	0	112.1	P94 A99 V100	P94-T96 PolarHBondContact O-N 2.99Å; P94-T96 VanDerWaalsContact O-N 3.13Å; T96-A99 PolarHBondContact O-N 3.21Å; T96-V100 VanDerWaalsContact O-CG2 3.28Å; T96-V100 WeakPolarHBondContact O-CG2 3.46Å; T96-V100 PolarHBondContact O-N 3.27Å
97	V	87.5	Confident	85.6	Confident	22 Å²	22	82.8 Å²	82.8	13%	0.133	47%	0.467	C	S	.	.	H	α-helix	trans	-67.8	-42.7	176.3	173.1	0	0	0	0	110.7	L93 P94 A99 V100 G101 K1089	L93-V97 HydrophobicContact CD2-CG1 4.17Å; L93-V97 HydrophobicContact CG-CG1 4.39Å; P94-V97 HydrophobicContact CG-CB 4.01Å; P94-V97 HydrophobicContact CG-CG2 3.76Å; P94-V97 PolarHBondContact O-N 3.48Å; V97-A99 VanDerWaalsContact C-N 3.34Å; V97-V100 PolarHBondContact O-N 2.8Å; V97-G101 PolarHBondContact O-N 2.93Å; V97-K1089 HydrophobicContact CG1-CD 3.68Å; V97-K1089 HydrophobicContact CG2-CD 4.49Å
98	L	87.3	Confident	86	Confident	50 Å²	50	81.7 Å²	81.7	26%	0.262	44%	0.443	S	S	.	.	H	α-helix	trans	-62.6	-42.1	176.2	-176.7	62.7	0	0	0	111.2	P94 L95 G101 L102 Y1082 I1085	P94-L98 PolarHBondContact O-N 3.47Å; L95-L98 PolarHBondContact O-N 3.37Å; L98-G101 PolarHBondContact O-N 3.45Å; L98-L102 WeakPolarHBondContact O-CB 3.09Å; L98-L102 PolarHBondContact O-N 3.24Å; L98-Y1082 HydrophobicContact CD1-CD2 4.17Å; L98-I1085 HydrophobicContact CD1-CD1 4.17Å
99	A	86.9	Confident	86.2	Confident	56 Å²	56	83.6 Å²	83.6	46%	0.463	43%	0.43	S	S	.	.	H	α-helix	trans	-66.4	-43.3	178.4	0	0	0	0	0	112	L95 T96 V97 L102 A103	L95-A99 WeakPolarHBondContact O-CB 3.25Å; L95-A99 PolarHBondContact O-N 2.96Å; T96-A99 PolarHBondContact O-N 3.21Å; V97-A99 VanDerWaalsContact C-N 3.34Å; A99-L102 PolarHBondContact O-N 3.46Å; A99-A103 VanDerWaalsContact O-CB 3.25Å; A99-A103 WeakPolarHBondContact O-CB 3.49Å; A99-A103 PolarHBondContact O-N 3.25Å
100	V	89.3	Confident	86.5	Confident	89 Å²	89	84.7 Å²	84.7	54%	0.539	44%	0.436	S	S	.	.	H	α-helix	trans	-65.4	-45.1	175.3	172.2	0	0	0	0	111.1	T96 V97 L102 A103 N104	T96-V100 VanDerWaalsContact O-CG2 3.28Å; T96-V100 WeakPolarHBondContact O-CG2 3.46Å; T96-V100 PolarHBondContact O-N 3.27Å; V97-V100 PolarHBondContact O-N 2.8Å; V100-L102 VanDerWaalsContact C-N 3.34Å; V100-L102 PolarHBondContact O-N 3.11Å; V100-A103 PolarHBondContact O-N 3.1Å; V100-N104 WeakPolarHBondContact O-CB 3.47Å; V100-N104 PolarHBondContact O-N 3.21Å
101	G	85.4	Confident	86.9	Confident	12 Å²	12	86.8 Å²	86.8	12%	0.124	44%	0.444	C	S	.	.	H	α-helix	trans	-62.2	-41.2	175.7	0	0	0	0	0	112.2	V97 L98 S105	V97-G101 PolarHBondContact O-N 2.93Å; L98-G101 PolarHBondContact O-N 3.45Å; G101-S105 WeakPolarHBondContact O-CB 3.44Å; G101-S105 PolarHBondContact O-N 3.23Å
102	L	88.5	Confident	87.2	Confident	88 Å²	88	80.8 Å²	80.8	46%	0.461	43%	0.429	S	S	.	.	H	α-helix	trans	-66.5	-41.1	174.7	-177.8	63.7	0	0	0	111.3	L98 A99 V100 S105 L106 L1081	L98-L102 WeakPolarHBondContact O-CB 3.09Å; L98-L102 PolarHBondContact O-N 3.24Å; A99-L102 PolarHBondContact O-N 3.46Å; V100-L102 VanDerWaalsContact C-N 3.34Å; V100-L102 PolarHBondContact O-N 3.11Å; L102-S105 PolarHBondContact O-N 3.45Å; L102-L106 WeakPolarHBondContact O-CA 3.29Å; L102-L106 WeakPolarHBondContact O-CB 3.28Å; L102-L106 PolarHBondContact O-N 3.25Å; L102-L1081 HydrophobicContact CD1-CD2 3.82Å
103	A	89.2	Confident	87.5	Confident	55 Å²	55	79.6 Å²	79.6	46%	0.455	42%	0.42	S	S	.	.	H	α-helix	trans	-64.8	-43.2	177	0	0	0	0	0	111.6	A99 V100 L106 R107	A99-A103 VanDerWaalsContact O-CB 3.25Å; A99-A103 WeakPolarHBondContact O-CB 3.49Å; A99-A103 PolarHBondContact O-N 3.25Å; V100-A103 PolarHBondContact O-N 3.1Å; A103-L106 PolarHBondContact O-N 3.47Å; A103-R107 VanDerWaalsContact O-CB 3.26Å; A103-R107 WeakPolarHBondContact O-CB 3.24Å; A103-R107 PolarHBondContact O-N 3.48Å
104	N	88.6	Confident	87.8	Confident	74 Å²	74	83 Å²	83	40%	0.396	44%	0.438	S	S	.	.	H	α-helix	trans	-68	-40.2	175.6	-76.7	-19.3	0	0	0	112.3	V100 R107 R108	V100-N104 WeakPolarHBondContact O-CB 3.47Å; V100-N104 PolarHBondContact O-N 3.21Å; N104-R107 PolarHBondContact O-N 3.07Å; N104-R108 WeakPolarHBondContact O-CG 3.41Å; N104-R108 PolarHBondContact O-N 3.15Å
105	S	86	Confident	88	Confident	29 Å²	29	82 Å²	82	20%	0.203	43%	0.428	C	S	.	.	H	α-helix	trans	-64.4	-45.1	174.2	-174.1	0	0	0	0	111.3	G101 L102 R107 R108 F109 L1081	G101-S105 WeakPolarHBondContact O-CB 3.44Å; G101-S105 PolarHBondContact O-N 3.23Å; L102-S105 PolarHBondContact O-N 3.45Å; S105-R107 PolarHBondContact O-N 3.42Å; S105-R108 PolarHBondContact O-N 3.44Å; S105-F109 WeakPolarHBondContact O-CB 3.23Å; S105-F109 PolarHBondContact O-N 3.23Å; S105-L1081 WeakPolarHBondContact OG-CD1 3.49Å
106	L	87.1	Confident	88.2	Confident	94 Å²	94	78.8 Å²	78.8	49%	0.492	41%	0.411	S	S	.	.	H	α-helix	trans	-63.3	-41	175.5	-177.5	63.8	0	0	0	110.9	L102 A103 F109 V110	L102-L106 WeakPolarHBondContact O-CA 3.29Å; L102-L106 WeakPolarHBondContact O-CB 3.28Å; L102-L106 PolarHBondContact O-N 3.25Å; A103-L106 PolarHBondContact O-N 3.47Å; L106-F109 HydrophobicContact CD1-CD1 4.41Å; L106-F109 PolarHBondContact O-N 2.89Å; L106-V110 HydrophobicContact CD1-CG2 3.93Å; L106-V110 HydrophobicContact CG-CG2 4.12Å; L106-V110 VanDerWaalsContact O-CB 3.28Å; L106-V110 WeakPolarHBondContact O-CB 3.41Å; L106-V110 WeakPolarHBondContact O-CG2 3.4Å; L106-V110 PolarHBondContact O-N 2.96Å
107	R	89.9	Confident	88.2	Confident	156 Å²	156	76.5 Å²	76.5	59%	0.589	40%	0.4	S	S	*	.	H	α-helix	trans	-60.8	-50.3	174.8	-174.4	-178.8	73.6	127.4	1.1	111.3	A103 N104 S105 F109 V110 L111	A103-R107 VanDerWaalsContact O-CB 3.26Å; A103-R107 WeakPolarHBondContact O-CB 3.24Å; A103-R107 PolarHBondContact O-N 3.48Å; N104-R107 PolarHBondContact O-N 3.07Å; S105-R107 PolarHBondContact O-N 3.42Å; R107-F109 VanDerWaalsContact C-N 3.33Å; R107-F109 PolarHBondContact O-N 3.19Å; R107-V110 PolarHBondContact O-N 3.45Å; R107-L111 HydrophobicContact CG-CD1 4.04Å; R107-L111 HydrophobicContact CG-CG 4.48Å; R107-L111 WeakPolarHBondContact O-CB 3.5Å; R107-L111 VanDerWaalsContact O-CG 3.28Å; R107-L111 WeakPolarHBondContact O-CG 3.44Å; R107-L111 PolarHBondContact O-N 2.97Å
108	R	87.2	Confident	88.4	Confident	113 Å²	113	79.2 Å²	79.2	43%	0.426	41%	0.413	S	S	.	.	H	α-helix	trans	-58.7	-45.4	175.7	-74.7	-171.8	-76.2	-156.9	1.6	111	N104 S105 N112 E1088	N104-R108 WeakPolarHBondContact O-CG 3.41Å; N104-R108 PolarHBondContact O-N 3.15Å; S105-R108 PolarHBondContact O-N 3.44Å; R108-N112 VanDerWaalsContact O-CB 3.3Å; R108-N112 WeakPolarHBondContact O-CB 3.45Å; R108-N112 PolarHBondContact O-N 2.88Å; R108-N112 PolarHBondContact O-OD1 3.37Å; R108-E1088 IonicContact NH1-OE1 2.75Å; R108-E1088 IonicContact NH2-OE1 3.25Å; R108-E1088 PolarHBondContact NH2-OE1 3.05Å; R108-E1088 IonicContact NH2-OE2 3.69Å
109	F	85.8	Confident	88.6	Confident	114 Å²	114	77.2 Å²	77.2	50%	0.5	40%	0.403	S	S	.	.	H	α-helix	trans	-60.3	-52.1	176.6	-179.2	-96.6	0	0	0	111.4	S105 L106 R107 L111 N112 W113	S105-F109 WeakPolarHBondContact O-CB 3.23Å; S105-F109 PolarHBondContact O-N 3.23Å; L106-F109 HydrophobicContact CD1-CD1 4.41Å; L106-F109 PolarHBondContact O-N 2.89Å; R107-F109 VanDerWaalsContact C-N 3.33Å; R107-F109 PolarHBondContact O-N 3.19Å; F109-L111 PolarHBondContact O-N 3.36Å; F109-N112 PolarHBondContact O-N 3.38Å; F109-W113 AromaticContact CD1-CD1 3.46Å; F109-W113 VanDerWaalsContact CD1-CD1 3.46Å; F109-W113 HydrophobicContact CD1-CG 4.45Å; F109-W113 AromaticContact CD1-NE1 3.85Å; F109-W113 AromaticContact CD2-CD1 3.69Å; F109-W113 AromaticContact CD2-NE1 3.62Å; F109-W113 AromaticContact CE1-CD1 3.31Å; F109-W113 HydrophobicContact CE1-CG 4.23Å; F109-W113 AromaticContact CE1-NE1 3.27Å; F109-W113 VanDerWaalsContact CE1-NE1 3.27Å; F109-W113 AromaticContact CE2-CD1 3.57Å; F109-W113 AromaticContact CE2-NE1 3.02Å; F109-W113 AromaticContact CG-CD1 3.67Å; F109-W113 AromaticContact CZ-CD1 3.41Å; F109-W113 VanDerWaalsContact CZ-CD1 3.41Å; F109-W113 AromaticContact CZ-CE2 3.72Å; F109-W113 HydrophobicContact CZ-CG 4.49Å; F109-W113 HydrophobicContact CZ-CZ2 4.29Å; F109-W113 AromaticContact CZ-NE1 2.84Å; F109-W113 WeakPolarHBondContact O-CB 3.22Å; F109-W113 PolarHBondContact O-N 3.47Å
110	V	89	Confident	88.8	Confident	65 Å²	65	81 Å²	81	39%	0.394	41%	0.409	S	S	.	.	H	α-helix	trans	-61.4	-44.7	179.9	169.3	0	0	0	0	111.2	L106 R107 W113 I114	L106-V110 HydrophobicContact CD1-CG2 3.93Å; L106-V110 HydrophobicContact CG-CG2 4.12Å; L106-V110 VanDerWaalsContact O-CB 3.28Å; L106-V110 WeakPolarHBondContact O-CB 3.41Å; L106-V110 WeakPolarHBondContact O-CG2 3.4Å; L106-V110 PolarHBondContact O-N 2.96Å; R107-V110 PolarHBondContact O-N 3.45Å; V110-W113 PolarHBondContact O-N 3.3Å; V110-I114 HydrophobicContact CG1-CD1 3.73Å; V110-I114 HydrophobicContact CG1-CG1 4.35Å; V110-I114 WeakPolarHBondContact O-CB 3.47Å; V110-I114 VanDerWaalsContact O-CG1 3.24Å; V110-I114 WeakPolarHBondContact O-CG1 3.21Å; V110-I114 PolarHBondContact O-N 3.44Å
111	L	89.7	Confident	88.8	Confident	96 Å²	96	79.8 Å²	79.8	50%	0.503	40%	0.402	S	S	.	.	H	α-helix	trans	-62.4	-45.1	176.1	-71.1	173.6	0	0	0	111.6	R107 F109 W113 I114 H115	R107-L111 HydrophobicContact CG-CD1 4.04Å; R107-L111 HydrophobicContact CG-CG 4.48Å; R107-L111 WeakPolarHBondContact O-CB 3.5Å; R107-L111 VanDerWaalsContact O-CG 3.28Å; R107-L111 WeakPolarHBondContact O-CG 3.44Å; R107-L111 PolarHBondContact O-N 2.97Å; F109-L111 PolarHBondContact O-N 3.36Å; L111-W113 VanDerWaalsContact C-N 3.3Å; L111-W113 PolarHBondContact O-N 3.32Å; L111-I114 PolarHBondContact O-N 2.85Å; L111-H115 WeakPolarHBondContact O-CB 3.49Å; L111-H115 PolarHBondContact O-N 3.35Å
112	N	88.1	Confident	89	Confident	102 Å²	102	79.7 Å²	79.7	55%	0.545	40%	0.4	S	S	.	.	H	α-helix	trans	-64.1	-36.5	175.3	-70.8	2.9	0	0	0	111.6	R108 F109 H115 L116	R108-N112 VanDerWaalsContact O-CB 3.3Å; R108-N112 WeakPolarHBondContact O-CB 3.45Å; R108-N112 PolarHBondContact O-N 2.88Å; R108-N112 PolarHBondContact O-OD1 3.37Å; F109-N112 PolarHBondContact O-N 3.38Å; N112-H115 PolarHBondContact O-N 3.38Å; N112-L116 VanDerWaalsContact O-CB 3.31Å; N112-L116 WeakPolarHBondContact O-CB 3.49Å; N112-L116 WeakPolarHBondContact O-CG 3.33Å; N112-L116 PolarHBondContact O-N 3.42Å
113	W	89.1	Confident	89.2	Confident	146 Å²	146	78.3 Å²	78.3	55%	0.553	39%	0.388	S	S	*	.	H	α-helix	trans	-67.8	-40.4	174.9	-93.6	91.8	0	0	0	112.7	F109 V110 L111 H115 L116 S117	F109-W113 AromaticContact CD1-CD1 3.46Å; F109-W113 VanDerWaalsContact CD1-CD1 3.46Å; F109-W113 HydrophobicContact CD1-CG 4.45Å; F109-W113 AromaticContact CD1-NE1 3.85Å; F109-W113 AromaticContact CD2-CD1 3.69Å; F109-W113 AromaticContact CD2-NE1 3.62Å; F109-W113 AromaticContact CE1-CD1 3.31Å; F109-W113 HydrophobicContact CE1-CG 4.23Å; F109-W113 AromaticContact CE1-NE1 3.27Å; F109-W113 VanDerWaalsContact CE1-NE1 3.27Å; F109-W113 AromaticContact CE2-CD1 3.57Å; F109-W113 AromaticContact CE2-NE1 3.02Å; F109-W113 AromaticContact CG-CD1 3.67Å; F109-W113 AromaticContact CZ-CD1 3.41Å; F109-W113 VanDerWaalsContact CZ-CD1 3.41Å; F109-W113 AromaticContact CZ-CE2 3.72Å; F109-W113 HydrophobicContact CZ-CG 4.49Å; F109-W113 HydrophobicContact CZ-CZ2 4.29Å; F109-W113 AromaticContact CZ-NE1 2.84Å; F109-W113 WeakPolarHBondContact O-CB 3.22Å; F109-W113 PolarHBondContact O-N 3.47Å; V110-W113 PolarHBondContact O-N 3.3Å; L111-W113 VanDerWaalsContact C-N 3.3Å; L111-W113 PolarHBondContact O-N 3.32Å; W113-H115 VanDerWaalsContact C-N 3.33Å; W113-L116 PolarHBondContact O-N 3.38Å; W113-S117 VanDerWaalsContact O-CB 3.27Å; W113-S117 WeakPolarHBondContact O-CB 3.41Å; W113-S117 PolarHBondContact O-N 2.95Å; W113-S117 PolarHBondContact O-OG 3.44Å
114	I	90.8	Very high	89.2	Confident	84 Å²	84	79.2 Å²	79.2	43%	0.431	39%	0.385	S	S	.	.	H	α-helix	trans	-63.3	-43.8	172.9	-69.8	165.5	0	0	0	109.4	V110 L111 S117 I118	V110-I114 HydrophobicContact CG1-CD1 3.73Å; V110-I114 HydrophobicContact CG1-CG1 4.35Å; V110-I114 WeakPolarHBondContact O-CB 3.47Å; V110-I114 VanDerWaalsContact O-CG1 3.24Å; V110-I114 WeakPolarHBondContact O-CG1 3.21Å; V110-I114 PolarHBondContact O-N 3.44Å; L111-I114 PolarHBondContact O-N 2.85Å; I114-S117 WeakPolarHBondContact CA-OG 3.41Å; I114-S117 PolarHBondContact O-N 2.95Å; I114-S117 PolarHBondContact O-OG 3.44Å; I114-I118 HydrophobicContact CG2-CD1 3.91Å; I114-I118 WeakPolarHBondContact O-CB 3.11Å; I114-I118 VanDerWaalsContact O-CG1 3.24Å; I114-I118 WeakPolarHBondContact O-CG1 3.19Å; I114-I118 PolarHBondContact O-N 3.21Å
115	H	89.8	Confident	89.2	Confident	27 Å²	27	78 Å²	78	13%	0.125	38%	0.38	C	S	.	.	H	α-helix	trans	-61.4	-50.1	176.1	-169.2	-86.2	0	0	0	111.6	L111 N112 W113 S117 I118 V119 G359 G362	L111-H115 WeakPolarHBondContact O-CB 3.49Å; L111-H115 PolarHBondContact O-N 3.35Å; N112-H115 PolarHBondContact O-N 3.38Å; W113-H115 VanDerWaalsContact C-N 3.33Å; H115-S117 VanDerWaalsContact C-N 3.3Å; H115-S117 PolarHBondContact O-N 3.01Å; H115-I118 WeakPolarHBondContact O-CB 3.47Å; H115-I118 PolarHBondContact O-N 3.25Å; H115-V119 WeakPolarHBondContact O-CG2 3.44Å; H115-V119 PolarHBondContact O-N 3.48Å; H115-G359 PolarHBondContact CE1-O 3.37Å; H115-G362 WeakPolarHBondContact CE1-CA 3.45Å; H115-G362 PolarHBondContact NE2-O 2.91Å
116	L	89.3	Confident	89.4	Confident	77 Å²	77	79.9 Å²	79.9	40%	0.403	39%	0.39	S	S	.	.	H	α-helix	trans	-62.7	-35.4	177.7	-73.6	171.2	0	0	0	112.4	N112 W113 V119 F120 L360	N112-L116 VanDerWaalsContact O-CB 3.31Å; N112-L116 WeakPolarHBondContact O-CB 3.49Å; N112-L116 WeakPolarHBondContact O-CG 3.33Å; N112-L116 PolarHBondContact O-N 3.42Å; W113-L116 PolarHBondContact O-N 3.38Å; L116-V119 PolarHBondContact O-N 3.16Å; L116-F120 VanDerWaalsContact O-CB 3.27Å; L116-F120 WeakPolarHBondContact O-CB 3.35Å; L116-F120 PolarHBondContact O-N 3.04Å; L116-L360 HydrophobicContact CD2-CD2 3.76Å
117	S	88.9	Confident	89.5	Confident	57 Å²	57	75.5 Å²	75.5	40%	0.399	37%	0.368	S	S	.	.	H	α-helix	trans	-70	-37.9	176.4	71.8	0	0	0	0	111.7	W113 I114 H115 T121	W113-S117 VanDerWaalsContact O-CB 3.27Å; W113-S117 WeakPolarHBondContact O-CB 3.41Å; W113-S117 PolarHBondContact O-N 2.95Å; W113-S117 PolarHBondContact O-OG 3.44Å; I114-S117 WeakPolarHBondContact CA-OG 3.41Å; I114-S117 PolarHBondContact O-N 2.95Å; I114-S117 PolarHBondContact O-OG 3.44Å; H115-S117 VanDerWaalsContact C-N 3.3Å; H115-S117 PolarHBondContact O-N 3.01Å; S117-T121 VanDerWaalsContact O-CB 3.25Å; S117-T121 WeakPolarHBondContact O-CB 3.4Å; S117-T121 PolarHBondContact O-N 3.16Å; S117-T121 PolarHBondContact O-OG1 3.37Å
118	I	90.6	Very high	89.6	Confident	79 Å²	79	68.2 Å²	68.2	41%	0.405	34%	0.341	S	S	.	.	H	α-helix	trans	-61.3	-49	171.7	-70.7	165.9	0	0	0	110.2	I114 H115 T121 A122 F366	I114-I118 HydrophobicContact CG2-CD1 3.91Å; I114-I118 WeakPolarHBondContact O-CB 3.11Å; I114-I118 VanDerWaalsContact O-CG1 3.24Å; I114-I118 WeakPolarHBondContact O-CG1 3.19Å; I114-I118 PolarHBondContact O-N 3.21Å; H115-I118 WeakPolarHBondContact O-CB 3.47Å; H115-I118 PolarHBondContact O-N 3.25Å; I118-T121 PolarHBondContact O-N 2.97Å; I118-A122 WeakPolarHBondContact O-CB 3.23Å; I118-A122 PolarHBondContact O-N 3.47Å; I118-F366 HydrophobicContact CG2-CZ 3.98Å
119	V	91.4	Very high	89.7	Confident	8 Å²	8	64 Å²	64	5%	0.048	33%	0.326	C	S	.	.	H	α-helix	trans	-58.1	-51.6	177.5	170.5	0	0	0	0	110.6	H115 L116 T121 A122 W123 L358 G359 F366	H115-V119 WeakPolarHBondContact O-CG2 3.44Å; H115-V119 PolarHBondContact O-N 3.48Å; L116-V119 PolarHBondContact O-N 3.16Å; V119-T121 VanDerWaalsContact C-N 3.33Å; V119-T121 PolarHBondContact O-N 2.86Å; V119-A122 PolarHBondContact O-N 2.82Å; V119-W123 PolarHBondContact O-N 3.39Å; V119-L358 VanDerWaalsContact CG1-O 3.3Å; V119-L358 WeakPolarHBondContact CG1-O 3.48Å; V119-G359 WeakPolarHBondContact CG2-O 3.32Å; V119-F366 HydrophobicContact CG2-CD1 4.19Å; V119-F366 HydrophobicContact CG2-CE1 3.88Å; V119-F366 HydrophobicContact CG2-CE2 4.45Å; V119-F366 HydrophobicContact CG2-CZ 4.04Å
120	F	90.6	Very high	89.9	Confident	135 Å²	135	59.5 Å²	59.5	59%	0.592	31%	0.309	S	S	*	.	H	α-helix	trans	-60.6	-41.6	179.3	-173.4	-94.9	0	0	0	112.3	L116 W123 L124	L116-F120 VanDerWaalsContact O-CB 3.27Å; L116-F120 WeakPolarHBondContact O-CB 3.35Å; L116-F120 PolarHBondContact O-N 3.04Å; F120-W123 PolarHBondContact O-N 3.5Å; F120-L124 HydrophobicContact CD1-CD1 3.92Å; F120-L124 HydrophobicContact CD2-CD1 3.5Å; F120-L124 HydrophobicContact CD2-CG 4.39Å; F120-L124 HydrophobicContact CE1-CD1 3.5Å; F120-L124 HydrophobicContact CE2-CD1 3.06Å; F120-L124 HydrophobicContact CE2-CG 4.32Å; F120-L124 HydrophobicContact CG-CD1 3.94Å; F120-L124 HydrophobicContact CZ-CD1 3.07Å; F120-L124 HydrophobicContact CZ-CG 4.44Å; F120-L124 WeakPolarHBondContact O-CB 3.34Å; F120-L124 PolarHBondContact O-N 3.31Å
121	T	90.2	Very high	89.9	Confident	65 Å²	65	56.5 Å²	56.5	40%	0.399	29%	0.291	S	S	.	.	H	α-helix	trans	-66.7	-41.2	177.7	-55.5	0	0	0	0	111.2	S117 I118 V119 W123 V125 V126	S117-T121 VanDerWaalsContact O-CB 3.25Å; S117-T121 WeakPolarHBondContact O-CB 3.4Å; S117-T121 PolarHBondContact O-N 3.16Å; S117-T121 PolarHBondContact O-OG1 3.37Å; I118-T121 PolarHBondContact O-N 2.97Å; V119-T121 VanDerWaalsContact C-N 3.33Å; V119-T121 PolarHBondContact O-N 2.86Å; T121-W123 PolarHBondContact O-N 2.9Å; T121-V125 HydrophobicContact CG2-CB 4.2Å; T121-V125 HydrophobicContact CG2-CG2 4.47Å; T121-V125 WeakPolarHBondContact O-CA 3.31Å; T121-V125 VanDerWaalsContact O-CB 3.31Å; T121-V125 WeakPolarHBondContact O-CB 3.49Å; T121-V125 PolarHBondContact O-N 3.49Å; T121-V126 PolarHBondContact O-N 2.87Å
122	A	90	Very high	89.9	Confident	9 Å²	9	52 Å²	52	7%	0.074	27%	0.268	C	S	.	.	I	π-helix	trans	-59.6	-47.7	176.3	0	0	0	0	0	111.5	I118 V119 V126 V127 F366 V370	I118-A122 WeakPolarHBondContact O-CB 3.23Å; I118-A122 PolarHBondContact O-N 3.47Å; V119-A122 PolarHBondContact O-N 2.82Å; A122-V126 WeakPolarHBondContact O-CB 3.24Å; A122-V126 PolarHBondContact O-N 2.79Å; A122-V127 WeakPolarHBondContact O-CG2 3.49Å; A122-V127 PolarHBondContact O-N 3.12Å; A122-F366 HydrophobicContact CB-CE2 3.75Å; A122-F366 HydrophobicContact CB-CZ 4.45Å; A122-V370 HydrophobicContact CB-CG2 4.38Å
123	W	91	Very high	89.9	Confident	59 Å²	59	48.1 Å²	48.1	22%	0.223	25%	0.246	C	C	.	.	I	π-helix	trans	-78.8	-38.1	-175.8	-68.3	113.5	0	0	0	114.7	V119 F120 T121 V127 P128 L358 V370 L373	V119-W123 PolarHBondContact O-N 3.39Å; F120-W123 PolarHBondContact O-N 3.5Å; T121-W123 PolarHBondContact O-N 2.9Å; W123-V127 HydrophobicContact CE3-CG2 4.42Å; W123-P128 VanDerWaalsContact O-CD 3.26Å; W123-P128 WeakPolarHBondContact O-CD 3.3Å; W123-L358 HydrophobicContact CZ2-CD2 4.22Å; W123-L358 PolarHBondContact NE1-O 2.92Å; W123-V370 HydrophobicContact CD2-CG2 4.45Å; W123-V370 HydrophobicContact CH2-CG2 4.1Å; W123-V370 HydrophobicContact CZ2-CG2 3.91Å; W123-V370 HydrophobicContact CZ3-CG2 4.46Å; W123-L373 HydrophobicContact CE3-CD2 4.41Å; W123-L373 HydrophobicContact CH2-CD2 4.48Å; W123-L373 HydrophobicContact CZ3-CD2 3.61Å
124	L	89.7	Confident	89.7	Confident	75 Å²	75	43.3 Å²	43.3	39%	0.393	23%	0.23	S	C	.	.	I	π-helix	trans	-98.2	-16.1	-174.2	-65.2	-178.7	0	0	0	114.8	F120	F120-L124 HydrophobicContact CD1-CD1 3.92Å; F120-L124 HydrophobicContact CD2-CD1 3.5Å; F120-L124 HydrophobicContact CD2-CG 4.39Å; F120-L124 HydrophobicContact CE1-CD1 3.5Å; F120-L124 HydrophobicContact CE2-CD1 3.06Å; F120-L124 HydrophobicContact CE2-CG 4.32Å; F120-L124 HydrophobicContact CG-CD1 3.94Å; F120-L124 HydrophobicContact CZ-CD1 3.07Å; F120-L124 HydrophobicContact CZ-CG 4.44Å; F120-L124 WeakPolarHBondContact O-CB 3.34Å; F120-L124 PolarHBondContact O-N 3.31Å
125	V	88.8	Confident	89.6	Confident	47 Å²	47	43.8 Å²	43.8	29%	0.285	23%	0.227	S	C	.	.	I	π-helix	trans	-118.9	-60	-178.8	-175.1	0	0	0	0	110	T121 L129	T121-V125 HydrophobicContact CG2-CB 4.2Å; T121-V125 HydrophobicContact CG2-CG2 4.47Å; T121-V125 WeakPolarHBondContact O-CA 3.31Å; T121-V125 VanDerWaalsContact O-CB 3.31Å; T121-V125 WeakPolarHBondContact O-CB 3.49Å; T121-V125 PolarHBondContact O-N 3.49Å; V125-L129 HydrophobicContact CG1-CD1 3.45Å; V125-L129 VanDerWaalsContact CG1-CD1 3.45Å; V125-L129 HydrophobicContact CG1-CG 4.3Å; V125-L129 WeakPolarHBondContact O-CB 3.39Å; V125-L129 WeakPolarHBondContact O-CD1 3.28Å; V125-L129 WeakPolarHBondContact O-CG 3.48Å; V125-L129 PolarHBondContact O-N 2.98Å
126	V	89.5	Confident	89.4	Confident	69 Å²	69	46.4 Å²	46.4	42%	0.418	24%	0.235	S	C	.	.	I	π-helix	trans	-63.3	-51	-173.2	-179.7	0	0	0	0	112.1	T121 A122 L129 S130	T121-V126 PolarHBondContact O-N 2.87Å; A122-V126 WeakPolarHBondContact O-CB 3.24Å; A122-V126 PolarHBondContact O-N 2.79Å; V126-L129 PolarHBondContact O-N 3.42Å; V126-S130 VanDerWaalsContact O-CB 3.31Å; V126-S130 WeakPolarHBondContact O-CB 3.31Å; V126-S130 PolarHBondContact O-N 3.12Å; V126-S130 PolarHBondContact O-OG 3.42Å
127	V	91	Very high	89	Confident	3 Å²	3	43.4 Å²	43.4	2%	0.018	22%	0.221	C	C	.	.	H	α-helix	trans	-61.5	-54.1	-179.1	169	0	0	0	0	111.7	A122 W123 L129 S130 A131 V170 V370 L373 I374	A122-V127 WeakPolarHBondContact O-CG2 3.49Å; A122-V127 PolarHBondContact O-N 3.12Å; W123-V127 HydrophobicContact CE3-CG2 4.42Å; V127-L129 PolarHBondContact O-N 3.2Å; V127-S130 PolarHBondContact O-N 3.28Å; V127-S130 PolarHBondContact O-OG 3.06Å; V127-A131 PolarHBondContact O-N 3.17Å; V127-A131 VanDerWaalsContact O-N 3.11Å; V127-V170 HydrophobicContact CG1-CG1 4.42Å; V127-V170 HydrophobicContact CG1-CG2 4.01Å; V127-V370 HydrophobicContact CG2-CG1 3.81Å; V127-L373 HydrophobicContact CG1-CD2 3.93Å; V127-L373 HydrophobicContact CG2-CD2 4.45Å; V127-I374 HydrophobicContact CG2-CG1 4.46Å
128	P	92.2	Very high	88.8	Confident	3 Å²	3	42.4 Å²	42.4	2%	0.019	21%	0.211	C	C	.	.	H	α-helix	trans	-59	-43	176.9	-28.8	38	0	0	0	113.7	W123 A131 C132 G166 F167	W123-P128 VanDerWaalsContact O-CD 3.26Å; W123-P128 WeakPolarHBondContact O-CD 3.3Å; P128-A131 PolarHBondContact O-N 3.18Å; P128-C132 WeakPolarHBondContact O-CB 3.48Å; P128-C132 PolarHBondContact O-N 3.34Å; P128-G166 WeakPolarHBondContact O-CA 3.49Å; P128-F167 HydrophobicContact CG-CD2 4.39Å
129	L	88.8	Confident	88.5	Confident	23 Å²	23	41.4 Å²	41.4	12%	0.12	20%	0.204	C	C	.	.	H	α-helix	trans	-64.7	-43.5	178.9	-71.8	175.6	0	0	0	111.8	V125 V126 V127 A131 C132 R133 L159 D162	V125-L129 HydrophobicContact CG1-CD1 3.45Å; V125-L129 VanDerWaalsContact CG1-CD1 3.45Å; V125-L129 HydrophobicContact CG1-CG 4.3Å; V125-L129 WeakPolarHBondContact O-CB 3.39Å; V125-L129 WeakPolarHBondContact O-CD1 3.28Å; V125-L129 WeakPolarHBondContact O-CG 3.48Å; V125-L129 PolarHBondContact O-N 2.98Å; V126-L129 PolarHBondContact O-N 3.42Å; V127-L129 PolarHBondContact O-N 3.2Å; L129-A131 VanDerWaalsContact C-N 3.29Å; L129-A131 PolarHBondContact O-N 2.84Å; L129-C132 PolarHBondContact O-N 3.08Å; L129-R133 WeakPolarHBondContact O-CB 3.33Å; L129-R133 WeakPolarHBondContact O-CG 3.41Å; L129-R133 PolarHBondContact O-N 3.34Å; L129-L159 HydrophobicContact CD1-CD1 3.59Å; L129-L159 HydrophobicContact CD2-CD1 4.03Å; L129-L159 HydrophobicContact CG-CD1 4.4Å; L129-D162 HydrophobicContact CD2-CB 3.77Å
130	S	88.6	Confident	87.9	Confident	21 Å²	21	45 Å²	45	15%	0.147	23%	0.226	C	C	.	.	H	α-helix	trans	-59	-42.1	177.1	70.2	0	0	0	0	111.5	V126 V127 M134	V126-S130 VanDerWaalsContact O-CB 3.31Å; V126-S130 WeakPolarHBondContact O-CB 3.31Å; V126-S130 PolarHBondContact O-N 3.12Å; V126-S130 PolarHBondContact O-OG 3.42Å; V127-S130 PolarHBondContact O-N 3.28Å; V127-S130 PolarHBondContact O-OG 3.06Å; S130-M134 WeakPolarHBondContact O-CB 3.47Å; S130-M134 PolarHBondContact O-N 2.9Å
131	A	90.7	Very high	86.7	Confident	2 Å²	2	41.7 Å²	41.7	2%	0.017	23%	0.23	C	C	.	.	H	α-helix	trans	-64.9	-45.7	176.5	0	0	0	0	0	112.3	V127 P128 L129 Y135 I169 V170	V127-A131 PolarHBondContact O-N 3.17Å; V127-A131 VanDerWaalsContact O-N 3.11Å; P128-A131 PolarHBondContact O-N 3.18Å; L129-A131 VanDerWaalsContact C-N 3.29Å; L129-A131 PolarHBondContact O-N 2.84Å; A131-Y135 VanDerWaalsContact O-CB 3.28Å; A131-Y135 WeakPolarHBondContact O-CB 3.31Å; A131-Y135 PolarHBondContact O-N 3.37Å; A131-I169 HydrophobicContact CB-CG2 4.19Å; A131-V170 HydrophobicContact CB-CG2 3.65Å
132	C	89.6	Confident	85.7	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.014	23%	0.226	C	C	.	.	H	α-helix	trans	-63.6	-46.2	178.5	-175	0	0	0	0	112.2	P128 L129 Y135 R136 D162	P128-C132 WeakPolarHBondContact O-CB 3.48Å; P128-C132 PolarHBondContact O-N 3.34Å; L129-C132 PolarHBondContact O-N 3.08Å; C132-Y135 PolarHBondContact O-N 3.27Å; C132-R136 WeakPolarHBondContact O-CG 3.39Å; C132-R136 PolarHBondContact O-N 3.14Å; C132-D162 WeakPolarHBondContact CB-O 3.49Å
133	R	86.5	Confident	84.6	Confident	20 Å²	20	45.6 Å²	45.6	8%	0.075	25%	0.254	C	S	.	.	H	α-helix	trans	-67	-42.3	179.4	-64.6	-73.1	178.9	-162	-9.2	111.4	L129 R136 C137 D152 S155 D162	L129-R133 WeakPolarHBondContact O-CB 3.33Å; L129-R133 WeakPolarHBondContact O-CG 3.41Å; L129-R133 PolarHBondContact O-N 3.34Å; R133-R136 PolarHBondContact O-N 2.97Å; R133-C137 VanDerWaalsContact O-CB 3.31Å; R133-C137 WeakPolarHBondContact O-CB 3.5Å; R133-C137 PolarHBondContact O-N 3.04Å; R133-D152 WeakPolarHBondContact CD-OD2 3.4Å; R133-D152 IonicContact CZ-OD2 2.83Å; R133-D152 PolarHBondContact NE-O 2.79Å; R133-D152 IonicContact NE-OD2 3.2Å; R133-D152 IonicContact NH1-OD1 3.61Å; R133-D152 PolarHBondContact NH1-OD1 3.19Å; R133-D152 IonicContact NH1-OD2 3.91Å; R133-D152 PolarHBondContact NH1-OD2 3.45Å; R133-S155 PolarHBondContact NH2-O 2.93Å; R133-D162 IonicContact CZ-OD2 3.57Å; R133-D162 VanDerWaalsContact CZ-OD2 3.3Å; R133-D162 IonicContact NH1-OD2 2.77Å; R133-D162 IonicContact NH2-OD2 3.96Å; R133-D162 PolarHBondContact NH2-OD2 3.14Å
134	M	85.6	Confident	83.6	Confident	44 Å²	44	50.2 Å²	50.2	22%	0.217	28%	0.276	C	S	.	.	H	α-helix	trans	-60.2	-48	174.6	-176.9	59.6	68.1	0	0	111.1	S130 R136 C137 L138 T378	S130-M134 WeakPolarHBondContact O-CB 3.47Å; S130-M134 PolarHBondContact O-N 2.9Å; M134-R136 PolarHBondContact O-N 3.11Å; M134-C137 PolarHBondContact O-N 2.91Å; M134-L138 HydrophobicContact CG-CD1 3.97Å; M134-L138 HydrophobicContact CG-CG 4.45Å; M134-L138 VanDerWaalsContact O-CG 3.31Å; M134-L138 WeakPolarHBondContact O-CG 3.38Å; M134-L138 PolarHBondContact O-N 3.25Å; M134-L138 HydrophobicContact SD-CD1 4.2Å; M134-L138 HydrophobicContact SD-CG 4.19Å; M134-T378 HydrophobicContact CE-CG2 3.77Å; M134-T378 HydrophobicContact CG-CG2 3.8Å; M134-T378 HydrophobicContact SD-CG2 3.72Å
135	Y	88.5	Confident	82.4	Confident	94 Å²	94	48 Å²	48	37%	0.369	27%	0.267	S	S	.	.	H	α-helix	trans	-56.6	-51.1	175.7	179.1	-88.3	0	0	0	111.6	A131 C132 C137 L138 F139 I169 I381	A131-Y135 VanDerWaalsContact O-CB 3.28Å; A131-Y135 WeakPolarHBondContact O-CB 3.31Å; A131-Y135 PolarHBondContact O-N 3.37Å; C132-Y135 PolarHBondContact O-N 3.27Å; Y135-C137 VanDerWaalsContact C-N 3.32Å; Y135-C137 PolarHBondContact O-N 3.03Å; Y135-L138 PolarHBondContact O-N 2.97Å; Y135-F139 HydrophobicContact CD1-CD2 4.27Å; Y135-F139 AromaticContact CD2-CD2 3.86Å; Y135-F139 HydrophobicContact CD2-CD2 3.86Å; Y135-F139 AromaticContact CD2-CE2 3.68Å; Y135-F139 HydrophobicContact CD2-CE2 3.68Å; Y135-F139 HydrophobicContact CE1-CD2 4.04Å; Y135-F139 HydrophobicContact CE1-CE2 4.5Å; Y135-F139 AromaticContact CE2-CD2 3.63Å; Y135-F139 HydrophobicContact CE2-CD2 3.63Å; Y135-F139 AromaticContact CE2-CE2 3.28Å; Y135-F139 HydrophobicContact CE2-CE2 3.28Å; Y135-F139 HydrophobicContact CE2-CZ 4.13Å; Y135-F139 HydrophobicContact CG-CD2 4.18Å; Y135-F139 HydrophobicContact CG-CE2 4.44Å; Y135-F139 AromaticContact CZ-CD2 3.71Å; Y135-F139 AromaticContact CZ-CE2 3.74Å; Y135-F139 WeakPolarHBondContact O-CD2 3.36Å; Y135-F139 PolarHBondContact O-N 3.37Å; Y135-F139 VanDerWaalsContact O-N 3.09Å; Y135-I169 HydrophobicContact CD1-CD1 4.27Å; Y135-I169 HydrophobicContact CD2-CD1 4.32Å; Y135-I169 HydrophobicContact CG-CD1 3.9Å; Y135-I381 HydrophobicContact CD2-CG2 4.14Å
136	R	85	Confident	81.2	Confident	82 Å²	82	50.7 Å²	50.7	31%	0.309	28%	0.279	S	S	.	.	H	α-helix	trans	-60.3	-41.8	177	-73.4	-177.1	-179.6	171.1	7.3	111.9	C132 R133 M134 F139 T140 D162	C132-R136 WeakPolarHBondContact O-CG 3.39Å; C132-R136 PolarHBondContact O-N 3.14Å; R133-R136 PolarHBondContact O-N 2.97Å; M134-R136 PolarHBondContact O-N 3.11Å; R136-F139 PolarHBondContact O-N 2.8Å; R136-T140 VanDerWaalsContact O-CB 3.28Å; R136-T140 WeakPolarHBondContact O-CB 3.37Å; R136-T140 WeakPolarHBondContact O-CG2 3.31Å; R136-T140 PolarHBondContact O-N 3.37Å; R136-T140 PolarHBondContact O-OG1 3.49Å; R136-D162 IonicContact CZ-OD1 3.8Å; R136-D162 IonicContact NH1-OD1 3.04Å; R136-D162 PolarHBondContact NH1-OD1 2.86Å; R136-D162 IonicContact NH1-OD2 3.12Å; R136-D162 PolarHBondContact NH1-OD2 3.33Å; R136-D162 IonicContact NH2-OD1 2.66Å; R136-D162 PolarHBondContact NH2-OD1 2.67Å
137	C	81.8	Confident	80.4	Confident	15 Å²	15	53.4 Å²	53.4	10%	0.101	29%	0.291	C	S	.	.	H	α-helix	trans	-63	-43.5	179.2	-170.9	0	0	0	0	111.9	R133 M134 Y135 T140 L149	R133-C137 VanDerWaalsContact O-CB 3.31Å; R133-C137 WeakPolarHBondContact O-CB 3.5Å; R133-C137 PolarHBondContact O-N 3.04Å; M134-C137 PolarHBondContact O-N 2.91Å; Y135-C137 VanDerWaalsContact C-N 3.32Å; Y135-C137 PolarHBondContact O-N 3.03Å; C137-T140 PolarHBondContact O-OG1 3.45Å; C137-L149 HydrophobicContact CB-CD1 4.12Å
138	L	83.9	Confident	79.5	Confident	36 Å²	36	55.3 Å²	55.3	19%	0.188	30%	0.302	C	S	.	.	H	α-helix	trans	-63.5	-46.3	179.1	-71.4	169.8	0	0	0	111.5	M134 Y135 I381 V382 F386	M134-L138 HydrophobicContact CG-CD1 3.97Å; M134-L138 HydrophobicContact CG-CG 4.45Å; M134-L138 VanDerWaalsContact O-CG 3.31Å; M134-L138 WeakPolarHBondContact O-CG 3.38Å; M134-L138 PolarHBondContact O-N 3.25Å; M134-L138 HydrophobicContact SD-CD1 4.2Å; M134-L138 HydrophobicContact SD-CG 4.19Å; Y135-L138 PolarHBondContact O-N 2.97Å; L138-I381 HydrophobicContact CD1-CB 4.35Å; L138-I381 HydrophobicContact CD1-CG2 3.58Å; L138-V382 HydrophobicContact CD1-CG2 3.82Å; L138-V382 HydrophobicContact CD2-CG2 4.15Å; L138-F386 HydrophobicContact CB-CD2 3.95Å; L138-F386 HydrophobicContact CB-CE2 4.45Å; L138-F386 WeakPolarHBondContact O-CE2 3.14Å
139	F	84.4	Confident	78.3	Confident	58 Å²	58	57 Å²	57	25%	0.254	31%	0.311	S	S	.	.	H	α-helix	trans	-83.5	-16	-176.6	-75.7	-84.3	0	0	0	115	Y135 R136 G141 A385 Y389	Y135-F139 HydrophobicContact CD1-CD2 4.27Å; Y135-F139 AromaticContact CD2-CD2 3.86Å; Y135-F139 HydrophobicContact CD2-CD2 3.86Å; Y135-F139 AromaticContact CD2-CE2 3.68Å; Y135-F139 HydrophobicContact CD2-CE2 3.68Å; Y135-F139 HydrophobicContact CE1-CD2 4.04Å; Y135-F139 HydrophobicContact CE1-CE2 4.5Å; Y135-F139 AromaticContact CE2-CD2 3.63Å; Y135-F139 HydrophobicContact CE2-CD2 3.63Å; Y135-F139 AromaticContact CE2-CE2 3.28Å; Y135-F139 HydrophobicContact CE2-CE2 3.28Å; Y135-F139 HydrophobicContact CE2-CZ 4.13Å; Y135-F139 HydrophobicContact CG-CD2 4.18Å; Y135-F139 HydrophobicContact CG-CE2 4.44Å; Y135-F139 AromaticContact CZ-CD2 3.71Å; Y135-F139 AromaticContact CZ-CE2 3.74Å; Y135-F139 WeakPolarHBondContact O-CD2 3.36Å; Y135-F139 PolarHBondContact O-N 3.37Å; Y135-F139 VanDerWaalsContact O-N 3.09Å; R136-F139 PolarHBondContact O-N 2.8Å; F139-G141 VanDerWaalsContact C-N 3.31Å; F139-A385 HydrophobicContact CE2-CB 4.31Å; F139-A385 HydrophobicContact CZ-CB 4.1Å; F139-Y389 AromaticContact CD1-CD1 3.93Å; F139-Y389 HydrophobicContact CD1-CD1 3.93Å; F139-Y389 HydrophobicContact CD1-CE1 4.1Å; F139-Y389 HydrophobicContact CD1-CG 4.48Å; F139-Y389 AromaticContact CE1-CD1 3.5Å; F139-Y389 HydrophobicContact CE1-CD1 3.5Å; F139-Y389 HydrophobicContact CE1-CD2 4.42Å; F139-Y389 HydrophobicContact CE1-CE1 4.1Å; F139-Y389 AromaticContact CE1-CG 3.68Å; F139-Y389 HydrophobicContact CE1-CG 3.68Å
140	T	79.9	Confident	77.3	Confident	83 Å²	83	59.7 Å²	59.7	51%	0.509	33%	0.33	S	S	.	.	H	α-helix	trans	-78.4	-16	172.9	49.5	0	0	0	0	113	R136 C137 S142	R136-T140 VanDerWaalsContact O-CB 3.28Å; R136-T140 WeakPolarHBondContact O-CB 3.37Å; R136-T140 WeakPolarHBondContact O-CG2 3.31Å; R136-T140 PolarHBondContact O-N 3.37Å; R136-T140 PolarHBondContact O-OG1 3.49Å; C137-T140 PolarHBondContact O-OG1 3.45Å; T140-S142 PolarHBondContact O-N 3.29Å; T140-S142 VanDerWaalsContact O-N 3.09Å
141	G	65.4	Low	76.5	Confident	65 Å²	65	65.1 Å²	65.1	67%	0.67	36%	0.357	S	S	*	.			trans	66.2	11.4	165.8	0	0	0	0	0	116.5	F139	F139-G141 VanDerWaalsContact C-N 3.31Å
142	S	69	Low	75.4	Confident	46 Å²	46	68.2 Å²	68.2	32%	0.322	37%	0.373	S	S	.	.			trans	-104.5	129.9	-176.4	103.1	0	0	0	0	112.2	T140 F144 S145 L146	T140-S142 PolarHBondContact O-N 3.29Å; T140-S142 VanDerWaalsContact O-N 3.09Å; S142-F144 PolarHBondContact O-N 3.38Å; S142-S145 VanDerWaalsContact O-CB 3.31Å; S142-S145 WeakPolarHBondContact O-CB 3.16Å; S142-S145 PolarHBondContact O-N 3.46Å; S142-S145 WeakPolarHBondContact OG-CB 3.32Å; S142-S145 PolarHBondContact OG-N 3.24Å; S142-S145 PolarHBondContact OG-OG 3.48Å; S142-L146 PolarHBondContact O-N 3.01Å
143	V	66.6	Low	74.4	Confident	111 Å²	111	72.9 Å²	72.9	67%	0.673	40%	0.396	S	S	*	.	H	α-helix	trans	-60.3	-32.4	172.3	-178.6	0	0	0	0	110.4	S145 L146 L147	V143-S145 VanDerWaalsContact C-N 3.3Å; V143-S145 PolarHBondContact O-N 3.46Å; V143-L146 WeakPolarHBondContact O-CB 3.12Å; V143-L146 PolarHBondContact O-N 2.9Å; V143-L147 HydrophobicContact CG1-CD1 4Å; V143-L147 WeakPolarHBondContact O-CD1 3.42Å; V143-L147 PolarHBondContact O-N 3.38Å
144	F	69.9	Low	73.5	Confident	155 Å²	155	77.4 Å²	77.4	68%	0.68	43%	0.425	S	S	*	.	H	α-helix	trans	-60.3	-39.5	174.1	-174.9	-102.1	0	0	0	112	S142 L146 L147 T148	S142-F144 PolarHBondContact O-N 3.38Å; F144-L146 VanDerWaalsContact C-N 3.29Å; F144-L146 PolarHBondContact O-N 2.9Å; F144-L147 PolarHBondContact O-N 3.22Å; F144-L147 VanDerWaalsContact O-N 3.16Å; F144-T148 HydrophobicContact CD1-CG2 4.07Å; F144-T148 HydrophobicContact CE1-CG2 3.62Å; F144-T148 HydrophobicContact CE2-CG2 4.28Å; F144-T148 HydrophobicContact CZ-CG2 3.74Å; F144-T148 WeakPolarHBondContact O-CG2 3.2Å; F144-T148 PolarHBondContact O-N 2.93Å; F144-T148 PolarHBondContact O-OG1 3.03Å
145	S	65.1	Low	72.8	Confident	29 Å²	29	77.1 Å²	77.1	20%	0.203	43%	0.428	C	S	.	.	H	α-helix	trans	-60.6	-37.3	176.1	-64.4	0	0	0	0	112	S142 V143 T148 L149	S142-S145 VanDerWaalsContact O-CB 3.31Å; S142-S145 WeakPolarHBondContact O-CB 3.16Å; S142-S145 PolarHBondContact O-N 3.46Å; S142-S145 WeakPolarHBondContact OG-CB 3.32Å; S142-S145 PolarHBondContact OG-N 3.24Å; S142-S145 PolarHBondContact OG-OG 3.48Å; V143-S145 VanDerWaalsContact C-N 3.3Å; V143-S145 PolarHBondContact O-N 3.46Å; S145-T148 WeakPolarHBondContact CA-OG1 3.35Å; S145-T148 CarbonylContact O-C 3.55Å; S145-T148 PolarHBondContact O-N 2.93Å; S145-T148 PolarHBondContact O-OG1 3.26Å; S145-T148 VanDerWaalsContact O-OG1 3.05Å; S145-L149 PolarHBondContact O-N 3.43Å
146	L	63.8	Low	71.9	Confident	103 Å²	103	78.1 Å²	78.1	54%	0.539	44%	0.444	S	S	.	.	H	α-helix	trans	-65.2	-42.1	174.8	-74.4	166.6	0	0	0	112	S142 V143 F144 T148 L149	S142-L146 PolarHBondContact O-N 3.01Å; V143-L146 WeakPolarHBondContact O-CB 3.12Å; V143-L146 PolarHBondContact O-N 2.9Å; F144-L146 VanDerWaalsContact C-N 3.29Å; F144-L146 PolarHBondContact O-N 2.9Å; L146-T148 VanDerWaalsContact C-N 3.33Å; L146-L149 HydrophobicContact CD2-CD1 4.32Å; L146-L149 WeakPolarHBondContact O-CB 3.46Å; L146-L149 PolarHBondContact O-N 3.44Å
147	L	71.5	Confident	71.3	Confident	127 Å²	127	81.8 Å²	81.8	67%	0.665	46%	0.462	S	S	*	.	H	α-helix	trans	-67.4	-34.8	176.3	-84.1	82.9	0	0	0	111.9	V143 F144 L149	V143-L147 HydrophobicContact CG1-CD1 4Å; V143-L147 WeakPolarHBondContact O-CD1 3.42Å; V143-L147 PolarHBondContact O-N 3.38Å; F144-L147 PolarHBondContact O-N 3.22Å; F144-L147 VanDerWaalsContact O-N 3.16Å; L147-L149 VanDerWaalsContact C-N 3.33Å
148	T	73.8	Confident	71.2	Confident	42 Å²	42	87.6 Å²	87.6	26%	0.258	49%	0.487	S	S	.	.	H	α-helix	trans	-82.3	-8	176.2	59.8	0	0	0	0	113.9	F144 S145 L146 L151 D152	F144-T148 HydrophobicContact CD1-CG2 4.07Å; F144-T148 HydrophobicContact CE1-CG2 3.62Å; F144-T148 HydrophobicContact CE2-CG2 4.28Å; F144-T148 HydrophobicContact CZ-CG2 3.74Å; F144-T148 WeakPolarHBondContact O-CG2 3.2Å; F144-T148 PolarHBondContact O-N 2.93Å; F144-T148 PolarHBondContact O-OG1 3.03Å; S145-T148 WeakPolarHBondContact CA-OG1 3.35Å; S145-T148 CarbonylContact O-C 3.55Å; S145-T148 PolarHBondContact O-N 2.93Å; S145-T148 PolarHBondContact O-OG1 3.26Å; S145-T148 VanDerWaalsContact O-OG1 3.05Å; L146-T148 VanDerWaalsContact C-N 3.33Å; T148-L151 CarbonylContact O-C 3.55Å; T148-L151 WeakPolarHBondContact O-CA 3.45Å; T148-L151 WeakPolarHBondContact O-CB 3.38Å; T148-L151 PolarHBondContact O-N 3.45Å; T148-D152 PolarHBondContact O-N 3.32Å
149	L	66.6	Low	71.1	Confident	39 Å²	39	89.5 Å²	89.5	20%	0.204	50%	0.497	C	S	.	.	H	α-helix	trans	-50	-48.6	-176.4	-166.3	151.5	0	0	0	113.3	C137 S145 L146 L147 L151 D152 M153	C137-L149 HydrophobicContact CB-CD1 4.12Å; S145-L149 PolarHBondContact O-N 3.43Å; L146-L149 HydrophobicContact CD2-CD1 4.32Å; L146-L149 WeakPolarHBondContact O-CB 3.46Å; L146-L149 PolarHBondContact O-N 3.44Å; L147-L149 VanDerWaalsContact C-N 3.33Å; L149-L151 VanDerWaalsContact C-N 3.28Å; L149-L151 PolarHBondContact O-N 2.99Å; L149-D152 PolarHBondContact O-N 3.24Å; L149-M153 HydrophobicContact CD2-CE 4.23Å; L149-M153 HydrophobicContact CD2-CG 3.89Å; L149-M153 HydrophobicContact CD2-SD 3.91Å; L149-M153 WeakPolarHBondContact O-CB 3.41Å; L149-M153 VanDerWaalsContact O-CG 3.26Å; L149-M153 WeakPolarHBondContact O-CG 3.49Å; L149-M153 PolarHBondContact O-N 3.45Å
150	P	67.4	Low	71	Confident	79 Å²	79	93.4 Å²	93.4	51%	0.513	52%	0.52	S	S	.	.	H	α-helix	trans	-62.8	-31.3	176.6	21.6	-32.1	0	0	0	113.8
151	L	71	Confident	71.3	Confident	136 Å²	136	94.2 Å²	94.2	71%	0.712	52%	0.518	S	S	*	.	H	α-helix	trans	-77.2	-39.2	176.3	-65	173.1	0	0	0	111.6	T148 L149 V154	T148-L151 CarbonylContact O-C 3.55Å; T148-L151 WeakPolarHBondContact O-CA 3.45Å; T148-L151 WeakPolarHBondContact O-CB 3.38Å; T148-L151 PolarHBondContact O-N 3.45Å; L149-L151 VanDerWaalsContact C-N 3.28Å; L149-L151 PolarHBondContact O-N 2.99Å; L151-V154 PolarHBondContact O-N 3.43Å
152	D	67.9	Low	72.4	Confident	66 Å²	66	91.2 Å²	91.2	35%	0.353	49%	0.486	S	S	.	.	H	α-helix	trans	-73.6	-27.1	177.7	-164.1	48.6	0	0	0	112.4	R133 T148 L149 V154 S155	R133-D152 WeakPolarHBondContact CD-OD2 3.4Å; R133-D152 IonicContact CZ-OD2 2.83Å; R133-D152 PolarHBondContact NE-O 2.79Å; R133-D152 IonicContact NE-OD2 3.2Å; R133-D152 IonicContact NH1-OD1 3.61Å; R133-D152 PolarHBondContact NH1-OD1 3.19Å; R133-D152 IonicContact NH1-OD2 3.91Å; R133-D152 PolarHBondContact NH1-OD2 3.45Å; T148-D152 PolarHBondContact O-N 3.32Å; L149-D152 PolarHBondContact O-N 3.24Å; D152-V154 PolarHBondContact O-N 2.99Å; D152-S155 VanDerWaalsContact O-CB 3.28Å; D152-S155 WeakPolarHBondContact O-CB 3.42Å; D152-S155 PolarHBondContact O-N 3.15Å
153	M	67.9	Low	73.4	Confident	101 Å²	101	89.9 Å²	89.9	50%	0.498	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-28.1	170.2	-80.1	-156.5	-53.6	0	0	112.6	L149	L149-M153 HydrophobicContact CD2-CE 4.23Å; L149-M153 HydrophobicContact CD2-CG 3.89Å; L149-M153 HydrophobicContact CD2-SD 3.91Å; L149-M153 WeakPolarHBondContact O-CB 3.41Å; L149-M153 VanDerWaalsContact O-CG 3.26Å; L149-M153 WeakPolarHBondContact O-CG 3.49Å; L149-M153 PolarHBondContact O-N 3.45Å
154	V	67.8	Low	74.6	Confident	115 Å²	115	88.4 Å²	88.4	70%	0.697	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-5.7	179.7	-176.1	0	0	0	0	112.2	L151 D152 T156	L151-V154 PolarHBondContact O-N 3.43Å; D152-V154 PolarHBondContact O-N 2.99Å; V154-T156 PolarHBondContact O-N 3.33Å
155	S	70.7	Confident	75.5	Confident	38 Å²	38	84.5 Å²	84.5	27%	0.266	45%	0.452	S	S	.	.			trans	-65.4	118.3	-179	-171.3	0	0	0	0	111.7	R133 D152 K157	R133-S155 PolarHBondContact NH2-O 2.93Å; D152-S155 VanDerWaalsContact O-CB 3.28Å; D152-S155 WeakPolarHBondContact O-CB 3.42Å; D152-S155 PolarHBondContact O-N 3.15Å; S155-K157 VanDerWaalsContact C-N 3.35Å
156	T	71.4	Confident	76.8	Confident	114 Å²	114	83.1 Å²	83.1	70%	0.699	44%	0.442	S	S	*	.			trans	-85.8	-2.8	-178.5	55.9	0	0	0	0	114	V154 H158 L159	V154-T156 PolarHBondContact O-N 3.33Å; T156-H158 PolarHBondContact O-N 3.4Å; T156-L159 PolarHBondContact O-N 3.21Å
157	K	72.2	Confident	78.2	Confident	160 Å²	160	83.1 Å²	83.1	70%	0.696	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	127.6	-179.4	-63.4	-178.2	-177	175.4	0	109.4	S155 L159	S155-K157 VanDerWaalsContact C-N 3.35Å; K157-L159 VanDerWaalsContact C-N 3.3Å; K157-L159 PolarHBondContact O-N 3.47Å
158	H	78.2	Confident	79.3	Confident	136 Å²	136	81.4 Å²	81.4	63%	0.63	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	29	-178	-55.1	-80.8	0	0	0	115.7	T156 L160 Q161 D162	T156-H158 PolarHBondContact O-N 3.4Å; H158-L160 VanDerWaalsContact C-N 3.3Å; H158-L160 PolarHBondContact O-N 2.91Å; H158-L160 VanDerWaalsContact O-N 3.12Å; H158-Q161 HydrophobicContact CB-CB 4.35Å; H158-Q161 PolarHBondContact O-N 3.27Å; H158-D162 PolarHBondContact O-N 3.1Å
159	L	81.9	Confident	80.1	Confident	76 Å²	76	80.7 Å²	80.7	40%	0.398	42%	0.423	S	S	.	.	H	α-helix	trans	-45.1	-48.5	-178.8	-172.1	72.7	0	0	0	113.9	L129 T156 K157 D162 C163	L129-L159 HydrophobicContact CD1-CD1 3.59Å; L129-L159 HydrophobicContact CD2-CD1 4.03Å; L129-L159 HydrophobicContact CG-CD1 4.4Å; T156-L159 PolarHBondContact O-N 3.21Å; K157-L159 VanDerWaalsContact C-N 3.3Å; K157-L159 PolarHBondContact O-N 3.47Å; L159-D162 PolarHBondContact O-N 3.45Å; L159-C163 WeakPolarHBondContact O-CB 3.38Å; L159-C163 PolarHBondContact O-N 3.44Å; L159-C163 PolarHBondContact O-SG 2.84Å
160	L	83.2	Confident	81.3	Confident	141 Å²	141	79.3 Å²	79.3	74%	0.738	42%	0.416	S	S	*	.	H	α-helix	trans	-64.5	-43.6	-177.8	-179.3	64	0	0	0	112.5	H158 D162 C163 V164	H158-L160 VanDerWaalsContact C-N 3.3Å; H158-L160 PolarHBondContact O-N 2.91Å; H158-L160 VanDerWaalsContact O-N 3.12Å; L160-D162 VanDerWaalsContact C-N 3.34Å; L160-C163 PolarHBondContact O-N 2.98Å; L160-V164 HydrophobicContact CD1-CG2 4.41Å; L160-V164 WeakPolarHBondContact O-CG2 3.29Å; L160-V164 PolarHBondContact O-N 3.06Å
161	Q	86.6	Confident	82.5	Confident	99 Å²	99	79.6 Å²	79.6	46%	0.463	41%	0.413	S	S	.	.	H	α-helix	trans	-65.3	-42.3	178.6	179.6	179.6	-12.7	0	0	110.5	H158 V164 Q165	H158-Q161 HydrophobicContact CB-CB 4.35Å; H158-Q161 PolarHBondContact O-N 3.27Å; Q161-V164 PolarHBondContact O-N 3.47Å; Q161-Q165 WeakPolarHBondContact O-CB 3.4Å; Q161-Q165 WeakPolarHBondContact O-CG 3.38Å; Q161-Q165 PolarHBondContact O-N 3.05Å
162	D	88.5	Confident	83.5	Confident	2 Å²	2	78.6 Å²	78.6	1%	0.011	41%	0.407	C	S	.	.	H	α-helix	trans	-66.2	-39.4	178.4	-69.2	-7	0	0	0	111.3	L129 C132 R133 R136 H158 L159 L160 G166	L129-D162 HydrophobicContact CD2-CB 3.77Å; C132-D162 WeakPolarHBondContact CB-O 3.49Å; R133-D162 IonicContact CZ-OD2 3.57Å; R133-D162 VanDerWaalsContact CZ-OD2 3.3Å; R133-D162 IonicContact NH1-OD2 2.77Å; R133-D162 IonicContact NH2-OD2 3.96Å; R133-D162 PolarHBondContact NH2-OD2 3.14Å; R136-D162 IonicContact CZ-OD1 3.8Å; R136-D162 IonicContact NH1-OD1 3.04Å; R136-D162 PolarHBondContact NH1-OD1 2.86Å; R136-D162 IonicContact NH1-OD2 3.12Å; R136-D162 PolarHBondContact NH1-OD2 3.33Å; R136-D162 IonicContact NH2-OD1 2.66Å; R136-D162 PolarHBondContact NH2-OD1 2.67Å; H158-D162 PolarHBondContact O-N 3.1Å; L159-D162 PolarHBondContact O-N 3.45Å; L160-D162 VanDerWaalsContact C-N 3.34Å; D162-G166 PolarHBondContact O-N 3.33Å
163	C	89.5	Confident	84.5	Confident	19 Å²	19	76 Å²	76	13%	0.128	40%	0.395	C	S	.	.	H	α-helix	trans	-63.8	-43.6	173.3	-73.4	0	0	0	0	112.3	L159 L160 G166 F167	L159-C163 WeakPolarHBondContact O-CB 3.38Å; L159-C163 PolarHBondContact O-N 3.44Å; L159-C163 PolarHBondContact O-SG 2.84Å; L160-C163 PolarHBondContact O-N 2.98Å; C163-G166 PolarHBondContact O-N 3.01Å; C163-F167 WeakPolarHBondContact O-CB 3.2Å; C163-F167 PolarHBondContact O-N 3.31Å
164	V	91	Very high	85.5	Confident	79 Å²	79	74.4 Å²	74.4	48%	0.479	39%	0.388	S	S	.	.	H	α-helix	trans	-64.6	-46.6	179	172.5	0	0	0	0	110.5	L160 Q161 G166 F167 I168	L160-V164 HydrophobicContact CD1-CG2 4.41Å; L160-V164 WeakPolarHBondContact O-CG2 3.29Å; L160-V164 PolarHBondContact O-N 3.06Å; Q161-V164 PolarHBondContact O-N 3.47Å; V164-G166 VanDerWaalsContact C-N 3.33Å; V164-G166 PolarHBondContact O-N 3.08Å; V164-F167 PolarHBondContact O-N 2.71Å; V164-I168 HydrophobicContact CG1-CD1 4.29Å; V164-I168 WeakPolarHBondContact O-CG1 3.46Å; V164-I168 PolarHBondContact O-N 3.28Å; V164-I168 VanDerWaalsContact O-N 3.1Å
165	Q	90.1	Very high	86.5	Confident	74 Å²	74	71.6 Å²	71.6	35%	0.346	38%	0.377	S	S	.	.	H	α-helix	trans	-61.3	-43.8	174.9	-72.4	-178	-14.6	0	0	111.4	Q161 F167 I168 I169	Q161-Q165 WeakPolarHBondContact O-CB 3.4Å; Q161-Q165 WeakPolarHBondContact O-CG 3.38Å; Q161-Q165 PolarHBondContact O-N 3.05Å; Q165-F167 VanDerWaalsContact C-N 3.34Å; Q165-F167 PolarHBondContact O-N 3.43Å; Q165-I168 WeakPolarHBondContact O-CB 3.47Å; Q165-I168 PolarHBondContact O-N 2.92Å; Q165-I169 WeakPolarHBondContact O-CG1 3.46Å; Q165-I169 PolarHBondContact O-N 3.47Å
166	G	92.5	Very high	87.3	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-58.9	-43.1	175.6	0	0	0	0	0	113.1	P128 D162 C163 V164 I168 I169 V170	P128-G166 WeakPolarHBondContact O-CA 3.49Å; D162-G166 PolarHBondContact O-N 3.33Å; C163-G166 PolarHBondContact O-N 3.01Å; V164-G166 VanDerWaalsContact C-N 3.33Å; V164-G166 PolarHBondContact O-N 3.08Å; G166-I168 VanDerWaalsContact C-N 3.34Å; G166-I168 PolarHBondContact O-N 3.21Å; G166-I169 PolarHBondContact O-N 2.98Å; G166-V170 VanDerWaalsContact O-CG2 3.28Å; G166-V170 WeakPolarHBondContact O-CG2 3.49Å; G166-V170 PolarHBondContact O-N 2.89Å
167	F	93.4	Very high	88.2	Confident	102 Å²	102	68.9 Å²	68.9	45%	0.447	36%	0.358	S	S	.	.	H	α-helix	trans	-65.4	-39	178.6	-168.1	-106.2	0	0	0	111.6	P128 C163 V164 Q165 V170 I171	P128-F167 HydrophobicContact CG-CD2 4.39Å; C163-F167 WeakPolarHBondContact O-CB 3.2Å; C163-F167 PolarHBondContact O-N 3.31Å; V164-F167 PolarHBondContact O-N 2.71Å; Q165-F167 VanDerWaalsContact C-N 3.34Å; Q165-F167 PolarHBondContact O-N 3.43Å; F167-V170 PolarHBondContact O-N 3.38Å; F167-I171 HydrophobicContact CD1-CD1 3.52Å; F167-I171 HydrophobicContact CD1-CG1 4.31Å; F167-I171 HydrophobicContact CE1-CD1 3.25Å; F167-I171 HydrophobicContact CE1-CG1 4.12Å; F167-I171 HydrophobicContact CG-CD1 4.42Å; F167-I171 HydrophobicContact CZ-CD1 3.95Å; F167-I171 HydrophobicContact CZ-CG1 4.42Å; F167-I171 WeakPolarHBondContact O-CB 3.32Å; F167-I171 WeakPolarHBondContact O-CG1 3.25Å; F167-I171 PolarHBondContact O-N 3.33Å
168	I	93.2	Very high	89	Confident	91 Å²	91	66 Å²	66	47%	0.467	35%	0.35	S	S	.	.	H	α-helix	trans	-60.8	-46.2	172.6	-66.1	165.3	0	0	0	110.4	V164 Q165 G166 V170 I171 L172	V164-I168 HydrophobicContact CG1-CD1 4.29Å; V164-I168 WeakPolarHBondContact O-CG1 3.46Å; V164-I168 PolarHBondContact O-N 3.28Å; V164-I168 VanDerWaalsContact O-N 3.1Å; Q165-I168 WeakPolarHBondContact O-CB 3.47Å; Q165-I168 PolarHBondContact O-N 2.92Å; G166-I168 VanDerWaalsContact C-N 3.34Å; G166-I168 PolarHBondContact O-N 3.21Å; I168-V170 PolarHBondContact O-N 3.03Å; I168-I171 PolarHBondContact O-N 2.85Å; I168-L172 HydrophobicContact CG2-CD1 4Å; I168-L172 HydrophobicContact CG2-CG 4.5Å; I168-L172 VanDerWaalsContact O-CG 3.32Å; I168-L172 WeakPolarHBondContact O-CG 3.16Å; I168-L172 PolarHBondContact O-N 2.97Å
169	I	91.7	Very high	89.4	Confident	28 Å²	28	61.4 Å²	61.4	14%	0.144	34%	0.339	C	S	.	.	H	α-helix	trans	-62	-44.7	178.3	-66.3	163.5	0	0	0	110.9	A131 Y135 Q165 G166 L172 A173 I381	A131-I169 HydrophobicContact CB-CG2 4.19Å; Y135-I169 HydrophobicContact CD1-CD1 4.27Å; Y135-I169 HydrophobicContact CD2-CD1 4.32Å; Y135-I169 HydrophobicContact CG-CD1 3.9Å; Q165-I169 WeakPolarHBondContact O-CG1 3.46Å; Q165-I169 PolarHBondContact O-N 3.47Å; G166-I169 PolarHBondContact O-N 2.98Å; I169-L172 PolarHBondContact O-N 3.15Å; I169-A173 WeakPolarHBondContact O-CB 3.16Å; I169-A173 PolarHBondContact O-N 3.19Å; I169-I381 HydrophobicContact CG2-CD1 3.87Å; I169-I381 HydrophobicContact CG2-CG1 4.21Å
170	V	92	Very high	89.7	Confident	10 Å²	10	61.8 Å²	61.8	6%	0.061	34%	0.335	C	S	.	.	H	α-helix	trans	-62.6	-43.3	177.6	172.5	0	0	0	0	110.9	V127 A131 G166 F167 I168 L172 A173 L174	V127-V170 HydrophobicContact CG1-CG1 4.42Å; V127-V170 HydrophobicContact CG1-CG2 4.01Å; A131-V170 HydrophobicContact CB-CG2 3.65Å; G166-V170 VanDerWaalsContact O-CG2 3.28Å; G166-V170 WeakPolarHBondContact O-CG2 3.49Å; G166-V170 PolarHBondContact O-N 2.89Å; F167-V170 PolarHBondContact O-N 3.38Å; I168-V170 PolarHBondContact O-N 3.03Å; V170-L172 VanDerWaalsContact C-N 3.33Å; V170-L172 PolarHBondContact O-N 3.19Å; V170-A173 PolarHBondContact O-N 2.94Å; V170-L174 HydrophobicContact CG1-CD1 3.89Å; V170-L174 HydrophobicContact CG1-CG 4.27Å; V170-L174 WeakPolarHBondContact O-CB 3.29Å; V170-L174 VanDerWaalsContact O-CG 3.27Å; V170-L174 WeakPolarHBondContact O-CG 3.32Å; V170-L174 PolarHBondContact O-N 3.43Å
171	I	91.8	Very high	89.9	Confident	85 Å²	85	57.7 Å²	57.7	44%	0.436	32%	0.316	S	S	.	.	H	α-helix	trans	-59.6	-45.5	175.1	-74.9	170.9	0	0	0	110.8	F167 I168 L174 A175	F167-I171 HydrophobicContact CD1-CD1 3.52Å; F167-I171 HydrophobicContact CD1-CG1 4.31Å; F167-I171 HydrophobicContact CE1-CD1 3.25Å; F167-I171 HydrophobicContact CE1-CG1 4.12Å; F167-I171 HydrophobicContact CG-CD1 4.42Å; F167-I171 HydrophobicContact CZ-CD1 3.95Å; F167-I171 HydrophobicContact CZ-CG1 4.42Å; F167-I171 WeakPolarHBondContact O-CB 3.32Å; F167-I171 WeakPolarHBondContact O-CG1 3.25Å; F167-I171 PolarHBondContact O-N 3.33Å; I168-I171 PolarHBondContact O-N 2.85Å; I171-L174 PolarHBondContact O-N 2.99Å; I171-A175 VanDerWaalsContact O-CB 3.3Å; I171-A175 WeakPolarHBondContact O-CB 3.35Å; I171-A175 PolarHBondContact O-N 3.25Å
172	L	91.3	Very high	89.9	Confident	115 Å²	115	55.7 Å²	55.7	60%	0.602	31%	0.313	S	S	*	.	H	α-helix	trans	-65.4	-41	179.3	-70.6	171.8	0	0	0	111.8	I168 I169 V170 A175 A176	I168-L172 HydrophobicContact CG2-CD1 4Å; I168-L172 HydrophobicContact CG2-CG 4.5Å; I168-L172 VanDerWaalsContact O-CG 3.32Å; I168-L172 WeakPolarHBondContact O-CG 3.16Å; I168-L172 PolarHBondContact O-N 2.97Å; I169-L172 PolarHBondContact O-N 3.15Å; V170-L172 VanDerWaalsContact C-N 3.33Å; V170-L172 PolarHBondContact O-N 3.19Å; L172-A175 PolarHBondContact O-N 2.93Å; L172-A176 WeakPolarHBondContact O-CB 3.29Å; L172-A176 PolarHBondContact O-N 3.43Å
173	A	89.9	Confident	89.8	Confident	11 Å²	11	56.2 Å²	56.2	9%	0.091	32%	0.316	C	S	.	.	H	α-helix	trans	-64.9	-42.8	175.9	0	0	0	0	0	111.7	I169 V170 A176 F177 N377 F380	I169-A173 WeakPolarHBondContact O-CB 3.16Å; I169-A173 PolarHBondContact O-N 3.19Å; V170-A173 PolarHBondContact O-N 2.94Å; A173-A176 PolarHBondContact O-N 3.43Å; A173-F177 WeakPolarHBondContact O-CB 3.46Å; A173-F177 PolarHBondContact O-N 2.82Å; A173-N377 WeakPolarHBondContact CB-OD1 3.5Å; A173-F380 HydrophobicContact CB-CB 4.45Å
174	L	89	Confident	89.8	Confident	67 Å²	67	62 Å²	62	35%	0.351	34%	0.335	S	S	.	.	H	α-helix	trans	-64.7	-41.3	174.1	-73.2	174.4	0	0	0	111.7	V170 I171 A176 F177 L178 L373	V170-L174 HydrophobicContact CG1-CD1 3.89Å; V170-L174 HydrophobicContact CG1-CG 4.27Å; V170-L174 WeakPolarHBondContact O-CB 3.29Å; V170-L174 VanDerWaalsContact O-CG 3.27Å; V170-L174 WeakPolarHBondContact O-CG 3.32Å; V170-L174 PolarHBondContact O-N 3.43Å; I171-L174 PolarHBondContact O-N 2.99Å; L174-A176 VanDerWaalsContact C-N 3.33Å; L174-A176 PolarHBondContact O-N 3.2Å; L174-F177 PolarHBondContact O-N 2.92Å; L174-L178 WeakPolarHBondContact O-CB 3.45Å; L174-L178 VanDerWaalsContact O-CG 3.29Å; L174-L178 WeakPolarHBondContact O-CG 3.2Å; L174-L178 PolarHBondContact O-N 3.07Å; L174-L373 HydrophobicContact CD2-CD1 4.05Å
175	A	88.9	Confident	89.5	Confident	57 Å²	57	62.8 Å²	62.8	47%	0.471	33%	0.334	S	S	.	.	H	α-helix	trans	-62.8	-40.6	174.9	0	0	0	0	0	111.4	I171 L172 L178 G179	I171-A175 VanDerWaalsContact O-CB 3.3Å; I171-A175 WeakPolarHBondContact O-CB 3.35Å; I171-A175 PolarHBondContact O-N 3.25Å; L172-A175 PolarHBondContact O-N 2.93Å; A175-L178 PolarHBondContact O-N 2.82Å; A175-G179 PolarHBondContact O-N 3.03Å
176	A	87.9	Confident	89.3	Confident	37 Å²	37	60.5 Å²	60.5	31%	0.306	32%	0.323	S	S	.	.	H	α-helix	trans	-64.8	-40.9	173.6	0	0	0	0	0	111.9	L172 A173 L174 G179 Y180 F380	L172-A176 WeakPolarHBondContact O-CB 3.29Å; L172-A176 PolarHBondContact O-N 3.43Å; A173-A176 PolarHBondContact O-N 3.43Å; L174-A176 VanDerWaalsContact C-N 3.33Å; L174-A176 PolarHBondContact O-N 3.2Å; A176-G179 PolarHBondContact O-N 3.15Å; A176-Y180 WeakPolarHBondContact O-CB 3.45Å; A176-Y180 PolarHBondContact O-N 2.96Å; A176-F380 HydrophobicContact CB-CD1 3.93Å; A176-F380 HydrophobicContact CB-CE1 4.17Å
177	F	90.1	Very high	89	Confident	57 Å²	57	61.1 Å²	61.1	25%	0.25	33%	0.326	C	S	.	.	H	α-helix	trans	-63.6	-47.2	175.1	175.8	-99.7	0	0	0	111.9	A173 L174 G179 Y180 V181 L376 F380	A173-F177 WeakPolarHBondContact O-CB 3.46Å; A173-F177 PolarHBondContact O-N 2.82Å; L174-F177 PolarHBondContact O-N 2.92Å; F177-G179 VanDerWaalsContact C-N 3.3Å; F177-G179 PolarHBondContact O-N 2.81Å; F177-Y180 WeakPolarHBondContact O-CB 3.26Å; F177-Y180 PolarHBondContact O-N 3.35Å; F177-V181 HydrophobicContact CD1-CG2 4.27Å; F177-V181 HydrophobicContact CE1-CG2 3.82Å; F177-V181 HydrophobicContact CE2-CG2 4.11Å; F177-V181 HydrophobicContact CZ-CG2 3.73Å; F177-V181 WeakPolarHBondContact O-CG2 3.41Å; F177-V181 PolarHBondContact O-N 3.43Å; F177-L376 HydrophobicContact CD2-CD1 4.37Å; F177-L376 HydrophobicContact CD2-CD2 3.91Å; F177-L376 HydrophobicContact CE2-CD1 4.43Å; F177-L376 HydrophobicContact CE2-CD2 4.09Å; F177-L376 HydrophobicContact CG-CD2 4.29Å; F177-F380 VanDerWaalsContact CA-CE1 3.47Å; F177-F380 HydrophobicContact CB-CE1 3.86Å; F177-F380 HydrophobicContact CB-CE2 4.47Å; F177-F380 HydrophobicContact CB-CZ 3.84Å; F177-F380 HydrophobicContact CD2-CE1 4.48Å; F177-F380 AromaticContact CD2-CE2 3.92Å; F177-F380 HydrophobicContact CD2-CE2 3.92Å; F177-F380 AromaticContact CD2-CZ 3.62Å; F177-F380 HydrophobicContact CD2-CZ 3.62Å; F177-F380 HydrophobicContact CG-CZ 4.23Å
178	L	88.6	Confident	88.4	Confident	100 Å²	100	61.7 Å²	61.7	52%	0.524	33%	0.333	S	S	.	.	H	α-helix	trans	-63.5	-37.1	175.5	-69.3	175	0	0	0	111.6	L174 A175 V181 S182	L174-L178 WeakPolarHBondContact O-CB 3.45Å; L174-L178 VanDerWaalsContact O-CG 3.29Å; L174-L178 WeakPolarHBondContact O-CG 3.2Å; L174-L178 PolarHBondContact O-N 3.07Å; A175-L178 PolarHBondContact O-N 2.82Å; L178-V181 PolarHBondContact O-N 2.95Å; L178-S182 WeakPolarHBondContact O-CB 3.23Å; L178-S182 PolarHBondContact O-N 3.4Å
179	G	86.8	Confident	87.8	Confident	39 Å²	39	60.3 Å²	60.3	40%	0.402	33%	0.325	S	S	.	.	H	α-helix	trans	-61.6	-43.4	171.9	0	0	0	0	0	112.2	A175 A176 F177 S182 L183	A175-G179 PolarHBondContact O-N 3.03Å; A176-G179 PolarHBondContact O-N 3.15Å; F177-G179 VanDerWaalsContact C-N 3.3Å; F177-G179 PolarHBondContact O-N 2.81Å; G179-S182 PolarHBondContact O-N 3.27Å; G179-L183 VanDerWaalsContact O-CB 3.3Å; G179-L183 WeakPolarHBondContact O-CB 3.39Å; G179-L183 PolarHBondContact O-N 3.44Å
180	Y	88.2	Confident	87.1	Confident	84 Å²	84	59.7 Å²	59.7	33%	0.329	33%	0.325	S	S	.	.	H	α-helix	trans	-62.2	-47.6	174.3	170.5	-95.2	0	0	0	112.2	A176 F177 L183 R184 Y452	A176-Y180 WeakPolarHBondContact O-CB 3.45Å; A176-Y180 PolarHBondContact O-N 2.96Å; F177-Y180 WeakPolarHBondContact O-CB 3.26Å; F177-Y180 PolarHBondContact O-N 3.35Å; Y180-L183 PolarHBondContact O-N 3.25Å; Y180-R184 WeakPolarHBondContact O-CB 3.42Å; Y180-R184 PolarHBondContact O-N 2.98Å; Y180-Y452 AromaticContact CD2-CD1 3.92Å; Y180-Y452 HydrophobicContact CD2-CD1 3.92Å; Y180-Y452 AromaticContact CD2-CE1 3.3Å; Y180-Y452 HydrophobicContact CD2-CE1 3.3Å; Y180-Y452 HydrophobicContact CD2-CE2 4.22Å; Y180-Y452 AromaticContact CD2-CZ 3.5Å; Y180-Y452 HydrophobicContact CE2-CD1 4.39Å; Y180-Y452 AromaticContact CE2-CE1 3.63Å; Y180-Y452 HydrophobicContact CE2-CE1 3.63Å; Y180-Y452 AromaticContact CE2-CE2 3.73Å; Y180-Y452 HydrophobicContact CE2-CE2 3.73Å; Y180-Y452 AromaticContact CE2-CZ 3.27Å; Y180-Y452 WeakPolarHBondContact CE2-OH 3.31Å; Y180-Y452 HydrophobicContact CG-CE1 4.24Å
181	V	87.8	Confident	86.5	Confident	56 Å²	56	61.2 Å²	61.2	34%	0.339	34%	0.335	S	S	.	.	H	α-helix	trans	-62.8	-44.6	178.1	172.5	0	0	0	0	110.7	F177 L178 L183 R184 E185	F177-V181 HydrophobicContact CD1-CG2 4.27Å; F177-V181 HydrophobicContact CE1-CG2 3.82Å; F177-V181 HydrophobicContact CE2-CG2 4.11Å; F177-V181 HydrophobicContact CZ-CG2 3.73Å; F177-V181 WeakPolarHBondContact O-CG2 3.41Å; F177-V181 PolarHBondContact O-N 3.43Å; L178-V181 PolarHBondContact O-N 2.95Å; V181-L183 PolarHBondContact O-N 3.46Å; V181-R184 PolarHBondContact O-N 3.13Å; V181-E185 PolarHBondContact O-N 2.86Å
182	S	85.6	Confident	86	Confident	56 Å²	56	57.5 Å²	57.5	39%	0.392	32%	0.316	S	S	.	.	H	α-helix	trans	-61.5	-43.5	177.1	-176.7	0	0	0	0	111.5	L178 G179 E185 Q186	L178-S182 WeakPolarHBondContact O-CB 3.23Å; L178-S182 PolarHBondContact O-N 3.4Å; G179-S182 PolarHBondContact O-N 3.27Å; S182-E185 PolarHBondContact O-N 3.31Å; S182-Q186 WeakPolarHBondContact O-CG 3.2Å; S182-Q186 PolarHBondContact O-N 3.26Å
183	L	87.5	Confident	85.3	Confident	13 Å²	13	54.7 Å²	54.7	7%	0.068	31%	0.309	C	S	.	.	H	α-helix	trans	-69.5	-37.9	178.5	-178.1	58.2	0	0	0	112	G179 Y180 V181 E185 Q186 L187 Y452 V455 I545 I549	G179-L183 VanDerWaalsContact O-CB 3.3Å; G179-L183 WeakPolarHBondContact O-CB 3.39Å; G179-L183 PolarHBondContact O-N 3.44Å; Y180-L183 PolarHBondContact O-N 3.25Å; V181-L183 PolarHBondContact O-N 3.46Å; L183-E185 VanDerWaalsContact C-N 3.31Å; L183-E185 PolarHBondContact O-N 2.73Å; L183-Q186 PolarHBondContact O-N 2.95Å; L183-L187 HydrophobicContact CG-CD1 4.32Å; L183-L187 VanDerWaalsContact O-CG 3.3Å; L183-L187 WeakPolarHBondContact O-CG 3.4Å; L183-L187 PolarHBondContact O-N 2.89Å; L183-Y452 HydrophobicContact CB-CD1 4.49Å; L183-Y452 HydrophobicContact CB-CE1 3.97Å; L183-Y452 HydrophobicContact CD2-CD1 3.3Å; L183-Y452 HydrophobicContact CD2-CE1 3.55Å; L183-Y452 HydrophobicContact CD2-CG 4.16Å; L183-Y452 HydrophobicContact CG-CD1 4.1Å; L183-Y452 HydrophobicContact CG-CE1 3.8Å; L183-V455 HydrophobicContact CD1-CG1 4.2Å; L183-V455 HydrophobicContact CD1-CG2 4.25Å; L183-V455 HydrophobicContact CD2-CB 4.07Å; L183-V455 HydrophobicContact CD2-CG1 4.17Å; L183-V455 HydrophobicContact CD2-CG2 4.38Å; L183-I545 HydrophobicContact CD1-CG2 3.95Å; L183-I549 HydrophobicContact CD1-CD1 3.42Å; L183-I549 VanDerWaalsContact CD1-CD1 3.42Å; L183-I549 HydrophobicContact CD1-CG1 3.95Å
184	R	88	Confident	84.6	Confident	141 Å²	141	58.5 Å²	58.5	53%	0.532	32%	0.321	S	S	.	.	H	α-helix	trans	-57.4	-47.2	172.2	179.6	-173.2	176.1	-120.3	0.7	110.8	Y180 V181 Q186 L187 L188	Y180-R184 WeakPolarHBondContact O-CB 3.42Å; Y180-R184 PolarHBondContact O-N 2.98Å; V181-R184 PolarHBondContact O-N 3.13Å; R184-Q186 VanDerWaalsContact C-N 3.27Å; R184-Q186 PolarHBondContact O-N 3.29Å; R184-L187 WeakPolarHBondContact O-CB 3.37Å; R184-L187 PolarHBondContact O-N 3.36Å; R184-L188 WeakPolarHBondContact O-CG 3.37Å; R184-L188 PolarHBondContact O-N 3.32Å
185	E	86.3	Confident	84.1	Confident	96 Å²	96	55.4 Å²	55.4	45%	0.449	31%	0.305	S	S	.	.	H	α-helix	trans	-59.9	-39.8	178.2	-179.5	55.7	-151.2	0	0	111.5	V181 S182 L183 L188 Q189	V181-E185 PolarHBondContact O-N 2.86Å; S182-E185 PolarHBondContact O-N 3.31Å; L183-E185 VanDerWaalsContact C-N 3.31Å; L183-E185 PolarHBondContact O-N 2.73Å; E185-L188 WeakPolarHBondContact O-CB 3.48Å; E185-L188 PolarHBondContact O-N 3.2Å; E185-Q189 WeakPolarHBondContact O-CG 3.25Å; E185-Q189 PolarHBondContact O-N 2.84Å; E185-Q189 PolarHBondContact OE1-NE2 2.97Å; E185-Q189 VanDerWaalsContact OE1-NE2 3.12Å
186	Q	86	Confident	83.3	Confident	26 Å²	26	56.7 Å²	56.7	12%	0.121	30%	0.302	C	S	.	.	H	α-helix	trans	-70.9	-34.4	176	-68.1	178.1	34.8	0	0	113.4	S182 L183 R184 L188 Q189 G190 I549	S182-Q186 WeakPolarHBondContact O-CG 3.2Å; S182-Q186 PolarHBondContact O-N 3.26Å; L183-Q186 PolarHBondContact O-N 2.95Å; R184-Q186 VanDerWaalsContact C-N 3.27Å; R184-Q186 PolarHBondContact O-N 3.29Å; Q186-L188 VanDerWaalsContact C-N 3.3Å; Q186-Q189 PolarHBondContact O-N 3.05Å; Q186-Q189 VanDerWaalsContact O-N 3.09Å; Q186-G190 PolarHBondContact O-N 3.38Å; Q186-G190 VanDerWaalsContact O-N 3.07Å; Q186-I549 HydrophobicContact CB-CD1 4.33Å
187	L	85.2	Confident	82.3	Confident	12 Å²	12	63.4 Å²	63.4	6%	0.063	32%	0.319	C	S	.	.	H	α-helix	trans	-63.2	-39.4	172.5	-72.1	168.4	0	0	0	111	L183 R184 Q189 G190 T191 L448 I451 Y452 I549	L183-L187 HydrophobicContact CG-CD1 4.32Å; L183-L187 VanDerWaalsContact O-CG 3.3Å; L183-L187 WeakPolarHBondContact O-CG 3.4Å; L183-L187 PolarHBondContact O-N 2.89Å; R184-L187 WeakPolarHBondContact O-CB 3.37Å; R184-L187 PolarHBondContact O-N 3.36Å; L187-Q189 PolarHBondContact O-N 2.92Å; L187-G190 CarbonylContact O-C 3.3Å; L187-G190 PolarHBondContact O-N 3.29Å; L187-T191 PolarHBondContact O-N 2.96Å; L187-T191 VanDerWaalsContact O-N 3.12Å; L187-T191 PolarHBondContact O-OG1 3.5Å; L187-L448 HydrophobicContact CD1-CD1 3.71Å; L187-I451 HydrophobicContact CD2-CD1 4.4Å; L187-I451 HydrophobicContact CD2-CG2 4.02Å; L187-Y452 HydrophobicContact CD1-CE2 4.42Å; L187-I549 HydrophobicContact CD2-CD1 3.92Å; L187-I549 HydrophobicContact CD2-CG1 4.39Å; L187-I549 HydrophobicContact CD2-CG2 3.78Å; L187-I549 HydrophobicContact CG-CD1 4.28Å
188	L	80.2	Confident	81	Confident	115 Å²	115	62 Å²	62	60%	0.602	31%	0.314	S	S	*	.	H	α-helix	trans	-61.9	-30.6	172.4	-67.3	172.6	0	0	0	112.4	R184 E185 Q186	R184-L188 WeakPolarHBondContact O-CG 3.37Å; R184-L188 PolarHBondContact O-N 3.32Å; E185-L188 WeakPolarHBondContact O-CB 3.48Å; E185-L188 PolarHBondContact O-N 3.2Å; Q186-L188 VanDerWaalsContact C-N 3.3Å
189	Q	80.5	Confident	79.7	Confident	61 Å²	61	60.7 Å²	60.7	29%	0.285	31%	0.31	S	S	.	.	H	α-helix	trans	-81.2	-19	177.7	-67.4	174.4	20.7	0	0	114	E185 Q186 L187	E185-Q189 WeakPolarHBondContact O-CG 3.25Å; E185-Q189 PolarHBondContact O-N 2.84Å; E185-Q189 PolarHBondContact OE1-NE2 2.97Å; E185-Q189 VanDerWaalsContact OE1-NE2 3.12Å; Q186-Q189 PolarHBondContact O-N 3.05Å; Q186-Q189 VanDerWaalsContact O-N 3.09Å; L187-Q189 PolarHBondContact O-N 2.92Å
190	G	78	Confident	78.1	Confident	15 Å²	15	64.3 Å²	64.3	16%	0.155	32%	0.316	C	S	.	.			trans	-170.5	83	-179.1	0	0	0	0	0	113.2	Q186 L187	Q186-G190 PolarHBondContact O-N 3.38Å; Q186-G190 VanDerWaalsContact O-N 3.07Å; L187-G190 CarbonylContact O-C 3.3Å; L187-G190 PolarHBondContact O-N 3.29Å
191	T	79.3	Confident	76.6	Confident	43 Å²	43	62.5 Å²	62.5	26%	0.264	32%	0.319	S	S	.	.			trans	-78.5	139.7	177.2	-64.4	0	0	0	0	110.5	L187 L195 E196	L187-T191 PolarHBondContact O-N 2.96Å; L187-T191 VanDerWaalsContact O-N 3.12Å; L187-T191 PolarHBondContact O-OG1 3.5Å; T191-L195 HydrophobicContact CG2-CB 4.04Å; T191-L195 HydrophobicContact CG2-CD2 3.95Å; T191-L195 HydrophobicContact CG2-CG 4.29Å; T191-E196 HydrophobicContact CG2-CG 3.79Å
192	P	80.7	Confident	74.9	Confident	6 Å²	6	63.9 Å²	63.9	4%	0.039	32%	0.321	C	S	.	.			trans	-67.8	137.3	174.5	25.9	-33.2	0	0	0	111.8	W194 L195 E196 I451 I549	P192-W194 HydrophobicContact CB-CZ2 4.34Å; P192-W194 HydrophobicContact CG-CZ2 3.87Å; P192-W194 PolarHBondContact O-N 2.94Å; P192-L195 HydrophobicContact CG-CB 4.06Å; P192-L195 WeakPolarHBondContact O-CB 3.42Å; P192-L195 PolarHBondContact O-N 2.56Å; P192-E196 PolarHBondContact O-N 3.42Å; P192-I451 HydrophobicContact CG-CD1 3.73Å; P192-I549 HydrophobicContact CG-CG2 4.47Å
193	A	76.1	Confident	73.3	Confident	56 Å²	56	63.3 Å²	63.3	46%	0.463	32%	0.32	S	S	.	.	H	α-helix	trans	-56.7	-28.8	-174.4	0	0	0	0	0	115	L195 R197	A193-L195 VanDerWaalsContact C-N 3.32Å; A193-R197 WeakPolarHBondContact O-CG 3.34Å; A193-R197 PolarHBondContact O-N 2.87Å; A193-R197 VanDerWaalsContact O-N 3.13Å
194	W	76.3	Confident	71.5	Confident	91 Å²	91	73.1 Å²	73.1	35%	0.345	36%	0.356	S	S	.	.	H	α-helix	trans	-69.7	-29.3	176.2	57.6	-99.1	0	0	0	112.4	P192 Y450 I451	P192-W194 HydrophobicContact CB-CZ2 4.34Å; P192-W194 HydrophobicContact CG-CZ2 3.87Å; P192-W194 PolarHBondContact O-N 2.94Å; W194-Y450 HydrophobicContact CH2-CD1 4.36Å; W194-I451 HydrophobicContact CH2-CD1 3.61Å; W194-I451 HydrophobicContact CH2-CG1 3.74Å; W194-I451 HydrophobicContact CZ2-CD1 3.78Å; W194-I451 HydrophobicContact CZ2-CG1 3.86Å
195	L	77.9	Confident	69.6	Low	3 Å²	3	70 Å²	70	2%	0.016	37%	0.368	C	S	.	.	H	α-helix	trans	-78.2	-34.2	175.7	-170.4	66.7	0	0	0	111.7	T191 P192 A193 D198 Y444 L448 I451	T191-L195 HydrophobicContact CG2-CB 4.04Å; T191-L195 HydrophobicContact CG2-CD2 3.95Å; T191-L195 HydrophobicContact CG2-CG 4.29Å; P192-L195 HydrophobicContact CG-CB 4.06Å; P192-L195 WeakPolarHBondContact O-CB 3.42Å; P192-L195 PolarHBondContact O-N 2.56Å; A193-L195 VanDerWaalsContact C-N 3.32Å; L195-D198 PolarHBondContact O-N 3.42Å; L195-Y444 HydrophobicContact CD1-CD2 3.65Å; L195-Y444 HydrophobicContact CD1-CE2 4.1Å; L195-Y444 HydrophobicContact CD1-CG 4.37Å; L195-Y444 HydrophobicContact CD2-CD2 4.49Å; L195-Y444 HydrophobicContact CD2-CE2 4.11Å; L195-Y444 HydrophobicContact CG-CD2 3.86Å; L195-Y444 HydrophobicContact CG-CE2 3.89Å; L195-L448 HydrophobicContact CD2-CD1 4.45Å; L195-I451 HydrophobicContact CD2-CD1 3.82Å
196	E	73.4	Confident	67.2	Low	84 Å²	84	68.8 Å²	68.8	39%	0.393	38%	0.375	S	S	.	.	H	α-helix	trans	-66.6	-36.8	174	-73.3	173.5	176.1	0	0	112.4	T191 P192 D198 V199 H200	T191-E196 HydrophobicContact CG2-CG 3.79Å; P192-E196 PolarHBondContact O-N 3.42Å; E196-D198 PolarHBondContact O-N 2.85Å; E196-V199 PolarHBondContact O-N 2.81Å; E196-H200 PolarHBondContact O-CD2 3.48Å; E196-H200 PolarHBondContact O-N 2.89Å
197	R	66.7	Low	64.7	Low	177 Å²	177	75.2 Å²	75.2	67%	0.668	41%	0.41	S	S	*	.	H	α-helix	trans	-55.4	-36.2	175.7	-78.3	173.8	-169.9	164.1	2.8	112.3	A193 H200 A201	A193-R197 WeakPolarHBondContact O-CG 3.34Å; A193-R197 PolarHBondContact O-N 2.87Å; A193-R197 VanDerWaalsContact O-N 3.13Å; R197-H200 PolarHBondContact O-N 3.26Å; R197-A201 PolarHBondContact O-N 3.46Å
198	D	62.1	Low	62.2	Low	28 Å²	28	80 Å²	80	15%	0.15	44%	0.441	C	S	.	.	H	α-helix	trans	-70.4	-36.2	178.9	-64.1	-23.4	0	0	0	111.9	L195 E196 H431 C443	L195-D198 PolarHBondContact O-N 3.42Å; E196-D198 PolarHBondContact O-N 2.85Å; D198-H431 IonicContact OD2-CE1 3.46Å; D198-C443 PolarHBondContact OD2-SG 2.7Å
199	V	62.2	Low	59.8	Low	72 Å²	72	79.6 Å²	79.6	44%	0.436	45%	0.446	S	S	.	.	H	α-helix	trans	-68.3	-42.7	173.7	-178.3	0	0	0	0	110.7	E196 A201 E202 Y444	E196-V199 PolarHBondContact O-N 2.81Å; V199-A201 VanDerWaalsContact C-N 3.33Å; V199-A201 PolarHBondContact O-N 3.44Å; V199-E202 WeakPolarHBondContact O-CB 3.43Å; V199-E202 PolarHBondContact O-N 3.11Å; V199-Y444 HydrophobicContact CG2-CD2 3.59Å; V199-Y444 HydrophobicContact CG2-CE2 3.69Å
200	H	53.2	Low	57.2	Low	116 Å²	116	88 Å²	88	54%	0.537	48%	0.475	S	S	.	.	H	α-helix	trans	-74.1	-19.6	179.3	-69.6	-62.7	0	0	0	114.1	E196 R197 E202 A203	E196-H200 PolarHBondContact O-CD2 3.48Å; E196-H200 PolarHBondContact O-N 2.89Å; R197-H200 PolarHBondContact O-N 3.26Å; H200-E202 PolarHBondContact O-N 2.85Å; H200-A203 PolarHBondContact O-N 3.3Å
201	A	55.7	Low	54.9	Low	46 Å²	46	93.2 Å²	93.2	38%	0.38	51%	0.506	S	S	.	.	H	α-helix	trans	-63.2	-30.7	170	0	0	0	0	0	111.7	R197 V199 P440	R197-A201 PolarHBondContact O-N 3.46Å; V199-A201 VanDerWaalsContact C-N 3.33Å; V199-A201 PolarHBondContact O-N 3.44Å; A201-P440 HydrophobicContact CB-CB 4.27Å
202	E	52.9	Low	52.6	Low	84 Å²	84	96.2 Å²	96.2	39%	0.393	54%	0.536	S	S	.	.	H	α-helix	trans	-70.4	-37.3	174.5	-167.5	154	-175.7	0	0	112	V199 H200 R204 G205 R441	V199-E202 WeakPolarHBondContact O-CB 3.43Å; V199-E202 PolarHBondContact O-N 3.11Å; H200-E202 PolarHBondContact O-N 2.85Å; E202-R204 PolarHBondContact O-N 3.17Å; E202-G205 PolarHBondContact O-N 2.94Å; E202-G205 VanDerWaalsContact O-N 3.11Å; E202-R441 IonicContact OE1-CZ 2.67Å; E202-R441 VanDerWaalsContact OE1-CZ 3.25Å; E202-R441 IonicContact OE1-NE 3.14Å; E202-R441 PolarHBondContact OE1-NE 2.88Å; E202-R441 IonicContact OE1-NH2 3.5Å; E202-R441 PolarHBondContact OE1-NH2 2.92Å; E202-R441 IonicContact OE2-NE 3.56Å
203	A	52	Low	49.8	Very low	44 Å²	44	100.7 Å²	100.7	36%	0.364	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.9	-11	179.6	0	0	0	0	0	114.4	H200 G205	H200-A203 PolarHBondContact O-N 3.3Å; A203-G205 VanDerWaalsContact C-N 3.34Å
204	R	49.5	Very low	47.4	Very low	219 Å²	219	101.7 Å²	101.7	83%	0.826	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-12	171.7	-69.3	-171.7	-124.3	179.2	1.9	113.4	E202	E202-R204 PolarHBondContact O-N 3.17Å
205	G	47.4	Very low	45.2	Very low	76 Å²	76	102.5 Å²	102.5	78%	0.784	62%	0.615	S	S	*	*	S	Bend	trans	-93.2	-9.2	179.6	0	0	0	0	0	115.3	E202 A203	E202-G205 PolarHBondContact O-N 2.94Å; E202-G205 VanDerWaalsContact O-N 3.11Å; A203-G205 VanDerWaalsContact C-N 3.34Å
206	A	36.9	Very low	42.6	Very low	71 Å²	71	110.6 Å²	110.6	59%	0.587	66%	0.658	S	S	*	*	S	Bend	trans	-132.7	139	174.5	0	0	0	0	0	107.8
207	D	33.5	Very low	40.3	Very low	160 Å²	160	110.1 Å²	110.1	86%	0.856	68%	0.676	S	S	*	*			trans	-44	143.3	-173.7	-76.7	-45.1	0	0	0	113.9
208	P	31.9	Very low	38.5	Very low	112 Å²	112	111.1 Å²	111.1	73%	0.727	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-67.2	125.8	-161	25.4	-34.2	0	0	0	112.4
209	P	29.8	Very low	36.8	Very low	108 Å²	108	120.7 Å²	120.7	70%	0.701	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-78.1	137.4	170.6	24.3	-19.6	0	0	0	110.8
210	R	26.5	Very low	35.2	Very low	237 Å²	237	123.2 Å²	123.2	89%	0.894	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-61.2	147.1	171.1	-75.4	175.1	175.7	162.8	-2.2	110.9	A212	R210-A212 PolarHBondContact O-N 3.5Å
211	P	29.8	Very low	34.2	Very low	124 Å²	124	125.1 Å²	125.1	81%	0.805	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-65.5	124.7	-174.6	25	-32.8	0	0	0	111.8	A213	P211-A213 PolarHBondContact O-N 2.75Å
212	A	29.1	Very low	32.9	Very low	107 Å²	107	130.9 Å²	130.9	88%	0.884	76%	0.762	S	S	*	*			trans	-71.5	108.1	169.6	0	0	0	0	0	109.1	R210	R210-A212 PolarHBondContact O-N 3.5Å
213	A	23.3	Very low	31.7	Very low	99 Å²	99	132.2 Å²	132.2	82%	0.818	78%	0.777	S	S	*	*			trans	-72.7	138.9	167.3	0	0	0	0	0	110.4	P211	P211-A213 PolarHBondContact O-N 2.75Å
214	G	25.7	Very low	30.7	Very low	77 Å²	77	135.7 Å²	135.7	79%	0.794	79%	0.79	S	S	*	*			trans	77.2	88	152.2	0	0	0	0	0	117.4
215	A	28.8	Very low	29.6	Very low	109 Å²	109	131.5 Å²	131.5	90%	0.901	78%	0.783	S	S	*	*			trans	-117.2	74.9	156.4	0	0	0	0	0	109.6
216	N	23.2	Very low	28.8	Very low	173 Å²	173	135.9 Å²	135.9	93%	0.925	78%	0.78	S	S	*	*			trans	-77.5	110.3	162.1	-88.8	-15.2	0	0	0	108.3
217	G	26.9	Very low	28.4	Very low	74 Å²	74	137 Å²	137	76%	0.763	78%	0.776	S	S	*	*			trans	-178.2	55	179.3	0	0	0	0	0	113.7
218	R	28.7	Very low	28.1	Very low	197 Å²	197	135.8 Å²	135.8	74%	0.743	77%	0.768	S	S	*	*			trans	-91.9	105.3	172.3	-85.2	-178.7	175.2	173.4	0.6	110.3
219	R	25.4	Very low	27.8	Very low	230 Å²	230	138.5 Å²	138.5	87%	0.868	77%	0.769	S	S	*	*			trans	-127.7	111.7	157.2	-78.3	-175.1	179	176.3	1.3	108.5	L221	R219-L221 PolarHBondContact O-N 3.26Å
220	P	29.3	Very low	27.6	Very low	124 Å²	124	136.5 Å²	136.5	81%	0.805	77%	0.768	S	S	*	*			trans	-74	119.9	174.4	27	-29	0	0	0	109.9
221	L	31	Very low	27.7	Very low	156 Å²	156	131.3 Å²	131.3	82%	0.817	76%	0.762	S	S	*	*			trans	-92.3	5.1	-176.3	-141.7	96.3	0	0	0	114.4	R219	R219-L221 PolarHBondContact O-N 3.26Å
222	F	28.3	Very low	27.6	Very low	168 Å²	168	128.6 Å²	128.6	74%	0.737	75%	0.75	S	S	*	*	S	Bend	trans	-125.2	125	177	-76.9	-78.5	0	0	0	111.3
223	P	28.5	Very low	27.5	Very low	112 Å²	112	129.6 Å²	129.6	73%	0.727	74%	0.741	S	S	*	*			trans	-69.6	132.3	173.3	27.5	-30.4	0	0	0	109.6	I225	P223-I225 PolarHBondContact O-N 2.86Å; P223-I225 VanDerWaalsContact O-N 3.13Å
224	D	30.4	Very low	27.5	Very low	116 Å²	116	129.6 Å²	129.6	62%	0.62	75%	0.75	S	S	*	*			trans	-47.7	119.2	175.4	-67	-48.5	0	0	0	110.8	F226 N227	D224-F226 PolarHBondContact O-N 2.91Å; D224-N227 WeakPolarHBondContact O-CB 3.47Å; D224-N227 PolarHBondContact O-N 2.77Å
225	I	28.2	Very low	27.5	Very low	132 Å²	132	127.7 Å²	127.7	68%	0.677	73%	0.731	S	S	*	*	G	3₁₀ helix	trans	-56.2	-24.9	179.8	-70.2	165.9	0	0	0	111.3	P223 N227 I228	P223-I225 PolarHBondContact O-N 2.86Å; P223-I225 VanDerWaalsContact O-N 3.13Å; I225-N227 VanDerWaalsContact C-N 3.3Å; I225-N227 PolarHBondContact O-N 3.33Å; I225-I228 WeakPolarHBondContact O-CB 3.43Å; I225-I228 PolarHBondContact O-N 2.84Å
226	F	28.7	Very low	27.3	Very low	167 Å²	167	125.9 Å²	125.9	73%	0.732	72%	0.723	S	S	*	*	G	3₁₀ helix	trans	-69.7	-20	174.9	-75.7	-77.4	0	0	0	114.3	D224 I228	D224-F226 PolarHBondContact O-N 2.91Å; F226-I228 VanDerWaalsContact C-N 3.28Å; F226-I228 PolarHBondContact O-N 2.78Å
227	N	30.5	Very low	27.4	Very low	94 Å²	94	125.4 Å²	125.4	50%	0.503	72%	0.72	S	S	.	*	G	3₁₀ helix	trans	-76.7	-11.5	172.9	-82.7	-29.3	0	0	0	113.5	D224 I225	D224-N227 WeakPolarHBondContact O-CB 3.47Å; D224-N227 PolarHBondContact O-N 2.77Å; I225-N227 VanDerWaalsContact C-N 3.3Å; I225-N227 PolarHBondContact O-N 3.33Å
228	I	26.9	Very low	27.3	Very low	135 Å²	135	123.9 Å²	123.9	69%	0.692	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-34.4	174.1	-64.8	172.3	0	0	0	110.8	I225 F226 G230	I225-I228 WeakPolarHBondContact O-CB 3.43Å; I225-I228 PolarHBondContact O-N 2.84Å; F226-I228 VanDerWaalsContact C-N 3.28Å; F226-I228 PolarHBondContact O-N 2.78Å; I228-G230 VanDerWaalsContact C-N 3.26Å; I228-G230 PolarHBondContact O-N 3.04Å; I228-G230 VanDerWaalsContact O-N 3.11Å
229	F	25.6	Very low	27.2	Very low	170 Å²	170	117.9 Å²	117.9	75%	0.746	70%	0.697	S	S	*	*	S	Bend	trans	-87.7	67.7	171.9	-71.7	-78.7	0	0	0	109.9	V231	F229-V231 VanDerWaalsContact C-N 3.33Å; F229-V231 PolarHBondContact O-N 2.64Å
230	G	25.7	Very low	27.2	Very low	66 Å²	66	111.8 Å²	111.8	68%	0.68	70%	0.695	S	S	*	*			trans	-57.4	79.5	-174.6	0	0	0	0	0	115.7	I228	I228-G230 VanDerWaalsContact C-N 3.26Å; I228-G230 PolarHBondContact O-N 3.04Å; I228-G230 VanDerWaalsContact O-N 3.11Å
231	V	27.8	Very low	27.1	Very low	127 Å²	127	111 Å²	111	77%	0.77	69%	0.688	S	S	*	*	S	Bend	trans	-125.2	-9.9	169.6	-174.4	0	0	0	0	113	F229	F229-V231 VanDerWaalsContact C-N 3.33Å; F229-V231 PolarHBondContact O-N 2.64Å
232	A	28.3	Very low	26.7	Very low	67 Å²	67	111.7 Å²	111.7	55%	0.554	69%	0.685	S	S	*	*	S	Bend	trans	-99.2	-24.2	-176.6	0	0	0	0	0	116.2
233	N	25.6	Very low	26.5	Very low	128 Å²	128	107.2 Å²	107.2	68%	0.684	69%	0.686	S	S	*	*			trans	-116.5	97.7	176.1	-83.5	-16.6	0	0	0	111.5	G235	N233-G235 PolarHBondContact O-N 3.42Å
234	G	24.2	Very low	26.2	Very low	99 Å²	99	111.1 Å²	111.1	100%	1.021	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	38.9	170.1	0	0	0	0	0	114.4
235	G	25.6	Very low	25.8	Very low	38 Å²	38	108.7 Å²	108.7	39%	0.392	70%	0.697	S	S	.	*	T	Hydrogen-bonded Turn	trans	-140.7	1.2	-175.2	0	0	0	0	0	115.8	N233 L237 A239	N233-G235 PolarHBondContact O-N 3.42Å; G235-L237 VanDerWaalsContact C-N 3.31Å; G235-L237 PolarHBondContact O-N 2.77Å; G235-A239 PolarHBondContact O-N 2.84Å
236	G	24.8	Very low	25.6	Very low	71 Å²	71	110 Å²	110	73%	0.732	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	62.8	-176.7	0	0	0	0	0	114.7
237	L	24.9	Very low	25.4	Very low	162 Å²	162	111.2 Å²	111.2	85%	0.848	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	172.6	-14.1	154.9	-104.2	144.1	0	0	0	111.5	G235	G235-L237 VanDerWaalsContact C-N 3.31Å; G235-L237 PolarHBondContact O-N 2.77Å
238	G	24.5	Very low	25.1	Very low	42 Å²	42	113.6 Å²	113.6	43%	0.433	73%	0.726	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.9	-37.4	177.7	0	0	0	0	0	114.7	V241 F242	G238-V241 PolarHBondContact O-N 3.14Å; G238-F242 PolarHBondContact O-N 3.41Å
239	A	26.5	Very low	25	Very low	72 Å²	72	113.1 Å²	113.1	60%	0.595	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	-25.5	-172.2	0	0	0	0	0	113.8	G235 V241	G235-A239 PolarHBondContact O-N 2.84Å; A239-V241 PolarHBondContact O-N 3.36Å
240	A	26	Very low	25	Very low	101 Å²	101	111.7 Å²	111.7	84%	0.835	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-7.7	177.1	0	0	0	0	0	113.9
241	V	26.7	Very low	24.9	Very low	108 Å²	108	116.9 Å²	116.9	66%	0.655	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.9	-15.1	179.4	179.9	0	0	0	0	112.4	G238 A239	G238-V241 PolarHBondContact O-N 3.14Å; A239-V241 PolarHBondContact O-N 3.36Å
242	F	23.2	Very low	24.7	Very low	171 Å²	171	116.4 Å²	116.4	75%	0.75	74%	0.742	S	S	*	*			trans	-125.3	73.3	175.6	-61.4	-75.1	0	0	0	110.3	G238 E244	G238-F242 PolarHBondContact O-N 3.41Å; F242-E244 PolarHBondContact O-N 3.02Å
243	G	23.7	Very low	24.5	Very low	74 Å²	74	122 Å²	122	76%	0.763	76%	0.757	S	S	*	*			trans	-80.3	101.8	154.3	0	0	0	0	0	107.9	G245	G243-G245 PolarHBondContact O-N 3.49Å
244	E	23.4	Very low	24.5	Very low	194 Å²	194	123.5 Å²	123.5	91%	0.907	77%	0.765	S	S	*	*			trans	-68.9	119.6	155.4	-80.9	-179.9	145.8	0	0	106.7	F242	F242-E244 PolarHBondContact O-N 3.02Å
245	G	22	Very low	24.5	Very low	65 Å²	65	126.4 Å²	126.4	67%	0.67	76%	0.756	S	S	*	*			trans	-74.8	141.9	175.3	0	0	0	0	0	111.2	G243	G243-G245 PolarHBondContact O-N 3.49Å
246	N	23.2	Very low	24.5	Very low	158 Å²	158	131.9 Å²	131.9	85%	0.845	78%	0.776	S	S	*	*			trans	-172.5	82.4	138.4	-100.1	1.2	0	0	0	107.7
247	E	24.8	Very low	24.4	Very low	194 Å²	194	134.6 Å²	134.6	91%	0.907	77%	0.774	S	S	*	*			trans	-131.3	101.6	156.9	-73.8	-176.9	-173.9	0	0	106.4
248	D	24.8	Very low	24.4	Very low	143 Å²	143	133.4 Å²	133.4	77%	0.765	77%	0.768	S	S	*	*			trans	-63.6	141.5	169.4	-74.4	-49	0	0	0	109.2	V250	D248-V250 PolarHBondContact O-N 3.36Å
249	P	24.5	Very low	24.2	Very low	125 Å²	125	140.1 Å²	140.1	81%	0.812	79%	0.788	S	S	*	*			trans	-70.5	114.1	-174.9	26.5	-31.6	0	0	0	111	E251	P249-E251 PolarHBondContact O-N 2.93Å
250	V	25.4	Very low	24	Very low	140 Å²	140	146 Å²	146	85%	0.848	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-70.7	117.2	165.9	178.7	0	0	0	0	108.2	D248	D248-V250 PolarHBondContact O-N 3.36Å
251	E	23.1	Very low	23.9	Very low	175 Å²	175	146.2 Å²	146.2	82%	0.818	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-67	136	174.7	-139.1	169.4	-169.3	0	0	109.6	P249 E253	P249-E251 PolarHBondContact O-N 2.93Å; E251-E253 PolarHBondContact O-N 3.39Å
252	P	24.8	Very low	23.6	Very low	117 Å²	117	149.2 Å²	149.2	76%	0.76	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-71.3	117.3	-171.4	25.8	-32.9	0	0	0	112.3	L254	P252-L254 PolarHBondContact O-N 3.42Å
253	E	23.7	Very low	23.4	Very low	185 Å²	185	149.1 Å²	149.1	86%	0.864	81%	0.805	S	S	*	*			trans	-63.5	110.4	169	-100.3	165.4	150.4	0	0	110.7	E251 L255	E251-E253 PolarHBondContact O-N 3.39Å; E253-L255 PolarHBondContact O-N 3.39Å
254	L	25.4	Very low	23.1	Very low	160 Å²	160	151.5 Å²	151.5	84%	0.838	81%	0.805	S	S	*	*			trans	-67.6	106.8	165.2	-109.2	111.8	0	0	0	108.7	P252 N256	P252-L254 PolarHBondContact O-N 3.42Å; L254-N256 PolarHBondContact O-N 2.86Å
255	L	22.8	Very low	23	Very low	159 Å²	159	149.3 Å²	149.3	83%	0.832	80%	0.804	S	S	*	*			trans	-60.6	113.3	162.5	-86.9	111.5	0	0	0	109.2	E253	E253-L255 PolarHBondContact O-N 3.39Å
256	N	25.7	Very low	22.8	Very low	153 Å²	153	153.9 Å²	153.9	82%	0.818	81%	0.808	S	S	*	*			trans	-118.3	125.4	163.1	-117.5	-8.6	0	0	0	109.4	L254	L254-N256 PolarHBondContact O-N 2.86Å
257	N	24.2	Very low	22.7	Very low	128 Å²	128	154.1 Å²	154.1	68%	0.684	80%	0.804	S	S	*	*			trans	-73.5	146.5	-174.7	-68.2	-34.9	0	0	0	112.4
258	D	24.4	Very low	22.5	Very low	138 Å²	138	152.3 Å²	152.3	74%	0.738	80%	0.796	S	S	*	*			trans	61.4	103.6	143	-54.4	-26.8	0	0	0	120.3
259	E	20.8	Very low	22.4	Very low	182 Å²	182	152.8 Å²	152.8	85%	0.85	80%	0.797	S	S	*	*				19.6	115.3	127.4	-62.7	-178.8	121.7	0	0	119.3
260	Q	22.6	Very low	22.4	Very low	197 Å²	197	153.8 Å²	153.8	92%	0.921	80%	0.801	S	S	*	*				-164.6	142.7	129.8	-106.8	172.8	17.4	0	0	111.6
261	P	22.6	Very low	22.3	Very low	105 Å²	105	154.7 Å²	154.7	68%	0.682	80%	0.801	S	S	*	*			trans	-98.6	154.8	-167.9	37.3	-32.4	0	0	0	113.7
262	H	20.7	Very low	22.9	Very low	171 Å²	171	151.2 Å²	151.2	79%	0.792	79%	0.794	S	S	*	*			trans	172.6	119.1	139.4	-91.5	-68.3	0	0	0	114.3
263	Q	18.6	Very low	22.8	Very low	168 Å²	168	154 Å²	154	79%	0.785	80%	0.797	S	S	*	*			trans	38.4	116.3	139.4	-68.8	174.5	-19.1	0	0	124.4
264	T	16.9	Very low	22.8	Very low	124 Å²	124	152.9 Å²	152.9	76%	0.761	79%	0.791	S	S	*	*				38.2	126	123.3	-19.5	0	0	0	0	122.5
265	V	22.5	Very low	22.8	Very low	148 Å²	148	151.7 Å²	151.7	90%	0.897	78%	0.784	S	S	*	*				-167.4	149.5	128.6	164.8	0	0	0	0	110.1
266	Q	17.7	Very low	22.7	Very low	162 Å²	162	155 Å²	155	76%	0.757	79%	0.786	S	S	*	*			trans	-93.2	-178.8	-165.7	-57.5	176.5	-52.8	0	0	116
267	Q	21.4	Very low	22.5	Very low	162 Å²	162	153 Å²	153	76%	0.757	78%	0.782	S	S	*	*			trans	88	142.1	153.8	-73.3	-179.1	-61	0	0	118.4
268	E	21.2	Very low	22.4	Very low	156 Å²	156	158.3 Å²	158.3	73%	0.729	79%	0.794	S	S	*	*			cis	-170.8	151.8	-9.2	-171.9	146.1	-175.2	0	0	111.3
269	L	22.3	Very low	22.5	Very low	153 Å²	153	156.6 Å²	156.6	80%	0.801	79%	0.793	S	S	*	*			trans	-32.3	155.5	165.4	-146.3	71.8	0	0	0	119.9
270	V	23.8	Very low	22.8	Very low	147 Å²	147	155.4 Å²	155.4	89%	0.891	79%	0.792	S	S	*	*				174.8	155.5	128.5	158.4	0	0	0	0	113.1
271	N	22.7	Very low	23.2	Very low	159 Å²	159	151 Å²	151	85%	0.85	78%	0.775	S	S	*	*			trans	-99.2	-179.6	-149.1	-126.2	7	0	0	0	117.3
272	P	36.9	Very low	23.4	Very low	102 Å²	102	152.3 Å²	152.3	66%	0.662	77%	0.771	S	S	*	*			trans	-112.1	173.7	-157.5	44.4	-39.8	0	0	0	116.8
273	E	22.7	Very low	23.8	Very low	175 Å²	175	151.4 Å²	151.4	82%	0.818	77%	0.768	S	S	*	*			trans	171.9	131.2	132.3	-97	-177.7	-177.8	0	0	116.2
274	H	23.8	Very low	23.9	Very low	161 Å²	161	152.4 Å²	152.4	75%	0.745	77%	0.772	S	S	*	*			trans	62.9	121.3	136.9	-86.8	-54.4	0	0	0	129.2
275	I	23.8	Very low	24	Very low	135 Å²	135	151.7 Å²	151.7	69%	0.692	77%	0.77	S	S	*	*				106.2	116.3	127.2	-65.4	164.7	0	0	0	123.9
276	R	22.3	Very low	23.9	Very low	230 Å²	230	150.5 Å²	150.5	87%	0.868	76%	0.763	S	S	*	*			trans	59	121.5	140.8	-74.2	-179.6	-166.2	-177.2	5.5	127.3
277	C	21.1	Very low	24.5	Very low	110 Å²	110	149.6 Å²	149.6	74%	0.743	76%	0.761	S	S	*	*			trans	32.2	125.1	131.3	-50.9	0	0	0	0	126.9
278	Y	21.5	Very low	24.4	Very low	239 Å²	239	147.2 Å²	147.2	94%	0.937	75%	0.754	S	S	*	*				167.4	175.6	126.2	-91	-72	0	0	0	111.6
279	S	26.4	Very low	24.5	Very low	102 Å²	102	143.7 Å²	143.7	71%	0.713	75%	0.747	S	S	*	*			trans	-109.5	163.3	-146.6	62.6	0	0	0	0	123
280	L	27.6	Very low	24.4	Very low	158 Å²	158	140 Å²	140	83%	0.827	75%	0.745	S	S	*	*			trans	71	115.9	152.7	-97.9	124.2	0	0	0	125.3
281	N	31.8	Very low	24.4	Very low	105 Å²	105	141 Å²	141	56%	0.561	74%	0.744	S	S	*	*			trans	171.9	138.6	151	-105.3	-14.3	0	0	0	118	N288	N281-N288 VanDerWaalsContact O-CB 3.24Å; N281-N288 WeakPolarHBondContact O-CB 3.32Å
282	Q	26.4	Very low	24.3	Very low	131 Å²	131	138.5 Å²	138.5	61%	0.612	74%	0.739	S	S	*	*			trans	32	144.6	140.9	-66.4	171.3	6.9	0	0	126.9	N288	Q282-N288 WeakPolarHBondContact O-CB 3Å
283	Q	27.6	Very low	23.5	Very low	153 Å²	153	142.4 Å²	142.4	72%	0.715	75%	0.748	S	S	*	*			trans	87	118.9	144	-77	169	-5.9	0	0	124.7
284	Q	21.3	Very low	23.4	Very low	188 Å²	188	139.6 Å²	139.6	88%	0.879	75%	0.748	S	S	*	*	S	Bend	trans	-35.3	163.6	139	-153.4	174.3	13.1	0	0	113.8
285	P	19.9	Very low	23.2	Very low	109 Å²	109	140 Å²	140	71%	0.708	76%	0.755	S	S	*	*	S	Bend		-50.1	166.3	-96.2	37.8	-35.6	0	0	0	112.8
286	V	20.4	Very low	23	Very low	124 Å²	124	143.4 Å²	143.4	75%	0.752	77%	0.768	S	S	*	*	S	Bend	trans	76.3	93.2	174.4	-166.4	0	0	0	0	111.7
287	I	28.8	Very low	22.9	Very low	142 Å²	142	137 Å²	137	73%	0.728	76%	0.759	S	S	*	*	S	Bend	trans	52.4	92.6	162.4	-47.9	174	0	0	0	114.3
288	N	20.4	Very low	22.7	Very low	112 Å²	112	136.4 Å²	136.4	60%	0.599	76%	0.755	S	S	*	*				163.9	163.2	129.2	-86.5	-34.8	0	0	0	113.4	N281 Q282	N281-N288 VanDerWaalsContact O-CB 3.24Å; N281-N288 WeakPolarHBondContact O-CB 3.32Å; Q282-N288 WeakPolarHBondContact O-CB 3Å
289	S	22.4	Very low	22.7	Very low	83 Å²	83	132.7 Å²	132.7	58%	0.58	75%	0.746	S	S	*	*			trans	-76.6	155.8	-168.2	47.2	0	0	0	0	115.9
290	G	21.7	Very low	22.4	Very low	74 Å²	74	136 Å²	136	76%	0.763	75%	0.75	S	S	*	*			trans	150.7	86.7	158.5	0	0	0	0	0	118.4
291	I	23.2	Very low	22.1	Very low	169 Å²	169	133.9 Å²	133.9	87%	0.867	75%	0.749	S	S	*	*			trans	9.5	122.6	143	-55.3	165.7	0	0	0	118.3
292	S	20.3	Very low	21.5	Very low	106 Å²	106	133.3 Å²	133.3	74%	0.741	76%	0.758	S	S	*	*				-171.9	116.5	127.8	13.8	0	0	0	0	112.5
293	E	20.2	Very low	21.3	Very low	184 Å²	184	134.3 Å²	134.3	86%	0.86	77%	0.768	S	S	*	*			trans	55	122.6	140.9	-68.5	177	157.1	0	0	122.8
294	S	20.1	Very low	21	Very low	117 Å²	117	132.8 Å²	132.8	82%	0.818	77%	0.769	S	S	*	*			trans	72.9	97.7	149.4	66.6	0	0	0	0	118.6
295	L	20.7	Very low	21.1	Very low	170 Å²	170	129.7 Å²	129.7	89%	0.89	76%	0.763	S	S	*	*				169.5	101.5	106.5	-161.4	75.3	0	0	0	107.7
296	E	19	Very low	21.2	Very low	205 Å²	205	131.6 Å²	131.6	96%	0.958	77%	0.767	S	S	*	*			trans	-116.6	109.9	176.3	-94.5	173	171	0	0	111.5
297	S	19.3	Very low	21.3	Very low	97 Å²	97	136.8 Å²	136.8	68%	0.678	77%	0.773	S	S	*	*			trans	-96	128.7	156.3	52.4	0	0	0	0	109.3
298	S	18.6	Very low	20.9	Very low	96 Å²	96	133.9 Å²	133.9	67%	0.671	78%	0.779	S	S	*	*			trans	57.5	135.8	138.5	58.1	0	0	0	0	122.1
299	H	20.8	Very low	21.2	Very low	161 Å²	161	133.9 Å²	133.9	75%	0.745	79%	0.788	S	S	*	*			trans	88.4	100.2	169.8	-66.9	-80.1	0	0	0	115.4
300	E	19.9	Very low	21.3	Very low	172 Å²	172	135.5 Å²	135.5	80%	0.804	80%	0.799	S	S	*	*				88.8	98.5	78.5	-94.2	-175.2	149	0	0	112.9
301	S	20.4	Very low	21.5	Very low	114 Å²	114	142.8 Å²	142.8	80%	0.797	81%	0.805	S	S	*	*			trans	179.8	103.4	148.7	51	0	0	0	0	106.1
302	A	21	Very low	21.7	Very low	92 Å²	92	140.2 Å²	140.2	76%	0.76	79%	0.793	S	S	*	*				50.7	86.2	75.7	0	0	0	0	0	112.4
303	D	21	Very low	22.1	Very low	153 Å²	153	140.6 Å²	140.6	82%	0.818	79%	0.793	S	S	*	*			trans	-174.1	132.3	139.5	-98.2	-24	0	0	0	114.8
304	T	22.2	Very low	22.6	Very low	121 Å²	121	137.3 Å²	137.3	74%	0.742	78%	0.777	S	S	*	*			trans	80.1	109.9	147.5	61.7	0	0	0	0	124.2
305	V	22.4	Very low	23	Very low	122 Å²	122	140.4 Å²	140.4	74%	0.739	78%	0.779	S	S	*	*				57.1	109.5	124.9	-173.9	0	0	0	0	119.8
306	N	22	Very low	23.3	Very low	150 Å²	150	139.8 Å²	139.8	80%	0.802	78%	0.776	S	S	*	*				159.6	148.4	102	-125.4	-33.6	0	0	0	114.5
307	R	22.4	Very low	23.8	Very low	232 Å²	232	132.2 Å²	132.2	88%	0.875	75%	0.748	S	S	*	*			trans	81	93	163.5	-67.5	-176.7	-176.7	170.8	2.9	120.3
308	G	21.6	Very low	24	Very low	82 Å²	82	137.1 Å²	137.1	85%	0.845	75%	0.752	S	S	*	*				58.2	72.5	115.1	0	0	0	0	0	117.8	S310	G308-S310 PolarHBondContact O-N 2.75Å
309	S	25.8	Very low	24.5	Very low	112 Å²	112	142.4 Å²	142.4	78%	0.783	76%	0.759	S	S	*	*			trans	-75.8	109.4	163	51.3	0	0	0	0	110.4	Y311	S309-Y311 PolarHBondContact O-N 2.95Å
310	S	25.2	Very low	24.9	Very low	117 Å²	117	142.7 Å²	142.7	82%	0.818	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-53.1	123.6	161.9	-163.3	0	0	0	0	109.5	G308 N312	G308-S310 PolarHBondContact O-N 2.75Å; S310-N312 PolarHBondContact O-N 3.35Å
311	Y	26.4	Very low	25.3	Very low	227 Å²	227	139.3 Å²	139.3	89%	0.89	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-56.4	117.3	-179.7	-84.5	-96	0	0	0	111	S309	S309-Y311 PolarHBondContact O-N 2.95Å
312	N	26.1	Very low	25.6	Very low	114 Å²	114	140.9 Å²	140.9	61%	0.61	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-89.9	118	-179.1	-147.4	2	0	0	0	108.3	S310 Q314	S310-N312 PolarHBondContact O-N 3.35Å; N312-Q314 PolarHBondContact ND2-OE1 3.21Å; N312-Q314 PolarHBondContact O-N 2.92Å
313	P	28.7	Very low	25.9	Very low	115 Å²	115	143 Å²	143	75%	0.747	75%	0.75	S	S	*	*			trans	-76.5	52.6	-176.2	31	-34.3	0	0	0	112.4
314	Q	31.2	Very low	26.2	Very low	114 Å²	114	138.8 Å²	138.8	53%	0.533	74%	0.743	S	S	.	*			trans	-91.8	-8.5	-174.7	-82.9	-177.5	-24.2	0	0	114.9	N312	N312-Q314 PolarHBondContact ND2-OE1 3.21Å; N312-Q314 PolarHBondContact O-N 2.92Å
315	Q	27.4	Very low	26.5	Very low	183 Å²	183	137.2 Å²	137.2	86%	0.855	74%	0.741	S	S	*	*	S	Bend	trans	-86.3	-24.3	-178.4	-75.5	179.8	-20.1	0	0	115
316	L	29	Very low	26.7	Very low	157 Å²	157	139.2 Å²	139.2	82%	0.822	75%	0.748	S	S	*	*	G	3₁₀ helix	trans	-85.8	-14.4	177.2	-98.3	104.2	0	0	0	114.8	W318	L316-W318 VanDerWaalsContact C-N 3.27Å; L316-W318 PolarHBondContact O-N 3.48Å
317	A	28.7	Very low	27	Very low	46 Å²	46	139.4 Å²	139.4	38%	0.38	75%	0.748	S	S	.	*	G	3₁₀ helix	trans	-76.8	-10.8	-178.3	0	0	0	0	0	113.8	Y319	A317-Y319 VanDerWaalsContact C-N 3.32Å; A317-Y319 PolarHBondContact O-N 3.46Å
318	W	23.5	Very low	27.2	Very low	200 Å²	200	135.9 Å²	135.9	76%	0.758	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-72.1	-24.8	-176.1	-144.5	84	0	0	0	113.3	L316	L316-W318 VanDerWaalsContact C-N 3.27Å; L316-W318 PolarHBondContact O-N 3.48Å
319	Y	29.4	Very low	27.6	Very low	207 Å²	207	135 Å²	135	81%	0.812	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-89.6	-8.9	-175.7	-78.5	-75.6	0	0	0	115.7	A317	A317-Y319 VanDerWaalsContact C-N 3.32Å; A317-Y319 PolarHBondContact O-N 3.46Å
320	M	28.8	Very low	27.6	Very low	166 Å²	166	137.5 Å²	137.5	82%	0.818	74%	0.743	S	S	*	*	S	Bend	trans	-106.2	-8.2	-173.3	-69.2	-170.8	75	0	0	116.2
321	E	29	Very low	27.7	Very low	101 Å²	101	139 Å²	139	47%	0.472	74%	0.74	S	S	.	*			trans	-103.8	-7.3	-169.3	-154.3	81.1	-149.2	0	0	115.5	N70 T323	N70-E321 PolarHBondContact ND2-OE1 3.38Å; E321-T323 VanDerWaalsContact C-N 3.3Å; E321-T323 PolarHBondContact O-N 3.02Å
322	N	25.5	Very low	27.8	Very low	148 Å²	148	133.8 Å²	133.8	79%	0.791	73%	0.734	S	S	*	*			trans	-86.6	56.8	-179.5	-79.1	-5.2	0	0	0	114
323	T	27.5	Very low	28.2	Very low	137 Å²	137	135.3 Å²	135.3	84%	0.84	74%	0.742	S	S	*	*			trans	-141.8	73.7	161.2	55	0	0	0	0	111	E321	E321-T323 VanDerWaalsContact C-N 3.3Å; E321-T323 PolarHBondContact O-N 3.02Å
324	G	27	Very low	28.6	Very low	64 Å²	64	139.1 Å²	139.1	66%	0.66	75%	0.75	S	S	*	*	S	Bend	trans	-169.6	101	173.6	0	0	0	0	0	111	N326	G324-N326 PolarHBondContact O-N 2.91Å
325	A	28.7	Very low	28.7	Very low	87 Å²	87	140.7 Å²	140.7	72%	0.719	76%	0.762	S	S	*	*			trans	-22.4	109.1	174	0	0	0	0	0	116.2	L327	A325-L327 HydrophobicContact CB-CD1 4.32Å; A325-L327 HydrophobicContact CB-CG 4.3Å; A325-L327 PolarHBondContact O-N 3.33Å; A325-L327 VanDerWaalsContact O-N 3.17Å
326	N	27	Very low	28.9	Very low	164 Å²	164	136 Å²	136	88%	0.877	76%	0.763	S	S	*	*			trans	-67.8	102.2	153.3	-74.1	-17.6	0	0	0	106.9	G324	G324-N326 PolarHBondContact O-N 2.91Å
327	L	27.3	Very low	28.9	Very low	154 Å²	154	139.1 Å²	139.1	81%	0.806	76%	0.764	S	S	*	*			trans	-114.6	59.6	169	-81.8	166.3	0	0	0	107.4	A325	A325-L327 HydrophobicContact CB-CD1 4.32Å; A325-L327 HydrophobicContact CB-CG 4.3Å; A325-L327 PolarHBondContact O-N 3.33Å; A325-L327 VanDerWaalsContact O-N 3.17Å
328	D	28.4	Very low	29.2	Very low	158 Å²	158	141 Å²	141	85%	0.845	78%	0.779	S	S	*	*			trans	-119.2	96.5	162.7	-70.6	-45.2	0	0	0	105.5
329	G	29.6	Very low	29.5	Very low	65 Å²	65	138 Å²	138	67%	0.67	78%	0.778	S	S	*	*			trans	-74.9	128.4	168.8	0	0	0	0	0	108.7	I331	G329-I331 PolarHBondContact O-N 2.88Å
330	D	26.1	Very low	29.4	Very low	163 Å²	163	135.3 Å²	135.3	87%	0.872	78%	0.778	S	S	*	*			trans	-12.3	103.7	160.1	-52.6	-42.4	0	0	0	114.1
331	I	26.5	Very low	29.7	Very low	150 Å²	150	132.7 Å²	132.7	77%	0.769	77%	0.767	S	S	*	*			trans	-99.3	115.8	156.8	-61.8	177.4	0	0	0	105.5	G329 D333	G329-I331 PolarHBondContact O-N 2.88Å; I331-D333 PolarHBondContact O-N 3.4Å
332	P	28.7	Very low	30	Very low	117 Å²	117	133.7 Å²	133.7	76%	0.76	78%	0.782	S	S	*	*			trans	-67.3	125.2	177.6	-12.9	26.5	0	0	0	110
333	D	33.3	Very low	30.7	Very low	145 Å²	145	130.7 Å²	130.7	78%	0.775	78%	0.778	S	S	*	*			trans	-67	137.4	171.6	-70.8	-43	0	0	0	110.5	I331 D335	I331-D333 PolarHBondContact O-N 3.4Å; D333-D335 PolarHBondContact O-N 3.34Å; D333-D335 VanDerWaalsContact O-N 3.14Å
334	E	37.4	Very low	31	Very low	196 Å²	196	131.5 Å²	131.5	92%	0.916	78%	0.777	S	S	*	*	S	Bend	trans	-68	-7.5	-172.4	-87.2	-166.9	147.2	0	0	115.4
335	D	33	Very low	31.6	Very low	147 Å²	147	132.5 Å²	132.5	79%	0.786	78%	0.779	S	S	*	*	S	Bend	trans	-112.3	84.4	178.5	-68.3	-39.1	0	0	0	109.8	D333 R337	D333-D335 PolarHBondContact O-N 3.34Å; D333-D335 VanDerWaalsContact O-N 3.14Å; D335-R337 PolarHBondContact O-N 2.93Å
336	G	31.6	Very low	31.8	Very low	84 Å²	84	135.8 Å²	135.8	87%	0.866	78%	0.784	S	S	*	*			trans	-56.9	56.7	-172.4	0	0	0	0	0	118
337	R	29.8	Very low	32	Very low	223 Å²	223	131.2 Å²	131.2	84%	0.842	78%	0.776	S	S	*	*			trans	-104.1	111.3	162.1	-78	-177.4	-174.6	149.9	4	108	D335 N339	D335-R337 PolarHBondContact O-N 2.93Å; R337-N339 PolarHBondContact O-N 2.75Å; R337-N339 VanDerWaalsContact O-N 3.15Å
338	A	34.6	Very low	32.5	Very low	86 Å²	86	127.9 Å²	127.9	71%	0.711	77%	0.771	S	S	*	*			trans	-55.1	117.1	166.4	0	0	0	0	0	108.9	N340	A338-N340 PolarHBondContact O-N 3.33Å
339	N	30.9	Very low	33	Very low	135 Å²	135	126.2 Å²	126.2	72%	0.722	77%	0.769	S	S	*	*			trans	-67.5	103.1	167	-76	-18.6	0	0	0	107.2	R337 D341	R337-N339 PolarHBondContact O-N 2.75Å; R337-N339 VanDerWaalsContact O-N 3.15Å; N339-D341 PolarHBondContact O-N 3.34Å; N339-D341 VanDerWaalsContact O-N 3.09Å
340	N	26.5	Very low	33.8	Very low	152 Å²	152	131.4 Å²	131.4	81%	0.813	78%	0.775	S	S	*	*			trans	-77.9	76.8	165.8	-68.4	-30.4	0	0	0	107.7	A338	A338-N340 PolarHBondContact O-N 3.33Å
341	D	34.7	Very low	35.1	Very low	111 Å²	111	127.7 Å²	127.7	59%	0.594	77%	0.767	S	S	*	*			trans	-77.9	125.6	170.2	-75.9	-40.6	0	0	0	109.1	N339 A343	N339-D341 PolarHBondContact O-N 3.34Å; N339-D341 VanDerWaalsContact O-N 3.09Å; D341-A343 PolarHBondContact O-N 2.96Å
342	P	36.5	Very low	36.7	Very low	122 Å²	122	127.4 Å²	127.4	79%	0.792	77%	0.765	S	S	*	*	G	3₁₀ helix	trans	-70.7	9.4	-175.1	-15	28.7	0	0	0	115.4
343	A	40.5	Very low	38.8	Very low	84 Å²	84	126.9 Å²	126.9	69%	0.694	76%	0.755	S	S	*	*	G	3₁₀ helix	trans	-85.3	-9.7	-175.8	0	0	0	0	0	114	D341 A345	D341-A343 PolarHBondContact O-N 2.96Å; A343-A345 VanDerWaalsContact C-N 3.31Å
344	D	33.4	Very low	40.9	Very low	155 Å²	155	129 Å²	129	83%	0.829	75%	0.753	S	S	*	*	G	3₁₀ helix	trans	-87.9	6.2	178	-68.6	-20.8	0	0	0	113.5
345	A	38.9	Very low	42.8	Very low	85 Å²	85	126 Å²	126	70%	0.702	74%	0.736	S	S	*	*	G	3₁₀ helix	trans	-80.9	-19.3	-179	0	0	0	0	0	114.4	A343 G347	A343-A345 VanDerWaalsContact C-N 3.31Å; A345-G347 PolarHBondContact O-N 3.19Å
346	D	34.2	Very low	44.9	Very low	155 Å²	155	123 Å²	123	83%	0.829	72%	0.718	S	S	*	*	S	Bend	trans	-96.2	76.1	176.9	-69.1	-26.6	0	0	0	110.1	A348	D346-A348 PolarHBondContact O-N 2.91Å
347	G	30.9	Very low	47.1	Very low	69 Å²	69	120.9 Å²	120.9	71%	0.711	69%	0.686	S	S	*	*			trans	-61.7	81.9	172	0	0	0	0	0	111.7	A345 P349	A345-G347 PolarHBondContact O-N 3.19Å; G347-P349 VanDerWaalsContact O-CD 3.26Å; G347-P349 WeakPolarHBondContact O-CD 3.38Å
348	A	36.9	Very low	49.6	Very low	84 Å²	84	113.3 Å²	113.3	69%	0.694	66%	0.662	S	S	*	*			trans	-59	113.6	155.3	0	0	0	0	0	106.1	D346 E350	D346-A348 PolarHBondContact O-N 2.91Å; A348-E350 PolarHBondContact O-N 3.39Å
349	P	38.9	Very low	51.8	Low	122 Å²	122	109.3 Å²	109.3	79%	0.792	63%	0.629	S	S	*	*			trans	-58.4	118.9	178.7	22.9	-30.7	0	0	0	107	G347 A351	G347-P349 VanDerWaalsContact O-CD 3.26Å; G347-P349 WeakPolarHBondContact O-CD 3.38Å; P349-A351 PolarHBondContact O-N 2.87Å
350	E	46.9	Very low	54.2	Low	174 Å²	174	107.1 Å²	107.1	81%	0.813	62%	0.617	S	S	*	*			trans	-45.1	114.3	178.7	-66.9	-177.8	159.4	0	0	108.4	A348 M352	A348-E350 PolarHBondContact O-N 3.39Å; E350-M352 PolarHBondContact O-N 3.5Å
351	A	53.3	Low	56.8	Low	85 Å²	85	104.2 Å²	104.2	70%	0.702	60%	0.601	S	S	*	*			trans	-50.5	115.7	176.6	0	0	0	0	0	107.6	P349 N353	P349-A351 PolarHBondContact O-N 2.87Å; A351-N353 PolarHBondContact O-N 3.07Å
352	M	60.3	Low	58.9	Low	145 Å²	145	101 Å²	101	71%	0.714	60%	0.595	S	S	*	*			trans	-47	104.9	-169.7	-176.3	157.1	56.3	0	0	110.8	E350 W354 L357	E350-M352 PolarHBondContact O-N 3.5Å; M352-W354 PolarHBondContact O-N 2.89Å; M352-W354 VanDerWaalsContact O-N 3.13Å; M352-L357 HydrophobicContact SD-CD1 4.24Å
353	N	71.5	Confident	61.2	Low	105 Å²	105	97 Å²	97	56%	0.561	57%	0.569	S	S	*	*			trans	-68.5	113.2	-174.4	-79.6	-44.8	0	0	0	109.1	A351 K355 H356 L357	A351-N353 PolarHBondContact O-N 3.07Å; N353-K355 PolarHBondContact O-N 3.36Å; N353-H356 HydrophobicContact CB-CB 4.45Å; N353-H356 WeakPolarHBondContact O-CB 3.47Å; N353-H356 PolarHBondContact O-N 3.33Å; N353-L357 PolarHBondContact O-N 3.46Å
354	W	77.6	Confident	63.3	Low	191 Å²	191	98.5 Å²	98.5	72%	0.723	57%	0.565	S	S	*	*	H	α-helix	trans	-51.6	-28.2	179.1	-70.1	99.3	0	0	0	114.1	M352 L357 L358	M352-W354 PolarHBondContact O-N 2.89Å; M352-W354 VanDerWaalsContact O-N 3.13Å; W354-L357 HydrophobicContact CE3-CD2 3.88Å; W354-L357 HydrophobicContact CZ3-CD2 3.88Å; W354-L358 WeakPolarHBondContact O-CB 3.31Å; W354-L358 WeakPolarHBondContact O-CG 3.49Å; W354-L358 PolarHBondContact O-N 3.4Å
355	K	77.8	Confident	65.7	Low	132 Å²	132	95.2 Å²	95.2	57%	0.574	55%	0.548	S	S	*	.	H	α-helix	trans	-66.5	-37.5	176.4	-60.2	179.7	-179.5	167.5	0	112.3	N353 G359 L360 D361	N353-K355 PolarHBondContact O-N 3.36Å; K355-G359 CarbonylContact O-C 3.53Å; K355-G359 PolarHBondContact O-N 2.83Å; K355-G359 VanDerWaalsContact O-N 3.14Å; K355-L360 HydrophobicContact CB-CB 4.18Å; K355-L360 PolarHBondContact O-N 2.89Å; K355-D361 VanDerWaalsContact C-OD2 3.24Å; K355-D361 WeakPolarHBondContact CB-OD1 3.45Å; K355-D361 WeakPolarHBondContact CB-OD2 3.41Å
356	H	77.4	Confident	68	Low	85 Å²	85	91.2 Å²	91.2	39%	0.394	52%	0.515	S	S	.	.	H	α-helix	trans	-71.1	-45.1	176.8	-168.3	76.7	0	0	0	110.2	N353 L358 G359 D361	N353-H356 HydrophobicContact CB-CB 4.45Å; N353-H356 WeakPolarHBondContact O-CB 3.47Å; N353-H356 PolarHBondContact O-N 3.33Å; H356-L358 PolarHBondContact O-N 3.4Å; H356-G359 PolarHBondContact O-N 3.49Å; H356-D361 VanDerWaalsContact CA-OD2 3.22Å; H356-D361 WeakPolarHBondContact CA-OD2 3.31Å; H356-D361 PolarHBondContact N-OD2 3.03Å
357	L	78.1	Confident	70.5	Confident	38 Å²	38	88.4 Å²	88.4	20%	0.199	50%	0.499	C	S	.	.	H	α-helix	trans	-59.7	-43	179.7	-170.7	74.1	0	0	0	112.7	M352 N353 W354 H369	M352-L357 HydrophobicContact SD-CD1 4.24Å; N353-L357 PolarHBondContact O-N 3.46Å; W354-L357 HydrophobicContact CE3-CD2 3.88Å; W354-L357 HydrophobicContact CZ3-CD2 3.88Å; L357-H369 VanDerWaalsContact CD1-CD2 3.48Å; L357-H369 WeakPolarHBondContact CD1-CD2 3.26Å
358	L	82.1	Confident	73.3	Confident	65 Å²	65	91.9 Å²	91.9	34%	0.34	50%	0.497	S	S	.	.	H	α-helix	trans	-81.9	-16.4	-179.8	-68.9	173.2	0	0	0	113.5	V119 W123 W354 H356 L360	V119-L358 VanDerWaalsContact CG1-O 3.3Å; V119-L358 WeakPolarHBondContact CG1-O 3.48Å; W123-L358 HydrophobicContact CZ2-CD2 4.22Å; W123-L358 PolarHBondContact NE1-O 2.92Å; W354-L358 WeakPolarHBondContact O-CB 3.31Å; W354-L358 WeakPolarHBondContact O-CG 3.49Å; W354-L358 PolarHBondContact O-N 3.4Å; H356-L358 PolarHBondContact O-N 3.4Å; L358-L360 HydrophobicContact CB-CG 4.21Å; L358-L360 HydrophobicContact CD1-CD1 4.37Å
359	G	80.8	Confident	75.8	Confident	2 Å²	2	90.9 Å²	90.9	2%	0.021	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	25	-172	0	0	0	0	0	114.1	H115 V119 K355 H356 D361	H115-G359 PolarHBondContact CE1-O 3.37Å; V119-G359 WeakPolarHBondContact CG2-O 3.32Å; K355-G359 CarbonylContact O-C 3.53Å; K355-G359 PolarHBondContact O-N 2.83Å; K355-G359 VanDerWaalsContact O-N 3.14Å; H356-G359 PolarHBondContact O-N 3.49Å; G359-D361 PolarHBondContact O-N 3.09Å
360	L	82.1	Confident	78.3	Confident	89 Å²	89	85.3 Å²	85.3	47%	0.466	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-15	175	-63.9	175.4	0	0	0	113	L116 K355 L358 G362	L116-L360 HydrophobicContact CD2-CD2 3.76Å; K355-L360 HydrophobicContact CB-CB 4.18Å; K355-L360 PolarHBondContact O-N 2.89Å; L358-L360 HydrophobicContact CB-CG 4.21Å; L358-L360 HydrophobicContact CD1-CD1 4.37Å; L360-G362 VanDerWaalsContact C-N 3.33Å; L360-G362 PolarHBondContact O-N 3.27Å
361	D	80.9	Confident	80.3	Confident	90 Å²	90	82.2 Å²	82.2	48%	0.481	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-2.5	-178.3	-64.1	-32	0	0	0	114.3	K355 H356 G359	K355-D361 VanDerWaalsContact C-OD2 3.24Å; K355-D361 WeakPolarHBondContact CB-OD1 3.45Å; K355-D361 WeakPolarHBondContact CB-OD2 3.41Å; H356-D361 VanDerWaalsContact CA-OD2 3.22Å; H356-D361 WeakPolarHBondContact CA-OD2 3.31Å; H356-D361 PolarHBondContact N-OD2 3.03Å; G359-D361 PolarHBondContact O-N 3.09Å
362	G	78.9	Confident	82.1	Confident	45 Å²	45	86 Å²	86	46%	0.464	43%	0.426	S	S	.	.	S	Bend	trans	90.8	-1.4	-178.8	0	0	0	0	0	115.3	H115 L360	H115-G362 WeakPolarHBondContact CE1-CA 3.45Å; H115-G362 PolarHBondContact NE2-O 2.91Å; L360-G362 VanDerWaalsContact C-N 3.33Å; L360-G362 PolarHBondContact O-N 3.27Å
363	S	83.7	Confident	83.5	Confident	36 Å²	36	80.2 Å²	80.2	25%	0.252	40%	0.398	S	S	.	.			trans	-82.1	139.1	175	177.2	0	0	0	0	111.6	N365 F366	S363-N365 PolarHBondContact O-N 2.73Å; S363-N365 WeakPolarHBondContact OG-CB 3.09Å; S363-N365 PolarHBondContact OG-N 3.36Å; S363-N365 VanDerWaalsContact OG-N 3.17Å; S363-N365 PolarHBondContact OG-ND2 2.94Å; S363-N365 PolarHBondContact OG-OD1 3.2Å; S363-F366 WeakPolarHBondContact O-CD1 3.46Å
364	L	84.1	Confident	84.3	Confident	116 Å²	116	77.1 Å²	77.1	61%	0.607	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-0.1	173.1	-66.4	177.3	0	0	0	113.7	F366 L367	L364-F366 HydrophobicContact CD2-CE1 4.14Å; L364-F366 PolarHBondContact O-N 3.16Å; L364-F366 VanDerWaalsContact O-N 3.12Å; L364-L367 WeakPolarHBondContact O-CB 3.18Å; L364-L367 PolarHBondContact O-N 2.77Å
365	N	84.2	Confident	85	Confident	86 Å²	86	70.8 Å²	70.8	46%	0.46	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-18.2	176.9	-63.6	-1.9	0	0	0	112.7	S363 L367 E368 H369	S363-N365 PolarHBondContact O-N 2.73Å; S363-N365 WeakPolarHBondContact OG-CB 3.09Å; S363-N365 PolarHBondContact OG-N 3.36Å; S363-N365 VanDerWaalsContact OG-N 3.17Å; S363-N365 PolarHBondContact OG-ND2 2.94Å; S363-N365 PolarHBondContact OG-OD1 3.2Å; N365-L367 PolarHBondContact O-N 3.09Å; N365-E368 WeakPolarHBondContact O-CB 3.35Å; N365-E368 PolarHBondContact O-N 3.35Å; N365-H369 PolarHBondContact O-ND1 3.45Å
366	F	87.2	Confident	85.6	Confident	2 Å²	2	65.6 Å²	65.6	1%	0.009	35%	0.348	C	S	.	.	H	α-helix	trans	-61.2	-24.3	173.3	86.1	-89.3	0	0	0	112.2	I118 V119 A122 S363 L364 E368 H369 V370	I118-F366 HydrophobicContact CG2-CZ 3.98Å; V119-F366 HydrophobicContact CG2-CD1 4.19Å; V119-F366 HydrophobicContact CG2-CE1 3.88Å; V119-F366 HydrophobicContact CG2-CE2 4.45Å; V119-F366 HydrophobicContact CG2-CZ 4.04Å; A122-F366 HydrophobicContact CB-CE2 3.75Å; A122-F366 HydrophobicContact CB-CZ 4.45Å; S363-F366 WeakPolarHBondContact O-CD1 3.46Å; L364-F366 HydrophobicContact CD2-CE1 4.14Å; L364-F366 PolarHBondContact O-N 3.16Å; L364-F366 VanDerWaalsContact O-N 3.12Å; F366-E368 VanDerWaalsContact C-N 3.28Å; F366-E368 PolarHBondContact O-N 3.11Å; F366-H369 WeakPolarHBondContact O-CB 3.45Å; F366-H369 PolarHBondContact O-N 3.03Å; F366-H369 VanDerWaalsContact O-N 3.15Å; F366-V370 HydrophobicContact CD2-CG2 3.85Å; F366-V370 HydrophobicContact CE2-CG2 4.11Å; F366-V370 WeakPolarHBondContact O-CG2 3.33Å; F366-V370 PolarHBondContact O-N 3.5Å
367	L	87.1	Confident	86.2	Confident	96 Å²	96	61.8 Å²	61.8	50%	0.503	33%	0.33	S	S	.	.	H	α-helix	trans	-64.4	-35.2	178.5	-166.1	78.1	0	0	0	111.6	L364 N365 H369 V370 L371	L364-L367 WeakPolarHBondContact O-CB 3.18Å; L364-L367 PolarHBondContact O-N 2.77Å; N365-L367 PolarHBondContact O-N 3.09Å; L367-H369 VanDerWaalsContact C-N 3.31Å; L367-H369 PolarHBondContact O-N 3.36Å; L367-V370 PolarHBondContact O-N 3Å; L367-L371 WeakPolarHBondContact O-CG 3.46Å; L367-L371 PolarHBondContact O-N 2.97Å
368	E	90.6	Very high	86.7	Confident	141 Å²	141	61.7 Å²	61.7	66%	0.659	33%	0.331	S	S	*	.	H	α-helix	trans	-60.5	-44.2	173.2	-174.4	-180	170.7	0	0	110.7	N365 F366 V370 L371 W372	N365-E368 WeakPolarHBondContact O-CB 3.35Å; N365-E368 PolarHBondContact O-N 3.35Å; F366-E368 VanDerWaalsContact C-N 3.28Å; F366-E368 PolarHBondContact O-N 3.11Å; E368-V370 PolarHBondContact O-N 3.25Å; E368-L371 PolarHBondContact O-N 3.47Å; E368-W372 WeakPolarHBondContact O-CB 3.29Å; E368-W372 PolarHBondContact O-N 2.93Å
369	H	88.9	Confident	87.2	Confident	64 Å²	64	63 Å²	63	30%	0.296	34%	0.338	S	S	.	.	H	α-helix	trans	-64.4	-39.3	176.3	-59.6	87.8	0	0	0	112.2	L357 N365 F366 L367 W372 L373	L357-H369 VanDerWaalsContact CD1-CD2 3.48Å; L357-H369 WeakPolarHBondContact CD1-CD2 3.26Å; N365-H369 PolarHBondContact O-ND1 3.45Å; F366-H369 WeakPolarHBondContact O-CB 3.45Å; F366-H369 PolarHBondContact O-N 3.03Å; F366-H369 VanDerWaalsContact O-N 3.15Å; L367-H369 VanDerWaalsContact C-N 3.31Å; L367-H369 PolarHBondContact O-N 3.36Å; H369-W372 PolarHBondContact O-N 2.94Å; H369-L373 VanDerWaalsContact O-CB 3.29Å; H369-L373 WeakPolarHBondContact O-CB 3.39Å; H369-L373 PolarHBondContact O-N 2.82Å
370	V	90	Very high	87.7	Confident	5 Å²	5	63.8 Å²	63.8	3%	0.03	34%	0.341	C	S	.	.	H	α-helix	trans	-61.7	-45.7	174	169.3	0	0	0	0	110.6	A122 W123 V127 F366 L367 E368 L373 I374	A122-V370 HydrophobicContact CB-CG2 4.38Å; W123-V370 HydrophobicContact CD2-CG2 4.45Å; W123-V370 HydrophobicContact CH2-CG2 4.1Å; W123-V370 HydrophobicContact CZ2-CG2 3.91Å; W123-V370 HydrophobicContact CZ3-CG2 4.46Å; V127-V370 HydrophobicContact CG2-CG1 3.81Å; F366-V370 HydrophobicContact CD2-CG2 3.85Å; F366-V370 HydrophobicContact CE2-CG2 4.11Å; F366-V370 WeakPolarHBondContact O-CG2 3.33Å; F366-V370 PolarHBondContact O-N 3.5Å; L367-V370 PolarHBondContact O-N 3Å; E368-V370 PolarHBondContact O-N 3.25Å; V370-L373 PolarHBondContact O-N 3.44Å; V370-I374 HydrophobicContact CG1-CD1 3.91Å; V370-I374 VanDerWaalsContact O-CG1 3.25Å; V370-I374 WeakPolarHBondContact O-CG1 3.46Å; V370-I374 PolarHBondContact O-N 3Å
371	L	90.3	Very high	88.1	Confident	109 Å²	109	60 Å²	60	57%	0.571	32%	0.321	S	S	*	.	H	α-helix	trans	-64.1	-43.8	177.5	-70.7	170.3	0	0	0	111.9	L367 E368 L373 I374 A375	L367-L371 WeakPolarHBondContact O-CG 3.46Å; L367-L371 PolarHBondContact O-N 2.97Å; E368-L371 PolarHBondContact O-N 3.47Å; L371-L373 VanDerWaalsContact C-N 3.32Å; L371-L373 PolarHBondContact O-N 2.91Å; L371-I374 PolarHBondContact O-N 2.93Å; L371-A375 WeakPolarHBondContact O-CB 3.28Å; L371-A375 PolarHBondContact O-N 2.93Å
372	W	89.6	Confident	88.5	Confident	165 Å²	165	57.9 Å²	57.9	63%	0.625	31%	0.311	S	S	*	.	H	α-helix	trans	-61.6	-41.5	175.9	-164.5	81.1	0	0	0	111.3	E368 H369 A375 L376	E368-W372 WeakPolarHBondContact O-CB 3.29Å; E368-W372 PolarHBondContact O-N 2.93Å; H369-W372 PolarHBondContact O-N 2.94Å; W372-A375 PolarHBondContact O-N 2.96Å; W372-L376 HydrophobicContact CE3-CD2 4.38Å; W372-L376 HydrophobicContact CH2-CD1 4.39Å; W372-L376 HydrophobicContact CH2-CD2 4.17Å; W372-L376 HydrophobicContact CZ3-CD2 3.79Å; W372-L376 VanDerWaalsContact O-CB 3.26Å; W372-L376 WeakPolarHBondContact O-CB 3.34Å; W372-L376 PolarHBondContact O-N 2.98Å
373	L	90.2	Very high	89	Confident	23 Å²	23	59.7 Å²	59.7	12%	0.12	31%	0.309	C	S	.	.	H	α-helix	trans	-65.3	-40	175.7	-177.7	64.4	0	0	0	112.4	W123 V127 L174 H369 V370 L371 L376 N377	W123-L373 HydrophobicContact CE3-CD2 4.41Å; W123-L373 HydrophobicContact CH2-CD2 4.48Å; W123-L373 HydrophobicContact CZ3-CD2 3.61Å; V127-L373 HydrophobicContact CG1-CD2 3.93Å; V127-L373 HydrophobicContact CG2-CD2 4.45Å; L174-L373 HydrophobicContact CD2-CD1 4.05Å; H369-L373 VanDerWaalsContact O-CB 3.29Å; H369-L373 WeakPolarHBondContact O-CB 3.39Å; H369-L373 PolarHBondContact O-N 2.82Å; V370-L373 PolarHBondContact O-N 3.44Å; L371-L373 VanDerWaalsContact C-N 3.32Å; L371-L373 PolarHBondContact O-N 2.91Å; L373-L376 PolarHBondContact O-N 3.41Å; L373-N377 VanDerWaalsContact O-CB 3.27Å; L373-N377 WeakPolarHBondContact O-CB 3.34Å; L373-N377 PolarHBondContact O-N 3.31Å; L373-N377 PolarHBondContact O-ND2 3.11Å
374	I	89.6	Confident	89.2	Confident	39 Å²	39	61.7 Å²	61.7	20%	0.2	31%	0.314	C	S	.	.	H	α-helix	trans	-63.8	-44.3	175.6	-68.1	168.8	0	0	0	110.5	V127 V370 L371 N377 T378	V127-I374 HydrophobicContact CG2-CG1 4.46Å; V370-I374 HydrophobicContact CG1-CD1 3.91Å; V370-I374 VanDerWaalsContact O-CG1 3.25Å; V370-I374 WeakPolarHBondContact O-CG1 3.46Å; V370-I374 PolarHBondContact O-N 3Å; L371-I374 PolarHBondContact O-N 2.93Å; I374-N377 PolarHBondContact O-N 3.42Å; I374-T378 WeakPolarHBondContact O-CB 3.16Å; I374-T378 PolarHBondContact O-N 3.39Å; I374-T378 PolarHBondContact O-OG1 3.14Å
375	A	90.8	Very high	89.5	Confident	59 Å²	59	57.6 Å²	57.6	49%	0.488	30%	0.297	S	S	.	.	H	α-helix	trans	-62.8	-46	176.4	0	0	0	0	0	111.5	L371 W372 T378 L379	L371-A375 WeakPolarHBondContact O-CB 3.28Å; L371-A375 PolarHBondContact O-N 2.93Å; W372-A375 PolarHBondContact O-N 2.96Å; A375-T378 PolarHBondContact O-N 3.34Å; A375-L379 WeakPolarHBondContact O-CB 3.39Å; A375-L379 PolarHBondContact O-N 3.29Å
376	L	90.8	Very high	89.8	Confident	23 Å²	23	56.2 Å²	56.2	12%	0.12	29%	0.287	C	S	.	.	H	α-helix	trans	-61.6	-47.5	176.9	-172.1	73.8	0	0	0	111.4	F177 W372 L373 T378 L379 F380	F177-L376 HydrophobicContact CD2-CD1 4.37Å; F177-L376 HydrophobicContact CD2-CD2 3.91Å; F177-L376 HydrophobicContact CE2-CD1 4.43Å; F177-L376 HydrophobicContact CE2-CD2 4.09Å; F177-L376 HydrophobicContact CG-CD2 4.29Å; W372-L376 HydrophobicContact CE3-CD2 4.38Å; W372-L376 HydrophobicContact CH2-CD1 4.39Å; W372-L376 HydrophobicContact CH2-CD2 4.17Å; W372-L376 HydrophobicContact CZ3-CD2 3.79Å; W372-L376 VanDerWaalsContact O-CB 3.26Å; W372-L376 WeakPolarHBondContact O-CB 3.34Å; W372-L376 PolarHBondContact O-N 2.98Å; L373-L376 PolarHBondContact O-N 3.41Å; L376-T378 VanDerWaalsContact C-N 3.31Å; L376-T378 PolarHBondContact O-N 3.08Å; L376-L379 WeakPolarHBondContact O-CB 3.19Å; L376-L379 PolarHBondContact O-N 3.45Å; L376-F380 HydrophobicContact CD1-CD2 3.96Å; L376-F380 HydrophobicContact CD1-CE2 3.62Å; L376-F380 HydrophobicContact CG-CD2 3.98Å; L376-F380 HydrophobicContact CG-CE2 4.01Å; L376-F380 VanDerWaalsContact O-CD2 3.28Å; L376-F380 WeakPolarHBondContact O-CD2 3.5Å; L376-F380 PolarHBondContact O-N 3.43Å
377	N	90	Very high	90	Very high	5 Å²	5	58.4 Å²	58.4	3%	0.027	30%	0.301	C	S	.	.	H	α-helix	trans	-59.6	-43.4	176.7	-77.6	-29	0	0	0	111.4	A173 L373 I374 L379 F380 I381	A173-N377 WeakPolarHBondContact CB-OD1 3.5Å; L373-N377 VanDerWaalsContact O-CB 3.27Å; L373-N377 WeakPolarHBondContact O-CB 3.34Å; L373-N377 PolarHBondContact O-N 3.31Å; L373-N377 PolarHBondContact O-ND2 3.11Å; I374-N377 PolarHBondContact O-N 3.42Å; N377-L379 PolarHBondContact O-N 3.49Å; N377-F380 PolarHBondContact O-N 2.67Å; N377-I381 WeakPolarHBondContact O-CD1 3.04Å; N377-I381 WeakPolarHBondContact O-CG1 3.37Å; N377-I381 PolarHBondContact O-N 2.86Å
378	T	89.9	Confident	90.2	Very high	35 Å²	35	54 Å²	54	22%	0.215	28%	0.278	C	S	.	.	H	α-helix	trans	-60.4	-46.7	176.4	-57.4	0	0	0	0	110.9	M134 I374 A375 L376 F380 I381 V382	M134-T378 HydrophobicContact CE-CG2 3.77Å; M134-T378 HydrophobicContact CG-CG2 3.8Å; M134-T378 HydrophobicContact SD-CG2 3.72Å; I374-T378 WeakPolarHBondContact O-CB 3.16Å; I374-T378 PolarHBondContact O-N 3.39Å; I374-T378 PolarHBondContact O-OG1 3.14Å; A375-T378 PolarHBondContact O-N 3.34Å; L376-T378 VanDerWaalsContact C-N 3.31Å; L376-T378 PolarHBondContact O-N 3.08Å; T378-F380 PolarHBondContact O-N 3.5Å; T378-I381 PolarHBondContact O-N 3.04Å; T378-V382 VanDerWaalsContact O-CG2 3.32Å; T378-V382 WeakPolarHBondContact O-CG2 3.25Å; T378-V382 PolarHBondContact O-N 2.82Å
379	L	91.2	Very high	90.3	Very high	92 Å²	92	50.2 Å²	50.2	48%	0.482	26%	0.259	S	S	.	.	H	α-helix	trans	-58.6	-46.3	176.7	-177.1	69.8	0	0	0	111.7	A375 L376 N377 V382 I383	A375-L379 WeakPolarHBondContact O-CB 3.39Å; A375-L379 PolarHBondContact O-N 3.29Å; L376-L379 WeakPolarHBondContact O-CB 3.19Å; L376-L379 PolarHBondContact O-N 3.45Å; N377-L379 PolarHBondContact O-N 3.49Å; L379-V382 PolarHBondContact O-N 3Å; L379-I383 HydrophobicContact CD1-CD1 3.72Å; L379-I383 HydrophobicContact CD1-CG1 4.29Å; L379-I383 HydrophobicContact CD2-CD1 4.4Å; L379-I383 HydrophobicContact CG-CD1 3.74Å; L379-I383 HydrophobicContact CG-CG1 4.48Å; L379-I383 WeakPolarHBondContact O-CB 3.21Å; L379-I383 VanDerWaalsContact O-CG1 3.32Å; L379-I383 WeakPolarHBondContact O-CG1 3.44Å; L379-I383 PolarHBondContact O-N 3.28Å
380	F	91	Very high	90.4	Very high	19 Å²	19	50.3 Å²	50.3	8%	0.083	26%	0.259	C	S	.	.	H	α-helix	trans	-66	-39.7	179.1	-89.6	-107.5	0	0	0	112.4	A173 A176 F177 L376 N377 T378 V382 I383 F384	A173-F380 HydrophobicContact CB-CB 4.45Å; A176-F380 HydrophobicContact CB-CD1 3.93Å; A176-F380 HydrophobicContact CB-CE1 4.17Å; F177-F380 VanDerWaalsContact CA-CE1 3.47Å; F177-F380 HydrophobicContact CB-CE1 3.86Å; F177-F380 HydrophobicContact CB-CE2 4.47Å; F177-F380 HydrophobicContact CB-CZ 3.84Å; F177-F380 HydrophobicContact CD2-CE1 4.48Å; F177-F380 AromaticContact CD2-CE2 3.92Å; F177-F380 HydrophobicContact CD2-CE2 3.92Å; F177-F380 AromaticContact CD2-CZ 3.62Å; F177-F380 HydrophobicContact CD2-CZ 3.62Å; F177-F380 HydrophobicContact CG-CZ 4.23Å; L376-F380 HydrophobicContact CD1-CD2 3.96Å; L376-F380 HydrophobicContact CD1-CE2 3.62Å; L376-F380 HydrophobicContact CG-CD2 3.98Å; L376-F380 HydrophobicContact CG-CE2 4.01Å; L376-F380 VanDerWaalsContact O-CD2 3.28Å; L376-F380 WeakPolarHBondContact O-CD2 3.5Å; L376-F380 PolarHBondContact O-N 3.43Å; N377-F380 PolarHBondContact O-N 2.67Å; T378-F380 PolarHBondContact O-N 3.5Å; F380-V382 VanDerWaalsContact C-N 3.32Å; F380-V382 PolarHBondContact O-N 3.46Å; F380-I383 PolarHBondContact O-N 3.05Å; F380-F384 HydrophobicContact CB-CD2 4.32Å; F380-F384 AromaticContact CD1-CD2 3.47Å; F380-F384 HydrophobicContact CD1-CD2 3.47Å; F380-F384 VanDerWaalsContact CD1-CD2 3.47Å; F380-F384 AromaticContact CD1-CE2 3.46Å; F380-F384 HydrophobicContact CD1-CE2 3.46Å; F380-F384 VanDerWaalsContact CD1-CE2 3.46Å; F380-F384 AromaticContact CE1-CD2 3.95Å; F380-F384 HydrophobicContact CE1-CD2 3.95Å; F380-F384 AromaticContact CE1-CE2 3.42Å; F380-F384 HydrophobicContact CE1-CE2 3.42Å; F380-F384 VanDerWaalsContact CE1-CE2 3.42Å; F380-F384 HydrophobicContact CE1-CZ 4.39Å; F380-F384 HydrophobicContact CG-CD2 4.09Å; F380-F384 HydrophobicContact CG-CE2 4.21Å; F380-F384 HydrophobicContact CZ-CE2 4.16Å; F380-F384 WeakPolarHBondContact O-CB 3.45Å; F380-F384 PolarHBondContact O-N 2.95Å
381	I	90.5	Very high	90.4	Very high	9 Å²	9	53.3 Å²	53.3	5%	0.046	27%	0.274	C	S	.	.	H	α-helix	trans	-62.5	-42.5	174.2	-66.2	162.7	0	0	0	110.1	Y135 L138 I169 N377 T378 A385 F386	Y135-I381 HydrophobicContact CD2-CG2 4.14Å; L138-I381 HydrophobicContact CD1-CB 4.35Å; L138-I381 HydrophobicContact CD1-CG2 3.58Å; I169-I381 HydrophobicContact CG2-CD1 3.87Å; I169-I381 HydrophobicContact CG2-CG1 4.21Å; N377-I381 WeakPolarHBondContact O-CD1 3.04Å; N377-I381 WeakPolarHBondContact O-CG1 3.37Å; N377-I381 PolarHBondContact O-N 2.86Å; T378-I381 PolarHBondContact O-N 3.04Å; I381-A385 HydrophobicContact CG2-CB 4.44Å; I381-A385 WeakPolarHBondContact O-CA 3.45Å; I381-A385 VanDerWaalsContact O-CB 3.28Å; I381-A385 WeakPolarHBondContact O-CB 3.4Å; I381-A385 PolarHBondContact O-N 3.47Å; I381-F386 PolarHBondContact O-N 3.28Å
382	V	90.1	Very high	90.5	Very high	46 Å²	46	48.1 Å²	48.1	28%	0.279	25%	0.246	S	C	.	.	I	π-helix	trans	-64.4	-50.1	178.2	172.5	0	0	0	0	111	L138 T378 L379 F380 C387	L138-V382 HydrophobicContact CD1-CG2 3.82Å; L138-V382 HydrophobicContact CD2-CG2 4.15Å; T378-V382 VanDerWaalsContact O-CG2 3.32Å; T378-V382 WeakPolarHBondContact O-CG2 3.25Å; T378-V382 PolarHBondContact O-N 2.82Å; L379-V382 PolarHBondContact O-N 3Å; F380-V382 VanDerWaalsContact C-N 3.32Å; F380-V382 PolarHBondContact O-N 3.46Å; V382-C387 WeakPolarHBondContact O-CB 3.3Å; V382-C387 PolarHBondContact O-N 3.48Å; V382-C387 PolarHBondContact O-SG 2.89Å; V382-C387 VanDerWaalsContact O-SG 3.36Å
383	I	88.9	Confident	90.6	Very high	83 Å²	83	43.5 Å²	43.5	43%	0.426	23%	0.232	S	C	.	.	I	π-helix	trans	-71.4	-47.2	-174.8	-66.5	175.6	0	0	0	112.3	L379 F380 P388	L379-I383 HydrophobicContact CD1-CD1 3.72Å; L379-I383 HydrophobicContact CD1-CG1 4.29Å; L379-I383 HydrophobicContact CD2-CD1 4.4Å; L379-I383 HydrophobicContact CG-CD1 3.74Å; L379-I383 HydrophobicContact CG-CG1 4.48Å; L379-I383 WeakPolarHBondContact O-CB 3.21Å; L379-I383 VanDerWaalsContact O-CG1 3.32Å; L379-I383 WeakPolarHBondContact O-CG1 3.44Å; L379-I383 PolarHBondContact O-N 3.28Å; F380-I383 PolarHBondContact O-N 3.05Å; I383-P388 WeakPolarHBondContact O-CD 3.32Å
384	F	88.7	Confident	90.7	Very high	78 Å²	78	49.8 Å²	49.8	34%	0.342	26%	0.258	S	S	.	.	I	π-helix	trans	-101.2	-9.9	-170.4	-64.8	-72.5	0	0	0	114.5	F380 Y420	F380-F384 HydrophobicContact CB-CD2 4.32Å; F380-F384 AromaticContact CD1-CD2 3.47Å; F380-F384 HydrophobicContact CD1-CD2 3.47Å; F380-F384 VanDerWaalsContact CD1-CD2 3.47Å; F380-F384 AromaticContact CD1-CE2 3.46Å; F380-F384 HydrophobicContact CD1-CE2 3.46Å; F380-F384 VanDerWaalsContact CD1-CE2 3.46Å; F380-F384 AromaticContact CE1-CD2 3.95Å; F380-F384 HydrophobicContact CE1-CD2 3.95Å; F380-F384 AromaticContact CE1-CE2 3.42Å; F380-F384 HydrophobicContact CE1-CE2 3.42Å; F380-F384 VanDerWaalsContact CE1-CE2 3.42Å; F380-F384 HydrophobicContact CE1-CZ 4.39Å; F380-F384 HydrophobicContact CG-CD2 4.09Å; F380-F384 HydrophobicContact CG-CE2 4.21Å; F380-F384 HydrophobicContact CZ-CE2 4.16Å; F380-F384 WeakPolarHBondContact O-CB 3.45Å; F380-F384 PolarHBondContact O-N 2.95Å; F384-Y420 VanDerWaalsContact C-OH 3.3Å; F384-Y420 WeakPolarHBondContact CA-OH 3.42Å; F384-Y420 PolarHBondContact O-OH 3.19Å
385	A	89.1	Confident	90.8	Very high	30 Å²	30	48.5 Å²	48.5	25%	0.248	25%	0.253	C	S	.	.	I	π-helix	trans	-119.1	-61.6	176.3	0	0	0	0	0	111.8	F139 I381 Y389	F139-A385 HydrophobicContact CE2-CB 4.31Å; F139-A385 HydrophobicContact CZ-CB 4.1Å; I381-A385 HydrophobicContact CG2-CB 4.44Å; I381-A385 WeakPolarHBondContact O-CA 3.45Å; I381-A385 VanDerWaalsContact O-CB 3.28Å; I381-A385 WeakPolarHBondContact O-CB 3.4Å; I381-A385 PolarHBondContact O-N 3.47Å; A385-Y389 WeakPolarHBondContact O-CB 3.28Å; A385-Y389 PolarHBondContact O-N 3.43Å; A385-Y389 VanDerWaalsContact O-N 3.11Å
386	F	90.9	Very high	90.8	Very high	58 Å²	58	46.1 Å²	46.1	25%	0.254	23%	0.232	S	C	.	.	I	π-helix	trans	-63.7	-53.3	-172.7	177.9	-95.1	0	0	0	112.6	L138 I381 Y389 H390	L138-F386 HydrophobicContact CB-CD2 3.95Å; L138-F386 HydrophobicContact CB-CE2 4.45Å; L138-F386 WeakPolarHBondContact O-CE2 3.14Å; I381-F386 PolarHBondContact O-N 3.28Å; F386-Y389 PolarHBondContact O-N 2.91Å; F386-H390 AromaticContact CD2-CD2 3.39Å; F386-H390 WeakPolarHBondContact CD2-CD2 3.43Å; F386-H390 AromaticContact CD2-NE2 3.53Å; F386-H390 AromaticContact CE1-CD2 3.9Å; F386-H390 AromaticContact CE2-CD2 3.16Å; F386-H390 WeakPolarHBondContact CE2-CD2 3.4Å; F386-H390 AromaticContact CE2-NE2 3.04Å; F386-H390 WeakPolarHBondContact CE2-NE2 3.5Å; F386-H390 AromaticContact CG-CD2 3.87Å; F386-H390 AromaticContact CZ-CD2 3.43Å; F386-H390 VanDerWaalsContact CZ-CD2 3.43Å; F386-H390 WeakPolarHBondContact CZ-CD2 3.38Å; F386-H390 AromaticContact CZ-NE2 3.62Å; F386-H390 PolarHBondContact O-CD2 3.33Å; F386-H390 PolarHBondContact O-N 3.36Å
387	C	90.9	Very high	90.8	Very high	47 Å²	47	49.3 Å²	49.3	32%	0.318	25%	0.249	S	C	.	.	H	α-helix	trans	-59.5	-54.5	-177.3	-76.5	0	0	0	0	112.5	V382 Y389 H390 M391 F423	V382-C387 WeakPolarHBondContact O-CB 3.3Å; V382-C387 PolarHBondContact O-N 3.48Å; V382-C387 PolarHBondContact O-SG 2.89Å; V382-C387 VanDerWaalsContact O-SG 3.36Å; C387-Y389 VanDerWaalsContact C-N 3.34Å; C387-Y389 PolarHBondContact O-N 2.95Å; C387-H390 PolarHBondContact O-N 3.32Å; C387-M391 WeakPolarHBondContact O-CB 3.49Å; C387-M391 PolarHBondContact O-N 2.86Å; C387-F423 HydrophobicContact CB-CE2 4.3Å; C387-F423 HydrophobicContact CB-CZ 4.01Å; C387-F423 WeakPolarHBondContact O-CE2 3.44Å
388	P	92.4	Very high	90.8	Very high	3 Å²	3	51.8 Å²	51.8	2%	0.019	28%	0.276	C	S	.	.	H	α-helix	trans	-57.5	-43.6	176.3	-25.4	34.3	0	0	0	112.8	I383 M391 G392 G419 Y420 F423	I383-P388 WeakPolarHBondContact O-CD 3.32Å; P388-M391 PolarHBondContact O-N 3.45Å; P388-G392 PolarHBondContact O-N 3.34Å; P388-G419 VanDerWaalsContact O-CA 3.28Å; P388-G419 WeakPolarHBondContact O-CA 3.46Å; P388-Y420 HydrophobicContact CB-CD1 4.15Å; P388-Y420 HydrophobicContact CB-CD2 3.79Å; P388-Y420 HydrophobicContact CB-CE1 4.06Å; P388-Y420 HydrophobicContact CB-CE2 3.66Å; P388-Y420 HydrophobicContact CB-CG 4.03Å; P388-Y420 HydrophobicContact CG-CD1 4.02Å; P388-Y420 HydrophobicContact CG-CD2 4.31Å; P388-Y420 HydrophobicContact CG-CE1 3.54Å; P388-Y420 HydrophobicContact CG-CE2 3.85Å; P388-Y420 HydrophobicContact CG-CG 4.39Å; P388-Y420 VanDerWaalsContact CG-CZ 3.46Å; P388-F423 HydrophobicContact CB-CD2 4.44Å; P388-F423 HydrophobicContact CG-CD2 4.49Å
389	Y	92.2	Very high	90.9	Very high	62 Å²	62	57.6 Å²	57.6	24%	0.243	30%	0.298	C	S	.	.	H	α-helix	trans	-61.2	-48.7	179.7	176.4	-97.5	0	0	0	112.6	F139 A385 F386 C387 G392 Q393 T415	F139-Y389 AromaticContact CD1-CD1 3.93Å; F139-Y389 HydrophobicContact CD1-CD1 3.93Å; F139-Y389 HydrophobicContact CD1-CE1 4.1Å; F139-Y389 HydrophobicContact CD1-CG 4.48Å; F139-Y389 AromaticContact CE1-CD1 3.5Å; F139-Y389 HydrophobicContact CE1-CD1 3.5Å; F139-Y389 HydrophobicContact CE1-CD2 4.42Å; F139-Y389 HydrophobicContact CE1-CE1 4.1Å; F139-Y389 AromaticContact CE1-CG 3.68Å; F139-Y389 HydrophobicContact CE1-CG 3.68Å; A385-Y389 WeakPolarHBondContact O-CB 3.28Å; A385-Y389 PolarHBondContact O-N 3.43Å; A385-Y389 VanDerWaalsContact O-N 3.11Å; F386-Y389 PolarHBondContact O-N 2.91Å; C387-Y389 VanDerWaalsContact C-N 3.34Å; C387-Y389 PolarHBondContact O-N 2.95Å; Y389-G392 CarbonylContact O-C 3.36Å; Y389-G392 WeakPolarHBondContact O-CA 3.41Å; Y389-G392 PolarHBondContact O-N 2.86Å; Y389-Q393 WeakPolarHBondContact O-CB 3.49Å; Y389-Q393 PolarHBondContact O-N 3.48Å; Y389-T415 WeakPolarHBondContact CD2-OG1 3.35Å; Y389-T415 WeakPolarHBondContact CE2-OG1 3.02Å
390	H	91	Very high	90.9	Very high	66 Å²	66	59.3 Å²	59.3	31%	0.306	31%	0.308	S	S	.	.	H	α-helix	trans	-68.1	-36.7	-179.6	-83.6	-72.5	0	0	0	113	F386 C387 G392 Q393 F394	F386-H390 AromaticContact CD2-CD2 3.39Å; F386-H390 WeakPolarHBondContact CD2-CD2 3.43Å; F386-H390 AromaticContact CD2-NE2 3.53Å; F386-H390 AromaticContact CE1-CD2 3.9Å; F386-H390 AromaticContact CE2-CD2 3.16Å; F386-H390 WeakPolarHBondContact CE2-CD2 3.4Å; F386-H390 AromaticContact CE2-NE2 3.04Å; F386-H390 WeakPolarHBondContact CE2-NE2 3.5Å; F386-H390 AromaticContact CG-CD2 3.87Å; F386-H390 AromaticContact CZ-CD2 3.43Å; F386-H390 VanDerWaalsContact CZ-CD2 3.43Å; F386-H390 WeakPolarHBondContact CZ-CD2 3.38Å; F386-H390 AromaticContact CZ-NE2 3.62Å; F386-H390 PolarHBondContact O-CD2 3.33Å; F386-H390 PolarHBondContact O-N 3.36Å; C387-H390 PolarHBondContact O-N 3.32Å; H390-G392 VanDerWaalsContact C-N 3.32Å; H390-Q393 PolarHBondContact O-N 2.98Å; H390-F394 WeakPolarHBondContact O-CB 3.41Å; H390-F394 PolarHBondContact O-N 3.36Å
391	M	91.1	Very high	90.8	Very high	68 Å²	68	61 Å²	61	34%	0.335	32%	0.318	S	S	.	.	H	α-helix	trans	-60.9	-44.9	171.7	-173	63.5	70.5	0	0	110.7	C387 P388 F394 T395 I422 F423	C387-M391 WeakPolarHBondContact O-CB 3.49Å; C387-M391 PolarHBondContact O-N 2.86Å; P388-M391 PolarHBondContact O-N 3.45Å; M391-F394 PolarHBondContact O-N 2.96Å; M391-T395 WeakPolarHBondContact O-CG2 3.39Å; M391-T395 PolarHBondContact O-N 3.4Å; M391-T395 VanDerWaalsContact O-N 3.12Å; M391-T395 PolarHBondContact O-OG1 2.93Å; M391-I422 HydrophobicContact CG-CB 4.36Å; M391-I422 HydrophobicContact CG-CG2 3.93Å; M391-I422 HydrophobicContact SD-CG2 4.21Å; M391-F423 HydrophobicContact CB-CD2 3.99Å; M391-F423 HydrophobicContact CB-CE2 3.41Å; M391-F423 VanDerWaalsContact CB-CE2 3.41Å; M391-F423 HydrophobicContact CB-CZ 4.16Å; M391-F423 HydrophobicContact CE-CE1 4.33Å; M391-F423 HydrophobicContact CE-CE2 4.22Å; M391-F423 HydrophobicContact CE-CZ 3.9Å; M391-F423 HydrophobicContact CG-CD2 4.07Å; M391-F423 HydrophobicContact CG-CE2 3.84Å; M391-F423 HydrophobicContact CG-CZ 4.46Å
392	G	92.6	Very high	90.7	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-57.7	-52.5	173.2	0	0	0	0	0	112.3	P388 Y389 H390 F394 T395 V396 T415	P388-G392 PolarHBondContact O-N 3.34Å; Y389-G392 CarbonylContact O-C 3.36Å; Y389-G392 WeakPolarHBondContact O-CA 3.41Å; Y389-G392 PolarHBondContact O-N 2.86Å; H390-G392 VanDerWaalsContact C-N 3.32Å; G392-F394 PolarHBondContact O-N 2.88Å; G392-T395 PolarHBondContact O-N 2.95Å; G392-T395 VanDerWaalsContact O-N 3.07Å; G392-T395 PolarHBondContact O-OG1 3.22Å; G392-V396 WeakPolarHBondContact O-CG2 3.36Å; G392-V396 PolarHBondContact O-N 2.9Å; G392-T415 VanDerWaalsContact CA-O 3.31Å; G392-T415 WeakPolarHBondContact CA-O 3.38Å
393	Q	90.9	Very high	90.6	Very high	68 Å²	68	73.4 Å²	73.4	32%	0.318	36%	0.363	S	S	.	.	H	α-helix	trans	-58	-44.9	179.3	-172.1	-178.7	15.7	0	0	112.4	Y389 H390 T395 V396 L397	Y389-Q393 WeakPolarHBondContact O-CB 3.49Å; Y389-Q393 PolarHBondContact O-N 3.48Å; H390-Q393 PolarHBondContact O-N 2.98Å; Q393-T395 VanDerWaalsContact C-N 3.25Å; Q393-T395 PolarHBondContact O-N 3.37Å; Q393-V396 PolarHBondContact O-N 2.7Å; Q393-L397 HydrophobicContact CG-CD1 4.14Å; Q393-L397 WeakPolarHBondContact O-CB 3.42Å; Q393-L397 WeakPolarHBondContact O-CG 3.23Å; Q393-L397 PolarHBondContact O-N 2.87Å
394	F	92.1	Very high	90.6	Very high	155 Å²	155	76.8 Å²	76.8	68%	0.68	38%	0.375	S	S	*	.	H	α-helix	trans	-56.9	-42.5	175.8	178.9	-100.4	0	0	0	111.4	H390 M391 G392 G398	H390-F394 WeakPolarHBondContact O-CB 3.41Å; H390-F394 PolarHBondContact O-N 3.36Å; M391-F394 PolarHBondContact O-N 2.96Å; G392-F394 PolarHBondContact O-N 2.88Å; F394-G398 PolarHBondContact O-N 3.45Å
395	T	91.4	Very high	90.6	Very high	13 Å²	13	73.6 Å²	73.6	8%	0.08	36%	0.361	C	S	.	.	H	α-helix	trans	-74.6	-34.1	-178.6	64.7	0	0	0	0	112.6	M391 G392 Q393 G398 F399 I418 I422	M391-T395 WeakPolarHBondContact O-CG2 3.39Å; M391-T395 PolarHBondContact O-N 3.4Å; M391-T395 VanDerWaalsContact O-N 3.12Å; M391-T395 PolarHBondContact O-OG1 2.93Å; G392-T395 PolarHBondContact O-N 2.95Å; G392-T395 VanDerWaalsContact O-N 3.07Å; G392-T395 PolarHBondContact O-OG1 3.22Å; Q393-T395 VanDerWaalsContact C-N 3.25Å; Q393-T395 PolarHBondContact O-N 3.37Å; T395-G398 PolarHBondContact O-N 3.19Å; T395-F399 VanDerWaalsContact O-CD2 3.26Å; T395-F399 WeakPolarHBondContact O-CD2 3.26Å; T395-F399 PolarHBondContact O-N 3.22Å; T395-I418 WeakPolarHBondContact OG1-CG2 3.46Å; T395-I422 VanDerWaalsContact CB-CD1 3.5Å; T395-I422 HydrophobicContact CG2-CD1 3.19Å; T395-I422 HydrophobicContact CG2-CG1 4.49Å; T395-I422 HydrophobicContact CG2-CG2 4.42Å; T395-I422 WeakPolarHBondContact OG1-CD1 3.21Å
396	V	91.7	Very high	90.5	Very high	9 Å²	9	76 Å²	76	6%	0.055	37%	0.37	C	S	.	.	H	α-helix	trans	-65.4	-43.9	175.7	166.9	0	0	0	0	111.4	G392 Q393 N400 L401 E402 I405 T415 I418	G392-V396 WeakPolarHBondContact O-CG2 3.36Å; G392-V396 PolarHBondContact O-N 2.9Å; Q393-V396 PolarHBondContact O-N 2.7Å; V396-N400 WeakPolarHBondContact O-CA 3.36Å; V396-N400 PolarHBondContact O-N 2.91Å; V396-N400 VanDerWaalsContact O-N 3.08Å; V396-L401 HydrophobicContact CG1-CB 4.29Å; V396-L401 PolarHBondContact O-N 2.82Å; V396-E402 HydrophobicContact CG1-CG 4.2Å; V396-I405 HydrophobicContact CB-CD1 3.88Å; V396-I405 HydrophobicContact CG1-CD1 3.43Å; V396-I405 VanDerWaalsContact CG1-CD1 3.43Å; V396-I405 HydrophobicContact CG2-CD1 3.1Å; V396-T415 HydrophobicContact CG2-CG2 4.28Å; V396-I418 HydrophobicContact CG2-CD1 3.98Å
397	L	90.5	Very high	90.2	Very high	89 Å²	89	76.4 Å²	76.4	47%	0.466	38%	0.384	S	S	.	.	H	α-helix	trans	-65.7	-43	172.8	-68.3	171.7	0	0	0	111	Q393 F399 N400 E402	Q393-L397 HydrophobicContact CG-CD1 4.14Å; Q393-L397 WeakPolarHBondContact O-CB 3.42Å; Q393-L397 WeakPolarHBondContact O-CG 3.23Å; Q393-L397 PolarHBondContact O-N 2.87Å; L397-F399 PolarHBondContact O-N 3.36Å; L397-N400 PolarHBondContact O-N 2.92Å; L397-E402 WeakPolarHBondContact CD2-OE1 3.45Å
398	G	90.2	Very high	89.9	Confident	58 Å²	58	76.5 Å²	76.5	60%	0.598	38%	0.383	S	S	*	.	H	α-helix	trans	-63.1	-37.8	-179.7	0	0	0	0	0	114.2	F394 T395	F394-G398 PolarHBondContact O-N 3.45Å; T395-G398 PolarHBondContact O-N 3.19Å
399	F	91.7	Very high	89.6	Confident	156 Å²	156	80 Å²	80	68%	0.684	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	6.9	-179.4	-68.8	-72	0	0	0	114.1	T395 L397 L401	T395-F399 VanDerWaalsContact O-CD2 3.26Å; T395-F399 WeakPolarHBondContact O-CD2 3.26Å; T395-F399 PolarHBondContact O-N 3.22Å; L397-F399 PolarHBondContact O-N 3.36Å; F399-L401 VanDerWaalsContact C-N 3.29Å; F399-L401 HydrophobicContact CB-CD1 3.99Å; F399-L401 HydrophobicContact CB-CG 3.83Å; F399-L401 PolarHBondContact O-N 2.72Å
400	N	90.7	Very high	89.3	Confident	129 Å²	129	79.3 Å²	79.3	69%	0.69	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	40.9	-175.9	-69.9	-45	0	0	0	113.8	V396 L397 E402	V396-N400 WeakPolarHBondContact O-CA 3.36Å; V396-N400 PolarHBondContact O-N 2.91Å; V396-N400 VanDerWaalsContact O-N 3.08Å; L397-N400 PolarHBondContact O-N 2.92Å; N400-E402 VanDerWaalsContact C-N 3.28Å; N400-E402 PolarHBondContact O-N 2.94Å
401	L	89.7	Confident	89.1	Confident	55 Å²	55	81.3 Å²	81.3	29%	0.288	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	5	-177.7	-65.2	174	0	0	0	114.1	V396 F399 R403 F404 I405	V396-L401 HydrophobicContact CG1-CB 4.29Å; V396-L401 PolarHBondContact O-N 2.82Å; F399-L401 VanDerWaalsContact C-N 3.29Å; F399-L401 HydrophobicContact CB-CD1 3.99Å; F399-L401 HydrophobicContact CB-CG 3.83Å; F399-L401 PolarHBondContact O-N 2.72Å; L401-R403 PolarHBondContact O-N 2.84Å; L401-R403 VanDerWaalsContact O-N 3.16Å; L401-F404 HydrophobicContact CD2-CD2 3.84Å; L401-F404 HydrophobicContact CD2-CE2 4.24Å; L401-F404 PolarHBondContact O-N 3.25Å; L401-I405 HydrophobicContact CB-CD1 4.39Å; L401-I405 PolarHBondContact O-N 3.14Å
402	E	88.7	Confident	88.9	Confident	95 Å²	95	80 Å²	80	44%	0.444	41%	0.411	S	S	.	.	H	α-helix	trans	-52.3	-40.2	-177.6	-62.5	-175.4	164	0	0	112.8	V396 L397 N400 F404 I405 N406	V396-E402 HydrophobicContact CG1-CG 4.2Å; L397-E402 WeakPolarHBondContact CD2-OE1 3.45Å; N400-E402 VanDerWaalsContact C-N 3.28Å; N400-E402 PolarHBondContact O-N 2.94Å; E402-F404 VanDerWaalsContact C-N 3.33Å; E402-F404 PolarHBondContact O-N 3.19Å; E402-I405 PolarHBondContact O-N 3.49Å; E402-N406 WeakPolarHBondContact O-CB 3.48Å; E402-N406 PolarHBondContact O-N 3.3Å; E402-N406 PolarHBondContact O-OD1 3.28Å
403	R	87.8	Confident	88.8	Confident	220 Å²	220	85 Å²	85	83%	0.83	43%	0.434	S	S	*	.	H	α-helix	trans	-61.9	-39.6	-179.9	-66.5	-175.8	-177.2	176.4	1.7	113	L401 A407	L401-R403 PolarHBondContact O-N 2.84Å; L401-R403 VanDerWaalsContact O-N 3.16Å; R403-A407 PolarHBondContact O-N 3.48Å
404	F	88.3	Confident	88.7	Confident	154 Å²	154	82.9 Å²	82.9	68%	0.675	43%	0.426	S	S	*	.	H	α-helix	trans	-73.8	-34.3	-179.6	-64.4	-73.5	0	0	0	111.5	L401 E402 A407	L401-F404 HydrophobicContact CD2-CD2 3.84Å; L401-F404 HydrophobicContact CD2-CE2 4.24Å; L401-F404 PolarHBondContact O-N 3.25Å; E402-F404 VanDerWaalsContact C-N 3.33Å; E402-F404 PolarHBondContact O-N 3.19Å; F404-A407 WeakPolarHBondContact O-CB 3.24Å; F404-A407 PolarHBondContact O-N 2.78Å
405	I	88.8	Confident	88.7	Confident	10 Å²	10	75.9 Å²	75.9	5%	0.051	40%	0.396	C	S	.	.	H	α-helix	trans	-76	-41.3	-179.8	-72.4	165.1	0	0	0	111.2	V396 L401 E402 A407 T408 E411 T415 I418	V396-I405 HydrophobicContact CB-CD1 3.88Å; V396-I405 HydrophobicContact CG1-CD1 3.43Å; V396-I405 VanDerWaalsContact CG1-CD1 3.43Å; V396-I405 HydrophobicContact CG2-CD1 3.1Å; L401-I405 HydrophobicContact CB-CD1 4.39Å; L401-I405 PolarHBondContact O-N 3.14Å; E402-I405 PolarHBondContact O-N 3.49Å; I405-A407 PolarHBondContact O-N 3.33Å; I405-T408 PolarHBondContact O-N 3.45Å; I405-T408 PolarHBondContact O-OG1 2.88Å; I405-E411 HydrophobicContact CG2-CB 3.96Å; I405-E411 HydrophobicContact CG2-CG 4.05Å; I405-T415 HydrophobicContact CD1-CG2 4.13Å; I405-T415 HydrophobicContact CG2-CG2 4.19Å; I405-I418 HydrophobicContact CD1-CD1 3.89Å; I405-I418 HydrophobicContact CG1-CD1 4.45Å
406	N	86	Confident	88.8	Confident	81 Å²	81	76.6 Å²	76.6	43%	0.433	40%	0.402	S	S	.	.	H	α-helix	trans	-63.4	-27.3	175.5	-64.2	-0	0	0	0	111.3	E402 T408 H409 E411	E402-N406 WeakPolarHBondContact O-CB 3.48Å; E402-N406 PolarHBondContact O-N 3.3Å; E402-N406 PolarHBondContact O-OD1 3.28Å; N406-T408 VanDerWaalsContact C-N 3.28Å; N406-T408 PolarHBondContact O-N 3.5Å; N406-H409 PolarHBondContact O-N 2.97Å; N406-E411 PolarHBondContact OD1-OE1 3.46Å
407	A	84.9	Confident	88.8	Confident	66 Å²	66	78.2 Å²	78.2	55%	0.545	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-23.6	174.6	0	0	0	0	0	113.6	R403 F404 I405 H409	R403-A407 PolarHBondContact O-N 3.48Å; F404-A407 WeakPolarHBondContact O-CB 3.24Å; F404-A407 PolarHBondContact O-N 2.78Å; I405-A407 PolarHBondContact O-N 3.33Å; A407-H409 VanDerWaalsContact C-N 3.31Å
408	T	85.7	Confident	88.9	Confident	50 Å²	50	76 Å²	76	31%	0.307	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-12	178.8	71.9	0	0	0	0	113.3	I405 N406 M410 S414	I405-T408 PolarHBondContact O-N 3.45Å; I405-T408 PolarHBondContact O-OG1 2.88Å; N406-T408 VanDerWaalsContact C-N 3.28Å; N406-T408 PolarHBondContact O-N 3.5Å; T408-M410 PolarHBondContact O-N 2.93Å; T408-M410 PolarHBondContact OG1-N 3.49Å; T408-S414 PolarHBondContact OG1-OG 2.93Å; T408-S414 VanDerWaalsContact OG1-OG 3.08Å
409	H	85.4	Confident	89.1	Confident	76 Å²	76	73.3 Å²	73.3	35%	0.352	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	5.1	-170.2	-66.6	-96	0	0	0	114.7	N406 A407 F493 H494 P497	N406-H409 PolarHBondContact O-N 2.97Å; A407-H409 VanDerWaalsContact C-N 3.31Å; H409-F493 AromaticContact CD2-CE1 3.83Å; H409-H494 AromaticContact CE1-ND1 3.48Å; H409-H494 PolarHBondContact CE1-ND1 3.32Å; H409-H494 AromaticContact NE2-CE1 3.51Å; H409-H494 AromaticContact NE2-ND1 3.07Å; H409-H494 PolarHBondContact NE2-ND1 2.84Å; H409-P497 HydrophobicContact CB-CB 3.83Å; H409-P497 HydrophobicContact CB-CG 3.81Å
410	M	86.2	Confident	89.3	Confident	47 Å²	47	68.3 Å²	68.3	23%	0.232	35%	0.347	C	S	.	.			trans	-126.6	55.8	-175.3	-62.2	-62.3	176.6	0	0	110.2	T408 G412 F413 S414 P497 V498	T408-M410 PolarHBondContact O-N 2.93Å; T408-M410 PolarHBondContact OG1-N 3.49Å; M410-G412 VanDerWaalsContact C-N 3.29Å; M410-G412 PolarHBondContact O-N 3.46Å; M410-F413 HydrophobicContact CB-CB 4.3Å; M410-F413 PolarHBondContact O-N 3.28Å; M410-F413 VanDerWaalsContact O-N 3.11Å; M410-S414 PolarHBondContact O-N 3.05Å; M410-S414 PolarHBondContact O-OG 3.41Å; M410-P497 HydrophobicContact CE-CB 3.74Å; M410-P497 HydrophobicContact CE-CG 4.07Å; M410-V498 VanDerWaalsContact CE-CA 3.46Å; M410-V498 HydrophobicContact CE-CB 3.93Å; M410-V498 HydrophobicContact CE-CG2 3.29Å; M410-V498 VanDerWaalsContact CE-N 3.28Å; M410-V498 HydrophobicContact SD-CG2 4.01Å
411	E	86.9	Confident	89.4	Confident	109 Å²	109	66.6 Å²	66.6	51%	0.509	34%	0.336	S	S	.	.	H	α-helix	trans	-53.4	-45.1	-170.6	-59.9	178.8	-172	0	0	112.3	I405 N406 F413 T415	I405-E411 HydrophobicContact CG2-CB 3.96Å; I405-E411 HydrophobicContact CG2-CG 4.05Å; N406-E411 PolarHBondContact OD1-OE1 3.46Å; E411-F413 PolarHBondContact O-N 2.87Å; E411-T415 WeakPolarHBondContact O-CB 3.29Å; E411-T415 WeakPolarHBondContact O-CG2 3.49Å; E411-T415 PolarHBondContact O-N 2.89Å; E411-T415 PolarHBondContact O-OG1 3.12Å
412	G	86.8	Confident	89.6	Confident	39 Å²	39	66.2 Å²	66.2	40%	0.402	33%	0.334	S	S	.	.	H	α-helix	trans	-64.6	-37.2	-179.9	0	0	0	0	0	114.9	M410 T415 S416	M410-G412 VanDerWaalsContact C-N 3.29Å; M410-G412 PolarHBondContact O-N 3.46Å; G412-T415 WeakPolarHBondContact CA-OG1 3.2Å; G412-T415 PolarHBondContact O-OG1 3.21Å; G412-T415 VanDerWaalsContact O-OG1 3.05Å; G412-S416 WeakPolarHBondContact O-CB 3.48Å; G412-S416 PolarHBondContact O-N 3.33Å; G412-S416 PolarHBondContact O-OG 3.22Å
413	F	89.5	Confident	89.8	Confident	107 Å²	107	64.3 Å²	64.3	47%	0.469	33%	0.325	S	S	.	.	H	α-helix	trans	-74.8	-44.2	178.5	178.1	-99.2	0	0	0	111.4	M410 E411 S416 L417 L460	M410-F413 HydrophobicContact CB-CB 4.3Å; M410-F413 PolarHBondContact O-N 3.28Å; M410-F413 VanDerWaalsContact O-N 3.11Å; E411-F413 PolarHBondContact O-N 2.87Å; F413-S416 PolarHBondContact O-N 3.04Å; F413-S416 PolarHBondContact O-OG 3.05Å; F413-L417 WeakPolarHBondContact O-CB 2.9Å; F413-L417 PolarHBondContact O-N 3.07Å; F413-L460 HydrophobicContact CE2-CD1 4.36Å; F413-L460 HydrophobicContact CE2-CD2 4.44Å; F413-L460 HydrophobicContact CZ-CD1 4.2Å; F413-L460 HydrophobicContact CZ-CD2 4.19Å
414	S	90.2	Very high	90	Very high	22 Å²	22	54.4 Å²	54.4	15%	0.154	29%	0.29	C	S	.	.	H	α-helix	trans	-67.1	-41.2	-179.8	-62.1	0	0	0	0	112.2	T408 M410 L417 I418	T408-S414 PolarHBondContact OG1-OG 2.93Å; T408-S414 VanDerWaalsContact OG1-OG 3.08Å; M410-S414 PolarHBondContact O-N 3.05Å; M410-S414 PolarHBondContact O-OG 3.41Å; S414-L417 PolarHBondContact O-N 2.74Å; S414-I418 WeakPolarHBondContact O-CG1 3.45Å; S414-I418 PolarHBondContact O-N 3.35Å; S414-I418 VanDerWaalsContact O-N 3.15Å
415	T	92.2	Very high	90.2	Very high	9 Å²	9	53 Å²	53	6%	0.055	28%	0.283	C	S	.	.	H	α-helix	trans	-62.3	-47.5	175.8	48.2	0	0	0	0	111.8	Y389 G392 V396 I405 E411 G412 L417 I418 G419	Y389-T415 WeakPolarHBondContact CD2-OG1 3.35Å; Y389-T415 WeakPolarHBondContact CE2-OG1 3.02Å; G392-T415 VanDerWaalsContact CA-O 3.31Å; G392-T415 WeakPolarHBondContact CA-O 3.38Å; V396-T415 HydrophobicContact CG2-CG2 4.28Å; I405-T415 HydrophobicContact CD1-CG2 4.13Å; I405-T415 HydrophobicContact CG2-CG2 4.19Å; E411-T415 WeakPolarHBondContact O-CB 3.29Å; E411-T415 WeakPolarHBondContact O-CG2 3.49Å; E411-T415 PolarHBondContact O-N 2.89Å; E411-T415 PolarHBondContact O-OG1 3.12Å; G412-T415 WeakPolarHBondContact CA-OG1 3.2Å; G412-T415 PolarHBondContact O-OG1 3.21Å; G412-T415 VanDerWaalsContact O-OG1 3.05Å; T415-L417 PolarHBondContact O-N 3.45Å; T415-I418 PolarHBondContact O-N 3.36Å; T415-G419 PolarHBondContact O-N 3.02Å
416	S	92.3	Very high	90.4	Very high	28 Å²	28	54.4 Å²	54.4	20%	0.196	30%	0.297	C	S	.	.	H	α-helix	trans	-63.4	-38.3	177.6	53.8	0	0	0	0	113.1	G412 F413 G419 Y420	G412-S416 WeakPolarHBondContact O-CB 3.48Å; G412-S416 PolarHBondContact O-N 3.33Å; G412-S416 PolarHBondContact O-OG 3.22Å; F413-S416 PolarHBondContact O-N 3.04Å; F413-S416 PolarHBondContact O-OG 3.05Å; S416-G419 WeakPolarHBondContact O-CA 3.31Å; S416-G419 PolarHBondContact O-N 2.89Å; S416-Y420 WeakPolarHBondContact O-CD2 3.01Å; S416-Y420 PolarHBondContact O-N 3.37Å
417	L	92.6	Very high	90.7	Very high	42 Å²	42	52.4 Å²	52.4	22%	0.22	29%	0.286	C	S	.	.	H	α-helix	trans	-60.4	-46	175.2	-176.5	67.7	0	0	0	112.1	F413 S414 T415 G419 Y420 I421 L457 L460	F413-L417 WeakPolarHBondContact O-CB 2.9Å; F413-L417 PolarHBondContact O-N 3.07Å; S414-L417 PolarHBondContact O-N 2.74Å; T415-L417 PolarHBondContact O-N 3.45Å; L417-G419 VanDerWaalsContact C-N 3.28Å; L417-G419 PolarHBondContact O-N 2.99Å; L417-Y420 PolarHBondContact O-N 3.37Å; L417-I421 HydrophobicContact CG-CD1 4.33Å; L417-I421 WeakPolarHBondContact O-CG1 3.11Å; L417-I421 PolarHBondContact O-N 2.94Å; L417-I421 VanDerWaalsContact O-N 3.09Å; L417-L457 HydrophobicContact CD1-CD2 3.88Å; L417-L460 HydrophobicContact CD1-CD2 3.69Å
418	I	93.1	Very high	91.1	Very high	44 Å²	44	51.9 Å²	51.9	23%	0.226	27%	0.273	C	S	.	.	H	α-helix	trans	-59.7	-44.2	174.9	-67.6	166	0	0	0	109.8	T395 V396 I405 S414 T415 Y420 I421 I422	T395-I418 WeakPolarHBondContact OG1-CG2 3.46Å; V396-I418 HydrophobicContact CG2-CD1 3.98Å; I405-I418 HydrophobicContact CD1-CD1 3.89Å; I405-I418 HydrophobicContact CG1-CD1 4.45Å; S414-I418 WeakPolarHBondContact O-CG1 3.45Å; S414-I418 PolarHBondContact O-N 3.35Å; S414-I418 VanDerWaalsContact O-N 3.15Å; T415-I418 PolarHBondContact O-N 3.36Å; I418-Y420 PolarHBondContact O-N 3.11Å; I418-I421 PolarHBondContact O-N 3.19Å; I418-I422 HydrophobicContact CG2-CD1 3.71Å; I418-I422 HydrophobicContact CG2-CG1 4.5Å; I418-I422 VanDerWaalsContact O-CG1 3.31Å; I418-I422 WeakPolarHBondContact O-CG1 3.21Å; I418-I422 PolarHBondContact O-N 3.06Å
419	G	94.5	Very high	91.4	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-55.6	-47.2	175.2	0	0	0	0	0	113.5	P388 T415 S416 L417 I421 I422 F423	P388-G419 VanDerWaalsContact O-CA 3.28Å; P388-G419 WeakPolarHBondContact O-CA 3.46Å; T415-G419 PolarHBondContact O-N 3.02Å; S416-G419 WeakPolarHBondContact O-CA 3.31Å; S416-G419 PolarHBondContact O-N 2.89Å; L417-G419 VanDerWaalsContact C-N 3.28Å; L417-G419 PolarHBondContact O-N 2.99Å; G419-I421 PolarHBondContact O-N 3.25Å; G419-I422 PolarHBondContact O-N 3.05Å; G419-F423 VanDerWaalsContact O-CD2 3.28Å; G419-F423 WeakPolarHBondContact O-CD2 3.34Å; G419-F423 PolarHBondContact O-N 3.45Å
420	Y	94.8	Very high	91.8	Very high	51 Å²	51	53 Å²	53	20%	0.2	28%	0.278	C	S	.	.	H	α-helix	trans	-63.3	-39.8	177.4	-84.2	-67.3	0	0	0	113.6	F384 P388 S416 L417 I418 I422 F423 A424 I453	F384-Y420 VanDerWaalsContact C-OH 3.3Å; F384-Y420 WeakPolarHBondContact CA-OH 3.42Å; F384-Y420 PolarHBondContact O-OH 3.19Å; P388-Y420 HydrophobicContact CB-CD1 4.15Å; P388-Y420 HydrophobicContact CB-CD2 3.79Å; P388-Y420 HydrophobicContact CB-CE1 4.06Å; P388-Y420 HydrophobicContact CB-CE2 3.66Å; P388-Y420 HydrophobicContact CB-CG 4.03Å; P388-Y420 HydrophobicContact CG-CD1 4.02Å; P388-Y420 HydrophobicContact CG-CD2 4.31Å; P388-Y420 HydrophobicContact CG-CE1 3.54Å; P388-Y420 HydrophobicContact CG-CE2 3.85Å; P388-Y420 HydrophobicContact CG-CG 4.39Å; P388-Y420 VanDerWaalsContact CG-CZ 3.46Å; S416-Y420 WeakPolarHBondContact O-CD2 3.01Å; S416-Y420 PolarHBondContact O-N 3.37Å; L417-Y420 PolarHBondContact O-N 3.37Å; I418-Y420 PolarHBondContact O-N 3.11Å; Y420-I422 VanDerWaalsContact C-N 3.28Å; Y420-I422 PolarHBondContact O-N 3.14Å; Y420-F423 PolarHBondContact O-N 2.82Å; Y420-A424 WeakPolarHBondContact O-CB 3.06Å; Y420-A424 PolarHBondContact O-N 3.31Å; Y420-I453 HydrophobicContact CD1-CG2 4.26Å
421	I	93.4	Very high	92	Very high	93 Å²	93	52.6 Å²	52.6	48%	0.477	28%	0.276	S	S	.	.	H	α-helix	trans	-62	-41.6	175.8	-67.7	167	0	0	0	110.1	L417 I418 G419 A424 F425 L457	L417-I421 HydrophobicContact CG-CD1 4.33Å; L417-I421 WeakPolarHBondContact O-CG1 3.11Å; L417-I421 PolarHBondContact O-N 2.94Å; L417-I421 VanDerWaalsContact O-N 3.09Å; I418-I421 PolarHBondContact O-N 3.19Å; G419-I421 PolarHBondContact O-N 3.25Å; I421-A424 WeakPolarHBondContact O-CB 3.36Å; I421-A424 PolarHBondContact O-N 3.3Å; I421-F425 PolarHBondContact O-N 3.35Å; I421-L457 HydrophobicContact CG1-CD1 4.35Å
422	I	93.7	Very high	92.1	Very high	47 Å²	47	52.5 Å²	52.5	24%	0.241	28%	0.275	C	S	.	.	H	α-helix	trans	-71.5	-38.7	179.4	-66.6	172.8	0	0	0	111.1	M391 T395 I418 G419 Y420 A424 F425 A426	M391-I422 HydrophobicContact CG-CB 4.36Å; M391-I422 HydrophobicContact CG-CG2 3.93Å; M391-I422 HydrophobicContact SD-CG2 4.21Å; T395-I422 VanDerWaalsContact CB-CD1 3.5Å; T395-I422 HydrophobicContact CG2-CD1 3.19Å; T395-I422 HydrophobicContact CG2-CG1 4.49Å; T395-I422 HydrophobicContact CG2-CG2 4.42Å; T395-I422 WeakPolarHBondContact OG1-CD1 3.21Å; I418-I422 HydrophobicContact CG2-CD1 3.71Å; I418-I422 HydrophobicContact CG2-CG1 4.5Å; I418-I422 VanDerWaalsContact O-CG1 3.31Å; I418-I422 WeakPolarHBondContact O-CG1 3.21Å; I418-I422 PolarHBondContact O-N 3.06Å; G419-I422 PolarHBondContact O-N 3.05Å; Y420-I422 VanDerWaalsContact C-N 3.28Å; Y420-I422 PolarHBondContact O-N 3.14Å; I422-A424 VanDerWaalsContact C-N 3.33Å; I422-A424 PolarHBondContact O-N 3.41Å; I422-F425 PolarHBondContact O-N 3.38Å; I422-A426 VanDerWaalsContact O-CB 3.3Å; I422-A426 WeakPolarHBondContact O-CB 3.14Å; I422-A426 PolarHBondContact O-N 3.42Å
423	F	92.9	Very high	92.4	Very high	55 Å²	55	54.5 Å²	54.5	24%	0.241	28%	0.276	C	S	.	.	H	α-helix	trans	-59.6	-42.9	170.4	-93.2	-71.9	0	0	0	111.9	C387 P388 M391 G419 Y420 F425 A426 L427 I453	C387-F423 HydrophobicContact CB-CE2 4.3Å; C387-F423 HydrophobicContact CB-CZ 4.01Å; C387-F423 WeakPolarHBondContact O-CE2 3.44Å; P388-F423 HydrophobicContact CB-CD2 4.44Å; P388-F423 HydrophobicContact CG-CD2 4.49Å; M391-F423 HydrophobicContact CB-CD2 3.99Å; M391-F423 HydrophobicContact CB-CE2 3.41Å; M391-F423 VanDerWaalsContact CB-CE2 3.41Å; M391-F423 HydrophobicContact CB-CZ 4.16Å; M391-F423 HydrophobicContact CE-CE1 4.33Å; M391-F423 HydrophobicContact CE-CE2 4.22Å; M391-F423 HydrophobicContact CE-CZ 3.9Å; M391-F423 HydrophobicContact CG-CD2 4.07Å; M391-F423 HydrophobicContact CG-CE2 3.84Å; M391-F423 HydrophobicContact CG-CZ 4.46Å; G419-F423 VanDerWaalsContact O-CD2 3.28Å; G419-F423 WeakPolarHBondContact O-CD2 3.34Å; G419-F423 PolarHBondContact O-N 3.45Å; Y420-F423 PolarHBondContact O-N 2.82Å; F423-F425 PolarHBondContact O-N 3.13Å; F423-A426 PolarHBondContact O-N 3.36Å; F423-L427 WeakPolarHBondContact O-CB 3.28Å; F423-L427 VanDerWaalsContact O-CG 3.29Å; F423-L427 WeakPolarHBondContact O-CG 3.34Å; F423-L427 PolarHBondContact O-N 2.98Å; F423-I453 HydrophobicContact CB-CD1 3.86Å
424	A	92.4	Very high	92.5	Very high	12 Å²	12	51.3 Å²	51.3	10%	0.099	26%	0.262	C	S	.	.	H	α-helix	trans	-60.5	-46.1	175.8	0	0	0	0	0	111.4	Y420 I421 I422 L427 I428 I453 L457	Y420-A424 WeakPolarHBondContact O-CB 3.06Å; Y420-A424 PolarHBondContact O-N 3.31Å; I421-A424 WeakPolarHBondContact O-CB 3.36Å; I421-A424 PolarHBondContact O-N 3.3Å; I422-A424 VanDerWaalsContact C-N 3.33Å; I422-A424 PolarHBondContact O-N 3.41Å; A424-L427 PolarHBondContact O-N 3.36Å; A424-I428 WeakPolarHBondContact O-CG1 3.49Å; A424-I428 PolarHBondContact O-N 2.88Å; A424-I428 VanDerWaalsContact O-N 3.07Å; A424-I453 HydrophobicContact CB-CG2 3.85Å; A424-L457 HydrophobicContact CB-CD1 4.37Å
425	F	92.5	Very high	92.3	Very high	124 Å²	124	53.6 Å²	53.6	54%	0.544	28%	0.275	S	S	.	.	H	α-helix	trans	-64.1	-43	177.1	-176.8	-106.2	0	0	0	112.4	I421 I422 F423 L427 I428 L429	I421-F425 PolarHBondContact O-N 3.35Å; I422-F425 PolarHBondContact O-N 3.38Å; F423-F425 PolarHBondContact O-N 3.13Å; F425-L427 VanDerWaalsContact C-N 3.34Å; F425-L427 PolarHBondContact O-N 3.06Å; F425-I428 PolarHBondContact O-N 3.25Å; F425-L429 HydrophobicContact CD1-CD1 3.85Å; F425-L429 HydrophobicContact CD1-CG 4.3Å; F425-L429 HydrophobicContact CE1-CD1 3.3Å; F425-L429 HydrophobicContact CE1-CD2 4.46Å; F425-L429 HydrophobicContact CE1-CG 3.91Å; F425-L429 HydrophobicContact CE2-CG 4.44Å; F425-L429 HydrophobicContact CZ-CD1 3.76Å; F425-L429 HydrophobicContact CZ-CD2 4.08Å; F425-L429 HydrophobicContact CZ-CG 3.98Å; F425-L429 WeakPolarHBondContact O-CG 3.17Å; F425-L429 PolarHBondContact O-N 3.19Å
426	A	93.3	Very high	92.2	Very high	41 Å²	41	59.7 Å²	59.7	34%	0.339	31%	0.306	S	S	.	.	H	α-helix	trans	-61.9	-40.7	176.2	0	0	0	0	0	111.8	I422 F423 L429 M430	I422-A426 VanDerWaalsContact O-CB 3.3Å; I422-A426 WeakPolarHBondContact O-CB 3.14Å; I422-A426 PolarHBondContact O-N 3.42Å; F423-A426 PolarHBondContact O-N 3.36Å; A426-L429 PolarHBondContact O-N 3.36Å; A426-M430 WeakPolarHBondContact O-CB 3.42Å; A426-M430 WeakPolarHBondContact O-CG 3.49Å; A426-M430 PolarHBondContact O-N 2.94Å
427	L	92.7	Very high	92.2	Very high	38 Å²	38	63.4 Å²	63.4	20%	0.199	32%	0.323	C	S	.	.	H	α-helix	trans	-65.6	-37.7	175.9	-72.5	174.7	0	0	0	112.5	F423 A424 F425 M430 H431 T446 I453	F423-L427 WeakPolarHBondContact O-CB 3.28Å; F423-L427 VanDerWaalsContact O-CG 3.29Å; F423-L427 WeakPolarHBondContact O-CG 3.34Å; F423-L427 PolarHBondContact O-N 2.98Å; A424-L427 PolarHBondContact O-N 3.36Å; F425-L427 VanDerWaalsContact C-N 3.34Å; F425-L427 PolarHBondContact O-N 3.06Å; L427-M430 PolarHBondContact O-N 3.37Å; L427-H431 VanDerWaalsContact O-CB 3.26Å; L427-H431 WeakPolarHBondContact O-CB 3.39Å; L427-H431 PolarHBondContact O-N 3.5Å; L427-T446 HydrophobicContact CD2-CG2 4.48Å; L427-I453 HydrophobicContact CD1-CD1 3.62Å; L427-I453 HydrophobicContact CD1-CG1 4.42Å
428	I	91.4	Very high	91.9	Very high	55 Å²	55	68.2 Å²	68.2	28%	0.282	35%	0.349	S	S	.	.	H	α-helix	trans	-62.1	-50.6	173.1	-66.7	162.7	0	0	0	110.2	A424 F425 M430 H431 E432 Y450	A424-I428 WeakPolarHBondContact O-CG1 3.49Å; A424-I428 PolarHBondContact O-N 2.88Å; A424-I428 VanDerWaalsContact O-N 3.07Å; F425-I428 PolarHBondContact O-N 3.25Å; I428-M430 VanDerWaalsContact C-N 3.33Å; I428-M430 PolarHBondContact O-N 3.47Å; I428-H431 WeakPolarHBondContact O-CB 3.45Å; I428-H431 PolarHBondContact O-N 3Å; I428-E432 WeakPolarHBondContact O-CG 3.31Å; I428-E432 PolarHBondContact O-N 3.46Å; I428-Y450 HydrophobicContact CD1-CD2 3.99Å; I428-Y450 HydrophobicContact CD1-CE2 3.56Å; I428-Y450 HydrophobicContact CG1-CD2 3.64Å; I428-Y450 HydrophobicContact CG1-CE2 3.7Å; I428-Y450 HydrophobicContact CG1-CG 4.22Å
429	L	93.6	Very high	91.6	Very high	70 Å²	70	70.7 Å²	70.7	37%	0.366	36%	0.361	S	S	.	.	H	α-helix	trans	-60.4	-42.2	178.8	-71.5	-177.7	0	0	0	112.1	F425 A426 H431 E432 I433	F425-L429 HydrophobicContact CD1-CD1 3.85Å; F425-L429 HydrophobicContact CD1-CG 4.3Å; F425-L429 HydrophobicContact CE1-CD1 3.3Å; F425-L429 HydrophobicContact CE1-CD2 4.46Å; F425-L429 HydrophobicContact CE1-CG 3.91Å; F425-L429 HydrophobicContact CE2-CG 4.44Å; F425-L429 HydrophobicContact CZ-CD1 3.76Å; F425-L429 HydrophobicContact CZ-CD2 4.08Å; F425-L429 HydrophobicContact CZ-CG 3.98Å; F425-L429 WeakPolarHBondContact O-CG 3.17Å; F425-L429 PolarHBondContact O-N 3.19Å; A426-L429 PolarHBondContact O-N 3.36Å; L429-H431 VanDerWaalsContact C-N 3.35Å; L429-E432 PolarHBondContact O-N 3.07Å; L429-I433 WeakPolarHBondContact O-CD1 3.49Å; L429-I433 VanDerWaalsContact O-CG1 3.24Å; L429-I433 WeakPolarHBondContact O-CG1 3.2Å; L429-I433 PolarHBondContact O-N 2.94Å
430	M	92.6	Very high	91.1	Very high	79 Å²	79	72.7 Å²	72.7	39%	0.389	37%	0.374	S	S	.	.	H	α-helix	trans	-65.3	-39.2	177.2	-72.4	-63.1	-60	0	0	111.8	A426 L427 I428 I433 F434 T446	A426-M430 WeakPolarHBondContact O-CB 3.42Å; A426-M430 WeakPolarHBondContact O-CG 3.49Å; A426-M430 PolarHBondContact O-N 2.94Å; L427-M430 PolarHBondContact O-N 3.37Å; I428-M430 VanDerWaalsContact C-N 3.33Å; I428-M430 PolarHBondContact O-N 3.47Å; M430-I433 PolarHBondContact O-N 3.07Å; M430-I433 HydrophobicContact SD-CD1 4.46Å; M430-F434 HydrophobicContact CB-CD2 4.48Å; M430-F434 HydrophobicContact CB-CE2 4.27Å; M430-F434 HydrophobicContact CE-CD2 4.42Å; M430-F434 HydrophobicContact CE-CE1 4.12Å; M430-F434 HydrophobicContact CE-CE2 3.48Å; M430-F434 VanDerWaalsContact CE-CE2 3.48Å; M430-F434 HydrophobicContact CE-CZ 3.29Å; M430-F434 WeakPolarHBondContact O-CB 3.39Å; M430-F434 WeakPolarHBondContact O-CD2 3.2Å; M430-F434 WeakPolarHBondContact O-CG 3.49Å; M430-F434 PolarHBondContact O-N 3.45Å; M430-T446 HydrophobicContact CB-CG2 4.12Å
431	H	90.2	Very high	90.7	Very high	39 Å²	39	78.2 Å²	78.2	18%	0.181	39%	0.394	C	S	.	.	H	α-helix	trans	-62.3	-43.1	174.7	-179.1	85.6	0	0	0	111.3	D198 L427 I428 L429 F434 T435 C443	D198-H431 IonicContact OD2-CE1 3.46Å; L427-H431 VanDerWaalsContact O-CB 3.26Å; L427-H431 WeakPolarHBondContact O-CB 3.39Å; L427-H431 PolarHBondContact O-N 3.5Å; I428-H431 WeakPolarHBondContact O-CB 3.45Å; I428-H431 PolarHBondContact O-N 3Å; L429-H431 VanDerWaalsContact C-N 3.35Å; H431-F434 PolarHBondContact O-N 3.18Å; H431-T435 WeakPolarHBondContact O-CB 3.5Å; H431-T435 PolarHBondContact O-N 3.1Å; H431-T435 PolarHBondContact O-OG1 3.19Å; H431-C443 PolarHBondContact CE1-SG 3.39Å; H431-C443 PolarHBondContact ND1-O 2.77Å; H431-C443 PolarHBondContact ND1-SG 2.92Å
432	E	89.9	Confident	90.5	Very high	107 Å²	107	74.8 Å²	74.8	50%	0.5	38%	0.38	S	S	.	.	H	α-helix	trans	-62	-44.7	174.1	-70.8	178.3	179.2	0	0	112	I428 L429 T435 I436	I428-E432 WeakPolarHBondContact O-CG 3.31Å; I428-E432 PolarHBondContact O-N 3.46Å; L429-E432 PolarHBondContact O-N 3.07Å; E432-T435 WeakPolarHBondContact O-CB 3.42Å; E432-T435 PolarHBondContact O-N 3.5Å; E432-I436 VanDerWaalsContact O-CG1 3.31Å; E432-I436 WeakPolarHBondContact O-CG1 3.43Å; E432-I436 PolarHBondContact O-N 3.3Å
433	I	92.9	Very high	90.3	Very high	81 Å²	81	72.7 Å²	72.7	42%	0.415	37%	0.37	S	S	.	.	H	α-helix	trans	-62.6	-44.8	177.3	-67.8	163.6	0	0	0	111	L429 M430 T435 I436 L437	L429-I433 WeakPolarHBondContact O-CD1 3.49Å; L429-I433 VanDerWaalsContact O-CG1 3.24Å; L429-I433 WeakPolarHBondContact O-CG1 3.2Å; L429-I433 PolarHBondContact O-N 2.94Å; M430-I433 PolarHBondContact O-N 3.07Å; M430-I433 HydrophobicContact SD-CD1 4.46Å; I433-T435 VanDerWaalsContact C-N 3.32Å; I433-T435 PolarHBondContact O-N 3.17Å; I433-I436 PolarHBondContact O-N 3.05Å; I433-L437 HydrophobicContact CG2-CD1 3.88Å; I433-L437 HydrophobicContact CG2-CG 4.39Å; I433-L437 VanDerWaalsContact O-CG 3.32Å; I433-L437 WeakPolarHBondContact O-CG 3.2Å; I433-L437 PolarHBondContact O-N 2.78Å
434	F	91.2	Very high	90	Very high	41 Å²	41	73.8 Å²	73.8	18%	0.18	37%	0.373	C	S	.	.	H	α-helix	trans	-69.4	-30.3	178.9	-69.3	-43.4	0	0	0	113.4	M430 H431 L437 N438 M439 A442 T446	M430-F434 HydrophobicContact CB-CD2 4.48Å; M430-F434 HydrophobicContact CB-CE2 4.27Å; M430-F434 HydrophobicContact CE-CD2 4.42Å; M430-F434 HydrophobicContact CE-CE1 4.12Å; M430-F434 HydrophobicContact CE-CE2 3.48Å; M430-F434 VanDerWaalsContact CE-CE2 3.48Å; M430-F434 HydrophobicContact CE-CZ 3.29Å; M430-F434 WeakPolarHBondContact O-CB 3.39Å; M430-F434 WeakPolarHBondContact O-CD2 3.2Å; M430-F434 WeakPolarHBondContact O-CG 3.49Å; M430-F434 PolarHBondContact O-N 3.45Å; H431-F434 PolarHBondContact O-N 3.18Å; F434-L437 HydrophobicContact CD1-CD1 4.43Å; F434-L437 CarbonylContact O-C 3.59Å; F434-L437 PolarHBondContact O-N 3.05Å; F434-N438 PolarHBondContact O-N 3.2Å; F434-N438 VanDerWaalsContact O-N 3.12Å; F434-M439 HydrophobicContact CD1-SD 4.25Å; F434-M439 PolarHBondContact O-N 3.49Å; F434-A442 HydrophobicContact CB-CB 4.14Å; F434-A442 HydrophobicContact CD1-CB 3.82Å; F434-A442 HydrophobicContact CD2-CB 3.62Å; F434-A442 HydrophobicContact CE1-CB 4.07Å; F434-A442 HydrophobicContact CE2-CB 3.86Å; F434-A442 HydrophobicContact CG-CB 3.6Å; F434-A442 HydrophobicContact CZ-CB 4.07Å; F434-T446 HydrophobicContact CD2-CG2 3.75Å; F434-T446 HydrophobicContact CE2-CG2 3.64Å
435	T	86.5	Confident	89.9	Confident	70 Å²	70	81.6 Å²	81.6	43%	0.429	40%	0.4	S	S	.	.	H	α-helix	trans	-62.8	-45.3	170.3	-58	0	0	0	0	110.2	H431 E432 I433 L437 N438 C443	H431-T435 WeakPolarHBondContact O-CB 3.5Å; H431-T435 PolarHBondContact O-N 3.1Å; H431-T435 PolarHBondContact O-OG1 3.19Å; E432-T435 WeakPolarHBondContact O-CB 3.42Å; E432-T435 PolarHBondContact O-N 3.5Å; I433-T435 VanDerWaalsContact C-N 3.32Å; I433-T435 PolarHBondContact O-N 3.17Å; T435-L437 VanDerWaalsContact C-N 3.33Å; T435-L437 PolarHBondContact O-N 2.72Å; T435-N438 PolarHBondContact O-N 3.09Å; T435-C443 PolarHBondContact OG1-SG 3.41Å; T435-C443 VanDerWaalsContact OG1-SG 3.34Å
436	I	90.4	Very high	89.8	Confident	137 Å²	137	76.5 Å²	76.5	70%	0.703	38%	0.379	S	S	*	.	H	α-helix	trans	-63.9	-38.7	176.4	-66.1	164.3	0	0	0	111.3	E432 I433 N438	E432-I436 VanDerWaalsContact O-CG1 3.31Å; E432-I436 WeakPolarHBondContact O-CG1 3.43Å; E432-I436 PolarHBondContact O-N 3.3Å; I433-I436 PolarHBondContact O-N 3.05Å; I436-N438 PolarHBondContact O-N 2.88Å
437	L	91.9	Very high	89.6	Confident	105 Å²	105	74.6 Å²	74.6	55%	0.55	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	1.3	178.4	-65.4	174.9	0	0	0	114	I433 F434 T435 M439	I433-L437 HydrophobicContact CG2-CD1 3.88Å; I433-L437 HydrophobicContact CG2-CG 4.39Å; I433-L437 VanDerWaalsContact O-CG 3.32Å; I433-L437 WeakPolarHBondContact O-CG 3.2Å; I433-L437 PolarHBondContact O-N 2.78Å; F434-L437 HydrophobicContact CD1-CD1 4.43Å; F434-L437 CarbonylContact O-C 3.59Å; F434-L437 PolarHBondContact O-N 3.05Å; T435-L437 VanDerWaalsContact C-N 3.33Å; T435-L437 PolarHBondContact O-N 2.72Å; L437-M439 VanDerWaalsContact C-N 3.31Å; L437-M439 HydrophobicContact CB-CG 4.26Å; L437-M439 PolarHBondContact O-N 3.49Å
438	N	85.9	Confident	89.5	Confident	144 Å²	144	73.6 Å²	73.6	77%	0.77	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	42.1	-177.4	-72.9	-39.4	0	0	0	113.9	F434 T435 I436 P440	F434-N438 PolarHBondContact O-N 3.2Å; F434-N438 VanDerWaalsContact O-N 3.12Å; T435-N438 PolarHBondContact O-N 3.09Å; I436-N438 PolarHBondContact O-N 2.88Å; N438-P440 WeakPolarHBondContact O-CD 3.43Å
439	M	87.6	Confident	89.4	Confident	95 Å²	95	72 Å²	72	47%	0.468	35%	0.354	S	S	.	.			trans	-104.8	88.1	176.9	-66.5	-174	71.5	0	0	111.2	F434 L437 R441 A442 C443	F434-M439 HydrophobicContact CD1-SD 4.25Å; F434-M439 PolarHBondContact O-N 3.49Å; L437-M439 VanDerWaalsContact C-N 3.31Å; L437-M439 HydrophobicContact CB-CG 4.26Å; L437-M439 PolarHBondContact O-N 3.49Å; M439-R441 PolarHBondContact O-N 2.9Å; M439-A442 HydrophobicContact CB-CB 4.02Å; M439-A442 PolarHBondContact O-N 3.02Å; M439-C443 WeakPolarHBondContact O-CB 3.41Å; M439-C443 PolarHBondContact O-N 2.57Å
440	P	83.9	Confident	89.3	Confident	43 Å²	43	70.6 Å²	70.6	28%	0.279	35%	0.345	S	S	.	.	H	α-helix	trans	-62.6	-40.3	-170.5	23.4	-33.8	0	0	0	113.3	A201 N438 A442 C443 Y444	A201-P440 HydrophobicContact CB-CB 4.27Å; N438-P440 WeakPolarHBondContact O-CD 3.43Å; P440-A442 PolarHBondContact O-N 3.17Å; P440-C443 VanDerWaalsContact O-CB 3.31Å; P440-C443 WeakPolarHBondContact O-CB 3.39Å; P440-C443 PolarHBondContact O-N 3.41Å; P440-Y444 PolarHBondContact O-N 2.88Å
441	R	86.7	Confident	89.3	Confident	166 Å²	166	66.9 Å²	66.9	63%	0.626	33%	0.327	S	S	*	.	H	α-helix	trans	-61	-44.6	177.5	-67.4	-176.3	-178.6	170.2	1.4	112.4	E202 M439 C443 Y444 W445	E202-R441 IonicContact OE1-CZ 2.67Å; E202-R441 VanDerWaalsContact OE1-CZ 3.25Å; E202-R441 IonicContact OE1-NE 3.14Å; E202-R441 PolarHBondContact OE1-NE 2.88Å; E202-R441 IonicContact OE1-NH2 3.5Å; E202-R441 PolarHBondContact OE1-NH2 2.92Å; E202-R441 IonicContact OE2-NE 3.56Å; M439-R441 PolarHBondContact O-N 2.9Å; R441-C443 VanDerWaalsContact C-N 3.32Å; R441-Y444 PolarHBondContact O-N 2.93Å; R441-W445 PolarHBondContact O-N 3.4Å; R441-W445 VanDerWaalsContact O-N 3.15Å
442	A	88.5	Confident	89.3	Confident	22 Å²	22	66.7 Å²	66.7	18%	0.182	32%	0.324	C	S	.	.	H	α-helix	trans	-68.1	-36.5	179.8	0	0	0	0	0	111.1	F434 M439 P440 T446	F434-A442 HydrophobicContact CB-CB 4.14Å; F434-A442 HydrophobicContact CD1-CB 3.82Å; F434-A442 HydrophobicContact CD2-CB 3.62Å; F434-A442 HydrophobicContact CE1-CB 4.07Å; F434-A442 HydrophobicContact CE2-CB 3.86Å; F434-A442 HydrophobicContact CG-CB 3.6Å; F434-A442 HydrophobicContact CZ-CB 4.07Å; M439-A442 HydrophobicContact CB-CB 4.02Å; M439-A442 PolarHBondContact O-N 3.02Å; P440-A442 PolarHBondContact O-N 3.17Å; A442-T446 WeakPolarHBondContact O-CB 3.22Å; A442-T446 WeakPolarHBondContact O-CG2 3.35Å; A442-T446 PolarHBondContact O-N 3.33Å; A442-T446 VanDerWaalsContact O-N 3.07Å; A442-T446 PolarHBondContact O-OG1 2.7Å
443	C	88.9	Confident	89.4	Confident	3 Å²	3	62.8 Å²	62.8	2%	0.02	31%	0.307	C	S	.	.	H	α-helix	trans	-59.7	-47.1	173.3	-157.2	0	0	0	0	111.9	D198 H431 T435 M439 P440 R441 T446 G447	D198-C443 PolarHBondContact OD2-SG 2.7Å; H431-C443 PolarHBondContact CE1-SG 3.39Å; H431-C443 PolarHBondContact ND1-O 2.77Å; H431-C443 PolarHBondContact ND1-SG 2.92Å; T435-C443 PolarHBondContact OG1-SG 3.41Å; T435-C443 VanDerWaalsContact OG1-SG 3.34Å; M439-C443 WeakPolarHBondContact O-CB 3.41Å; M439-C443 PolarHBondContact O-N 2.57Å; P440-C443 VanDerWaalsContact O-CB 3.31Å; P440-C443 WeakPolarHBondContact O-CB 3.39Å; P440-C443 PolarHBondContact O-N 3.41Å; R441-C443 VanDerWaalsContact C-N 3.32Å; C443-T446 PolarHBondContact O-OG1 3.28Å; C443-G447 PolarHBondContact O-N 2.85Å
444	Y	87.8	Confident	89.4	Confident	78 Å²	78	59.7 Å²	59.7	31%	0.306	29%	0.29	S	S	.	.	H	α-helix	trans	-60.7	-51.8	177.4	177.3	-96.8	0	0	0	112.8	L195 V199 P440 R441 T446 G447 L448	L195-Y444 HydrophobicContact CD1-CD2 3.65Å; L195-Y444 HydrophobicContact CD1-CE2 4.1Å; L195-Y444 HydrophobicContact CD1-CG 4.37Å; L195-Y444 HydrophobicContact CD2-CD2 4.49Å; L195-Y444 HydrophobicContact CD2-CE2 4.11Å; L195-Y444 HydrophobicContact CG-CD2 3.86Å; L195-Y444 HydrophobicContact CG-CE2 3.89Å; V199-Y444 HydrophobicContact CG2-CD2 3.59Å; V199-Y444 HydrophobicContact CG2-CE2 3.69Å; P440-Y444 PolarHBondContact O-N 2.88Å; R441-Y444 PolarHBondContact O-N 2.93Å; Y444-T446 PolarHBondContact O-N 3.32Å; Y444-G447 PolarHBondContact O-N 2.66Å; Y444-L448 HydrophobicContact CE1-CD2 4.31Å; Y444-L448 VanDerWaalsContact O-CB 3.25Å; Y444-L448 WeakPolarHBondContact O-CB 3.38Å; Y444-L448 PolarHBondContact O-N 3.08Å
445	W	89.4	Confident	89.4	Confident	175 Å²	175	58.2 Å²	58.2	66%	0.663	28%	0.284	S	S	*	.	H	α-helix	trans	-65.3	-38.2	-178.5	-74.6	106.7	0	0	0	112.9	R441 L448 G449	R441-W445 PolarHBondContact O-N 3.4Å; R441-W445 VanDerWaalsContact O-N 3.15Å; W445-L448 HydrophobicContact CE3-CD2 4.29Å; W445-L448 HydrophobicContact CZ3-CD2 4.36Å; W445-G449 PolarHBondContact O-N 2.73Å
446	T	91	Very high	89.6	Confident	17 Å²	17	57.6 Å²	57.6	10%	0.104	29%	0.286	C	S	.	.	H	α-helix	trans	-69.4	-41.6	175.7	49.5	0	0	0	0	112.3	L427 M430 F434 A442 C443 Y444 G449 Y450	L427-T446 HydrophobicContact CD2-CG2 4.48Å; M430-T446 HydrophobicContact CB-CG2 4.12Å; F434-T446 HydrophobicContact CD2-CG2 3.75Å; F434-T446 HydrophobicContact CE2-CG2 3.64Å; A442-T446 WeakPolarHBondContact O-CB 3.22Å; A442-T446 WeakPolarHBondContact O-CG2 3.35Å; A442-T446 PolarHBondContact O-N 3.33Å; A442-T446 VanDerWaalsContact O-N 3.07Å; A442-T446 PolarHBondContact O-OG1 2.7Å; C443-T446 PolarHBondContact O-OG1 3.28Å; Y444-T446 PolarHBondContact O-N 3.32Å; T446-G449 PolarHBondContact O-N 3.42Å; T446-Y450 PolarHBondContact O-N 3.3Å
447	G	89.4	Confident	89.7	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.01	26%	0.263	C	S	.	.	H	α-helix	trans	-62.8	-43.3	174.8	0	0	0	0	0	112.4	C443 Y444 Y450 I451	C443-G447 PolarHBondContact O-N 2.85Å; Y444-G447 PolarHBondContact O-N 2.66Å; G447-Y450 WeakPolarHBondContact O-CB 3.26Å; G447-Y450 PolarHBondContact O-N 3.08Å; G447-I451 WeakPolarHBondContact O-CG1 3.4Å; G447-I451 PolarHBondContact O-N 3.37Å
448	L	90.1	Very high	89.7	Confident	18 Å²	18	48.2 Å²	48.2	9%	0.094	24%	0.238	C	C	.	.	H	α-helix	trans	-60.9	-49.2	174.6	-177	69	0	0	0	111	L187 L195 Y444 W445 Y450 I451 Y452	L187-L448 HydrophobicContact CD1-CD1 3.71Å; L195-L448 HydrophobicContact CD2-CD1 4.45Å; Y444-L448 HydrophobicContact CE1-CD2 4.31Å; Y444-L448 VanDerWaalsContact O-CB 3.25Å; Y444-L448 WeakPolarHBondContact O-CB 3.38Å; Y444-L448 PolarHBondContact O-N 3.08Å; W445-L448 HydrophobicContact CE3-CD2 4.29Å; W445-L448 HydrophobicContact CZ3-CD2 4.36Å; L448-Y450 VanDerWaalsContact C-N 3.28Å; L448-Y450 PolarHBondContact O-N 3.13Å; L448-I451 PolarHBondContact O-N 3.41Å; L448-I451 VanDerWaalsContact O-N 3.14Å; L448-Y452 HydrophobicContact CD1-CD2 4.25Å; L448-Y452 HydrophobicContact CD1-CE2 3.63Å; L448-Y452 HydrophobicContact CD2-CE2 4.03Å; L448-Y452 HydrophobicContact CG-CD2 3.94Å; L448-Y452 HydrophobicContact CG-CE2 3.54Å; L448-Y452 WeakPolarHBondContact O-CD2 3.32Å; L448-Y452 PolarHBondContact O-N 3.01Å; L448-Y452 VanDerWaalsContact O-N 3.09Å
449	G	89.8	Confident	89.9	Confident	20 Å²	20	43.6 Å²	43.6	21%	0.206	22%	0.217	C	C	.	.	H	α-helix	trans	-57.3	-40	175.8	0	0	0	0	0	112.9	W445 T446 Y452 I453	W445-G449 PolarHBondContact O-N 2.73Å; T446-G449 PolarHBondContact O-N 3.42Å; G449-Y452 PolarHBondContact O-N 3.07Å; G449-I453 WeakPolarHBondContact O-CG1 3.4Å; G449-I453 PolarHBondContact O-N 3.19Å; G449-I453 VanDerWaalsContact O-N 3.13Å
450	Y	91.8	Very high	90.1	Very high	42 Å²	42	41.9 Å²	41.9	17%	0.165	21%	0.209	C	C	.	.	H	α-helix	trans	-62.2	-45.1	174.9	165.2	-109.6	0	0	0	111.9	W194 I428 T446 G447 L448 Y452 I453 K454	W194-Y450 HydrophobicContact CH2-CD1 4.36Å; I428-Y450 HydrophobicContact CD1-CD2 3.99Å; I428-Y450 HydrophobicContact CD1-CE2 3.56Å; I428-Y450 HydrophobicContact CG1-CD2 3.64Å; I428-Y450 HydrophobicContact CG1-CE2 3.7Å; I428-Y450 HydrophobicContact CG1-CG 4.22Å; T446-Y450 PolarHBondContact O-N 3.3Å; G447-Y450 WeakPolarHBondContact O-CB 3.26Å; G447-Y450 PolarHBondContact O-N 3.08Å; L448-Y450 VanDerWaalsContact C-N 3.28Å; L448-Y450 PolarHBondContact O-N 3.13Å; Y450-Y452 VanDerWaalsContact C-N 3.32Å; Y450-Y452 PolarHBondContact O-N 3.5Å; Y450-I453 PolarHBondContact O-N 3.33Å; Y450-K454 HydrophobicContact CE1-CD 4.24Å; Y450-K454 HydrophobicContact CE2-CB 4.26Å; Y450-K454 WeakPolarHBondContact O-CB 3.36Å; Y450-K454 PolarHBondContact O-N 3.47Å
451	I	91	Very high	90.3	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-60.1	-43.4	177.9	-65	165.1	0	0	0	110.9	L187 P192 W194 L195 G447 L448 K454 V455 I549	L187-I451 HydrophobicContact CD2-CD1 4.4Å; L187-I451 HydrophobicContact CD2-CG2 4.02Å; P192-I451 HydrophobicContact CG-CD1 3.73Å; W194-I451 HydrophobicContact CH2-CD1 3.61Å; W194-I451 HydrophobicContact CH2-CG1 3.74Å; W194-I451 HydrophobicContact CZ2-CD1 3.78Å; W194-I451 HydrophobicContact CZ2-CG1 3.86Å; L195-I451 HydrophobicContact CD2-CD1 3.82Å; G447-I451 WeakPolarHBondContact O-CG1 3.4Å; G447-I451 PolarHBondContact O-N 3.37Å; L448-I451 PolarHBondContact O-N 3.41Å; L448-I451 VanDerWaalsContact O-N 3.14Å; I451-K454 PolarHBondContact O-N 3.35Å; I451-V455 HydrophobicContact CG2-CG2 4.24Å; I451-V455 WeakPolarHBondContact O-CG2 3.27Å; I451-V455 PolarHBondContact O-N 3.47Å; I451-I549 HydrophobicContact CG2-CG1 4.19Å; I451-I549 HydrophobicContact CG2-CG2 4.16Å
452	Y	90.1	Very high	90.5	Very high	35 Å²	35	36.4 Å²	36.4	14%	0.137	19%	0.188	C	C	.	.	H	α-helix	trans	-56.8	-51.7	176.6	-81.6	-71.3	0	0	0	112	Y180 L183 L187 L448 G449 Y450 A456	Y180-Y452 AromaticContact CD2-CD1 3.92Å; Y180-Y452 HydrophobicContact CD2-CD1 3.92Å; Y180-Y452 AromaticContact CD2-CE1 3.3Å; Y180-Y452 HydrophobicContact CD2-CE1 3.3Å; Y180-Y452 HydrophobicContact CD2-CE2 4.22Å; Y180-Y452 AromaticContact CD2-CZ 3.5Å; Y180-Y452 HydrophobicContact CE2-CD1 4.39Å; Y180-Y452 AromaticContact CE2-CE1 3.63Å; Y180-Y452 HydrophobicContact CE2-CE1 3.63Å; Y180-Y452 AromaticContact CE2-CE2 3.73Å; Y180-Y452 HydrophobicContact CE2-CE2 3.73Å; Y180-Y452 AromaticContact CE2-CZ 3.27Å; Y180-Y452 WeakPolarHBondContact CE2-OH 3.31Å; Y180-Y452 HydrophobicContact CG-CE1 4.24Å; L183-Y452 HydrophobicContact CB-CD1 4.49Å; L183-Y452 HydrophobicContact CB-CE1 3.97Å; L183-Y452 HydrophobicContact CD2-CD1 3.3Å; L183-Y452 HydrophobicContact CD2-CE1 3.55Å; L183-Y452 HydrophobicContact CD2-CG 4.16Å; L183-Y452 HydrophobicContact CG-CD1 4.1Å; L183-Y452 HydrophobicContact CG-CE1 3.8Å; L187-Y452 HydrophobicContact CD1-CE2 4.42Å; L448-Y452 HydrophobicContact CD1-CD2 4.25Å; L448-Y452 HydrophobicContact CD1-CE2 3.63Å; L448-Y452 HydrophobicContact CD2-CE2 4.03Å; L448-Y452 HydrophobicContact CG-CD2 3.94Å; L448-Y452 HydrophobicContact CG-CE2 3.54Å; L448-Y452 WeakPolarHBondContact O-CD2 3.32Å; L448-Y452 PolarHBondContact O-N 3.01Å; L448-Y452 VanDerWaalsContact O-N 3.09Å; G449-Y452 PolarHBondContact O-N 3.07Å; Y450-Y452 VanDerWaalsContact C-N 3.32Å; Y450-Y452 PolarHBondContact O-N 3.5Å; Y452-A456 WeakPolarHBondContact O-CB 3.39Å; Y452-A456 PolarHBondContact O-N 3.01Å; Y452-A456 VanDerWaalsContact O-N 3.07Å
453	I	91.9	Very high	90.5	Very high	25 Å²	25	39.5 Å²	39.5	13%	0.128	20%	0.201	C	C	.	.	H	α-helix	trans	-67.3	-39.7	-179.5	-61.7	-176.6	0	0	0	111	Y420 F423 A424 L427 G449 Y450 A456 L457	Y420-I453 HydrophobicContact CD1-CG2 4.26Å; F423-I453 HydrophobicContact CB-CD1 3.86Å; A424-I453 HydrophobicContact CB-CG2 3.85Å; L427-I453 HydrophobicContact CD1-CD1 3.62Å; L427-I453 HydrophobicContact CD1-CG1 4.42Å; G449-I453 WeakPolarHBondContact O-CG1 3.4Å; G449-I453 PolarHBondContact O-N 3.19Å; G449-I453 VanDerWaalsContact O-N 3.13Å; Y450-I453 PolarHBondContact O-N 3.33Å; I453-A456 PolarHBondContact O-N 3.23Å; I453-L457 HydrophobicContact CG2-CD1 3.76Å; I453-L457 HydrophobicContact CG2-CG 4.1Å; I453-L457 WeakPolarHBondContact O-CB 3.32Å; I453-L457 WeakPolarHBondContact O-CG 3.28Å; I453-L457 PolarHBondContact O-N 2.91Å
454	K	92.8	Very high	90.6	Very high	15 Å²	15	40.1 Å²	40.1	7%	0.065	21%	0.208	C	C	.	.	H	α-helix	trans	-56.9	-53.3	176.5	179.3	-162.4	177.7	-156.1	0	111.1	Y450 I451 A456 L457 L458 M548 I549 Q551	Y450-K454 HydrophobicContact CE1-CD 4.24Å; Y450-K454 HydrophobicContact CE2-CB 4.26Å; Y450-K454 WeakPolarHBondContact O-CB 3.36Å; Y450-K454 PolarHBondContact O-N 3.47Å; I451-K454 PolarHBondContact O-N 3.35Å; K454-A456 VanDerWaalsContact C-N 3.34Å; K454-A456 PolarHBondContact O-N 3.4Å; K454-L457 PolarHBondContact O-N 3.44Å; K454-L458 HydrophobicContact CG-CD1 4.05Å; K454-L458 HydrophobicContact CG-CG 4.5Å; K454-L458 WeakPolarHBondContact O-CB 3.41Å; K454-L458 VanDerWaalsContact O-CG 3.26Å; K454-L458 WeakPolarHBondContact O-CG 3.34Å; K454-L458 PolarHBondContact O-N 2.89Å; K454-M548 WeakPolarHBondContact CE-O 3.41Å; K454-M548 PolarHBondContact NZ-O 2.75Å; K454-I549 PolarHBondContact NZ-O 2.93Å; K454-Q551 PolarHBondContact NZ-O 3.18Å
455	V	92.3	Very high	90.8	Very high	10 Å²	10	39 Å²	39	6%	0.061	21%	0.206	C	C	.	.	H	α-helix	trans	-63.4	-41.3	-179.4	172.9	0	0	0	0	110.9	L183 I451 L458 S459 I545 M548 I549	L183-V455 HydrophobicContact CD1-CG1 4.2Å; L183-V455 HydrophobicContact CD1-CG2 4.25Å; L183-V455 HydrophobicContact CD2-CB 4.07Å; L183-V455 HydrophobicContact CD2-CG1 4.17Å; L183-V455 HydrophobicContact CD2-CG2 4.38Å; I451-V455 HydrophobicContact CG2-CG2 4.24Å; I451-V455 WeakPolarHBondContact O-CG2 3.27Å; I451-V455 PolarHBondContact O-N 3.47Å; V455-L458 PolarHBondContact O-N 3.32Å; V455-S459 VanDerWaalsContact O-CB 3.27Å; V455-S459 WeakPolarHBondContact O-CB 3.34Å; V455-S459 PolarHBondContact O-N 2.89Å; V455-I545 HydrophobicContact CG1-CG2 3.81Å; V455-M548 HydrophobicContact CG1-CE 4.24Å; V455-M548 HydrophobicContact CG2-CB 4.46Å; V455-M548 WeakPolarHBondContact O-CE 3.46Å; V455-I549 HydrophobicContact CG2-CG1 3.68Å
456	A	90.8	Very high	90.9	Very high	57 Å²	57	32.3 Å²	32.3	47%	0.471	18%	0.182	S	C	.	.	H	α-helix	trans	-62	-45.8	176.9	0	0	0	0	0	112.6	Y452 I453 K454 S459 L460	Y452-A456 WeakPolarHBondContact O-CB 3.39Å; Y452-A456 PolarHBondContact O-N 3.01Å; Y452-A456 VanDerWaalsContact O-N 3.07Å; I453-A456 PolarHBondContact O-N 3.23Å; K454-A456 VanDerWaalsContact C-N 3.34Å; K454-A456 PolarHBondContact O-N 3.4Å; A456-S459 PolarHBondContact O-N 3.37Å; A456-L460 WeakPolarHBondContact O-CB 3.29Å; A456-L460 PolarHBondContact O-N 3.23Å
457	L	92.5	Very high	91	Very high	39 Å²	39	31.5 Å²	31.5	20%	0.204	18%	0.177	C	C	.	.	H	α-helix	trans	-66.2	-42.1	177.9	-75.1	176.2	0	0	0	112.3	L417 I421 A424 I453 K454 L460 M461	L417-L457 HydrophobicContact CD1-CD2 3.88Å; I421-L457 HydrophobicContact CG1-CD1 4.35Å; A424-L457 HydrophobicContact CB-CD1 4.37Å; I453-L457 HydrophobicContact CG2-CD1 3.76Å; I453-L457 HydrophobicContact CG2-CG 4.1Å; I453-L457 WeakPolarHBondContact O-CB 3.32Å; I453-L457 WeakPolarHBondContact O-CG 3.28Å; I453-L457 PolarHBondContact O-N 2.91Å; K454-L457 PolarHBondContact O-N 3.44Å; L457-L460 PolarHBondContact O-N 2.97Å; L457-M461 WeakPolarHBondContact O-CB 3.23Å; L457-M461 PolarHBondContact O-N 3.41Å
458	L	91.8	Very high	91.3	Very high	6 Å²	6	33.8 Å²	33.8	3%	0.031	19%	0.189	C	C	.	.	H	α-helix	trans	-65.2	-40	176.1	-69.7	180	0	0	0	111.3	K454 V455 M461 E462 M548 L553 Y556	K454-L458 HydrophobicContact CG-CD1 4.05Å; K454-L458 HydrophobicContact CG-CG 4.5Å; K454-L458 WeakPolarHBondContact O-CB 3.41Å; K454-L458 VanDerWaalsContact O-CG 3.26Å; K454-L458 WeakPolarHBondContact O-CG 3.34Å; K454-L458 PolarHBondContact O-N 2.89Å; V455-L458 PolarHBondContact O-N 3.32Å; L458-M461 HydrophobicContact CD2-CE 3.37Å; L458-M461 PolarHBondContact O-N 2.96Å; L458-E462 WeakPolarHBondContact O-CB 3.26Å; L458-E462 PolarHBondContact O-N 2.86Å; L458-M548 HydrophobicContact CB-CE 3.27Å; L458-M548 HydrophobicContact CD1-CB 4.19Å; L458-M548 HydrophobicContact CD1-CE 4.46Å; L458-M548 HydrophobicContact CD1-CG 4.46Å; L458-L553 HydrophobicContact CD1-CD1 4.42Å; L458-L553 HydrophobicContact CD2-CD1 3.81Å; L458-L553 HydrophobicContact CG-CD1 4.41Å; L458-Y556 HydrophobicContact CB-CE1 4.43Å; L458-Y556 HydrophobicContact CD1-CD1 4.09Å; L458-Y556 HydrophobicContact CD1-CE1 4.15Å; L458-Y556 HydrophobicContact CD1-CG 4.42Å; L458-Y556 HydrophobicContact CD2-CD1 3.66Å; L458-Y556 HydrophobicContact CD2-CE1 3.66Å; L458-Y556 HydrophobicContact CG-CD1 4.46Å; L458-Y556 HydrophobicContact CG-CE1 4.3Å
459	S	89.5	Confident	91.4	Very high	47 Å²	47	36.3 Å²	36.3	33%	0.329	20%	0.202	S	C	.	.	H	α-helix	trans	-64.9	-43.3	176	-177.2	0	0	0	0	111.8	V455 A456 M461 E462 L463 M548	V455-S459 VanDerWaalsContact O-CB 3.27Å; V455-S459 WeakPolarHBondContact O-CB 3.34Å; V455-S459 PolarHBondContact O-N 2.89Å; A456-S459 PolarHBondContact O-N 3.37Å; S459-M461 VanDerWaalsContact C-N 3.29Å; S459-M461 PolarHBondContact O-N 3.28Å; S459-E462 PolarHBondContact O-N 3.12Å; S459-L463 WeakPolarHBondContact O-CB 3.28Å; S459-L463 PolarHBondContact O-N 2.95Å; S459-M548 VanDerWaalsContact N-CE 3.27Å
460	L	91.5	Very high	91.6	Very high	59 Å²	59	35.7 Å²	35.7	31%	0.309	19%	0.194	S	C	.	.	H	α-helix	trans	-61.3	-39.1	174.7	178.4	62.7	0	0	0	111.9	F413 L417 A456 L457 G464 I465	F413-L460 HydrophobicContact CE2-CD1 4.36Å; F413-L460 HydrophobicContact CE2-CD2 4.44Å; F413-L460 HydrophobicContact CZ-CD1 4.2Å; F413-L460 HydrophobicContact CZ-CD2 4.19Å; L417-L460 HydrophobicContact CD1-CD2 3.69Å; A456-L460 WeakPolarHBondContact O-CB 3.29Å; A456-L460 PolarHBondContact O-N 3.23Å; L457-L460 PolarHBondContact O-N 2.97Å; L460-G464 CarbonylContact O-C 3.58Å; L460-G464 WeakPolarHBondContact O-CA 3.25Å; L460-G464 PolarHBondContact O-N 3.47Å; L460-I465 PolarHBondContact O-N 3.25Å
461	M	89.7	Confident	91.7	Very high	44 Å²	44	33.8 Å²	33.8	22%	0.217	19%	0.187	C	C	.	.	I	π-helix	trans	-67.1	-46.2	176.9	179.7	-179.8	48.7	0	0	111.6	L457 L458 S459 I465 F466 Y556 L560	L457-M461 WeakPolarHBondContact O-CB 3.23Å; L457-M461 PolarHBondContact O-N 3.41Å; L458-M461 HydrophobicContact CD2-CE 3.37Å; L458-M461 PolarHBondContact O-N 2.96Å; S459-M461 VanDerWaalsContact C-N 3.29Å; S459-M461 PolarHBondContact O-N 3.28Å; M461-I465 PolarHBondContact O-N 3.46Å; M461-F466 HydrophobicContact CE-CZ 4.43Å; M461-F466 HydrophobicContact CG-CD2 4.44Å; M461-F466 HydrophobicContact CG-CE1 3.81Å; M461-F466 HydrophobicContact CG-CE2 3.64Å; M461-F466 HydrophobicContact CG-CZ 3.29Å; M461-F466 VanDerWaalsContact O-CD2 3.3Å; M461-F466 WeakPolarHBondContact O-CD2 3.14Å; M461-F466 WeakPolarHBondContact O-CG 3.18Å; M461-F466 PolarHBondContact O-N 3.35Å; M461-F466 HydrophobicContact SD-CE1 4.3Å; M461-F466 HydrophobicContact SD-CE2 4.26Å; M461-F466 HydrophobicContact SD-CZ 3.58Å; M461-F466 VanDerWaalsContact SD-CZ 3.58Å; M461-Y556 HydrophobicContact CE-CE1 4.3Å; M461-L560 HydrophobicContact CE-CD2 3.1Å; M461-L560 HydrophobicContact CG-CD2 4.36Å; M461-L560 HydrophobicContact SD-CD2 3.56Å; M461-L560 VanDerWaalsContact SD-CD2 3.56Å
462	E	89.7	Confident	91.8	Very high	51 Å²	51	37.5 Å²	37.5	24%	0.238	20%	0.203	C	C	.	.	I	π-helix	trans	-71.3	-46.8	-177.7	-170.8	172.8	174.6	0	0	113.5	L458 S459 P467 Y556	L458-E462 WeakPolarHBondContact O-CB 3.26Å; L458-E462 PolarHBondContact O-N 2.86Å; S459-E462 PolarHBondContact O-N 3.12Å; E462-P467 WeakPolarHBondContact O-CD 3.4Å; E462-Y556 PolarHBondContact OE2-OH 2.92Å
463	L	89.8	Confident	91.9	Very high	87 Å²	87	39.8 Å²	39.8	46%	0.455	21%	0.212	S	C	.	.	I	π-helix	trans	-95.7	-19.4	-174.5	-63.2	175.9	0	0	0	114.1	S459 P467 W505	S459-L463 WeakPolarHBondContact O-CB 3.28Å; S459-L463 PolarHBondContact O-N 2.95Å; L463-P467 WeakPolarHBondContact O-CG 3.28Å; L463-W505 PolarHBondContact O-NE1 3.35Å; L463-W505 VanDerWaalsContact O-NE1 3.13Å
464	G	90.3	Very high	92	Very high	16 Å²	16	39.5 Å²	39.5	17%	0.165	21%	0.21	C	C	.	.	I	π-helix	trans	-105.3	-65.5	-178.8	0	0	0	0	0	112.6	L460 P467 I468	L460-G464 CarbonylContact O-C 3.58Å; L460-G464 WeakPolarHBondContact O-CA 3.25Å; L460-G464 PolarHBondContact O-N 3.47Å; G464-P467 WeakPolarHBondContact O-CD 3.35Å; G464-I468 VanDerWaalsContact O-CD1 3.32Å; G464-I468 WeakPolarHBondContact O-CD1 3.38Å; G464-I468 VanDerWaalsContact O-CG1 3.28Å; G464-I468 WeakPolarHBondContact O-CG1 3.43Å; G464-I468 PolarHBondContact O-N 3.17Å
465	I	92.3	Very high	92	Very high	54 Å²	54	39.7 Å²	39.7	28%	0.277	21%	0.212	S	C	.	.	I	π-helix	trans	-73.8	-45.9	-169.1	-60.1	175.3	0	0	0	112.3	L460 M461 I468 L469	L460-I465 PolarHBondContact O-N 3.25Å; M461-I465 PolarHBondContact O-N 3.46Å; I465-I468 WeakPolarHBondContact O-CB 3.15Å; I465-I468 PolarHBondContact O-N 3.02Å; I465-I468 VanDerWaalsContact O-N 3.15Å; I465-L469 HydrophobicContact CG2-CD1 3.87Å; I465-L469 HydrophobicContact CG2-CG 4.08Å; I465-L469 WeakPolarHBondContact O-CG 3.49Å; I465-L469 PolarHBondContact O-N 3.18Å
466	F	91.2	Very high	91.9	Very high	35 Å²	35	41.5 Å²	41.5	15%	0.154	23%	0.228	C	C	.	.	H	α-helix	trans	-64	-40.3	-178.5	-63.9	-34.7	0	0	0	115.2	M461 I468 L469 S470 L560 Y564	M461-F466 HydrophobicContact CE-CZ 4.43Å; M461-F466 HydrophobicContact CG-CD2 4.44Å; M461-F466 HydrophobicContact CG-CE1 3.81Å; M461-F466 HydrophobicContact CG-CE2 3.64Å; M461-F466 HydrophobicContact CG-CZ 3.29Å; M461-F466 VanDerWaalsContact O-CD2 3.3Å; M461-F466 WeakPolarHBondContact O-CD2 3.14Å; M461-F466 WeakPolarHBondContact O-CG 3.18Å; M461-F466 PolarHBondContact O-N 3.35Å; M461-F466 HydrophobicContact SD-CE1 4.3Å; M461-F466 HydrophobicContact SD-CE2 4.26Å; M461-F466 HydrophobicContact SD-CZ 3.58Å; M461-F466 VanDerWaalsContact SD-CZ 3.58Å; F466-I468 VanDerWaalsContact C-N 3.26Å; F466-I468 PolarHBondContact O-N 2.93Å; F466-L469 HydrophobicContact CD1-CD1 4.25Å; F466-L469 PolarHBondContact O-N 2.86Å; F466-S470 WeakPolarHBondContact O-CB 3.33Å; F466-S470 PolarHBondContact O-N 3.12Å; F466-S470 PolarHBondContact O-OG 2.97Å; F466-L560 HydrophobicContact CD2-CD1 4.32Å; F466-L560 HydrophobicContact CD2-CG 4.48Å; F466-L560 HydrophobicContact CE2-CD1 3.47Å; F466-L560 VanDerWaalsContact CE2-CD1 3.47Å; F466-L560 HydrophobicContact CE2-CD2 3.39Å; F466-L560 HydrophobicContact CE2-CG 3.32Å; F466-L560 HydrophobicContact CZ-CD1 4.12Å; F466-L560 HydrophobicContact CZ-CD2 3.3Å; F466-L560 HydrophobicContact CZ-CG 3.42Å; F466-L560 VanDerWaalsContact CZ-CG 3.42Å; F466-Y564 HydrophobicContact CD1-CD2 4.22Å
467	P	93.9	Very high	92	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.6	-36	173	-21.1	31.8	0	0	0	111.9	E462 L463 G464 S470 G471 G508 M509 I512	E462-P467 WeakPolarHBondContact O-CD 3.4Å; L463-P467 WeakPolarHBondContact O-CG 3.28Å; G464-P467 WeakPolarHBondContact O-CD 3.35Å; P467-S470 WeakPolarHBondContact CA-OG 3.43Å; P467-S470 PolarHBondContact O-OG 2.89Å; P467-S470 VanDerWaalsContact O-OG 3.05Å; P467-G471 PolarHBondContact O-N 3.21Å; P467-G508 WeakPolarHBondContact O-CA 3.48Å; P467-M509 HydrophobicContact CB-CG 3.66Å; P467-M509 HydrophobicContact CB-SD 3.55Å; P467-M509 VanDerWaalsContact CB-SD 3.55Å; P467-M509 HydrophobicContact CG-CG 4.02Å; P467-M509 HydrophobicContact CG-SD 3.21Å; P467-M509 WeakPolarHBondContact CG-SD 3.35Å; P467-I512 HydrophobicContact CB-CD1 3.97Å; P467-I512 HydrophobicContact CG-CD1 3.7Å
468	I	93.8	Very high	91.8	Very high	49 Å²	49	38.2 Å²	38.2	25%	0.251	20%	0.204	S	C	.	.	H	α-helix	trans	-61.6	-51.6	172.8	-69.8	166.4	0	0	0	110	G464 I465 F466 S470 G471 F472 W505	G464-I468 VanDerWaalsContact O-CD1 3.32Å; G464-I468 WeakPolarHBondContact O-CD1 3.38Å; G464-I468 VanDerWaalsContact O-CG1 3.28Å; G464-I468 WeakPolarHBondContact O-CG1 3.43Å; G464-I468 PolarHBondContact O-N 3.17Å; I465-I468 WeakPolarHBondContact O-CB 3.15Å; I465-I468 PolarHBondContact O-N 3.02Å; I465-I468 VanDerWaalsContact O-N 3.15Å; F466-I468 VanDerWaalsContact C-N 3.26Å; F466-I468 PolarHBondContact O-N 2.93Å; I468-S470 PolarHBondContact O-N 2.86Å; I468-G471 PolarHBondContact O-N 2.84Å; I468-F472 HydrophobicContact CG2-CD2 3.58Å; I468-F472 HydrophobicContact CG2-CE2 3.42Å; I468-F472 VanDerWaalsContact CG2-CE2 3.42Å; I468-F472 WeakPolarHBondContact O-CD2 3.4Å; I468-F472 PolarHBondContact O-N 2.78Å; I468-W505 HydrophobicContact CG1-CB 3.68Å; I468-W505 HydrophobicContact CG1-CG 4.29Å
469	L	93.5	Very high	91.8	Very high	71 Å²	71	39 Å²	39	37%	0.372	21%	0.208	S	C	.	.	H	α-helix	trans	-62.4	-40.2	-178.8	-68.1	177.4	0	0	0	112.7	I465 F466 F472 W473 Y564	I465-L469 HydrophobicContact CG2-CD1 3.87Å; I465-L469 HydrophobicContact CG2-CG 4.08Å; I465-L469 WeakPolarHBondContact O-CG 3.49Å; I465-L469 PolarHBondContact O-N 3.18Å; F466-L469 HydrophobicContact CD1-CD1 4.25Å; F466-L469 PolarHBondContact O-N 2.86Å; L469-F472 PolarHBondContact O-N 3.47Å; L469-W473 WeakPolarHBondContact O-CB 3.32Å; L469-W473 PolarHBondContact O-N 3.36Å; L469-Y564 HydrophobicContact CB-CE2 4.15Å; L469-Y564 WeakPolarHBondContact CB-OH 3.27Å
470	S	92.9	Very high	91.7	Very high	7 Å²	7	38.4 Å²	38.4	5%	0.049	20%	0.204	C	C	.	.	H	α-helix	trans	-67.2	-38	175.5	66.2	0	0	0	0	111.6	F466 P467 I468 W473 I474 G508	F466-S470 WeakPolarHBondContact O-CB 3.33Å; F466-S470 PolarHBondContact O-N 3.12Å; F466-S470 PolarHBondContact O-OG 2.97Å; P467-S470 WeakPolarHBondContact CA-OG 3.43Å; P467-S470 PolarHBondContact O-OG 2.89Å; P467-S470 VanDerWaalsContact O-OG 3.05Å; I468-S470 PolarHBondContact O-N 2.86Å; S470-W473 WeakPolarHBondContact O-CB 3.49Å; S470-W473 PolarHBondContact O-N 3.26Å; S470-I474 VanDerWaalsContact O-CG1 3.29Å; S470-I474 WeakPolarHBondContact O-CG1 3.15Å; S470-I474 PolarHBondContact O-N 3.35Å; S470-G508 VanDerWaalsContact OG-CA 3.26Å; S470-G508 WeakPolarHBondContact OG-CA 3.46Å
471	G	94.2	Very high	91.4	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.01	19%	0.193	C	C	.	.	H	α-helix	trans	-59.5	-46.8	171.8	0	0	0	0	0	113	P467 I468 W473 I474 D475 H504	P467-G471 PolarHBondContact O-N 3.21Å; I468-G471 PolarHBondContact O-N 2.84Å; G471-W473 VanDerWaalsContact C-N 3.31Å; G471-W473 PolarHBondContact O-N 3.5Å; G471-I474 PolarHBondContact O-N 3.4Å; G471-D475 PolarHBondContact O-N 3.45Å; G471-H504 WeakPolarHBondContact CA-O 3.07Å
472	F	92.7	Very high	91.2	Very high	79 Å²	79	37.5 Å²	37.5	35%	0.346	20%	0.197	S	C	.	.	H	α-helix	trans	-60.5	-40.1	174	-85.6	-74.2	0	0	0	112.4	I468 L469 I474 D475 A476 F500 H504	I468-F472 HydrophobicContact CG2-CD2 3.58Å; I468-F472 HydrophobicContact CG2-CE2 3.42Å; I468-F472 VanDerWaalsContact CG2-CE2 3.42Å; I468-F472 WeakPolarHBondContact O-CD2 3.4Å; I468-F472 PolarHBondContact O-N 2.78Å; L469-F472 PolarHBondContact O-N 3.47Å; F472-I474 VanDerWaalsContact C-N 3.32Å; F472-I474 PolarHBondContact O-N 3.46Å; F472-D475 PolarHBondContact O-N 2.89Å; F472-A476 WeakPolarHBondContact O-CB 3.3Å; F472-A476 PolarHBondContact O-N 3.46Å; F472-F500 HydrophobicContact CD1-CE1 4.42Å; F472-F500 HydrophobicContact CE1-CD1 4.37Å; F472-F500 AromaticContact CE1-CE1 3.52Å; F472-F500 HydrophobicContact CE1-CE1 3.52Å; F472-F500 HydrophobicContact CE1-CZ 4.38Å; F472-F500 HydrophobicContact CZ-CD1 4.28Å; F472-F500 AromaticContact CZ-CE1 3.86Å; F472-F500 HydrophobicContact CZ-CE1 3.86Å; F472-H504 HydrophobicContact CD2-CB 4.49Å
473	W	93.7	Very high	91	Very high	84 Å²	84	41.2 Å²	41.2	32%	0.318	22%	0.218	S	C	.	.	H	α-helix	trans	-64.6	-39.4	177.8	-146.3	-15.3	0	0	0	111.8	L469 S470 G471 C477 Y564 G568	L469-W473 WeakPolarHBondContact O-CB 3.32Å; L469-W473 PolarHBondContact O-N 3.36Å; S470-W473 WeakPolarHBondContact O-CB 3.49Å; S470-W473 PolarHBondContact O-N 3.26Å; G471-W473 VanDerWaalsContact C-N 3.31Å; G471-W473 PolarHBondContact O-N 3.5Å; W473-C477 PolarHBondContact O-N 2.86Å; W473-C477 PolarHBondContact O-SG 3.16Å; W473-Y564 HydrophobicContact CE3-CE1 4.14Å; W473-Y564 HydrophobicContact CE3-CE2 4.44Å; W473-Y564 AromaticContact CE3-CZ 3.74Å; W473-Y564 VanDerWaalsContact CE3-OH 3.3Å; W473-Y564 HydrophobicContact CH2-CE1 4.35Å; W473-Y564 HydrophobicContact CZ3-CD1 4.22Å; W473-Y564 AromaticContact CZ3-CE1 3.49Å; W473-Y564 HydrophobicContact CZ3-CE1 3.49Å; W473-Y564 VanDerWaalsContact CZ3-CE1 3.49Å; W473-Y564 HydrophobicContact CZ3-CE2 4.37Å; W473-Y564 AromaticContact CZ3-CZ 3.57Å; W473-G568 VanDerWaalsContact CH2-CA 3.42Å
474	I	93.5	Very high	90.8	Very high	18 Å²	18	37.9 Å²	37.9	9%	0.092	20%	0.204	C	C	.	.	H	α-helix	trans	-66.2	-45.3	174.9	-69.6	164.9	0	0	0	111.2	S470 G471 F472 A476 C477 T478 I507 Y511 I571 L575	S470-I474 VanDerWaalsContact O-CG1 3.29Å; S470-I474 WeakPolarHBondContact O-CG1 3.15Å; S470-I474 PolarHBondContact O-N 3.35Å; G471-I474 PolarHBondContact O-N 3.4Å; F472-I474 VanDerWaalsContact C-N 3.32Å; F472-I474 PolarHBondContact O-N 3.46Å; I474-A476 VanDerWaalsContact C-N 3.31Å; I474-A476 PolarHBondContact O-N 3.25Å; I474-C477 PolarHBondContact O-N 2.94Å; I474-C477 VanDerWaalsContact O-N 3.14Å; I474-T478 HydrophobicContact CG2-CG2 4.24Å; I474-T478 WeakPolarHBondContact O-CB 3.31Å; I474-T478 WeakPolarHBondContact O-CG2 3.36Å; I474-T478 PolarHBondContact O-N 3.18Å; I474-T478 PolarHBondContact O-OG1 3.29Å; I474-I507 HydrophobicContact CD1-CG2 4.2Å; I474-I507 HydrophobicContact CG2-CG2 4.13Å; I474-Y511 HydrophobicContact CD1-CD2 4.12Å; I474-Y511 HydrophobicContact CD1-CG 3.87Å; I474-I571 HydrophobicContact CD1-CD1 4.47Å; I474-I571 HydrophobicContact CG1-CD1 4.13Å; I474-I571 HydrophobicContact CG1-CG1 4.33Å; I474-I571 HydrophobicContact CG1-CG2 3.89Å; I474-L575 HydrophobicContact CG1-CD1 4.15Å; I474-L575 HydrophobicContact CG2-CD1 3.96Å
475	D	91.8	Very high	90.8	Very high	20 Å²	20	40.6 Å²	40.6	11%	0.107	22%	0.217	C	C	.	.	H	α-helix	trans	-59.7	-44.5	177.3	-171.6	41	0	0	0	110.2	G471 F472 C477 T478 L479 R489 H504	G471-D475 PolarHBondContact O-N 3.45Å; F472-D475 PolarHBondContact O-N 2.89Å; D475-C477 VanDerWaalsContact C-N 3.33Å; D475-C477 PolarHBondContact O-N 2.87Å; D475-T478 WeakPolarHBondContact CA-OG1 3.45Å; D475-T478 PolarHBondContact O-N 3.29Å; D475-T478 VanDerWaalsContact O-N 3.08Å; D475-T478 PolarHBondContact O-OG1 3.39Å; D475-L479 WeakPolarHBondContact O-CG 3.37Å; D475-L479 PolarHBondContact O-N 3.26Å; D475-L479 VanDerWaalsContact O-N 3.17Å; D475-R489 IonicContact OD1-CZ 3.69Å; D475-R489 IonicContact OD1-NE 3.06Å; D475-R489 PolarHBondContact OD1-NE 3.43Å; D475-R489 IonicContact OD1-NH2 2.87Å; D475-R489 PolarHBondContact OD1-NH2 2.81Å; D475-R489 IonicContact OD2-NE 3.42Å; D475-R489 PolarHBondContact OD2-NE 2.92Å; D475-H504 WeakPolarHBondContact CB-NE2 3.44Å; D475-H504 IonicContact OD2-NE2 3.77Å; D475-H504 PolarHBondContact OD2-NE2 3.47Å
476	A	91.7	Very high	90.6	Very high	48 Å²	48	43.6 Å²	43.6	40%	0.397	23%	0.233	S	C	.	.	H	α-helix	trans	-58.4	-41.2	174.7	0	0	0	0	0	113	F472 I474 T478	F472-A476 WeakPolarHBondContact O-CB 3.3Å; F472-A476 PolarHBondContact O-N 3.46Å; I474-A476 VanDerWaalsContact C-N 3.31Å; I474-A476 PolarHBondContact O-N 3.25Å; A476-T478 VanDerWaalsContact C-N 3.3Å; A476-T478 PolarHBondContact O-N 3.48Å
477	C	91.3	Very high	90.6	Very high	8 Å²	8	47.2 Å²	47.2	5%	0.054	26%	0.258	C	S	.	.	H	α-helix	trans	-73.6	-18.2	177.8	-66.5	0	0	0	0	113.9	W473 I474 D475 I571 L575 W576	W473-C477 PolarHBondContact O-N 2.86Å; W473-C477 PolarHBondContact O-SG 3.16Å; I474-C477 PolarHBondContact O-N 2.94Å; I474-C477 VanDerWaalsContact O-N 3.14Å; D475-C477 VanDerWaalsContact C-N 3.33Å; D475-C477 PolarHBondContact O-N 2.87Å; C477-I571 HydrophobicContact CB-CG2 4.49Å; C477-L575 HydrophobicContact CB-CB 4.27Å; C477-W576 HydrophobicContact CB-CB 3.95Å
478	T	90.2	Very high	90.3	Very high	18 Å²	18	52.4 Å²	52.4	11%	0.11	28%	0.282	C	S	.	.	H	α-helix	trans	-106.2	2.6	-175.6	55.6	0	0	0	0	113.6	I474 D475 A476 S480 L481 F482 L575	I474-T478 HydrophobicContact CG2-CG2 4.24Å; I474-T478 WeakPolarHBondContact O-CB 3.31Å; I474-T478 WeakPolarHBondContact O-CG2 3.36Å; I474-T478 PolarHBondContact O-N 3.18Å; I474-T478 PolarHBondContact O-OG1 3.29Å; D475-T478 WeakPolarHBondContact CA-OG1 3.45Å; D475-T478 PolarHBondContact O-N 3.29Å; D475-T478 VanDerWaalsContact O-N 3.08Å; D475-T478 PolarHBondContact O-OG1 3.39Å; A476-T478 VanDerWaalsContact C-N 3.3Å; A476-T478 PolarHBondContact O-N 3.48Å; T478-S480 VanDerWaalsContact C-N 3.29Å; T478-S480 PolarHBondContact O-N 3.02Å; T478-L481 WeakPolarHBondContact O-CB 3.18Å; T478-L481 PolarHBondContact O-N 3.36Å; T478-F482 WeakPolarHBondContact O-CD2 3.45Å; T478-L575 HydrophobicContact CG2-CD1 4.42Å
479	L	90.1	Very high	90.1	Very high	23 Å²	23	53.4 Å²	53.4	12%	0.12	28%	0.283	C	S	.	.	H	α-helix	trans	-55.3	-42.7	175.8	-68.7	175.9	0	0	0	113.1	D475 L481 F482 N483 A484 L486 R489	D475-L479 WeakPolarHBondContact O-CG 3.37Å; D475-L479 PolarHBondContact O-N 3.26Å; D475-L479 VanDerWaalsContact O-N 3.17Å; L479-L481 PolarHBondContact O-N 3.14Å; L479-F482 PolarHBondContact O-N 2.87Å; L479-N483 PolarHBondContact O-N 3.4Å; L479-A484 HydrophobicContact CD2-CB 4.22Å; L479-A484 PolarHBondContact O-N 2.96Å; L479-L486 HydrophobicContact CD1-CD2 3.6Å; L479-L486 HydrophobicContact CD1-CG 3.6Å; L479-R489 HydrophobicContact CD2-CG 3.91Å
480	S	88	Confident	89.9	Confident	34 Å²	34	52.1 Å²	52.1	24%	0.238	28%	0.282	C	S	.	.	H	α-helix	trans	-64.8	-28.8	178.2	58	0	0	0	0	112.5	T478 F482 T579	T478-S480 VanDerWaalsContact C-N 3.29Å; T478-S480 PolarHBondContact O-N 3.02Å; S480-F482 VanDerWaalsContact C-N 3.33Å; S480-F482 PolarHBondContact O-N 3.47Å; S480-T579 PolarHBondContact OG-OG1 3.46Å
481	L	86.2	Confident	89.7	Confident	15 Å²	15	55 Å²	55	8%	0.079	30%	0.303	C	S	.	.	H	α-helix	trans	-64.5	-37.9	178.6	-166.5	61.4	0	0	0	112	T478 L479 T579 L590 P591 F592	T478-L481 WeakPolarHBondContact O-CB 3.18Å; T478-L481 PolarHBondContact O-N 3.36Å; L479-L481 PolarHBondContact O-N 3.14Å; L481-T579 HydrophobicContact CB-CG2 4.44Å; L481-T579 HydrophobicContact CD1-CG2 4.04Å; L481-L590 HydrophobicContact CD1-CD2 3.53Å; L481-P591 WeakPolarHBondContact O-CA 3.42Å; L481-F592 HydrophobicContact CD1-CD2 3.24Å; L481-F592 HydrophobicContact CD1-CE2 3.19Å; L481-F592 HydrophobicContact CD1-CG 4.03Å; L481-F592 HydrophobicContact CD1-CZ 3.94Å; L481-F592 HydrophobicContact CD2-CD2 3.83Å; L481-F592 HydrophobicContact CD2-CE2 4.13Å; L481-F592 HydrophobicContact CG-CD2 3.43Å; L481-F592 VanDerWaalsContact CG-CD2 3.43Å; L481-F592 HydrophobicContact CG-CE2 3.88Å; L481-F592 HydrophobicContact CG-CG 4.2Å; L481-F592 PolarHBondContact O-N 3.47Å
482	F	85.7	Confident	89.4	Confident	69 Å²	69	58.1 Å²	58.1	30%	0.303	32%	0.321	S	S	.	.	H	α-helix	trans	-105.5	1.3	-176.1	-58.9	-65.8	0	0	0	113.9	T478 L479 S480 A484 F592 I594	T478-F482 WeakPolarHBondContact O-CD2 3.45Å; L479-F482 PolarHBondContact O-N 2.87Å; S480-F482 VanDerWaalsContact C-N 3.33Å; S480-F482 PolarHBondContact O-N 3.47Å; F482-A484 HydrophobicContact CB-CB 4.44Å; F482-A484 PolarHBondContact O-N 3.4Å; F482-F592 HydrophobicContact CD1-CB 4.3Å; F482-F592 WeakPolarHBondContact CD1-O 3.45Å; F482-F592 HydrophobicContact CE1-CB 4.17Å; F482-I594 HydrophobicContact CE1-CB 4.29Å; F482-I594 HydrophobicContact CE1-CD1 3.57Å; F482-I594 HydrophobicContact CE1-CG1 3.9Å; F482-I594 HydrophobicContact CZ-CD1 4.05Å
483	N	83.7	Confident	89.3	Confident	129 Å²	129	56.2 Å²	56.2	69%	0.69	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	40.6	-171	-166.9	42	0	0	0	112.7	L479 P591	L479-N483 PolarHBondContact O-N 3.4Å; N483-P591 HydrophobicContact CB-CB 3.72Å; N483-P591 HydrophobicContact CB-CG 3.93Å
484	A	85.8	Confident	89.1	Confident	18 Å²	18	57.7 Å²	57.7	15%	0.149	32%	0.323	C	S	.	.			trans	-101.4	156.6	178.5	0	0	0	0	0	111	L479 F482	L479-A484 HydrophobicContact CD2-CB 4.22Å; L479-A484 PolarHBondContact O-N 2.96Å; F482-A484 HydrophobicContact CB-CB 4.44Å; F482-A484 PolarHBondContact O-N 3.4Å
485	T	90	Very high	88.8	Confident	73 Å²	73	66.8 Å²	66.8	45%	0.448	36%	0.358	S	S	.	.			trans	-110.5	156.2	175.2	68.8	0	0	0	0	111.7	T487 Q488 R489	T485-T487 PolarHBondContact O-N 3.25Å; T485-T487 PolarHBondContact OG1-OG1 2.88Å; T485-Q488 WeakPolarHBondContact O-CB 3.49Å; T485-Q488 PolarHBondContact O-N 3.15Å; T485-Q488 VanDerWaalsContact O-N 3.15Å; T485-Q488 PolarHBondContact OG1-N 2.91Å; T485-R489 PolarHBondContact O-N 2.9Å; T485-R489 VanDerWaalsContact O-N 3.15Å
486	L	89.4	Confident	88.7	Confident	116 Å²	116	67.4 Å²	67.4	61%	0.607	37%	0.366	S	S	*	.	H	α-helix	trans	-56.8	-35.5	173.1	-74.2	171.1	0	0	0	112.2	L479 Q488 R489 A490	L479-L486 HydrophobicContact CD1-CD2 3.6Å; L479-L486 HydrophobicContact CD1-CG 3.6Å; L486-Q488 PolarHBondContact O-N 3.48Å; L486-R489 PolarHBondContact O-N 3.25Å; L486-A490 WeakPolarHBondContact O-CB 3.32Å; L486-A490 PolarHBondContact O-N 3.4Å
487	T	89.6	Confident	88.7	Confident	111 Å²	111	66.2 Å²	66.2	68%	0.681	35%	0.354	S	S	*	.	H	α-helix	trans	-65.5	-38.7	178.8	65.8	0	0	0	0	112.2	T485 A490 S491	T485-T487 PolarHBondContact O-N 3.25Å; T485-T487 PolarHBondContact OG1-OG1 2.88Å; T487-A490 PolarHBondContact O-N 2.84Å; T487-S491 PolarHBondContact O-N 2.95Å
488	Q	89.1	Confident	88.5	Confident	109 Å²	109	70.5 Å²	70.5	51%	0.509	38%	0.38	S	S	.	.	H	α-helix	trans	-65.5	-43.6	174.9	-172.4	178.8	-0.3	0	0	110.6	T485 L486 S491 V492	T485-Q488 WeakPolarHBondContact O-CB 3.49Å; T485-Q488 PolarHBondContact O-N 3.15Å; T485-Q488 VanDerWaalsContact O-N 3.15Å; T485-Q488 PolarHBondContact OG1-N 2.91Å; L486-Q488 PolarHBondContact O-N 3.48Å; Q488-S491 PolarHBondContact O-N 3.46Å; Q488-S491 PolarHBondContact O-OG 3.43Å; Q488-V492 WeakPolarHBondContact O-CG2 3.45Å; Q488-V492 PolarHBondContact O-N 3.15Å
489	R	89.7	Confident	88.4	Confident	71 Å²	71	72.1 Å²	72.1	27%	0.268	40%	0.395	S	S	.	.	H	α-helix	trans	-63	-41.8	175.5	-67.9	-60.4	-161.5	-149.4	-2.1	112.5	D475 L479 T485 L486 S491 V492 F493 F500	D475-R489 IonicContact OD1-CZ 3.69Å; D475-R489 IonicContact OD1-NE 3.06Å; D475-R489 PolarHBondContact OD1-NE 3.43Å; D475-R489 IonicContact OD1-NH2 2.87Å; D475-R489 PolarHBondContact OD1-NH2 2.81Å; D475-R489 IonicContact OD2-NE 3.42Å; D475-R489 PolarHBondContact OD2-NE 2.92Å; L479-R489 HydrophobicContact CD2-CG 3.91Å; T485-R489 PolarHBondContact O-N 2.9Å; T485-R489 VanDerWaalsContact O-N 3.15Å; L486-R489 PolarHBondContact O-N 3.25Å; R489-S491 VanDerWaalsContact C-N 3.31Å; R489-S491 PolarHBondContact O-N 3.44Å; R489-V492 WeakPolarHBondContact O-CB 3.35Å; R489-V492 PolarHBondContact O-N 3.39Å; R489-V492 VanDerWaalsContact O-N 3.12Å; R489-F493 PolarHBondContact O-N 2.93Å; R489-F500 HydrophobicContact CB-CZ 4.5Å
490	A	88.7	Confident	88.5	Confident	43 Å²	43	72 Å²	72	36%	0.355	39%	0.394	S	S	.	.	H	α-helix	trans	-60.5	-39.7	175.9	0	0	0	0	0	112	L486 T487 V492 F493 H494	L486-A490 WeakPolarHBondContact O-CB 3.32Å; L486-A490 PolarHBondContact O-N 3.4Å; T487-A490 PolarHBondContact O-N 2.84Å; A490-V492 VanDerWaalsContact C-N 3.29Å; A490-V492 PolarHBondContact O-N 2.87Å; A490-F493 WeakPolarHBondContact O-CB 3.33Å; A490-F493 PolarHBondContact O-N 3.3Å; A490-H494 PolarHBondContact O-CD2 3.12Å; A490-H494 PolarHBondContact O-N 3.39Å
491	S	89.7	Confident	88.6	Confident	68 Å²	68	72 Å²	72	48%	0.476	39%	0.392	S	S	.	.	H	α-helix	trans	-62.5	-35.7	175.6	76.4	0	0	0	0	112.8	T487 Q488 R489 H494 Y495	T487-S491 PolarHBondContact O-N 2.95Å; Q488-S491 PolarHBondContact O-N 3.46Å; Q488-S491 PolarHBondContact O-OG 3.43Å; R489-S491 VanDerWaalsContact C-N 3.31Å; R489-S491 PolarHBondContact O-N 3.44Å; S491-H494 PolarHBondContact O-N 3.22Å; S491-Y495 PolarHBondContact O-N 3.34Å; S491-Y495 VanDerWaalsContact O-N 3.12Å
492	V	87.9	Confident	89	Confident	66 Å²	66	77 Å²	77	40%	0.4	41%	0.414	S	S	.	.	H	α-helix	trans	-70.3	-39.9	175.3	-179.5	0	0	0	0	110.8	Q488 R489 A490 H494 Y495 A496 F500	Q488-V492 WeakPolarHBondContact O-CG2 3.45Å; Q488-V492 PolarHBondContact O-N 3.15Å; R489-V492 WeakPolarHBondContact O-CB 3.35Å; R489-V492 PolarHBondContact O-N 3.39Å; R489-V492 VanDerWaalsContact O-N 3.12Å; A490-V492 VanDerWaalsContact C-N 3.29Å; A490-V492 PolarHBondContact O-N 2.87Å; V492-H494 VanDerWaalsContact C-N 3.33Å; V492-H494 PolarHBondContact O-N 3.13Å; V492-Y495 PolarHBondContact O-N 2.99Å; V492-A496 PolarHBondContact O-N 2.85Å; V492-F500 HydrophobicContact CB-CD2 4.34Å; V492-F500 HydrophobicContact CB-CE2 4.46Å; V492-F500 HydrophobicContact CG1-CD2 3.96Å; V492-F500 HydrophobicContact CG1-CE2 4.47Å
493	F	89.8	Confident	89	Confident	40 Å²	40	78.1 Å²	78.1	18%	0.175	42%	0.422	C	S	.	.	H	α-helix	trans	-59.9	-42.3	173.5	175	-109	0	0	0	111.8	H409 R489 A490 Y495 A496 P497 F500 T501	H409-F493 AromaticContact CD2-CE1 3.83Å; R489-F493 PolarHBondContact O-N 2.93Å; A490-F493 WeakPolarHBondContact O-CB 3.33Å; A490-F493 PolarHBondContact O-N 3.3Å; F493-Y495 VanDerWaalsContact C-N 3.32Å; F493-Y495 PolarHBondContact O-N 3.07Å; F493-A496 CarbonylContact O-C 3.56Å; F493-P497 HydrophobicContact CD2-CB 4.09Å; F493-P497 HydrophobicContact CE2-CB 3.78Å; F493-P497 HydrophobicContact CZ-CB 4.22Å; F493-P497 VanDerWaalsContact O-CA 3.25Å; F493-P497 WeakPolarHBondContact O-CA 3.49Å; F493-P497 WeakPolarHBondContact O-CB 3.3Å; F493-P497 VanDerWaalsContact O-CD 3.3Å; F493-P497 WeakPolarHBondContact O-CD 3.42Å; F493-P497 VanDerWaalsContact O-N 3.11Å; F493-F500 HydrophobicContact CB-CD1 3.97Å; F493-F500 HydrophobicContact CB-CD2 4.32Å; F493-F500 HydrophobicContact CB-CE1 4.08Å; F493-F500 HydrophobicContact CB-CE2 4.42Å; F493-F500 HydrophobicContact CB-CG 4.07Å; F493-F500 HydrophobicContact CB-CZ 4.3Å; F493-F500 HydrophobicContact CD2-CB 4.22Å; F493-F500 AromaticContact CD2-CD1 3.51Å; F493-F500 HydrophobicContact CD2-CD1 3.51Å; F493-F500 HydrophobicContact CD2-CE1 4.11Å; F493-F500 HydrophobicContact CD2-CG 4.04Å; F493-F500 HydrophobicContact CE2-CD1 4.46Å; F493-F500 HydrophobicContact CG-CD1 4.16Å; F493-F500 HydrophobicContact CG-CE1 4.44Å; F493-T501 HydrophobicContact CE2-CG2 3.96Å
494	H	89.6	Confident	89.5	Confident	115 Å²	115	72.4 Å²	72.4	53%	0.532	39%	0.391	S	S	.	.	H	α-helix	trans	-64	-34.6	175	-76.6	-62.7	0	0	0	113.4	H409 A490 S491 V492	H409-H494 AromaticContact CE1-ND1 3.48Å; H409-H494 PolarHBondContact CE1-ND1 3.32Å; H409-H494 AromaticContact NE2-CE1 3.51Å; H409-H494 AromaticContact NE2-ND1 3.07Å; H409-H494 PolarHBondContact NE2-ND1 2.84Å; A490-H494 PolarHBondContact O-CD2 3.12Å; A490-H494 PolarHBondContact O-N 3.39Å; S491-H494 PolarHBondContact O-N 3.22Å; V492-H494 VanDerWaalsContact C-N 3.33Å; V492-H494 PolarHBondContact O-N 3.13Å
495	Y	87.8	Confident	89.9	Confident	209 Å²	209	75.8 Å²	75.8	82%	0.82	40%	0.4	S	S	*	.	H	α-helix	trans	-75.4	-42.2	178.8	-178.2	-99.3	0	0	0	112.7	S491 V492 F493	S491-Y495 PolarHBondContact O-N 3.34Å; S491-Y495 VanDerWaalsContact O-N 3.12Å; V492-Y495 PolarHBondContact O-N 2.99Å; F493-Y495 VanDerWaalsContact C-N 3.32Å; F493-Y495 PolarHBondContact O-N 3.07Å
496	A	89.4	Confident	89.8	Confident	33 Å²	33	74.2 Å²	74.2	27%	0.273	39%	0.394	S	S	.	.			trans	-142.3	72.9	-174.8	0	0	0	0	0	112.3	V492 F493 V498 A499 F500	V492-A496 PolarHBondContact O-N 2.85Å; F493-A496 CarbonylContact O-C 3.56Å; A496-V498 PolarHBondContact O-N 2.89Å; A496-A499 HydrophobicContact CB-CB 4.33Å; A496-F500 WeakPolarHBondContact O-CB 3.31Å; A496-F500 PolarHBondContact O-N 3.09Å
497	P	90.8	Very high	89.8	Confident	23 Å²	23	72.1 Å²	72.1	15%	0.149	38%	0.383	C	S	.	.	H	α-helix	trans	-65.8	-40.4	-171.6	25.2	-34.5	0	0	0	112.7	H409 M410 F493 F500 T501	H409-P497 HydrophobicContact CB-CB 3.83Å; H409-P497 HydrophobicContact CB-CG 3.81Å; M410-P497 HydrophobicContact CE-CB 3.74Å; M410-P497 HydrophobicContact CE-CG 4.07Å; F493-P497 HydrophobicContact CD2-CB 4.09Å; F493-P497 HydrophobicContact CE2-CB 3.78Å; F493-P497 HydrophobicContact CZ-CB 4.22Å; F493-P497 VanDerWaalsContact O-CA 3.25Å; F493-P497 WeakPolarHBondContact O-CA 3.49Å; F493-P497 WeakPolarHBondContact O-CB 3.3Å; F493-P497 VanDerWaalsContact O-CD 3.3Å; F493-P497 WeakPolarHBondContact O-CD 3.42Å; F493-P497 VanDerWaalsContact O-N 3.11Å; P497-F500 PolarHBondContact O-N 2.89Å; P497-T501 WeakPolarHBondContact O-CB 3.27Å; P497-T501 VanDerWaalsContact O-CG2 3.29Å; P497-T501 WeakPolarHBondContact O-CG2 3.48Å; P497-T501 PolarHBondContact O-N 2.95Å; P497-T501 PolarHBondContact O-OG1 3.21Å; P497-T501 VanDerWaalsContact O-OG1 3.04Å
498	V	88.2	Confident	90	Very high	97 Å²	97	66.8 Å²	66.8	59%	0.588	35%	0.35	S	S	*	.	H	α-helix	trans	-62.9	-54.3	179.3	-177.4	0	0	0	0	110.8	M410 A496 F500 T501 F502	M410-V498 VanDerWaalsContact CE-CA 3.46Å; M410-V498 HydrophobicContact CE-CB 3.93Å; M410-V498 HydrophobicContact CE-CG2 3.29Å; M410-V498 VanDerWaalsContact CE-N 3.28Å; M410-V498 HydrophobicContact SD-CG2 4.01Å; A496-V498 PolarHBondContact O-N 2.89Å; V498-F500 VanDerWaalsContact C-N 3.28Å; V498-F500 PolarHBondContact O-N 3.28Å; V498-T501 PolarHBondContact O-N 3.37Å; V498-T501 PolarHBondContact O-OG1 3.16Å; V498-F502 WeakPolarHBondContact O-CB 3.33Å; V498-F502 PolarHBondContact O-N 3.36Å
499	A	87.9	Confident	90.1	Very high	53 Å²	53	63 Å²	63	44%	0.438	33%	0.333	S	S	.	.	H	α-helix	trans	-61.1	-40.5	-179.9	0	0	0	0	0	111.3	A496 F502 I503	A496-A499 HydrophobicContact CB-CB 4.33Å; A499-F502 PolarHBondContact O-N 3.28Å; A499-I503 WeakPolarHBondContact O-CD1 3.49Å; A499-I503 VanDerWaalsContact O-CG1 3.24Å; A499-I503 WeakPolarHBondContact O-CG1 3.3Å; A499-I503 PolarHBondContact O-N 3.48Å
500	F	90.9	Very high	89.9	Confident	20 Å²	20	63.8 Å²	63.8	9%	0.088	34%	0.342	C	S	.	.	H	α-helix	trans	-61	-53	176.1	-172	-85.9	0	0	0	111.5	F472 R489 V492 F493 A496 P497 V498 F502 I503 H504	F472-F500 HydrophobicContact CD1-CE1 4.42Å; F472-F500 HydrophobicContact CE1-CD1 4.37Å; F472-F500 AromaticContact CE1-CE1 3.52Å; F472-F500 HydrophobicContact CE1-CE1 3.52Å; F472-F500 HydrophobicContact CE1-CZ 4.38Å; F472-F500 HydrophobicContact CZ-CD1 4.28Å; F472-F500 AromaticContact CZ-CE1 3.86Å; F472-F500 HydrophobicContact CZ-CE1 3.86Å; R489-F500 HydrophobicContact CB-CZ 4.5Å; V492-F500 HydrophobicContact CB-CD2 4.34Å; V492-F500 HydrophobicContact CB-CE2 4.46Å; V492-F500 HydrophobicContact CG1-CD2 3.96Å; V492-F500 HydrophobicContact CG1-CE2 4.47Å; F493-F500 HydrophobicContact CB-CD1 3.97Å; F493-F500 HydrophobicContact CB-CD2 4.32Å; F493-F500 HydrophobicContact CB-CE1 4.08Å; F493-F500 HydrophobicContact CB-CE2 4.42Å; F493-F500 HydrophobicContact CB-CG 4.07Å; F493-F500 HydrophobicContact CB-CZ 4.3Å; F493-F500 HydrophobicContact CD2-CB 4.22Å; F493-F500 AromaticContact CD2-CD1 3.51Å; F493-F500 HydrophobicContact CD2-CD1 3.51Å; F493-F500 HydrophobicContact CD2-CE1 4.11Å; F493-F500 HydrophobicContact CD2-CG 4.04Å; F493-F500 HydrophobicContact CE2-CD1 4.46Å; F493-F500 HydrophobicContact CG-CD1 4.16Å; F493-F500 HydrophobicContact CG-CE1 4.44Å; A496-F500 WeakPolarHBondContact O-CB 3.31Å; A496-F500 PolarHBondContact O-N 3.09Å; P497-F500 PolarHBondContact O-N 2.89Å; V498-F500 VanDerWaalsContact C-N 3.28Å; V498-F500 PolarHBondContact O-N 3.28Å; F500-F502 VanDerWaalsContact C-N 3.31Å; F500-F502 PolarHBondContact O-N 3.46Å; F500-I503 PolarHBondContact O-N 3.15Å; F500-H504 AromaticContact CD1-CE1 3.6Å; F500-H504 AromaticContact CD1-ND1 3.56Å; F500-H504 AromaticContact CD2-CE1 3.84Å; F500-H504 AromaticContact CE1-CE1 3.16Å; F500-H504 WeakPolarHBondContact CE1-CE1 3.3Å; F500-H504 AromaticContact CE1-ND1 3.5Å; F500-H504 WeakPolarHBondContact CE1-ND1 3.31Å; F500-H504 AromaticContact CE1-NE2 3.76Å; F500-H504 AromaticContact CE2-CE1 3.45Å; F500-H504 VanDerWaalsContact CE2-CE1 3.45Å; F500-H504 WeakPolarHBondContact CE2-CE1 3.25Å; F500-H504 AromaticContact CG-CE1 3.93Å; F500-H504 AromaticContact CG-ND1 4Å; F500-H504 AromaticContact CZ-CE1 3.09Å; F500-H504 WeakPolarHBondContact CZ-CE1 3.39Å; F500-H504 AromaticContact CZ-ND1 3.9Å; F500-H504 AromaticContact CZ-NE2 3.6Å; F500-H504 PolarHBondContact O-N 3.37Å; F500-H504 VanDerWaalsContact O-N 3.13Å; F500-H504 PolarHBondContact O-ND1 2.91Å
501	T	91	Very high	89.9	Confident	35 Å²	35	62.8 Å²	62.8	22%	0.215	33%	0.329	C	S	.	.	H	α-helix	trans	-60.4	-38.6	177.7	55.8	0	0	0	0	112.8	F493 P497 V498 H504 W505	F493-T501 HydrophobicContact CE2-CG2 3.96Å; P497-T501 WeakPolarHBondContact O-CB 3.27Å; P497-T501 VanDerWaalsContact O-CG2 3.29Å; P497-T501 WeakPolarHBondContact O-CG2 3.48Å; P497-T501 PolarHBondContact O-N 2.95Å; P497-T501 PolarHBondContact O-OG1 3.21Å; P497-T501 VanDerWaalsContact O-OG1 3.04Å; V498-T501 PolarHBondContact O-N 3.37Å; V498-T501 PolarHBondContact O-OG1 3.16Å; T501-H504 PolarHBondContact O-N 3.05Å; T501-W505 WeakPolarHBondContact O-CB 3.15Å; T501-W505 PolarHBondContact O-N 3.22Å
502	F	93.4	Very high	89.8	Confident	120 Å²	120	61.4 Å²	61.4	53%	0.526	32%	0.316	S	S	.	.	H	α-helix	trans	-65.6	-42.4	177.9	178.3	-98.8	0	0	0	112.4	V498 A499 F500 H504 W505 A506	V498-F502 WeakPolarHBondContact O-CB 3.33Å; V498-F502 PolarHBondContact O-N 3.36Å; A499-F502 PolarHBondContact O-N 3.28Å; F500-F502 VanDerWaalsContact C-N 3.31Å; F500-F502 PolarHBondContact O-N 3.46Å; F502-H504 VanDerWaalsContact C-N 3.32Å; F502-H504 PolarHBondContact O-N 3.3Å; F502-W505 AromaticContact CD2-CE3 3.78Å; F502-W505 HydrophobicContact CD2-CE3 3.78Å; F502-W505 HydrophobicContact CD2-CZ3 4.07Å; F502-W505 AromaticContact CE2-CE3 3.63Å; F502-W505 HydrophobicContact CE2-CE3 3.63Å; F502-W505 AromaticContact CE2-CZ3 3.43Å; F502-W505 HydrophobicContact CE2-CZ3 3.43Å; F502-W505 VanDerWaalsContact CE2-CZ3 3.43Å; F502-W505 HydrophobicContact CZ-CE3 4.36Å; F502-W505 HydrophobicContact CZ-CZ3 4.04Å; F502-W505 WeakPolarHBondContact O-CB 3.42Å; F502-W505 PolarHBondContact O-N 2.97Å; F502-A506 WeakPolarHBondContact O-CB 3.31Å; F502-A506 PolarHBondContact O-N 3.33Å
503	I	87.7	Confident	89.6	Confident	91 Å²	91	63.8 Å²	63.8	47%	0.467	32%	0.321	S	S	.	.	H	α-helix	trans	-62.1	-42.9	175.9	-69.8	164.7	0	0	0	110.3	A499 F500 A506 I507	A499-I503 WeakPolarHBondContact O-CD1 3.49Å; A499-I503 VanDerWaalsContact O-CG1 3.24Å; A499-I503 WeakPolarHBondContact O-CG1 3.3Å; A499-I503 PolarHBondContact O-N 3.48Å; F500-I503 PolarHBondContact O-N 3.15Å; I503-A506 PolarHBondContact O-N 2.91Å; I503-I507 HydrophobicContact CG2-CD1 3.75Å; I503-I507 HydrophobicContact CG2-CG1 4.47Å; I503-I507 VanDerWaalsContact O-CG1 3.29Å; I503-I507 WeakPolarHBondContact O-CG1 3.33Å; I503-I507 PolarHBondContact O-N 2.92Å
504	H	92.7	Very high	89.3	Confident	10 Å²	10	67.9 Å²	67.9	5%	0.046	34%	0.336	C	S	.	.	H	α-helix	trans	-65.6	-43.3	177.1	-70.5	75.2	0	0	0	111.6	G471 F472 D475 F500 T501 F502 A506 I507 G508	G471-H504 WeakPolarHBondContact CA-O 3.07Å; F472-H504 HydrophobicContact CD2-CB 4.49Å; D475-H504 WeakPolarHBondContact CB-NE2 3.44Å; D475-H504 IonicContact OD2-NE2 3.77Å; D475-H504 PolarHBondContact OD2-NE2 3.47Å; F500-H504 AromaticContact CD1-CE1 3.6Å; F500-H504 AromaticContact CD1-ND1 3.56Å; F500-H504 AromaticContact CD2-CE1 3.84Å; F500-H504 AromaticContact CE1-CE1 3.16Å; F500-H504 WeakPolarHBondContact CE1-CE1 3.3Å; F500-H504 AromaticContact CE1-ND1 3.5Å; F500-H504 WeakPolarHBondContact CE1-ND1 3.31Å; F500-H504 AromaticContact CE1-NE2 3.76Å; F500-H504 AromaticContact CE2-CE1 3.45Å; F500-H504 VanDerWaalsContact CE2-CE1 3.45Å; F500-H504 WeakPolarHBondContact CE2-CE1 3.25Å; F500-H504 AromaticContact CG-CE1 3.93Å; F500-H504 AromaticContact CG-ND1 4Å; F500-H504 AromaticContact CZ-CE1 3.09Å; F500-H504 WeakPolarHBondContact CZ-CE1 3.39Å; F500-H504 AromaticContact CZ-ND1 3.9Å; F500-H504 AromaticContact CZ-NE2 3.6Å; F500-H504 PolarHBondContact O-N 3.37Å; F500-H504 VanDerWaalsContact O-N 3.13Å; F500-H504 PolarHBondContact O-ND1 2.91Å; T501-H504 PolarHBondContact O-N 3.05Å; F502-H504 VanDerWaalsContact C-N 3.32Å; F502-H504 PolarHBondContact O-N 3.3Å; H504-A506 PolarHBondContact O-N 2.84Å; H504-I507 PolarHBondContact O-N 3.17Å; H504-G508 PolarHBondContact O-N 3.24Å
505	W	94.8	Very high	89.1	Confident	88 Å²	88	63.4 Å²	63.4	33%	0.333	32%	0.316	S	S	.	.	H	α-helix	trans	-56.2	-47.7	172.1	172.5	78.6	0	0	0	111.9	L463 I468 T501 F502 G508 M509	L463-W505 PolarHBondContact O-NE1 3.35Å; L463-W505 VanDerWaalsContact O-NE1 3.13Å; I468-W505 HydrophobicContact CG1-CB 3.68Å; I468-W505 HydrophobicContact CG1-CG 4.29Å; T501-W505 WeakPolarHBondContact O-CB 3.15Å; T501-W505 PolarHBondContact O-N 3.22Å; F502-W505 AromaticContact CD2-CE3 3.78Å; F502-W505 HydrophobicContact CD2-CE3 3.78Å; F502-W505 HydrophobicContact CD2-CZ3 4.07Å; F502-W505 AromaticContact CE2-CE3 3.63Å; F502-W505 HydrophobicContact CE2-CE3 3.63Å; F502-W505 AromaticContact CE2-CZ3 3.43Å; F502-W505 HydrophobicContact CE2-CZ3 3.43Å; F502-W505 VanDerWaalsContact CE2-CZ3 3.43Å; F502-W505 HydrophobicContact CZ-CE3 4.36Å; F502-W505 HydrophobicContact CZ-CZ3 4.04Å; F502-W505 WeakPolarHBondContact O-CB 3.42Å; F502-W505 PolarHBondContact O-N 2.97Å; W505-G508 PolarHBondContact O-N 3.49Å; W505-M509 HydrophobicContact CD2-CG 4.22Å; W505-M509 HydrophobicContact CG-CG 4.5Å; W505-M509 HydrophobicContact CZ2-CG 4.01Å; W505-M509 WeakPolarHBondContact O-CB 3.32Å; W505-M509 WeakPolarHBondContact O-CG 3.32Å; W505-M509 PolarHBondContact O-N 3.37Å
506	A	88.3	Confident	88.8	Confident	40 Å²	40	54.6 Å²	54.6	33%	0.331	29%	0.287	S	S	.	.	H	α-helix	trans	-63.9	-43.6	-179	0	0	0	0	0	112.2	F502 I503 H504 M509 L510	F502-A506 WeakPolarHBondContact O-CB 3.31Å; F502-A506 PolarHBondContact O-N 3.33Å; I503-A506 PolarHBondContact O-N 2.91Å; H504-A506 PolarHBondContact O-N 2.84Å; A506-M509 PolarHBondContact O-N 2.94Å; A506-L510 VanDerWaalsContact O-CB 3.31Å; A506-L510 WeakPolarHBondContact O-CB 3.46Å; A506-L510 PolarHBondContact O-N 3.05Å
507	I	89.4	Confident	88.5	Confident	72 Å²	72	56.4 Å²	56.4	37%	0.369	30%	0.297	S	S	.	.	H	α-helix	trans	-64.3	-41.5	175.8	-68	168.2	0	0	0	110.7	I474 I503 H504 L510 Y511	I474-I507 HydrophobicContact CD1-CG2 4.2Å; I474-I507 HydrophobicContact CG2-CG2 4.13Å; I503-I507 HydrophobicContact CG2-CD1 3.75Å; I503-I507 HydrophobicContact CG2-CG1 4.47Å; I503-I507 VanDerWaalsContact O-CG1 3.29Å; I503-I507 WeakPolarHBondContact O-CG1 3.33Å; I503-I507 PolarHBondContact O-N 2.92Å; H504-I507 PolarHBondContact O-N 3.17Å; I507-L510 WeakPolarHBondContact O-CB 3.36Å; I507-L510 PolarHBondContact O-N 3.46Å; I507-Y511 PolarHBondContact O-N 3.47Å
508	G	93.1	Very high	88	Confident	0 Å²	0	59 Å²	59	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-65.5	-42.9	176.6	0	0	0	0	0	113.1	P467 S470 H504 W505 L510 Y511 I512	P467-G508 WeakPolarHBondContact O-CA 3.48Å; S470-G508 VanDerWaalsContact OG-CA 3.26Å; S470-G508 WeakPolarHBondContact OG-CA 3.46Å; H504-G508 PolarHBondContact O-N 3.24Å; W505-G508 PolarHBondContact O-N 3.49Å; G508-L510 VanDerWaalsContact C-N 3.33Å; G508-L510 PolarHBondContact O-N 2.87Å; G508-Y511 WeakPolarHBondContact O-CB 3.44Å; G508-Y511 PolarHBondContact O-N 2.83Å; G508-I512 VanDerWaalsContact O-CG1 3.23Å; G508-I512 WeakPolarHBondContact O-CG1 3.18Å; G508-I512 PolarHBondContact O-N 3.3Å
509	M	91.1	Very high	87.8	Confident	30 Å²	30	56 Å²	56	15%	0.148	29%	0.29	C	S	.	.	H	α-helix	trans	-60.8	-43.5	173.2	-76.6	-56.6	-64.7	0	0	111.3	P467 W505 A506 Y511 I512 F513	P467-M509 HydrophobicContact CB-CG 3.66Å; P467-M509 HydrophobicContact CB-SD 3.55Å; P467-M509 VanDerWaalsContact CB-SD 3.55Å; P467-M509 HydrophobicContact CG-CG 4.02Å; P467-M509 HydrophobicContact CG-SD 3.21Å; P467-M509 WeakPolarHBondContact CG-SD 3.35Å; W505-M509 HydrophobicContact CD2-CG 4.22Å; W505-M509 HydrophobicContact CG-CG 4.5Å; W505-M509 HydrophobicContact CZ2-CG 4.01Å; W505-M509 WeakPolarHBondContact O-CB 3.32Å; W505-M509 WeakPolarHBondContact O-CG 3.32Å; W505-M509 PolarHBondContact O-N 3.37Å; A506-M509 PolarHBondContact O-N 2.94Å; M509-Y511 VanDerWaalsContact C-N 3.33Å; M509-Y511 PolarHBondContact O-N 3.43Å; M509-I512 PolarHBondContact O-N 3.42Å; M509-I512 HydrophobicContact SD-CD1 4.24Å; M509-F513 HydrophobicContact CB-CE2 4.28Å; M509-F513 HydrophobicContact CE-CE2 3.73Å; M509-F513 HydrophobicContact CE-CZ 3.66Å; M509-F513 WeakPolarHBondContact O-CD2 3.42Å; M509-F513 WeakPolarHBondContact O-CG 3.46Å; M509-F513 PolarHBondContact O-N 2.68Å
510	L	86.8	Confident	87.4	Confident	86 Å²	86	56.4 Å²	56.4	45%	0.45	29%	0.287	S	S	.	.	H	α-helix	trans	-60.1	-43.8	176.8	-177.9	64.3	0	0	0	111.6	A506 I507 G508 F513 Y514	A506-L510 VanDerWaalsContact O-CB 3.31Å; A506-L510 WeakPolarHBondContact O-CB 3.46Å; A506-L510 PolarHBondContact O-N 3.05Å; I507-L510 WeakPolarHBondContact O-CB 3.36Å; I507-L510 PolarHBondContact O-N 3.46Å; G508-L510 VanDerWaalsContact C-N 3.33Å; G508-L510 PolarHBondContact O-N 2.87Å; L510-F513 PolarHBondContact O-N 3.42Å; L510-Y514 HydrophobicContact CD1-CD2 3.92Å; L510-Y514 HydrophobicContact CD1-CE2 3.32Å; L510-Y514 HydrophobicContact CD2-CE2 3.91Å; L510-Y514 HydrophobicContact CG-CD2 3.77Å; L510-Y514 HydrophobicContact CG-CE2 3.4Å; L510-Y514 WeakPolarHBondContact O-CD2 3.5Å; L510-Y514 PolarHBondContact O-N 2.94Å
511	Y	88.9	Confident	87.1	Confident	23 Å²	23	57 Å²	57	9%	0.09	29%	0.291	C	S	.	.	H	α-helix	trans	-59.3	-46.9	173.6	168.8	-96.4	0	0	0	111.8	I474 I507 G508 M509 F513 Y514 M515 W567 I571	I474-Y511 HydrophobicContact CD1-CD2 4.12Å; I474-Y511 HydrophobicContact CD1-CG 3.87Å; I507-Y511 PolarHBondContact O-N 3.47Å; G508-Y511 WeakPolarHBondContact O-CB 3.44Å; G508-Y511 PolarHBondContact O-N 2.83Å; M509-Y511 VanDerWaalsContact C-N 3.33Å; M509-Y511 PolarHBondContact O-N 3.43Å; Y511-F513 VanDerWaalsContact C-N 3.31Å; Y511-F513 PolarHBondContact O-N 3.48Å; Y511-Y514 PolarHBondContact O-N 3.23Å; Y511-M515 HydrophobicContact CD1-CG 4.5Å; Y511-M515 HydrophobicContact CD2-CE 4.19Å; Y511-M515 HydrophobicContact CD2-CG 4.25Å; Y511-M515 HydrophobicContact CE1-CG 3.97Å; Y511-M515 HydrophobicContact CE2-CE 3.34Å; Y511-M515 HydrophobicContact CE2-CG 3.72Å; Y511-M515 HydrophobicContact CE2-SD 4.35Å; Y511-M515 PolarHBondContact O-N 3.39Å; Y511-W567 HydrophobicContact CE1-CB 4.47Å; Y511-W567 AromaticContact CE1-CE3 3.91Å; Y511-W567 HydrophobicContact CE1-CE3 3.91Å; Y511-W567 PolarHBondContact OH-O 3.39Å; Y511-I571 HydrophobicContact CD1-CD1 4.32Å; Y511-I571 HydrophobicContact CD2-CG1 4.37Å; Y511-I571 HydrophobicContact CE1-CD1 3.85Å; Y511-I571 HydrophobicContact CE1-CG1 3.93Å; Y511-I571 HydrophobicContact CE2-CD1 4.4Å; Y511-I571 HydrophobicContact CE2-CG1 3.66Å; Y511-I571 VanDerWaalsContact CZ-CG1 3.43Å
512	I	86.9	Confident	86.7	Confident	38 Å²	38	56 Å²	56	20%	0.195	29%	0.287	C	S	.	.	H	α-helix	trans	-58.3	-45.1	178.2	-66.6	164.1	0	0	0	110.5	P467 G508 M509 M515 A516 W567	P467-I512 HydrophobicContact CB-CD1 3.97Å; P467-I512 HydrophobicContact CG-CD1 3.7Å; G508-I512 VanDerWaalsContact O-CG1 3.23Å; G508-I512 WeakPolarHBondContact O-CG1 3.18Å; G508-I512 PolarHBondContact O-N 3.3Å; M509-I512 PolarHBondContact O-N 3.42Å; M509-I512 HydrophobicContact SD-CD1 4.24Å; I512-M515 PolarHBondContact O-N 2.98Å; I512-A516 WeakPolarHBondContact O-CB 3.31Å; I512-A516 PolarHBondContact O-N 3.25Å; I512-W567 HydrophobicContact CB-CZ3 3.86Å; I512-W567 HydrophobicContact CG1-CE3 4.21Å; I512-W567 HydrophobicContact CG1-CZ3 3.67Å; I512-W567 HydrophobicContact CG2-CH2 4.05Å; I512-W567 HydrophobicContact CG2-CZ3 3.75Å
513	F	83.8	Confident	86.1	Confident	117 Å²	117	51.8 Å²	51.8	51%	0.513	27%	0.268	S	S	.	.	H	α-helix	trans	-64.6	-40.2	177.4	-72.2	-52.5	0	0	0	113.3	M509 L510 Y511 A516 S517	M509-F513 HydrophobicContact CB-CE2 4.28Å; M509-F513 HydrophobicContact CE-CE2 3.73Å; M509-F513 HydrophobicContact CE-CZ 3.66Å; M509-F513 WeakPolarHBondContact O-CD2 3.42Å; M509-F513 WeakPolarHBondContact O-CG 3.46Å; M509-F513 PolarHBondContact O-N 2.68Å; L510-F513 PolarHBondContact O-N 3.42Å; Y511-F513 VanDerWaalsContact C-N 3.31Å; Y511-F513 PolarHBondContact O-N 3.48Å; F513-A516 PolarHBondContact O-N 3.34Å; F513-S517 WeakPolarHBondContact O-CB 3.36Å; F513-S517 PolarHBondContact O-N 2.68Å; F513-S517 PolarHBondContact O-OG 3.02Å
514	Y	83.5	Confident	85.8	Confident	125 Å²	125	50 Å²	50	49%	0.49	26%	0.263	S	S	.	.	H	α-helix	trans	-67.3	-39.1	176.4	-77.9	-53.8	0	0	0	112.3	L510 Y511 S517 L518	L510-Y514 HydrophobicContact CD1-CD2 3.92Å; L510-Y514 HydrophobicContact CD1-CE2 3.32Å; L510-Y514 HydrophobicContact CD2-CE2 3.91Å; L510-Y514 HydrophobicContact CG-CD2 3.77Å; L510-Y514 HydrophobicContact CG-CE2 3.4Å; L510-Y514 WeakPolarHBondContact O-CD2 3.5Å; L510-Y514 PolarHBondContact O-N 2.94Å; Y511-Y514 PolarHBondContact O-N 3.23Å; Y514-S517 PolarHBondContact O-N 2.85Å; Y514-L518 WeakPolarHBondContact O-CB 3.31Å; Y514-L518 PolarHBondContact O-N 3.19Å
515	M	84.4	Confident	85.5	Confident	21 Å²	21	50.3 Å²	50.3	10%	0.103	27%	0.266	C	S	.	.	H	α-helix	trans	-66.3	-43	174.7	-73.5	-58.5	162.9	0	0	111.8	Y511 I512 S517 L518 L519 W567 M574	Y511-M515 HydrophobicContact CD1-CG 4.5Å; Y511-M515 HydrophobicContact CD2-CE 4.19Å; Y511-M515 HydrophobicContact CD2-CG 4.25Å; Y511-M515 HydrophobicContact CE1-CG 3.97Å; Y511-M515 HydrophobicContact CE2-CE 3.34Å; Y511-M515 HydrophobicContact CE2-CG 3.72Å; Y511-M515 HydrophobicContact CE2-SD 4.35Å; Y511-M515 PolarHBondContact O-N 3.39Å; I512-M515 PolarHBondContact O-N 2.98Å; M515-S517 VanDerWaalsContact C-N 3.31Å; M515-S517 PolarHBondContact O-N 3.49Å; M515-L518 PolarHBondContact O-N 3.21Å; M515-L518 HydrophobicContact SD-CD2 4.23Å; M515-L519 WeakPolarHBondContact O-CG 3.49Å; M515-L519 PolarHBondContact O-N 2.88Å; M515-W567 HydrophobicContact CB-CH2 4.48Å; M515-W567 HydrophobicContact CB-CZ3 4.36Å; M515-M574 HydrophobicContact CE-CE 3.92Å; M515-M574 HydrophobicContact CE-SD 3.45Å; M515-M574 WeakPolarHBondContact CE-SD 3.46Å
516	A	82.6	Confident	85	Confident	25 Å²	25	47.6 Å²	47.6	21%	0.207	26%	0.258	C	S	.	.	H	α-helix	trans	-58.5	-43.8	172.5	0	0	0	0	0	111.5	I512 F513 L518 L519 V520	I512-A516 WeakPolarHBondContact O-CB 3.31Å; I512-A516 PolarHBondContact O-N 3.25Å; F513-A516 PolarHBondContact O-N 3.34Å; A516-L518 PolarHBondContact O-N 3.04Å; A516-L519 WeakPolarHBondContact O-CB 2.88Å; A516-L519 PolarHBondContact O-N 3.44Å; A516-V520 WeakPolarHBondContact O-CG2 3.19Å; A516-V520 PolarHBondContact O-N 2.92Å
517	S	81.7	Confident	84.6	Confident	70 Å²	70	46.8 Å²	46.8	49%	0.49	25%	0.246	S	C	.	.	H	α-helix	trans	-63.6	-39.4	177.2	-59.4	0	0	0	0	112.6	F513 Y514 M515 V520 L521	F513-S517 WeakPolarHBondContact O-CB 3.36Å; F513-S517 PolarHBondContact O-N 2.68Å; F513-S517 PolarHBondContact O-OG 3.02Å; Y514-S517 PolarHBondContact O-N 2.85Å; M515-S517 VanDerWaalsContact C-N 3.31Å; M515-S517 PolarHBondContact O-N 3.49Å; S517-V520 PolarHBondContact O-N 3.21Å; S517-L521 WeakPolarHBondContact O-CB 3.39Å; S517-L521 PolarHBondContact O-N 2.93Å
518	L	82.2	Confident	83.7	Confident	77 Å²	77	45.5 Å²	45.5	40%	0.403	24%	0.242	S	C	.	.	H	α-helix	trans	-64.5	-40.3	175.1	-178.8	65	0	0	0	111.4	Y514 M515 A516 L521 G522 L788	Y514-L518 WeakPolarHBondContact O-CB 3.31Å; Y514-L518 PolarHBondContact O-N 3.19Å; M515-L518 PolarHBondContact O-N 3.21Å; M515-L518 HydrophobicContact SD-CD2 4.23Å; A516-L518 PolarHBondContact O-N 3.04Å; L518-L521 PolarHBondContact O-N 3.23Å; L518-G522 PolarHBondContact O-N 3.39Å; L518-L788 HydrophobicContact CD2-CD2 4.44Å
519	L	82.3	Confident	82.5	Confident	36 Å²	36	47.7 Å²	47.7	19%	0.188	27%	0.266	C	S	.	.	H	α-helix	trans	-65.4	-42.5	175.8	-70	170.6	0	0	0	111.8	M515 A516 G522 R523 I534	M515-L519 WeakPolarHBondContact O-CG 3.49Å; M515-L519 PolarHBondContact O-N 2.88Å; A516-L519 WeakPolarHBondContact O-CB 2.88Å; A516-L519 PolarHBondContact O-N 3.44Å; L519-G522 PolarHBondContact O-N 2.94Å; L519-R523 WeakPolarHBondContact O-CG 3.37Å; L519-R523 PolarHBondContact O-N 3.43Å; L519-I534 HydrophobicContact CD1-CD1 4.46Å; L519-I534 HydrophobicContact CD1-CG2 4.02Å; L519-I534 HydrophobicContact CD2-CD1 3.63Å
520	V	81	Confident	81.8	Confident	61 Å²	61	47.3 Å²	47.3	37%	0.37	27%	0.265	S	S	.	.	H	α-helix	trans	-63.7	-44.7	175.5	172	0	0	0	0	111.1	A516 S517 G522 R523 S524	A516-V520 WeakPolarHBondContact O-CG2 3.19Å; A516-V520 PolarHBondContact O-N 2.92Å; S517-V520 PolarHBondContact O-N 3.21Å; V520-G522 VanDerWaalsContact C-N 3.35Å; V520-G522 PolarHBondContact O-N 3.28Å; V520-R523 PolarHBondContact O-N 3.2Å; V520-S524 PolarHBondContact O-N 2.86Å
521	L	83.1	Confident	81.2	Confident	33 Å²	33	44.7 Å²	44.7	17%	0.173	25%	0.251	C	S	.	.	H	α-helix	trans	-61.1	-44	174.9	175.6	67.8	0	0	0	111.6	S517 L518 R523 S524 L627 R628 V631	S517-L521 WeakPolarHBondContact O-CB 3.39Å; S517-L521 PolarHBondContact O-N 2.93Å; L518-L521 PolarHBondContact O-N 3.23Å; L521-R523 VanDerWaalsContact C-N 3.33Å; L521-R523 PolarHBondContact O-N 2.87Å; L521-S524 PolarHBondContact O-N 3.42Å; L521-S524 PolarHBondContact O-OG 2.91Å; L521-L627 HydrophobicContact CD2-CD1 4.46Å; L521-L627 HydrophobicContact CD2-CD2 3.47Å; L521-L627 VanDerWaalsContact CD2-CD2 3.47Å; L521-L627 HydrophobicContact CD2-CG 3.66Å; L521-R628 HydrophobicContact CD1-CB 4.4Å; L521-V631 HydrophobicContact CD2-CG2 4.06Å; L521-V631 HydrophobicContact CG-CG2 4.41Å
522	G	83.7	Confident	80.1	Confident	14 Å²	14	52.9 Å²	52.9	14%	0.144	28%	0.282	C	S	.	.	H	α-helix	trans	-56.3	-48.1	175.1	0	0	0	0	0	111.3	L518 L519 V520 S524 V525 L526	L518-G522 PolarHBondContact O-N 3.39Å; L519-G522 PolarHBondContact O-N 2.94Å; V520-G522 VanDerWaalsContact C-N 3.35Å; V520-G522 PolarHBondContact O-N 3.28Å; G522-S524 VanDerWaalsContact C-N 3.31Å; G522-S524 PolarHBondContact O-N 3.14Å; G522-V525 PolarHBondContact O-N 2.8Å; G522-V525 VanDerWaalsContact O-N 3.12Å; G522-L526 VanDerWaalsContact O-CB 3.3Å; G522-L526 WeakPolarHBondContact O-CB 3.42Å; G522-L526 WeakPolarHBondContact O-CG 3.28Å; G522-L526 PolarHBondContact O-N 3.43Å
523	R	81.4	Confident	79.1	Confident	31 Å²	31	58.7 Å²	58.7	12%	0.117	31%	0.306	C	S	.	.	H	α-helix	trans	-64.1	-30.4	177.7	-70.1	-173.6	-174.4	112.2	-11.8	114.2	L519 V520 L521 V525 L531 I534 Y535 H536	L519-R523 WeakPolarHBondContact O-CG 3.37Å; L519-R523 PolarHBondContact O-N 3.43Å; V520-R523 PolarHBondContact O-N 3.2Å; L521-R523 VanDerWaalsContact C-N 3.33Å; L521-R523 PolarHBondContact O-N 2.87Å; R523-V525 PolarHBondContact O-N 3.27Å; R523-L531 HydrophobicContact CG-CB 4.28Å; R523-L531 HydrophobicContact CG-CD1 3.47Å; R523-L531 VanDerWaalsContact CG-CD1 3.47Å; R523-L531 HydrophobicContact CG-CG 4.46Å; R523-I534 PolarHBondContact NH2-O 3.33Å; R523-Y535 PolarHBondContact NH2-O 3.28Å; R523-H536 WeakPolarHBondContact CD-CE1 3.37Å; R523-H536 WeakPolarHBondContact CD-NE2 3.35Å; R523-H536 PolarHBondContact NE-CE1 2.8Å; R523-H536 PolarHBondContact NE-NE2 3.4Å
524	S	81.1	Confident	78.3	Confident	53 Å²	53	55.2 Å²	55.2	37%	0.371	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-13.6	175.4	76.3	0	0	0	0	114.4	V520 L521 G522	V520-S524 PolarHBondContact O-N 2.86Å; L521-S524 PolarHBondContact O-N 3.42Å; L521-S524 PolarHBondContact O-OG 2.91Å; G522-S524 VanDerWaalsContact C-N 3.31Å; G522-S524 PolarHBondContact O-N 3.14Å
525	V	85.6	Confident	77.3	Confident	16 Å²	16	54.5 Å²	54.5	10%	0.097	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.7	-35.8	-179.6	178.2	0	0	0	0	111.6	G522 R523 R628 V631 R632 C635	G522-V525 PolarHBondContact O-N 2.8Å; G522-V525 VanDerWaalsContact O-N 3.12Å; R523-V525 PolarHBondContact O-N 3.27Å; V525-R628 HydrophobicContact CG2-CG 3.61Å; V525-V631 HydrophobicContact CB-CG1 4.14Å; V525-V631 HydrophobicContact CG1-CG1 4.17Å; V525-V631 HydrophobicContact CG2-CB 4.2Å; V525-V631 HydrophobicContact CG2-CG1 3.97Å; V525-R632 VanDerWaalsContact CG1-CA 3.5Å; V525-R632 HydrophobicContact CG1-CB 3.8Å; V525-R632 HydrophobicContact CG1-CG 4.24Å; V525-C635 HydrophobicContact CG1-CB 4.5Å
526	L	85.1	Confident	75.9	Confident	32 Å²	32	55.8 Å²	55.8	17%	0.168	30%	0.295	C	S	.	.	S	Bend	trans	-79.9	149.4	-179.5	-64.3	175.8	0	0	0	110.7	G522 L531 L648	G522-L526 VanDerWaalsContact O-CB 3.3Å; G522-L526 WeakPolarHBondContact O-CB 3.42Å; G522-L526 WeakPolarHBondContact O-CG 3.28Å; G522-L526 PolarHBondContact O-N 3.43Å; L526-L531 HydrophobicContact CD1-CD1 3.77Å; L526-L531 HydrophobicContact CD1-CG 4.08Å; L526-L648 HydrophobicContact CD2-CD1 3.33Å; L526-L648 HydrophobicContact CD2-CD2 4.18Å; L526-L648 HydrophobicContact CD2-CG 3.46Å; L526-L648 VanDerWaalsContact CD2-CG 3.46Å
527	R	79.2	Confident	74.7	Confident	22 Å²	22	59.2 Å²	59.2	8%	0.083	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-57.6	141.7	172.8	-173	-170.9	-172.3	165.9	6.9	112.3	G529 V530 S646 L648 I765 P766 Y767	R527-G529 PolarHBondContact O-N 3.45Å; R527-V530 HydrophobicContact CB-CG2 4.26Å; R527-V530 PolarHBondContact O-N 3.48Å; R527-S646 PolarHBondContact NH1-O 3.13Å; R527-L648 WeakPolarHBondContact CB-O 3.44Å; R527-L648 PolarHBondContact N-O 2.96Å; R527-I765 HydrophobicContact CG-CD1 4.28Å; R527-I765 PolarHBondContact NH2-O 3.45Å; R527-P766 VanDerWaalsContact CZ-O 3.31Å; R527-P766 PolarHBondContact NH1-O 3.17Å; R527-P766 VanDerWaalsContact NH1-O 3.08Å; R527-P766 PolarHBondContact NH2-O 3.47Å; R527-Y767 VanDerWaalsContact NH1-CB 3.32Å
528	P	70.1	Confident	73.5	Confident	45 Å²	45	60.5 Å²	60.5	29%	0.292	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	127.1	167.6	-22.7	32.4	0	0	0	110.8	F761 I765	P528-F761 HydrophobicContact CB-CD1 4.47Å; P528-F761 HydrophobicContact CG-CD1 4.13Å; P528-I765 HydrophobicContact CB-CD1 4.26Å; P528-I765 HydrophobicContact CG-CD1 4.12Å
529	G	67.7	Low	72.5	Confident	47 Å²	47	58.8 Å²	58.8	49%	0.485	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	109.1	-25.1	179.9	0	0	0	0	0	116.7	R527 L531 R532	R527-G529 PolarHBondContact O-N 3.45Å; G529-L531 VanDerWaalsContact C-N 3.34Å; G529-L531 PolarHBondContact O-N 3.03Å; G529-R532 WeakPolarHBondContact O-CB 3.28Å; G529-R532 PolarHBondContact O-N 2.79Å
530	V	77.6	Confident	71.4	Confident	21 Å²	21	62.8 Å²	62.8	13%	0.127	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-39.1	179.6	177.7	0	0	0	0	111.7	R527 Y647 L648	R527-V530 HydrophobicContact CB-CG2 4.26Å; R527-V530 PolarHBondContact O-N 3.48Å; V530-Y647 HydrophobicContact CG1-CE1 4.1Å; V530-Y647 HydrophobicContact CG2-CE1 4.37Å; V530-Y647 WeakPolarHBondContact CG2-O 3.41Å; V530-L648 HydrophobicContact CG1-CD1 4.43Å
531	L	73	Confident	70.5	Confident	31 Å²	31	66.6 Å²	66.6	16%	0.162	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	24.7	179.7	-68.1	175.4	0	0	0	113.2	R523 L526 G529 F533 I534	R523-L531 HydrophobicContact CG-CB 4.28Å; R523-L531 HydrophobicContact CG-CD1 3.47Å; R523-L531 VanDerWaalsContact CG-CD1 3.47Å; R523-L531 HydrophobicContact CG-CG 4.46Å; L526-L531 HydrophobicContact CD1-CD1 3.77Å; L526-L531 HydrophobicContact CD1-CG 4.08Å; G529-L531 VanDerWaalsContact C-N 3.34Å; G529-L531 PolarHBondContact O-N 3.03Å; L531-F533 HydrophobicContact CD2-CE1 3.85Å; L531-F533 HydrophobicContact CD2-CZ 4.01Å; L531-F533 PolarHBondContact O-N 2.92Å; L531-F533 VanDerWaalsContact O-N 3.14Å; L531-I534 HydrophobicContact CD2-CD1 4.42Å; L531-I534 PolarHBondContact O-N 2.88Å; L531-I534 VanDerWaalsContact O-N 3.08Å; L531-I534 VanDerWaalsContact O-O 3.13Å
532	R	67.4	Low	69.8	Low	195 Å²	195	66.2 Å²	66.2	74%	0.736	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-28.7	-179.2	-173.5	179.1	-175.9	-175.7	6	113.5	G529 I534	G529-R532 WeakPolarHBondContact O-CB 3.28Å; G529-R532 PolarHBondContact O-N 2.79Å; R532-I534 VanDerWaalsContact C-N 3.26Å; R532-I534 PolarHBondContact O-N 3.22Å
533	F	65.8	Low	69.6	Low	161 Å²	161	69.2 Å²	69.2	71%	0.706	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-18.8	-179.7	69.1	-86.8	0	0	0	113.9	L531	L531-F533 HydrophobicContact CD2-CE1 3.85Å; L531-F533 HydrophobicContact CD2-CZ 4.01Å; L531-F533 PolarHBondContact O-N 2.92Å; L531-F533 VanDerWaalsContact O-N 3.14Å
534	I	65.3	Low	69.6	Low	43 Å²	43	70.4 Å²	70.4	22%	0.221	36%	0.361	C	S	.	.	S	Bend	trans	-104.3	120.2	175.9	-50.5	-177.9	0	0	0	107.3	L519 R523 L531 R532	L519-I534 HydrophobicContact CD1-CD1 4.46Å; L519-I534 HydrophobicContact CD1-CG2 4.02Å; L519-I534 HydrophobicContact CD2-CD1 3.63Å; R523-I534 PolarHBondContact NH2-O 3.33Å; L531-I534 HydrophobicContact CD2-CD1 4.42Å; L531-I534 PolarHBondContact O-N 2.88Å; L531-I534 VanDerWaalsContact O-N 3.08Å; L531-I534 VanDerWaalsContact O-O 3.13Å; R532-I534 VanDerWaalsContact C-N 3.26Å; R532-I534 PolarHBondContact O-N 3.22Å
535	Y	62.7	Low	69.7	Low	110 Å²	110	70.8 Å²	70.8	43%	0.431	36%	0.359	S	S	.	.			trans	-61.4	144.7	177.3	-156.4	-76.9	0	0	0	111.1	R523 F537 Y542	R523-Y535 PolarHBondContact NH2-O 3.28Å; Y535-F537 PolarHBondContact O-N 3.05Å; Y535-Y542 AromaticContact CD1-CD1 3.65Å; Y535-Y542 HydrophobicContact CD1-CD1 3.65Å; Y535-Y542 AromaticContact CD1-CD2 3.95Å; Y535-Y542 HydrophobicContact CD1-CD2 3.95Å; Y535-Y542 AromaticContact CD1-CE1 3.51Å; Y535-Y542 HydrophobicContact CD1-CE1 3.51Å; Y535-Y542 AromaticContact CD1-CE2 3.77Å; Y535-Y542 HydrophobicContact CD1-CE2 3.77Å; Y535-Y542 AromaticContact CD1-CG 3.84Å; Y535-Y542 HydrophobicContact CD1-CG 3.84Å; Y535-Y542 AromaticContact CD1-CZ 3.55Å; Y535-Y542 HydrophobicContact CD2-CE2 4.42Å; Y535-Y542 VanDerWaalsContact CE1-CB 3.47Å; Y535-Y542 AromaticContact CE1-CD1 3.27Å; Y535-Y542 HydrophobicContact CE1-CD1 3.27Å; Y535-Y542 AromaticContact CE1-CD2 3.03Å; Y535-Y542 HydrophobicContact CE1-CD2 3.03Å; Y535-Y542 AromaticContact CE1-CE1 3.55Å; Y535-Y542 HydrophobicContact CE1-CE1 3.55Å; Y535-Y542 AromaticContact CE1-CE2 3.27Å; Y535-Y542 HydrophobicContact CE1-CE2 3.27Å; Y535-Y542 AromaticContact CE1-CG 2.97Å; Y535-Y542 HydrophobicContact CE1-CG 2.97Å; Y535-Y542 AromaticContact CE1-CZ 3.52Å; Y535-Y542 HydrophobicContact CE2-CD2 4.06Å; Y535-Y542 AromaticContact CE2-CE2 3.87Å; Y535-Y542 HydrophobicContact CE2-CE2 3.87Å; Y535-Y542 HydrophobicContact CG-CE1 4.5Å; Y535-Y542 HydrophobicContact CG-CE2 4.37Å; Y535-Y542 AromaticContact CZ-CD2 3.04Å; Y535-Y542 AromaticContact CZ-CE2 3.27Å; Y535-Y542 AromaticContact CZ-CG 3.5Å; Y535-Y542 VanDerWaalsContact CZ-CG 3.5Å; Y535-Y542 AromaticContact CZ-CZ 3.97Å; Y535-Y542 WeakPolarHBondContact OH-CB 3.47Å; Y535-Y542 WeakPolarHBondContact OH-CD2 3.32Å
536	H	56.4	Low	69.7	Low	49 Å²	49	72.3 Å²	72.3	23%	0.227	37%	0.365	C	S	.	.			trans	-82.1	109.5	173.8	-92.9	102.2	0	0	0	110.2	R523 N538 D539	R523-H536 WeakPolarHBondContact CD-CE1 3.37Å; R523-H536 WeakPolarHBondContact CD-NE2 3.35Å; R523-H536 PolarHBondContact NE-CE1 2.8Å; R523-H536 PolarHBondContact NE-NE2 3.4Å; H536-N538 PolarHBondContact O-N 3.27Å; H536-D539 HydrophobicContact CB-CB 3.74Å; H536-D539 PolarHBondContact O-N 3.47Å
537	F	57.1	Low	69.6	Low	96 Å²	96	72.5 Å²	72.5	42%	0.421	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-15.1	169.3	-67.3	-77.7	0	0	0	113.3	Y535	Y535-F537 PolarHBondContact O-N 3.05Å
538	N	57	Low	70	Confident	98 Å²	98	71.8 Å²	71.8	52%	0.524	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	12.9	-177.5	-68.2	5.8	0	0	0	113.2	H536	H536-N538 PolarHBondContact O-N 3.27Å
539	D	59.7	Low	70.8	Confident	41 Å²	41	69.8 Å²	69.8	22%	0.219	35%	0.351	C	S	.	.			trans	-70	125	173.8	-148.8	-34.4	0	0	0	108.5	H536 D541 Y542	H536-D539 HydrophobicContact CB-CB 3.74Å; H536-D539 PolarHBondContact O-N 3.47Å; D539-D541 PolarHBondContact O-N 2.97Å; D539-Y542 PolarHBondContact O-N 3.48Å
540	P	59.1	Low	71.7	Confident	119 Å²	119	71.6 Å²	71.6	77%	0.773	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-27.5	176.1	22.1	-34.3	0	0	0	113	Y542	P540-Y542 VanDerWaalsContact C-N 3.32Å
541	D	62.2	Low	72.1	Confident	141 Å²	141	73.3 Å²	73.3	75%	0.754	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-11.5	178.5	-67.3	-34.6	0	0	0	113.3	D539 K543	D539-D541 PolarHBondContact O-N 2.97Å; D541-K543 PolarHBondContact O-N 3.44Å
542	Y	68.7	Low	72.8	Confident	25 Å²	25	75.1 Å²	75.1	10%	0.098	37%	0.369	C	S	.	.			trans	-84	115.6	-177.9	-175.9	-135.9	0	0	0	113.6	Y535 D539 P540 P544 D547	Y535-Y542 AromaticContact CD1-CD1 3.65Å; Y535-Y542 HydrophobicContact CD1-CD1 3.65Å; Y535-Y542 AromaticContact CD1-CD2 3.95Å; Y535-Y542 HydrophobicContact CD1-CD2 3.95Å; Y535-Y542 AromaticContact CD1-CE1 3.51Å; Y535-Y542 HydrophobicContact CD1-CE1 3.51Å; Y535-Y542 AromaticContact CD1-CE2 3.77Å; Y535-Y542 HydrophobicContact CD1-CE2 3.77Å; Y535-Y542 AromaticContact CD1-CG 3.84Å; Y535-Y542 HydrophobicContact CD1-CG 3.84Å; Y535-Y542 AromaticContact CD1-CZ 3.55Å; Y535-Y542 HydrophobicContact CD2-CE2 4.42Å; Y535-Y542 VanDerWaalsContact CE1-CB 3.47Å; Y535-Y542 AromaticContact CE1-CD1 3.27Å; Y535-Y542 HydrophobicContact CE1-CD1 3.27Å; Y535-Y542 AromaticContact CE1-CD2 3.03Å; Y535-Y542 HydrophobicContact CE1-CD2 3.03Å; Y535-Y542 AromaticContact CE1-CE1 3.55Å; Y535-Y542 HydrophobicContact CE1-CE1 3.55Å; Y535-Y542 AromaticContact CE1-CE2 3.27Å; Y535-Y542 HydrophobicContact CE1-CE2 3.27Å; Y535-Y542 AromaticContact CE1-CG 2.97Å; Y535-Y542 HydrophobicContact CE1-CG 2.97Å; Y535-Y542 AromaticContact CE1-CZ 3.52Å; Y535-Y542 HydrophobicContact CE2-CD2 4.06Å; Y535-Y542 AromaticContact CE2-CE2 3.87Å; Y535-Y542 HydrophobicContact CE2-CE2 3.87Å; Y535-Y542 HydrophobicContact CG-CE1 4.5Å; Y535-Y542 HydrophobicContact CG-CE2 4.37Å; Y535-Y542 AromaticContact CZ-CD2 3.04Å; Y535-Y542 AromaticContact CZ-CE2 3.27Å; Y535-Y542 AromaticContact CZ-CG 3.5Å; Y535-Y542 VanDerWaalsContact CZ-CG 3.5Å; Y535-Y542 AromaticContact CZ-CZ 3.97Å; Y535-Y542 WeakPolarHBondContact OH-CB 3.47Å; Y535-Y542 WeakPolarHBondContact OH-CD2 3.32Å; D539-Y542 PolarHBondContact O-N 3.48Å; P540-Y542 VanDerWaalsContact C-N 3.32Å; Y542-P544 HydrophobicContact CD1-CB 4.34Å; Y542-P544 HydrophobicContact CE1-CB 3.75Å; Y542-P544 HydrophobicContact CE1-CG 4.42Å; Y542-P544 VanDerWaalsContact O-CD 3.28Å; Y542-P544 WeakPolarHBondContact O-CD 2.95Å; Y542-D547 HydrophobicContact CE2-CB 4.14Å; Y542-D547 VanDerWaalsContact CE2-OD2 3.23Å; Y542-D547 WeakPolarHBondContact CE2-OD2 3.42Å; Y542-D547 PolarHBondContact OH-OD2 3.18Å
543	K	79.5	Confident	73.7	Confident	78 Å²	78	68.7 Å²	68.7	34%	0.339	35%	0.349	S	S	.	.			trans	-106.1	94.1	171.1	-67.1	175.7	-179.6	177	0	109.8	D541 I545 Q546 D547	D541-K543 PolarHBondContact O-N 3.44Å; K543-I545 PolarHBondContact O-N 3.19Å; K543-I545 VanDerWaalsContact O-N 3.17Å; K543-Q546 HydrophobicContact CB-CB 3.75Å; K543-Q546 WeakPolarHBondContact O-CB 3.35Å; K543-Q546 PolarHBondContact O-N 2.87Å; K543-D547 PolarHBondContact O-N 3.34Å; K543-D547 VanDerWaalsContact O-N 3.15Å
544	P	80.6	Confident	74.8	Confident	55 Å²	55	65.3 Å²	65.3	36%	0.357	34%	0.343	S	S	.	.	H	α-helix	trans	-57.5	-36.7	-175.4	20.5	-32.7	0	0	0	113	Y542 D547 M548	Y542-P544 HydrophobicContact CD1-CB 4.34Å; Y542-P544 HydrophobicContact CE1-CB 3.75Å; Y542-P544 HydrophobicContact CE1-CG 4.42Å; Y542-P544 VanDerWaalsContact O-CD 3.28Å; Y542-P544 WeakPolarHBondContact O-CD 2.95Å; P544-D547 VanDerWaalsContact O-CB 3.26Å; P544-D547 WeakPolarHBondContact O-CB 3.46Å; P544-D547 PolarHBondContact O-N 3.31Å; P544-M548 VanDerWaalsContact O-CG 3.29Å; P544-M548 WeakPolarHBondContact O-CG 3.4Å; P544-M548 PolarHBondContact O-N 3.11Å; P544-M548 VanDerWaalsContact O-N 3.1Å
545	I	83.6	Confident	75.9	Confident	62 Å²	62	68 Å²	68	32%	0.318	36%	0.357	S	S	.	.	H	α-helix	trans	-71	-36.6	-179.4	-58.6	164.6	0	0	0	111	L183 V455 K543 D547 M548 I549	L183-I545 HydrophobicContact CD1-CG2 3.95Å; V455-I545 HydrophobicContact CG1-CG2 3.81Å; K543-I545 PolarHBondContact O-N 3.19Å; K543-I545 VanDerWaalsContact O-N 3.17Å; I545-D547 VanDerWaalsContact C-N 3.31Å; I545-D547 PolarHBondContact O-N 2.81Å; I545-M548 WeakPolarHBondContact O-CB 3.2Å; I545-M548 PolarHBondContact O-N 3.21Å; I545-I549 WeakPolarHBondContact O-CG1 3.45Å; I545-I549 PolarHBondContact O-N 2.87Å
546	Q	85.1	Confident	77	Confident	47 Å²	47	62.8 Å²	62.8	22%	0.22	34%	0.337	C	S	.	.	H	α-helix	trans	-64.1	-39.5	174.9	-173.3	174.9	3.5	0	0	111.1	K543 M548 I549 L550	K543-Q546 HydrophobicContact CB-CB 3.75Å; K543-Q546 WeakPolarHBondContact O-CB 3.35Å; K543-Q546 PolarHBondContact O-N 2.87Å; Q546-M548 VanDerWaalsContact C-N 3.32Å; Q546-M548 PolarHBondContact O-N 3.3Å; Q546-I549 WeakPolarHBondContact O-CB 3.35Å; Q546-I549 PolarHBondContact O-N 3.25Å; Q546-I549 VanDerWaalsContact O-N 3.17Å; Q546-L550 HydrophobicContact CG-CD1 3.91Å; Q546-L550 HydrophobicContact CG-CG 4.43Å; Q546-L550 WeakPolarHBondContact O-CG 3.45Å; Q546-L550 PolarHBondContact O-N 2.69Å
547	D	84	Confident	78.5	Confident	37 Å²	37	63.8 Å²	63.8	20%	0.198	34%	0.343	C	S	.	.	H	α-helix	trans	-58.5	-42.9	172.5	-110.5	29.1	0	0	0	112.3	Y542 K543 P544 I545 I549 L550 Q551	Y542-D547 HydrophobicContact CE2-CB 4.14Å; Y542-D547 VanDerWaalsContact CE2-OD2 3.23Å; Y542-D547 WeakPolarHBondContact CE2-OD2 3.42Å; Y542-D547 PolarHBondContact OH-OD2 3.18Å; K543-D547 PolarHBondContact O-N 3.34Å; K543-D547 VanDerWaalsContact O-N 3.15Å; P544-D547 VanDerWaalsContact O-CB 3.26Å; P544-D547 WeakPolarHBondContact O-CB 3.46Å; P544-D547 PolarHBondContact O-N 3.31Å; I545-D547 VanDerWaalsContact C-N 3.31Å; I545-D547 PolarHBondContact O-N 2.81Å; D547-I549 VanDerWaalsContact C-N 3.3Å; D547-I549 PolarHBondContact O-N 3.43Å; D547-L550 PolarHBondContact O-N 2.97Å; D547-Q551 WeakPolarHBondContact O-CB 3.37Å; D547-Q551 WeakPolarHBondContact O-CG 3.15Å; D547-Q551 PolarHBondContact O-N 3.34Å
548	M	86.6	Confident	80.1	Confident	7 Å²	7	65.9 Å²	65.9	3%	0.034	35%	0.354	C	S	.	.	H	α-helix	trans	-65.4	-32.7	176.3	-65.4	159.9	73.1	0	0	112.5	K454 V455 L458 S459 P544 I545 Q546 Y556	K454-M548 WeakPolarHBondContact CE-O 3.41Å; K454-M548 PolarHBondContact NZ-O 2.75Å; V455-M548 HydrophobicContact CG1-CE 4.24Å; V455-M548 HydrophobicContact CG2-CB 4.46Å; V455-M548 WeakPolarHBondContact O-CE 3.46Å; L458-M548 HydrophobicContact CB-CE 3.27Å; L458-M548 HydrophobicContact CD1-CB 4.19Å; L458-M548 HydrophobicContact CD1-CE 4.46Å; L458-M548 HydrophobicContact CD1-CG 4.46Å; S459-M548 VanDerWaalsContact N-CE 3.27Å; P544-M548 VanDerWaalsContact O-CG 3.29Å; P544-M548 WeakPolarHBondContact O-CG 3.4Å; P544-M548 PolarHBondContact O-N 3.11Å; P544-M548 VanDerWaalsContact O-N 3.1Å; I545-M548 WeakPolarHBondContact O-CB 3.2Å; I545-M548 PolarHBondContact O-N 3.21Å; Q546-M548 VanDerWaalsContact C-N 3.32Å; Q546-M548 PolarHBondContact O-N 3.3Å; M548-Y556 HydrophobicContact CG-CE2 3.83Å
549	I	88	Confident	81.5	Confident	3 Å²	3	65 Å²	65	2%	0.015	34%	0.343	C	S	.	.	H	α-helix	trans	-68.3	-54.6	175.5	-66.5	164.4	0	0	0	110	L183 Q186 L187 P192 I451 K454 V455 I545 Q546 D547	L183-I549 HydrophobicContact CD1-CD1 3.42Å; L183-I549 VanDerWaalsContact CD1-CD1 3.42Å; L183-I549 HydrophobicContact CD1-CG1 3.95Å; Q186-I549 HydrophobicContact CB-CD1 4.33Å; L187-I549 HydrophobicContact CD2-CD1 3.92Å; L187-I549 HydrophobicContact CD2-CG1 4.39Å; L187-I549 HydrophobicContact CD2-CG2 3.78Å; L187-I549 HydrophobicContact CG-CD1 4.28Å; P192-I549 HydrophobicContact CG-CG2 4.47Å; I451-I549 HydrophobicContact CG2-CG1 4.19Å; I451-I549 HydrophobicContact CG2-CG2 4.16Å; K454-I549 PolarHBondContact NZ-O 2.93Å; V455-I549 HydrophobicContact CG2-CG1 3.68Å; I545-I549 WeakPolarHBondContact O-CG1 3.45Å; I545-I549 PolarHBondContact O-N 2.87Å; Q546-I549 WeakPolarHBondContact O-CB 3.35Å; Q546-I549 PolarHBondContact O-N 3.25Å; Q546-I549 VanDerWaalsContact O-N 3.17Å; D547-I549 VanDerWaalsContact C-N 3.3Å; D547-I549 PolarHBondContact O-N 3.43Å
550	L	86.7	Confident	82.8	Confident	85 Å²	85	63.7 Å²	63.7	45%	0.445	34%	0.336	S	S	.	.	H	α-helix	trans	-74.1	-35.5	-168.4	-66.6	173.2	0	0	0	113.5	Q546 D547	Q546-L550 HydrophobicContact CG-CD1 3.91Å; Q546-L550 HydrophobicContact CG-CG 4.43Å; Q546-L550 WeakPolarHBondContact O-CG 3.45Å; Q546-L550 PolarHBondContact O-N 2.69Å; D547-L550 PolarHBondContact O-N 2.97Å
551	Q	84.9	Confident	84.2	Confident	57 Å²	57	63.2 Å²	63.2	27%	0.266	33%	0.326	S	S	.	.	S	Bend	trans	-77.7	140.4	-174.3	-68.2	-174.3	12.2	0	0	112.9	K454 D547 R559	K454-Q551 PolarHBondContact NZ-O 3.18Å; D547-Q551 WeakPolarHBondContact O-CB 3.37Å; D547-Q551 WeakPolarHBondContact O-CG 3.15Å; D547-Q551 PolarHBondContact O-N 3.34Å; Q551-R559 VanDerWaalsContact CD-NH1 3.34Å
552	P	87.9	Confident	85.3	Confident	68 Å²	68	59 Å²	59	44%	0.442	31%	0.311	S	S	.	.			trans	-64.7	140.1	172.5	26.7	-33.2	0	0	0	110.9	P554 L555 Y556	P552-P554 VanDerWaalsContact C-CD 3.48Å; P552-L555 HydrophobicContact CG-CB 4.08Å; P552-L555 HydrophobicContact CG-CD1 3.85Å; P552-L555 HydrophobicContact CG-CD2 3.89Å; P552-L555 HydrophobicContact CG-CG 4.13Å; P552-L555 PolarHBondContact O-N 3.46Å; P552-Y556 PolarHBondContact O-N 3.39Å; P552-Y556 VanDerWaalsContact O-N 3.16Å
553	L	86.8	Confident	86.1	Confident	61 Å²	61	61 Å²	61	32%	0.319	32%	0.322	S	S	.	.	H	α-helix	trans	-50.7	-45.9	-176.8	-174.4	64.2	0	0	0	114.6	L458 L555 Y556 I557	L458-L553 HydrophobicContact CD1-CD1 4.42Å; L458-L553 HydrophobicContact CD2-CD1 3.81Å; L458-L553 HydrophobicContact CG-CD1 4.41Å; L553-L555 PolarHBondContact O-N 3.12Å; L553-Y556 PolarHBondContact O-N 3.2Å; L553-I557 HydrophobicContact CD1-CD1 3.86Å; L553-I557 HydrophobicContact CD1-CG1 4.11Å; L553-I557 HydrophobicContact CD2-CD1 4.33Å; L553-I557 HydrophobicContact CG-CD1 3.71Å; L553-I557 HydrophobicContact CG-CG1 4.33Å; L553-I557 WeakPolarHBondContact O-CG1 3.33Å; L553-I557 PolarHBondContact O-N 3.07Å
554	P	88.7	Confident	86.5	Confident	89 Å²	89	60.2 Å²	60.2	58%	0.578	32%	0.318	S	S	*	.	H	α-helix	trans	-65.3	-38.8	-178	23.8	-34.6	0	0	0	113.3	P552 Y556 I557 Q558	P552-P554 VanDerWaalsContact C-CD 3.48Å; P554-Y556 VanDerWaalsContact C-N 3.35Å; P554-I557 PolarHBondContact O-N 3.33Å; P554-Q558 WeakPolarHBondContact O-CB 3.38Å; P554-Q558 PolarHBondContact O-N 3.01Å
555	L	88.3	Confident	86.9	Confident	100 Å²	100	59.9 Å²	59.9	52%	0.524	32%	0.317	S	S	.	.	H	α-helix	trans	-66.7	-41.3	177.6	-82.3	64.7	0	0	0	110.6	P552 L553 Q558 R559	P552-L555 HydrophobicContact CG-CB 4.08Å; P552-L555 HydrophobicContact CG-CD1 3.85Å; P552-L555 HydrophobicContact CG-CD2 3.89Å; P552-L555 HydrophobicContact CG-CG 4.13Å; P552-L555 PolarHBondContact O-N 3.46Å; L553-L555 PolarHBondContact O-N 3.12Å; L555-Q558 PolarHBondContact O-N 3.33Å; L555-R559 WeakPolarHBondContact O-CB 3.29Å; L555-R559 PolarHBondContact O-N 2.89Å
556	Y	86.7	Confident	87.1	Confident	1 Å²	1	60.8 Å²	60.8	0%	0.004	33%	0.325	C	S	.	.	H	α-helix	trans	-62.2	-48.5	176.6	-173.5	-84.5	0	0	0	110.9	L458 M461 E462 M548 P552 L553 P554 Q558 R559 L560	L458-Y556 HydrophobicContact CB-CE1 4.43Å; L458-Y556 HydrophobicContact CD1-CD1 4.09Å; L458-Y556 HydrophobicContact CD1-CE1 4.15Å; L458-Y556 HydrophobicContact CD1-CG 4.42Å; L458-Y556 HydrophobicContact CD2-CD1 3.66Å; L458-Y556 HydrophobicContact CD2-CE1 3.66Å; L458-Y556 HydrophobicContact CG-CD1 4.46Å; L458-Y556 HydrophobicContact CG-CE1 4.3Å; M461-Y556 HydrophobicContact CE-CE1 4.3Å; E462-Y556 PolarHBondContact OE2-OH 2.92Å; M548-Y556 HydrophobicContact CG-CE2 3.83Å; P552-Y556 PolarHBondContact O-N 3.39Å; P552-Y556 VanDerWaalsContact O-N 3.16Å; L553-Y556 PolarHBondContact O-N 3.2Å; P554-Y556 VanDerWaalsContact C-N 3.35Å; Y556-Q558 PolarHBondContact O-N 3.43Å; Y556-R559 WeakPolarHBondContact O-CB 3.38Å; Y556-R559 PolarHBondContact O-N 3.35Å; Y556-L560 HydrophobicContact CD1-CD2 4.28Å; Y556-L560 HydrophobicContact CE1-CD1 4.33Å; Y556-L560 HydrophobicContact CE1-CD2 3.85Å; Y556-L560 VanDerWaalsContact O-CB 3.25Å; Y556-L560 WeakPolarHBondContact O-CB 2.96Å; Y556-L560 PolarHBondContact O-N 2.85Å
557	I	87.9	Confident	87.2	Confident	69 Å²	69	60.6 Å²	60.6	35%	0.354	32%	0.322	S	S	.	.	H	α-helix	trans	-60.3	-43.9	177.5	-68.8	171.9	0	0	0	111.4	L553 P554 R559 L560 I561	L553-I557 HydrophobicContact CD1-CD1 3.86Å; L553-I557 HydrophobicContact CD1-CG1 4.11Å; L553-I557 HydrophobicContact CD2-CD1 4.33Å; L553-I557 HydrophobicContact CG-CD1 3.71Å; L553-I557 HydrophobicContact CG-CG1 4.33Å; L553-I557 WeakPolarHBondContact O-CG1 3.33Å; L553-I557 PolarHBondContact O-N 3.07Å; P554-I557 PolarHBondContact O-N 3.33Å; I557-R559 PolarHBondContact O-N 3.5Å; I557-L560 WeakPolarHBondContact O-CB 3.28Å; I557-L560 PolarHBondContact O-N 3.21Å; I557-I561 HydrophobicContact CG2-CD1 3.74Å; I557-I561 HydrophobicContact CG2-CG1 4.35Å; I557-I561 VanDerWaalsContact O-CG1 3.31Å; I557-I561 WeakPolarHBondContact O-CG1 3.34Å; I557-I561 PolarHBondContact O-N 3.31Å
558	Q	90	Very high	87.5	Confident	141 Å²	141	58.9 Å²	58.9	66%	0.659	31%	0.314	S	S	*	.	H	α-helix	trans	-59.7	-46.9	177.1	-178.5	-176.5	-5.7	0	0	111.6	P554 L555 Y556 L560 I561 A562	P554-Q558 WeakPolarHBondContact O-CB 3.38Å; P554-Q558 PolarHBondContact O-N 3.01Å; L555-Q558 PolarHBondContact O-N 3.33Å; Y556-Q558 PolarHBondContact O-N 3.43Å; Q558-L560 VanDerWaalsContact C-N 3.26Å; Q558-L560 PolarHBondContact O-N 3.21Å; Q558-I561 PolarHBondContact O-N 2.88Å; Q558-A562 PolarHBondContact O-N 2.87Å; Q558-A562 VanDerWaalsContact O-N 3.1Å
559	R	86.8	Confident	87.8	Confident	78 Å²	78	63.3 Å²	63.3	29%	0.294	34%	0.336	S	S	.	.	H	α-helix	trans	-58.4	-42.8	176.1	-172.2	-174.6	89.4	-155.8	15.7	111.1	Q551 L555 Y556 I557 A562 I563	Q551-R559 VanDerWaalsContact CD-NH1 3.34Å; L555-R559 WeakPolarHBondContact O-CB 3.29Å; L555-R559 PolarHBondContact O-N 2.89Å; Y556-R559 WeakPolarHBondContact O-CB 3.38Å; Y556-R559 PolarHBondContact O-N 3.35Å; I557-R559 PolarHBondContact O-N 3.5Å; R559-A562 WeakPolarHBondContact O-CB 3.45Å; R559-A562 PolarHBondContact O-N 2.9Å; R559-I563 HydrophobicContact CG-CD1 4.14Å; R559-I563 WeakPolarHBondContact O-CG1 3.3Å; R559-I563 PolarHBondContact O-N 3.32Å
560	L	85.7	Confident	87.9	Confident	14 Å²	14	65.4 Å²	65.4	7%	0.073	35%	0.347	C	S	.	.	H	α-helix	trans	-66	-44.5	-177.2	-162.1	62.7	0	0	0	112.7	M461 F466 Y556 I557 Q558 A562 I563 Y564	M461-L560 HydrophobicContact CE-CD2 3.1Å; M461-L560 HydrophobicContact CG-CD2 4.36Å; M461-L560 HydrophobicContact SD-CD2 3.56Å; M461-L560 VanDerWaalsContact SD-CD2 3.56Å; F466-L560 HydrophobicContact CD2-CD1 4.32Å; F466-L560 HydrophobicContact CD2-CG 4.48Å; F466-L560 HydrophobicContact CE2-CD1 3.47Å; F466-L560 VanDerWaalsContact CE2-CD1 3.47Å; F466-L560 HydrophobicContact CE2-CD2 3.39Å; F466-L560 HydrophobicContact CE2-CG 3.32Å; F466-L560 HydrophobicContact CZ-CD1 4.12Å; F466-L560 HydrophobicContact CZ-CD2 3.3Å; F466-L560 HydrophobicContact CZ-CG 3.42Å; F466-L560 VanDerWaalsContact CZ-CG 3.42Å; Y556-L560 HydrophobicContact CD1-CD2 4.28Å; Y556-L560 HydrophobicContact CE1-CD1 4.33Å; Y556-L560 HydrophobicContact CE1-CD2 3.85Å; Y556-L560 VanDerWaalsContact O-CB 3.25Å; Y556-L560 WeakPolarHBondContact O-CB 2.96Å; Y556-L560 PolarHBondContact O-N 2.85Å; I557-L560 WeakPolarHBondContact O-CB 3.28Å; I557-L560 PolarHBondContact O-N 3.21Å; Q558-L560 VanDerWaalsContact C-N 3.26Å; Q558-L560 PolarHBondContact O-N 3.21Å; L560-A562 VanDerWaalsContact C-N 3.29Å; L560-A562 PolarHBondContact O-N 3.34Å; L560-I563 PolarHBondContact O-N 2.85Å; L560-Y564 WeakPolarHBondContact O-CB 3.16Å; L560-Y564 PolarHBondContact O-N 3.04Å
561	I	88.5	Confident	88.2	Confident	110 Å²	110	61.5 Å²	61.5	56%	0.564	33%	0.327	S	S	*	.	H	α-helix	trans	-60.2	-42.1	173.9	-68	166.6	0	0	0	110.2	I557 Q558 Y564 S565	I557-I561 HydrophobicContact CG2-CD1 3.74Å; I557-I561 HydrophobicContact CG2-CG1 4.35Å; I557-I561 VanDerWaalsContact O-CG1 3.31Å; I557-I561 WeakPolarHBondContact O-CG1 3.34Å; I557-I561 PolarHBondContact O-N 3.31Å; Q558-I561 PolarHBondContact O-N 2.88Å; I561-Y564 PolarHBondContact O-N 3.34Å; I561-S565 VanDerWaalsContact O-CB 3.31Å; I561-S565 WeakPolarHBondContact O-CB 3.42Å; I561-S565 PolarHBondContact O-N 3.45Å; I561-S565 PolarHBondContact O-OG 3.48Å
562	A	86.9	Confident	88.5	Confident	51 Å²	51	61 Å²	61	42%	0.421	33%	0.327	S	S	.	.	H	α-helix	trans	-61.3	-48.5	177.5	0	0	0	0	0	111.8	Q558 R559 L560 S565 V566	Q558-A562 PolarHBondContact O-N 2.87Å; Q558-A562 VanDerWaalsContact O-N 3.1Å; R559-A562 WeakPolarHBondContact O-CB 3.45Å; R559-A562 PolarHBondContact O-N 2.9Å; L560-A562 VanDerWaalsContact C-N 3.29Å; L560-A562 PolarHBondContact O-N 3.34Å; A562-S565 PolarHBondContact O-N 2.79Å; A562-S565 PolarHBondContact O-OG 3.4Å; A562-V566 WeakPolarHBondContact O-CG2 3.37Å; A562-V566 PolarHBondContact O-N 2.96Å; A562-V566 VanDerWaalsContact O-N 3.08Å
563	I	85.8	Confident	88.7	Confident	67 Å²	67	59.8 Å²	59.8	34%	0.344	32%	0.317	S	S	.	.	H	α-helix	trans	-60.8	-49.5	177.9	-67	168.4	0	0	0	110.7	R559 L560 S565 V566 W567	R559-I563 HydrophobicContact CG-CD1 4.14Å; R559-I563 WeakPolarHBondContact O-CG1 3.3Å; R559-I563 PolarHBondContact O-N 3.32Å; L560-I563 PolarHBondContact O-N 2.85Å; I563-S565 VanDerWaalsContact C-N 3.29Å; I563-S565 PolarHBondContact O-N 3.44Å; I563-V566 PolarHBondContact O-N 3.49Å; I563-W567 HydrophobicContact CG2-CG 4.48Å; I563-W567 HydrophobicContact CG2-CZ2 4.49Å; I563-W567 PolarHBondContact O-N 2.84Å
564	Y	87.1	Confident	88.9	Confident	62 Å²	62	58.3 Å²	58.3	24%	0.243	31%	0.309	C	S	.	.	H	α-helix	trans	-59.8	-39.6	179.5	-178.3	-102.3	0	0	0	112	F466 L469 W473 L560 I561 W567 G568	F466-Y564 HydrophobicContact CD1-CD2 4.22Å; L469-Y564 HydrophobicContact CB-CE2 4.15Å; L469-Y564 WeakPolarHBondContact CB-OH 3.27Å; W473-Y564 HydrophobicContact CE3-CE1 4.14Å; W473-Y564 HydrophobicContact CE3-CE2 4.44Å; W473-Y564 AromaticContact CE3-CZ 3.74Å; W473-Y564 VanDerWaalsContact CE3-OH 3.3Å; W473-Y564 HydrophobicContact CH2-CE1 4.35Å; W473-Y564 HydrophobicContact CZ3-CD1 4.22Å; W473-Y564 AromaticContact CZ3-CE1 3.49Å; W473-Y564 HydrophobicContact CZ3-CE1 3.49Å; W473-Y564 VanDerWaalsContact CZ3-CE1 3.49Å; W473-Y564 HydrophobicContact CZ3-CE2 4.37Å; W473-Y564 AromaticContact CZ3-CZ 3.57Å; L560-Y564 WeakPolarHBondContact O-CB 3.16Å; L560-Y564 PolarHBondContact O-N 3.04Å; I561-Y564 PolarHBondContact O-N 3.34Å; Y564-W567 PolarHBondContact O-N 2.82Å; Y564-G568 PolarHBondContact O-N 3.17Å
565	S	89.2	Confident	89	Confident	49 Å²	49	56 Å²	56	34%	0.343	29%	0.291	S	S	.	.	H	α-helix	trans	-64.1	-42.7	176.7	74.7	0	0	0	0	112.7	I561 A562 I563 W567 G568 I569	I561-S565 VanDerWaalsContact O-CB 3.31Å; I561-S565 WeakPolarHBondContact O-CB 3.42Å; I561-S565 PolarHBondContact O-N 3.45Å; I561-S565 PolarHBondContact O-OG 3.48Å; A562-S565 PolarHBondContact O-N 2.79Å; A562-S565 PolarHBondContact O-OG 3.4Å; I563-S565 VanDerWaalsContact C-N 3.29Å; I563-S565 PolarHBondContact O-N 3.44Å; S565-W567 VanDerWaalsContact C-N 3.33Å; S565-W567 PolarHBondContact O-N 3.25Å; S565-G568 PolarHBondContact O-N 2.87Å; S565-I569 WeakPolarHBondContact O-CD1 3.34Å; S565-I569 VanDerWaalsContact O-CG1 3.26Å; S565-I569 WeakPolarHBondContact O-CG1 3.37Å; S565-I569 PolarHBondContact O-N 3.36Å
566	V	87	Confident	89.2	Confident	80 Å²	80	57 Å²	57	49%	0.485	29%	0.288	S	S	.	.	H	α-helix	trans	-62.6	-43.4	177.1	171.4	0	0	0	0	110.4	A562 I563 I569 L570	A562-V566 WeakPolarHBondContact O-CG2 3.37Å; A562-V566 PolarHBondContact O-N 2.96Å; A562-V566 VanDerWaalsContact O-N 3.08Å; I563-V566 PolarHBondContact O-N 3.49Å; V566-I569 PolarHBondContact O-N 3.22Å; V566-L570 HydrophobicContact CG1-CD1 4.36Å; V566-L570 WeakPolarHBondContact O-CG 3.38Å; V566-L570 PolarHBondContact O-N 2.83Å
567	W	87.4	Confident	89.5	Confident	44 Å²	44	59.7 Å²	59.7	17%	0.167	30%	0.303	C	S	.	.	H	α-helix	trans	-68.9	-39.6	-179.5	-70	37.2	0	0	0	111.1	Y511 I512 M515 I563 Y564 S565 L570 I571	Y511-W567 HydrophobicContact CE1-CB 4.47Å; Y511-W567 AromaticContact CE1-CE3 3.91Å; Y511-W567 HydrophobicContact CE1-CE3 3.91Å; Y511-W567 PolarHBondContact OH-O 3.39Å; I512-W567 HydrophobicContact CB-CZ3 3.86Å; I512-W567 HydrophobicContact CG1-CE3 4.21Å; I512-W567 HydrophobicContact CG1-CZ3 3.67Å; I512-W567 HydrophobicContact CG2-CH2 4.05Å; I512-W567 HydrophobicContact CG2-CZ3 3.75Å; M515-W567 HydrophobicContact CB-CH2 4.48Å; M515-W567 HydrophobicContact CB-CZ3 4.36Å; I563-W567 HydrophobicContact CG2-CG 4.48Å; I563-W567 HydrophobicContact CG2-CZ2 4.49Å; I563-W567 PolarHBondContact O-N 2.84Å; Y564-W567 PolarHBondContact O-N 2.82Å; S565-W567 VanDerWaalsContact C-N 3.33Å; S565-W567 PolarHBondContact O-N 3.25Å; W567-L570 WeakPolarHBondContact O-CB 3.27Å; W567-L570 PolarHBondContact O-N 2.84Å; W567-I571 WeakPolarHBondContact O-CG1 3.46Å; W567-I571 PolarHBondContact O-N 2.99Å
568	G	91.2	Very high	89.7	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.01	29%	0.286	C	S	.	.	H	α-helix	trans	-58.2	-46.5	171.9	0	0	0	0	0	114.2	W473 Y564 S565 L570 I571 V572	W473-G568 VanDerWaalsContact CH2-CA 3.42Å; Y564-G568 PolarHBondContact O-N 3.17Å; S565-G568 PolarHBondContact O-N 2.87Å; G568-L570 VanDerWaalsContact C-N 3.3Å; G568-L570 PolarHBondContact O-N 2.61Å; G568-I571 WeakPolarHBondContact O-CB 3.37Å; G568-I571 PolarHBondContact O-N 3.15Å; G568-V572 PolarHBondContact O-N 3.08Å; G568-V572 VanDerWaalsContact O-N 3.15Å
569	I	91.8	Very high	89.7	Confident	100 Å²	100	49.8 Å²	49.8	51%	0.513	26%	0.255	S	S	.	.	H	α-helix	trans	-61.6	-41.8	175.8	-67.7	163.4	0	0	0	110.3	S565 V566 I571 V572 L573	S565-I569 WeakPolarHBondContact O-CD1 3.34Å; S565-I569 VanDerWaalsContact O-CG1 3.26Å; S565-I569 WeakPolarHBondContact O-CG1 3.37Å; S565-I569 PolarHBondContact O-N 3.36Å; V566-I569 PolarHBondContact O-N 3.22Å; I569-I571 VanDerWaalsContact C-N 3.34Å; I569-I571 PolarHBondContact O-N 3.28Å; I569-V572 PolarHBondContact O-N 2.92Å; I569-L573 HydrophobicContact CG2-CD1 3.77Å; I569-L573 HydrophobicContact CG2-CG 4.27Å; I569-L573 WeakPolarHBondContact O-CB 3.16Å; I569-L573 VanDerWaalsContact O-CG 3.31Å; I569-L573 WeakPolarHBondContact O-CG 3.25Å; I569-L573 PolarHBondContact O-N 3.31Å
570	L	90.6	Very high	89.9	Confident	47 Å²	47	48.3 Å²	48.3	25%	0.246	25%	0.251	C	S	.	.	H	α-helix	trans	-62.1	-38.4	175.5	-72.9	171.8	0	0	0	112.4	V566 W567 G568 L573 M574	V566-L570 HydrophobicContact CG1-CD1 4.36Å; V566-L570 WeakPolarHBondContact O-CG 3.38Å; V566-L570 PolarHBondContact O-N 2.83Å; W567-L570 WeakPolarHBondContact O-CB 3.27Å; W567-L570 PolarHBondContact O-N 2.84Å; G568-L570 VanDerWaalsContact C-N 3.3Å; G568-L570 PolarHBondContact O-N 2.61Å; L570-L573 PolarHBondContact O-N 3.38Å; L570-M574 WeakPolarHBondContact O-CB 3.24Å; L570-M574 VanDerWaalsContact O-CG 3.23Å; L570-M574 WeakPolarHBondContact O-CG 3.41Å; L570-M574 PolarHBondContact O-N 3.11Å
571	I	92.3	Very high	90.1	Very high	3 Å²	3	49.7 Å²	49.7	2%	0.015	26%	0.26	C	S	.	.	H	α-helix	trans	-59.6	-48.5	174.8	-69.4	165.9	0	0	0	110.7	I474 C477 Y511 W567 G568 I569 L573 M574 L575	I474-I571 HydrophobicContact CD1-CD1 4.47Å; I474-I571 HydrophobicContact CG1-CD1 4.13Å; I474-I571 HydrophobicContact CG1-CG1 4.33Å; I474-I571 HydrophobicContact CG1-CG2 3.89Å; C477-I571 HydrophobicContact CB-CG2 4.49Å; Y511-I571 HydrophobicContact CD1-CD1 4.32Å; Y511-I571 HydrophobicContact CD2-CG1 4.37Å; Y511-I571 HydrophobicContact CE1-CD1 3.85Å; Y511-I571 HydrophobicContact CE1-CG1 3.93Å; Y511-I571 HydrophobicContact CE2-CD1 4.4Å; Y511-I571 HydrophobicContact CE2-CG1 3.66Å; Y511-I571 VanDerWaalsContact CZ-CG1 3.43Å; W567-I571 WeakPolarHBondContact O-CG1 3.46Å; W567-I571 PolarHBondContact O-N 2.99Å; G568-I571 WeakPolarHBondContact O-CB 3.37Å; G568-I571 PolarHBondContact O-N 3.15Å; I569-I571 VanDerWaalsContact C-N 3.34Å; I569-I571 PolarHBondContact O-N 3.28Å; I571-L573 PolarHBondContact O-N 3.29Å; I571-M574 PolarHBondContact O-N 2.89Å; I571-L575 HydrophobicContact CG2-CD1 4.34Å; I571-L575 WeakPolarHBondContact O-CB 3.33Å; I571-L575 PolarHBondContact O-N 2.85Å
572	V	92.8	Very high	90.2	Very high	46 Å²	46	44.4 Å²	44.4	28%	0.279	23%	0.233	S	C	.	.	I	π-helix	trans	-62.3	-44.7	179.5	175.8	0	0	0	0	111	G568 I569 W576 L577	G568-V572 PolarHBondContact O-N 3.08Å; G568-V572 VanDerWaalsContact O-N 3.15Å; I569-V572 PolarHBondContact O-N 2.92Å; V572-W576 HydrophobicContact CG1-CB 4.24Å; V572-W576 HydrophobicContact CG1-CD2 4.37Å; V572-W576 HydrophobicContact CG1-CE3 3.79Å; V572-W576 WeakPolarHBondContact O-CB 3.5Å; V572-W576 PolarHBondContact O-N 3.27Å; V572-W576 VanDerWaalsContact O-N 3.16Å; V572-L577 PolarHBondContact O-N 2.95Å
573	L	91.6	Very high	90.2	Very high	43 Å²	43	48.7 Å²	48.7	23%	0.225	24%	0.238	C	C	.	.	I	π-helix	trans	-68.7	-34.8	179.4	-69	174.6	0	0	0	113	I569 L570 I571 L577 P578 I785 I789	I569-L573 HydrophobicContact CG2-CD1 3.77Å; I569-L573 HydrophobicContact CG2-CG 4.27Å; I569-L573 WeakPolarHBondContact O-CB 3.16Å; I569-L573 VanDerWaalsContact O-CG 3.31Å; I569-L573 WeakPolarHBondContact O-CG 3.25Å; I569-L573 PolarHBondContact O-N 3.31Å; L570-L573 PolarHBondContact O-N 3.38Å; I571-L573 PolarHBondContact O-N 3.29Å; L573-L577 HydrophobicContact CD2-CD2 4.36Å; L573-P578 WeakPolarHBondContact O-CD 3.45Å; L573-I785 HydrophobicContact CD1-CG2 3.95Å; L573-I789 WeakPolarHBondContact O-CG1 3.41Å
574	M	90.1	Very high	90.3	Very high	29 Å²	29	52.5 Å²	52.5	14%	0.143	25%	0.254	C	S	.	.	I	π-helix	trans	-91.8	-18.6	-176.2	-66.2	-178.9	74.2	0	0	113.7	M515 L570 I571 P578 L788 S792	M515-M574 HydrophobicContact CE-CE 3.92Å; M515-M574 HydrophobicContact CE-SD 3.45Å; M515-M574 WeakPolarHBondContact CE-SD 3.46Å; L570-M574 WeakPolarHBondContact O-CB 3.24Å; L570-M574 VanDerWaalsContact O-CG 3.23Å; L570-M574 WeakPolarHBondContact O-CG 3.41Å; L570-M574 PolarHBondContact O-N 3.11Å; I571-M574 PolarHBondContact O-N 2.89Å; M574-P578 WeakPolarHBondContact O-CG 3.41Å; M574-L788 HydrophobicContact CE-CD2 4.36Å; M574-S792 WeakPolarHBondContact O-CB 3.49Å; M574-S792 PolarHBondContact O-OG 3.34Å
575	L	91.1	Very high	90.5	Very high	40 Å²	40	56.2 Å²	56.2	21%	0.209	27%	0.272	C	S	.	.	I	π-helix	trans	-122.8	-56.4	-178.4	-66.3	176.3	0	0	0	113	I474 C477 T478 I571 T579	I474-L575 HydrophobicContact CG1-CD1 4.15Å; I474-L575 HydrophobicContact CG2-CD1 3.96Å; C477-L575 HydrophobicContact CB-CB 4.27Å; T478-L575 HydrophobicContact CG2-CD1 4.42Å; I571-L575 HydrophobicContact CG2-CD1 4.34Å; I571-L575 WeakPolarHBondContact O-CB 3.33Å; I571-L575 PolarHBondContact O-N 2.85Å; L575-T579 WeakPolarHBondContact O-CB 3.29Å; L575-T579 VanDerWaalsContact O-CG2 3.22Å; L575-T579 WeakPolarHBondContact O-CG2 3.37Å; L575-T579 PolarHBondContact O-N 2.84Å; L575-T579 VanDerWaalsContact O-N 3.11Å; L575-T579 PolarHBondContact O-OG1 3.41Å
576	W	92.8	Very high	90.3	Very high	122 Å²	122	59.2 Å²	59.2	46%	0.462	28%	0.279	S	S	.	.	I	π-helix	trans	-66	-47.7	-176.1	178	79.2	0	0	0	112.2	C477 V572 T579 E580	C477-W576 HydrophobicContact CB-CB 3.95Å; V572-W576 HydrophobicContact CG1-CB 4.24Å; V572-W576 HydrophobicContact CG1-CD2 4.37Å; V572-W576 HydrophobicContact CG1-CE3 3.79Å; V572-W576 WeakPolarHBondContact O-CB 3.5Å; V572-W576 PolarHBondContact O-N 3.27Å; V572-W576 VanDerWaalsContact O-N 3.16Å; W576-T579 PolarHBondContact O-N 3.33Å; W576-T579 PolarHBondContact O-OG1 2.84Å; W576-E580 HydrophobicContact CZ2-CG 4.16Å; W576-E580 PolarHBondContact O-N 3.45Å; W576-E580 VanDerWaalsContact O-N 3.11Å
577	L	92.3	Very high	90.1	Very high	58 Å²	58	59.7 Å²	59.7	30%	0.304	28%	0.284	S	S	.	.	H	α-helix	trans	-63.3	-47.6	-179.8	179.5	76.2	0	0	0	112.3	V572 L573 T579 E580 V581 I789	V572-L577 PolarHBondContact O-N 2.95Å; L573-L577 HydrophobicContact CD2-CD2 4.36Å; L577-T579 VanDerWaalsContact C-N 3.34Å; L577-T579 PolarHBondContact O-N 3.25Å; L577-E580 PolarHBondContact O-N 2.89Å; L577-V581 VanDerWaalsContact O-CG2 3.27Å; L577-V581 WeakPolarHBondContact O-CG2 3.21Å; L577-V581 PolarHBondContact O-N 3.49Å; L577-I789 HydrophobicContact CD2-CD1 3.62Å; L577-I789 HydrophobicContact CD2-CG1 4.15Å; L577-I789 HydrophobicContact CD2-CG2 4.32Å
578	P	92.2	Very high	89.8	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-59.2	-39.1	174.8	-32.1	40.1	0	0	0	114.4	L573 M574 V581 I582 I789 L793 L796	L573-P578 WeakPolarHBondContact O-CD 3.45Å; M574-P578 WeakPolarHBondContact O-CG 3.41Å; P578-V581 PolarHBondContact O-N 3.37Å; P578-I582 WeakPolarHBondContact O-CD1 3.49Å; P578-I582 WeakPolarHBondContact O-CG1 3.3Å; P578-I582 PolarHBondContact O-N 3.33Å; P578-I789 HydrophobicContact CG-CG2 4.4Å; P578-L793 HydrophobicContact CB-CD2 3.7Å; P578-L793 HydrophobicContact CB-CG 3.93Å; P578-L793 HydrophobicContact CG-CG 4.42Å; P578-L793 WeakPolarHBondContact O-CD2 2.88Å; P578-L796 HydrophobicContact CB-CD1 3.94Å
579	T	90.6	Very high	89.5	Confident	1 Å²	1	66.5 Å²	66.5	1%	0.006	32%	0.322	C	S	.	.	H	α-helix	trans	-67.6	-39	179.7	51.7	0	0	0	0	112	S480 L481 L575 W576 L577 I582 R583 L796	S480-T579 PolarHBondContact OG-OG1 3.46Å; L481-T579 HydrophobicContact CB-CG2 4.44Å; L481-T579 HydrophobicContact CD1-CG2 4.04Å; L575-T579 WeakPolarHBondContact O-CB 3.29Å; L575-T579 VanDerWaalsContact O-CG2 3.22Å; L575-T579 WeakPolarHBondContact O-CG2 3.37Å; L575-T579 PolarHBondContact O-N 2.84Å; L575-T579 VanDerWaalsContact O-N 3.11Å; L575-T579 PolarHBondContact O-OG1 3.41Å; W576-T579 PolarHBondContact O-N 3.33Å; W576-T579 PolarHBondContact O-OG1 2.84Å; L577-T579 VanDerWaalsContact C-N 3.34Å; L577-T579 PolarHBondContact O-N 3.25Å; T579-I582 PolarHBondContact O-N 3.38Å; T579-R583 WeakPolarHBondContact O-CB 3.43Å; T579-R583 PolarHBondContact O-N 2.82Å; T579-L796 HydrophobicContact CG2-CD1 4.35Å
580	E	90.6	Very high	89	Confident	47 Å²	47	62.8 Å²	62.8	22%	0.22	30%	0.303	C	S	.	.	H	α-helix	trans	-68.2	-39.6	173.5	-74.1	-57.8	123.4	0	0	112.8	W576 L577 I582 R583 H584	W576-E580 HydrophobicContact CZ2-CG 4.16Å; W576-E580 PolarHBondContact O-N 3.45Å; W576-E580 VanDerWaalsContact O-N 3.11Å; L577-E580 PolarHBondContact O-N 2.89Å; E580-I582 VanDerWaalsContact C-N 3.34Å; E580-I582 PolarHBondContact O-N 3.17Å; E580-R583 PolarHBondContact O-N 3.09Å; E580-R583 IonicContact OE1-NE 3.33Å; E580-R583 PolarHBondContact OE1-NE 2.73Å; E580-R583 IonicContact OE2-CZ 3.21Å; E580-R583 IonicContact OE2-NE 2.89Å; E580-R583 PolarHBondContact OE2-NE 2.82Å; E580-R583 IonicContact OE2-NH2 2.7Å; E580-R583 PolarHBondContact OE2-NH2 3.35Å; E580-H584 WeakPolarHBondContact O-CB 3.41Å; E580-H584 PolarHBondContact O-N 3.06Å
581	V	90.6	Very high	88.5	Confident	43 Å²	43	62.7 Å²	62.7	26%	0.261	31%	0.305	S	S	.	.	H	α-helix	trans	-59.1	-46.6	172.3	169.4	0	0	0	0	110.1	L577 P578 R583 H584 F585 L793	L577-V581 VanDerWaalsContact O-CG2 3.27Å; L577-V581 WeakPolarHBondContact O-CG2 3.21Å; L577-V581 PolarHBondContact O-N 3.49Å; P578-V581 PolarHBondContact O-N 3.37Å; V581-R583 PolarHBondContact O-N 3.36Å; V581-H584 PolarHBondContact O-N 3.49Å; V581-F585 HydrophobicContact CG1-CD2 3.62Å; V581-F585 HydrophobicContact CG1-CE2 3.97Å; V581-F585 VanDerWaalsContact O-CD2 3.28Å; V581-F585 WeakPolarHBondContact O-CD2 3.3Å; V581-F585 PolarHBondContact O-N 3.49Å; V581-L793 HydrophobicContact CB-CD2 4.16Å; V581-L793 HydrophobicContact CG1-CD1 4.15Å; V581-L793 HydrophobicContact CG1-CD2 3.91Å
582	I	89.3	Confident	87.9	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-62	-43.8	176.7	-68	163.1	0	0	0	111	P578 T579 E580 H584 F585 F586 F589 L590 L793 L796 I797	P578-I582 WeakPolarHBondContact O-CD1 3.49Å; P578-I582 WeakPolarHBondContact O-CG1 3.3Å; P578-I582 PolarHBondContact O-N 3.33Å; T579-I582 PolarHBondContact O-N 3.38Å; E580-I582 VanDerWaalsContact C-N 3.34Å; E580-I582 PolarHBondContact O-N 3.17Å; I582-H584 PolarHBondContact O-N 2.86Å; I582-F585 PolarHBondContact O-N 3.07Å; I582-F586 HydrophobicContact CG2-CB 4.37Å; I582-F586 CarbonylContact O-C 3.27Å; I582-F586 VanDerWaalsContact O-C 3.27Å; I582-F586 VanDerWaalsContact O-CA 3.28Å; I582-F586 WeakPolarHBondContact O-CA 3.49Å; I582-F586 WeakPolarHBondContact O-CB 3.44Å; I582-F586 PolarHBondContact O-N 3.21Å; I582-F589 HydrophobicContact CG2-CB 4.46Å; I582-F589 HydrophobicContact CG2-CD1 3.81Å; I582-L590 HydrophobicContact CB-CD1 4.15Å; I582-L590 HydrophobicContact CG2-CD1 3.71Å; I582-L590 HydrophobicContact CG2-CD2 4.39Å; I582-L590 HydrophobicContact CG2-CG 3.77Å; I582-L793 HydrophobicContact CD1-CD2 4.09Å; I582-L793 HydrophobicContact CG1-CD2 3.8Å; I582-L796 HydrophobicContact CD1-CB 3.91Å; I582-L796 HydrophobicContact CD1-CD1 4.21Å; I582-I797 HydrophobicContact CD1-CD1 4.14Å; I582-I797 HydrophobicContact CD1-CG1 3.69Å; I582-I797 HydrophobicContact CG1-CD1 3.77Å; I582-I797 HydrophobicContact CG1-CG1 3.81Å
583	R	87.3	Confident	87	Confident	140 Å²	140	68 Å²	68	53%	0.528	32%	0.32	S	S	.	.	H	α-helix	trans	-60.2	-36.9	178.1	-169.7	-179.8	69.7	82	1	111.9	T579 E580 V581 L590	T579-R583 WeakPolarHBondContact O-CB 3.43Å; T579-R583 PolarHBondContact O-N 2.82Å; E580-R583 PolarHBondContact O-N 3.09Å; E580-R583 IonicContact OE1-NE 3.33Å; E580-R583 PolarHBondContact OE1-NE 2.73Å; E580-R583 IonicContact OE2-CZ 3.21Å; E580-R583 IonicContact OE2-NE 2.89Å; E580-R583 PolarHBondContact OE2-NE 2.82Å; E580-R583 IonicContact OE2-NH2 2.7Å; E580-R583 PolarHBondContact OE2-NH2 3.35Å; V581-R583 PolarHBondContact O-N 3.36Å; R583-L590 HydrophobicContact CB-CD1 4.18Å
584	H	89.2	Confident	85.9	Confident	147 Å²	147	69.5 Å²	69.5	68%	0.681	33%	0.328	S	S	*	.	H	α-helix	trans	-76.5	-48.4	179.1	-171.8	76.7	0	0	0	112.9	E580 V581 I582	E580-H584 WeakPolarHBondContact O-CB 3.41Å; E580-H584 PolarHBondContact O-N 3.06Å; V581-H584 PolarHBondContact O-N 3.49Å; I582-H584 PolarHBondContact O-N 2.86Å
585	F	89.7	Confident	84.4	Confident	141 Å²	141	71.4 Å²	71.4	62%	0.618	35%	0.345	S	S	*	.	H	α-helix	trans	-84.7	-29.6	-175.1	-74.5	-79.4	0	0	0	113.8	V581 I582	V581-F585 HydrophobicContact CG1-CD2 3.62Å; V581-F585 HydrophobicContact CG1-CE2 3.97Å; V581-F585 VanDerWaalsContact O-CD2 3.28Å; V581-F585 WeakPolarHBondContact O-CD2 3.3Å; V581-F585 PolarHBondContact O-N 3.49Å; I582-F585 PolarHBondContact O-N 3.07Å
586	F	86.6	Confident	82.5	Confident	112 Å²	112	72.1 Å²	72.1	49%	0.491	36%	0.356	S	S	.	.			trans	-130.6	69.1	-176.5	-57.9	-75.3	0	0	0	111.5	I582 N588 F589 I797	I582-F586 HydrophobicContact CG2-CB 4.37Å; I582-F586 CarbonylContact O-C 3.27Å; I582-F586 VanDerWaalsContact O-C 3.27Å; I582-F586 VanDerWaalsContact O-CA 3.28Å; I582-F586 WeakPolarHBondContact O-CA 3.49Å; I582-F586 WeakPolarHBondContact O-CB 3.44Å; I582-F586 PolarHBondContact O-N 3.21Å; F586-N588 PolarHBondContact O-N 3.39Å; F586-N588 VanDerWaalsContact O-N 3.09Å; F586-F589 HydrophobicContact CB-CB 3.87Å; F586-F589 WeakPolarHBondContact O-CB 3.34Å; F586-F589 PolarHBondContact O-N 3.2Å; F586-I797 HydrophobicContact CD2-CD1 4.24Å; F586-I797 HydrophobicContact CE2-CD1 4Å
587	P	82	Confident	80.3	Confident	89 Å²	89	69.6 Å²	69.6	58%	0.578	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-24.8	-173.4	24.8	-35.3	0	0	0	114.1
588	N	81.5	Confident	78.4	Confident	161 Å²	161	72 Å²	72	86%	0.861	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-6.8	179.8	-66.1	-11.2	0	0	0	114	F586	F586-N588 PolarHBondContact O-N 3.39Å; F586-N588 VanDerWaalsContact O-N 3.09Å
589	F	83.5	Confident	76.4	Confident	27 Å²	27	81 Å²	81	12%	0.118	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-33.8	-174.4	-172.5	-104.1	0	0	0	113	I582 F586 F592 I797 V800	I582-F589 HydrophobicContact CG2-CB 4.46Å; I582-F589 HydrophobicContact CG2-CD1 3.81Å; F586-F589 HydrophobicContact CB-CB 3.87Å; F586-F589 WeakPolarHBondContact O-CB 3.34Å; F586-F589 PolarHBondContact O-N 3.2Å; F589-F592 AromaticContact CD1-CE1 3.8Å; F589-F592 HydrophobicContact CD1-CE1 3.8Å; F589-F592 HydrophobicContact CD1-CZ 4.27Å; F589-F592 AromaticContact CE1-CE1 3.39Å; F589-F592 HydrophobicContact CE1-CE1 3.39Å; F589-F592 AromaticContact CE1-CZ 3.6Å; F589-F592 HydrophobicContact CE1-CZ 3.6Å; F589-F592 HydrophobicContact CZ-CE1 4.06Å; F589-F592 HydrophobicContact CZ-CZ 4.35Å; F589-I797 HydrophobicContact CE1-CG1 4.42Å; F589-I797 HydrophobicContact CZ-CB 4.49Å; F589-I797 HydrophobicContact CZ-CG2 4.29Å; F589-V800 HydrophobicContact CE1-CG1 4.45Å; F589-V800 HydrophobicContact CE2-CB 4.37Å; F589-V800 HydrophobicContact CE2-CG1 4.03Å; F589-V800 HydrophobicContact CZ-CB 3.72Å; F589-V800 HydrophobicContact CZ-CG1 3.7Å
590	L	82.5	Confident	74.7	Confident	23 Å²	23	82.6 Å²	82.6	12%	0.12	42%	0.42	C	S	.	.			trans	-97	154.1	174.4	-64.9	176.4	0	0	0	110	L481 I582 R583 F592	L481-L590 HydrophobicContact CD1-CD2 3.53Å; I582-L590 HydrophobicContact CB-CD1 4.15Å; I582-L590 HydrophobicContact CG2-CD1 3.71Å; I582-L590 HydrophobicContact CG2-CD2 4.39Å; I582-L590 HydrophobicContact CG2-CG 3.77Å; R583-L590 HydrophobicContact CB-CD1 4.18Å; L590-F592 HydrophobicContact CD2-CD1 3.98Å; L590-F592 HydrophobicContact CD2-CE1 3.82Å; L590-F592 HydrophobicContact CD2-CE2 4.48Å; L590-F592 HydrophobicContact CD2-CG 4.37Å; L590-F592 HydrophobicContact CD2-CZ 4.09Å
591	P	80.2	Confident	73	Confident	45 Å²	45	82.7 Å²	82.7	29%	0.292	43%	0.425	S	S	.	.			cis	-85.2	155.5	2.1	32.5	-34.2	0	0	0	114	L481 N483 R593	L481-P591 WeakPolarHBondContact O-CA 3.42Å; N483-P591 HydrophobicContact CB-CB 3.72Å; N483-P591 HydrophobicContact CB-CG 3.93Å; P591-R593 PolarHBondContact O-N 3Å
592	F	79.7	Confident	71.1	Confident	20 Å²	20	83.3 Å²	83.3	9%	0.088	43%	0.427	C	S	.	.			trans	-72.5	114.2	168.2	-65.6	-18.8	0	0	0	109.9	L481 F482 F589 L590 I594 V800 D820	L481-F592 HydrophobicContact CD1-CD2 3.24Å; L481-F592 HydrophobicContact CD1-CE2 3.19Å; L481-F592 HydrophobicContact CD1-CG 4.03Å; L481-F592 HydrophobicContact CD1-CZ 3.94Å; L481-F592 HydrophobicContact CD2-CD2 3.83Å; L481-F592 HydrophobicContact CD2-CE2 4.13Å; L481-F592 HydrophobicContact CG-CD2 3.43Å; L481-F592 VanDerWaalsContact CG-CD2 3.43Å; L481-F592 HydrophobicContact CG-CE2 3.88Å; L481-F592 HydrophobicContact CG-CG 4.2Å; L481-F592 PolarHBondContact O-N 3.47Å; F482-F592 HydrophobicContact CD1-CB 4.3Å; F482-F592 WeakPolarHBondContact CD1-O 3.45Å; F482-F592 HydrophobicContact CE1-CB 4.17Å; F589-F592 AromaticContact CD1-CE1 3.8Å; F589-F592 HydrophobicContact CD1-CE1 3.8Å; F589-F592 HydrophobicContact CD1-CZ 4.27Å; F589-F592 AromaticContact CE1-CE1 3.39Å; F589-F592 HydrophobicContact CE1-CE1 3.39Å; F589-F592 AromaticContact CE1-CZ 3.6Å; F589-F592 HydrophobicContact CE1-CZ 3.6Å; F589-F592 HydrophobicContact CZ-CE1 4.06Å; F589-F592 HydrophobicContact CZ-CZ 4.35Å; L590-F592 HydrophobicContact CD2-CD1 3.98Å; L590-F592 HydrophobicContact CD2-CE1 3.82Å; L590-F592 HydrophobicContact CD2-CE2 4.48Å; L590-F592 HydrophobicContact CD2-CG 4.37Å; L590-F592 HydrophobicContact CD2-CZ 4.09Å; F592-I594 PolarHBondContact O-N 3.27Å; F592-I594 VanDerWaalsContact O-N 3.14Å; F592-V800 HydrophobicContact CD1-CG1 4.43Å; F592-V800 HydrophobicContact CE1-CB 4.4Å; F592-V800 HydrophobicContact CE1-CG1 3.93Å; F592-V800 HydrophobicContact CE1-CG2 4.36Å; F592-V800 HydrophobicContact CZ-CG2 4.18Å; F592-D820 WeakPolarHBondContact CA-OD2 3.13Å
593	R	73.8	Confident	69.6	Low	139 Å²	139	84.2 Å²	84.2	53%	0.525	43%	0.431	S	S	.	.			trans	-87.2	78.9	175.7	-62.9	-172.7	-173.8	-168.8	4	109.6	P591 S595 S817 D820	P591-R593 PolarHBondContact O-N 3Å; R593-S595 VanDerWaalsContact C-N 3.34Å; R593-S595 PolarHBondContact O-N 3.45Å; R593-S817 PolarHBondContact NH1-OG 2.79Å; R593-D820 PolarHBondContact N-OD2 3.1Å
594	I	69.2	Low	68.3	Low	75 Å²	75	83.5 Å²	83.5	39%	0.385	43%	0.43	S	S	.	.			trans	-86.8	84.3	162.7	-52.3	-179	0	0	0	106.1	F482 F592 A596 V821	F482-I594 HydrophobicContact CE1-CB 4.29Å; F482-I594 HydrophobicContact CE1-CD1 3.57Å; F482-I594 HydrophobicContact CE1-CG1 3.9Å; F482-I594 HydrophobicContact CZ-CD1 4.05Å; F592-I594 PolarHBondContact O-N 3.27Å; F592-I594 VanDerWaalsContact O-N 3.14Å; I594-A596 PolarHBondContact O-N 3.31Å; I594-V821 HydrophobicContact CB-CG2 4.45Å; I594-V821 HydrophobicContact CG1-CG2 4.3Å; I594-V821 HydrophobicContact CG2-CG2 3.89Å
595	S	57.4	Low	67	Low	70 Å²	70	77.1 Å²	77.1	49%	0.49	40%	0.401	S	S	.	.			trans	-68.1	90.1	169.5	-65.6	0	0	0	0	108.2	R593 A597	R593-S595 VanDerWaalsContact C-N 3.34Å; R593-S595 PolarHBondContact O-N 3.45Å; S595-A597 PolarHBondContact O-N 2.82Å
596	A	51	Low	65.7	Low	54 Å²	54	71.1 Å²	71.1	45%	0.446	38%	0.376	S	S	.	.			trans	-69.4	-1.8	163.8	0	0	0	0	0	111.6	I594 Y598	I594-A596 PolarHBondContact O-N 3.31Å; A596-Y598 VanDerWaalsContact C-N 3.28Å; A596-Y598 WeakPolarHBondContact O-CD2 3.27Å; A596-Y598 WeakPolarHBondContact O-CE2 3.28Å; A596-Y598 PolarHBondContact O-N 2.95Å
597	A	47	Very low	64.7	Low	70 Å²	70	69.3 Å²	69.3	58%	0.579	37%	0.369	S	S	*	.	S	Bend	trans	-71.4	88.2	167.4	0	0	0	0	0	108.6	S595 E599	S595-A597 PolarHBondContact O-N 2.82Å; A597-E599 VanDerWaalsContact C-N 3.3Å; A597-E599 PolarHBondContact O-N 3.32Å
598	Y	51.9	Low	63.8	Low	108 Å²	108	67.8 Å²	67.8	42%	0.424	36%	0.355	S	S	.	.			trans	-64.2	76.4	-174.4	-55.3	-77.3	0	0	0	113	A596 D603 Y604	A596-Y598 VanDerWaalsContact C-N 3.28Å; A596-Y598 WeakPolarHBondContact O-CD2 3.27Å; A596-Y598 WeakPolarHBondContact O-CE2 3.28Å; A596-Y598 PolarHBondContact O-N 2.95Å; Y598-D603 HydrophobicContact CD1-CB 4.46Å; Y598-Y604 HydrophobicContact CD1-CD1 4.34Å; Y598-Y604 HydrophobicContact CD1-CD2 4.16Å; Y598-Y604 AromaticContact CD1-CE1 3.87Å; Y598-Y604 HydrophobicContact CD1-CE1 3.87Å; Y598-Y604 AromaticContact CD1-CE2 3.66Å; Y598-Y604 HydrophobicContact CD1-CE2 3.66Å; Y598-Y604 HydrophobicContact CD1-CG 4.48Å; Y598-Y604 AromaticContact CD1-CZ 3.49Å; Y598-Y604 VanDerWaalsContact CD1-CZ 3.49Å; Y598-Y604 HydrophobicContact CE1-CD1 4.22Å; Y598-Y604 AromaticContact CE1-CE1 3.83Å; Y598-Y604 HydrophobicContact CE1-CE1 3.83Å; Y598-Y604 HydrophobicContact CE1-CE2 4.43Å; Y598-Y604 AromaticContact CE1-CZ 3.94Å; Y598-Y604 HydrophobicContact CG-CE1 4.34Å; Y598-Y604 AromaticContact CG-CE2 3.87Å; Y598-Y604 HydrophobicContact CG-CE2 3.87Å; Y598-Y604 AromaticContact CG-CZ 3.61Å
599	E	51.5	Low	63.1	Low	189 Å²	189	60.9 Å²	60.9	88%	0.883	32%	0.318	S	S	*	.			trans	-82.5	-25.3	170.5	-69.3	-171.2	177.2	0	0	111.8	A597	A597-E599 VanDerWaalsContact C-N 3.3Å; A597-E599 PolarHBondContact O-N 3.32Å
600	S	54.7	Low	62.2	Low	34 Å²	34	61.7 Å²	61.7	24%	0.238	32%	0.323	C	S	.	.	S	Bend	trans	-121.1	136.6	-176.2	88.4	0	0	0	0	113.1	L602 D603	S600-L602 PolarHBondContact O-N 2.9Å; S600-L602 VanDerWaalsContact O-N 3.16Å; S600-D603 PolarHBondContact O-N 3.01Å; S600-D603 PolarHBondContact OG-OD2 3.12Å
601	P	54.2	Low	61.3	Low	49 Å²	49	65.8 Å²	65.8	32%	0.318	34%	0.344	S	S	.	.	H	α-helix	trans	-62.3	-17.7	173	-19	30.2	0	0	0	113.9	D603 S605	P601-D603 PolarHBondContact O-N 3.5Å; P601-S605 PolarHBondContact O-N 3.35Å; P601-S605 PolarHBondContact O-OG 2.99Å
602	L	51.9	Low	60.7	Low	57 Å²	57	66 Å²	66	30%	0.298	34%	0.342	S	S	.	.	H	α-helix	trans	-63.3	-29.5	175.5	-171.2	68.1	0	0	0	111.9	S600 S605 L606 W969	S600-L602 PolarHBondContact O-N 2.9Å; S600-L602 VanDerWaalsContact O-N 3.16Å; L602-S605 VanDerWaalsContact O-CB 3.3Å; L602-S605 WeakPolarHBondContact O-CB 3.46Å; L602-S605 PolarHBondContact O-N 3.42Å; L602-L606 HydrophobicContact CG-CD1 4.19Å; L602-L606 WeakPolarHBondContact O-CD1 3.18Å; L602-L606 VanDerWaalsContact O-CG 3.31Å; L602-L606 WeakPolarHBondContact O-CG 3.41Å; L602-L606 PolarHBondContact O-N 3.37Å; L602-L606 VanDerWaalsContact O-N 3.14Å; L602-W969 HydrophobicContact CD1-CB 4.37Å
603	D	56.5	Low	60	Low	18 Å²	18	67.8 Å²	67.8	10%	0.096	35%	0.354	C	S	.	.	H	α-helix	trans	-68.1	-42.9	-178	-61.9	-51.2	0	0	0	111.8	Y598 S600 P601 S605 L606 E607 H819	Y598-D603 HydrophobicContact CD1-CB 4.46Å; S600-D603 PolarHBondContact O-N 3.01Å; S600-D603 PolarHBondContact OG-OD2 3.12Å; P601-D603 PolarHBondContact O-N 3.5Å; D603-S605 VanDerWaalsContact C-N 3.27Å; D603-S605 PolarHBondContact O-N 3.28Å; D603-L606 PolarHBondContact O-N 2.88Å; D603-E607 PolarHBondContact O-N 3.45Å; D603-H819 IonicContact OD1-CE1 3.3Å; D603-H819 IonicContact OD1-ND1 2.79Å; D603-H819 PolarHBondContact OD1-ND1 3.38Å; D603-H819 VanDerWaalsContact OD1-ND1 3.14Å
604	Y	59.7	Low	59.6	Low	126 Å²	126	61.2 Å²	61.2	49%	0.494	33%	0.329	S	S	.	.	H	α-helix	trans	-59.9	-39.4	172.1	-68.9	-79	0	0	0	112.3	Y598 L606 M608	Y598-Y604 HydrophobicContact CD1-CD1 4.34Å; Y598-Y604 HydrophobicContact CD1-CD2 4.16Å; Y598-Y604 AromaticContact CD1-CE1 3.87Å; Y598-Y604 HydrophobicContact CD1-CE1 3.87Å; Y598-Y604 AromaticContact CD1-CE2 3.66Å; Y598-Y604 HydrophobicContact CD1-CE2 3.66Å; Y598-Y604 HydrophobicContact CD1-CG 4.48Å; Y598-Y604 AromaticContact CD1-CZ 3.49Å; Y598-Y604 VanDerWaalsContact CD1-CZ 3.49Å; Y598-Y604 HydrophobicContact CE1-CD1 4.22Å; Y598-Y604 AromaticContact CE1-CE1 3.83Å; Y598-Y604 HydrophobicContact CE1-CE1 3.83Å; Y598-Y604 HydrophobicContact CE1-CE2 4.43Å; Y598-Y604 AromaticContact CE1-CZ 3.94Å; Y598-Y604 HydrophobicContact CG-CE1 4.34Å; Y598-Y604 AromaticContact CG-CE2 3.87Å; Y598-Y604 HydrophobicContact CG-CE2 3.87Å; Y598-Y604 AromaticContact CG-CZ 3.61Å; Y604-L606 VanDerWaalsContact C-N 3.31Å; Y604-L606 PolarHBondContact O-N 3.04Å; Y604-M608 WeakPolarHBondContact O-CG 3.26Å; Y604-M608 PolarHBondContact O-N 2.98Å
605	S	63.7	Low	59.4	Low	12 Å²	12	60.2 Å²	60.2	8%	0.084	32%	0.324	C	S	.	.	H	α-helix	trans	-62.2	-39.5	-179.2	-70.3	0	0	0	0	111.4	P601 L602 D603 M608 I609 I973	P601-S605 PolarHBondContact O-N 3.35Å; P601-S605 PolarHBondContact O-OG 2.99Å; L602-S605 VanDerWaalsContact O-CB 3.3Å; L602-S605 WeakPolarHBondContact O-CB 3.46Å; L602-S605 PolarHBondContact O-N 3.42Å; D603-S605 VanDerWaalsContact C-N 3.27Å; D603-S605 PolarHBondContact O-N 3.28Å; S605-M608 PolarHBondContact O-N 3.14Å; S605-I609 VanDerWaalsContact O-CG1 3.25Å; S605-I609 WeakPolarHBondContact O-CG1 3.33Å; S605-I609 PolarHBondContact O-N 3.49Å; S605-I973 WeakPolarHBondContact O-CD1 3.33Å
606	L	61.5	Low	59.7	Low	15 Å²	15	59.8 Å²	59.8	8%	0.079	32%	0.32	C	S	.	.	H	α-helix	trans	-73.6	-41	-175.6	-68.4	161.2	0	0	0	113.5	L602 D603 Y604 M608 I609 L610 V821 I822	L602-L606 HydrophobicContact CG-CD1 4.19Å; L602-L606 WeakPolarHBondContact O-CD1 3.18Å; L602-L606 VanDerWaalsContact O-CG 3.31Å; L602-L606 WeakPolarHBondContact O-CG 3.41Å; L602-L606 PolarHBondContact O-N 3.37Å; L602-L606 VanDerWaalsContact O-N 3.14Å; D603-L606 PolarHBondContact O-N 2.88Å; Y604-L606 VanDerWaalsContact C-N 3.31Å; Y604-L606 PolarHBondContact O-N 3.04Å; L606-M608 VanDerWaalsContact C-N 3.28Å; L606-M608 PolarHBondContact O-N 3.43Å; L606-I609 HydrophobicContact CD2-CD1 4.33Å; L606-I609 PolarHBondContact O-N 2.95Å; L606-L610 PolarHBondContact O-N 2.74Å; L606-V821 HydrophobicContact CB-CG1 3.84Å; L606-I822 HydrophobicContact CD1-CD1 3.89Å; L606-I822 HydrophobicContact CD1-CG1 3.27Å; L606-I822 HydrophobicContact CD2-CG1 3.89Å; L606-I822 HydrophobicContact CG-CG1 4.21Å
607	E	65.2	Low	60.3	Low	75 Å²	75	60.2 Å²	60.2	35%	0.35	31%	0.312	S	S	.	.	H	α-helix	trans	-62.3	-39.9	172.5	-70.2	-175.9	171.8	0	0	110.9	D603 L610 L611	D603-E607 PolarHBondContact O-N 3.45Å; E607-L610 WeakPolarHBondContact O-CB 3.38Å; E607-L610 PolarHBondContact O-N 3.03Å; E607-L611 WeakPolarHBondContact O-CB 3.27Å; E607-L611 PolarHBondContact O-N 3.3Å
608	M	64.2	Low	61	Low	57 Å²	57	59.2 Å²	59.2	28%	0.281	30%	0.296	S	S	.	.	H	α-helix	trans	-66	-38.4	174.2	-72.9	-171.8	73.2	0	0	112.8	Y604 S605 L606 L610 L611 Q612 I973 M977	Y604-M608 WeakPolarHBondContact O-CG 3.26Å; Y604-M608 PolarHBondContact O-N 2.98Å; S605-M608 PolarHBondContact O-N 3.14Å; L606-M608 VanDerWaalsContact C-N 3.28Å; L606-M608 PolarHBondContact O-N 3.43Å; M608-L610 VanDerWaalsContact C-N 3.32Å; M608-L611 PolarHBondContact O-N 3.49Å; M608-Q612 WeakPolarHBondContact O-CB 3.45Å; M608-Q612 VanDerWaalsContact O-CG 3.3Å; M608-Q612 WeakPolarHBondContact O-CG 3.44Å; M608-Q612 PolarHBondContact O-N 3.39Å; M608-I973 HydrophobicContact CB-CG2 3.79Å; M608-I973 HydrophobicContact CE-CG2 4.23Å; M608-I973 HydrophobicContact SD-CG2 4.36Å; M608-M977 HydrophobicContact CE-CB 4.27Å; M608-M977 HydrophobicContact CE-CG 4.17Å; M608-M977 HydrophobicContact CE-SD 3.51Å; M608-M977 VanDerWaalsContact CE-SD 3.51Å
609	I	65.8	Low	61.5	Low	16 Å²	16	58.6 Å²	58.6	8%	0.082	30%	0.3	C	S	.	.	H	α-helix	trans	-60.3	-45.9	172	-70.9	163.9	0	0	0	110.1	S605 L606 L611 V613 V614 V825 W969 W972 I973	S605-I609 VanDerWaalsContact O-CG1 3.25Å; S605-I609 WeakPolarHBondContact O-CG1 3.33Å; S605-I609 PolarHBondContact O-N 3.49Å; L606-I609 HydrophobicContact CD2-CD1 4.33Å; L606-I609 PolarHBondContact O-N 2.95Å; I609-L611 PolarHBondContact O-N 3.16Å; I609-V613 HydrophobicContact CG2-CB 4.38Å; I609-V613 WeakPolarHBondContact O-CA 3.43Å; I609-V613 WeakPolarHBondContact O-CB 3.16Å; I609-V613 PolarHBondContact O-N 3.27Å; I609-V614 HydrophobicContact CG2-CG2 4.25Å; I609-V614 PolarHBondContact O-N 2.88Å; I609-V825 HydrophobicContact CG2-CG1 3.83Å; I609-W969 HydrophobicContact CD1-CE3 4.4Å; I609-W972 HydrophobicContact CD1-CZ3 4.24Å; I609-W972 HydrophobicContact CG1-CZ3 4.01Å; I609-I973 HydrophobicContact CD1-CD1 3.47Å; I609-I973 VanDerWaalsContact CD1-CD1 3.47Å; I609-I973 HydrophobicContact CD1-CG1 4.03Å; I609-I973 HydrophobicContact CG1-CD1 3.49Å; I609-I973 VanDerWaalsContact CG1-CD1 3.49Å; I609-I973 HydrophobicContact CG1-CG1 3.63Å
610	L	65.3	Low	62.3	Low	43 Å²	43	52.6 Å²	52.6	23%	0.225	27%	0.274	C	S	.	.	I	π-helix	trans	-58.3	-49.5	178.4	-174	66.6	0	0	0	110.8	L606 E607 M608 V614 L615 L824 V825 F828	L606-L610 PolarHBondContact O-N 2.74Å; E607-L610 WeakPolarHBondContact O-CB 3.38Å; E607-L610 PolarHBondContact O-N 3.03Å; M608-L610 VanDerWaalsContact C-N 3.32Å; L610-V614 HydrophobicContact CD1-CB 4.12Å; L610-V614 HydrophobicContact CD1-CG1 4.11Å; L610-V614 WeakPolarHBondContact O-CB 3.41Å; L610-V614 PolarHBondContact O-N 3.14Å; L610-L615 WeakPolarHBondContact O-CB 3.29Å; L610-L615 PolarHBondContact O-N 3.42Å; L610-L824 HydrophobicContact CD2-CD2 4.07Å; L610-V825 HydrophobicContact CB-CG2 3.98Å; L610-V825 HydrophobicContact CD1-CG2 4.16Å; L610-F828 HydrophobicContact CD1-CD2 3.97Å
611	L	63.6	Low	62.9	Low	109 Å²	109	56.4 Å²	56.4	57%	0.571	29%	0.291	S	S	*	.	I	π-helix	trans	-75.7	-33.5	-176.1	-78.2	157.4	0	0	0	114.1	E607 M608 I609 L615 P616	E607-L611 WeakPolarHBondContact O-CB 3.27Å; E607-L611 PolarHBondContact O-N 3.3Å; M608-L611 PolarHBondContact O-N 3.49Å; I609-L611 PolarHBondContact O-N 3.16Å; L611-L615 HydrophobicContact CD2-CD2 4.12Å; L611-P616 WeakPolarHBondContact O-CD 3.35Å
612	Q	68.1	Low	63.4	Low	51 Å²	51	60.3 Å²	60.3	24%	0.238	31%	0.305	C	S	.	.	I	π-helix	trans	-101.1	-28.5	-171.6	-61.9	-174.6	-12	0	0	114	M608 P616	M608-Q612 WeakPolarHBondContact O-CB 3.45Å; M608-Q612 VanDerWaalsContact O-CG 3.3Å; M608-Q612 WeakPolarHBondContact O-CG 3.44Å; M608-Q612 PolarHBondContact O-N 3.39Å; Q612-P616 WeakPolarHBondContact O-CG 3.49Å
613	V	64.6	Low	64.3	Low	56 Å²	56	59.2 Å²	59.2	34%	0.339	31%	0.305	S	S	.	.	I	π-helix	trans	-109.8	-52	-177.4	-177.4	0	0	0	0	110.2	I609 F617 W972 I976	I609-V613 HydrophobicContact CG2-CB 4.38Å; I609-V613 WeakPolarHBondContact O-CA 3.43Å; I609-V613 WeakPolarHBondContact O-CB 3.16Å; I609-V613 PolarHBondContact O-N 3.27Å; V613-F617 WeakPolarHBondContact O-CB 3.46Å; V613-F617 PolarHBondContact O-N 2.91Å; V613-W972 HydrophobicContact CG2-CH2 3.99Å; V613-I976 HydrophobicContact CG2-CD1 4.3Å
614	V	64.9	Low	65.2	Low	1 Å²	1	63.4 Å²	63.4	1%	0.006	32%	0.322	C	S	.	.	I	π-helix	trans	-74.7	-46.5	-174.5	-176.5	0	0	0	0	111.4	I609 L610 F617 L618 V825 F828 T829	I609-V614 HydrophobicContact CG2-CG2 4.25Å; I609-V614 PolarHBondContact O-N 2.88Å; L610-V614 HydrophobicContact CD1-CB 4.12Å; L610-V614 HydrophobicContact CD1-CG1 4.11Å; L610-V614 WeakPolarHBondContact O-CB 3.41Å; L610-V614 PolarHBondContact O-N 3.14Å; V614-F617 CarbonylContact O-C 3.58Å; V614-F617 WeakPolarHBondContact O-CB 3.3Å; V614-F617 PolarHBondContact O-N 2.71Å; V614-L618 HydrophobicContact CG1-CD1 3.89Å; V614-L618 HydrophobicContact CG1-CG 4.22Å; V614-L618 VanDerWaalsContact O-CG 3.27Å; V614-L618 WeakPolarHBondContact O-CG 3.49Å; V614-L618 PolarHBondContact O-N 3.1Å; V614-V825 HydrophobicContact CG2-CG1 4.2Å; V614-F828 HydrophobicContact CG1-CB 3.55Å; V614-F828 HydrophobicContact CG1-CG 4.44Å; V614-T829 HydrophobicContact CG2-CG2 3.64Å
615	L	64.8	Low	66	Low	54 Å²	54	60.2 Å²	60.2	28%	0.283	32%	0.316	S	S	.	.	H	α-helix	trans	-64.4	-47.1	-176.1	-177.6	67.9	0	0	0	112.5	L610 L611 F617 L618 L619	L610-L615 WeakPolarHBondContact O-CB 3.29Å; L610-L615 PolarHBondContact O-N 3.42Å; L611-L615 HydrophobicContact CD2-CD2 4.12Å; L615-F617 VanDerWaalsContact C-N 3.28Å; L615-F617 PolarHBondContact O-N 2.99Å; L615-L618 CarbonylContact O-C 3.47Å; L615-L618 PolarHBondContact O-N 2.9Å; L615-L618 VanDerWaalsContact O-N 3.14Å; L615-L619 HydrophobicContact CD1-CD1 3.76Å; L615-L619 HydrophobicContact CD1-CG 4Å; L615-L619 HydrophobicContact CD2-CD1 4.32Å; L615-L619 HydrophobicContact CG-CD1 3.71Å; L615-L619 HydrophobicContact CG-CG 4.27Å; L615-L619 WeakPolarHBondContact O-CB 3.28Å; L615-L619 VanDerWaalsContact O-CG 3.29Å; L615-L619 WeakPolarHBondContact O-CG 3.34Å; L615-L619 PolarHBondContact O-N 3.28Å
616	P	64.5	Low	66.7	Low	62 Å²	62	61.7 Å²	61.7	40%	0.403	33%	0.326	S	S	.	.	H	α-helix	trans	-65.2	-33.7	174.1	-23.6	37.6	0	0	0	112.5	L611 Q612 L618 L619 D620	L611-P616 WeakPolarHBondContact O-CD 3.35Å; Q612-P616 WeakPolarHBondContact O-CG 3.49Å; P616-L618 VanDerWaalsContact C-N 3.27Å; P616-L618 PolarHBondContact O-N 2.92Å; P616-L619 PolarHBondContact O-N 3.16Å; P616-D620 PolarHBondContact O-N 2.82Å; P616-D620 VanDerWaalsContact O-N 3.16Å
617	F	62.7	Low	67.6	Low	62 Å²	62	65 Å²	65	27%	0.272	34%	0.343	S	S	.	.	H	α-helix	trans	-62.9	-34.4	174	177.5	-99.4	0	0	0	112.4	V613 V614 L615 I833 R836	V613-F617 WeakPolarHBondContact O-CB 3.46Å; V613-F617 PolarHBondContact O-N 2.91Å; V614-F617 CarbonylContact O-C 3.58Å; V614-F617 WeakPolarHBondContact O-CB 3.3Å; V614-F617 PolarHBondContact O-N 2.71Å; L615-F617 VanDerWaalsContact C-N 3.28Å; L615-F617 PolarHBondContact O-N 2.99Å; F617-I833 HydrophobicContact CZ-CG1 4.34Å; F617-R836 VanDerWaalsContact CD2-CZ 3.46Å; F617-R836 HydrophobicContact CZ-CG 4.44Å; F617-R836 PolarHBondContact O-NH2 3.49Å
618	L	61.1	Low	68.6	Low	50 Å²	50	67.4 Å²	67.4	26%	0.262	35%	0.349	S	S	.	.	H	α-helix	trans	-79.7	-28.6	173.6	-67.5	175	0	0	0	113.5	V614 L615 P616 A623 F828	V614-L618 HydrophobicContact CG1-CD1 3.89Å; V614-L618 HydrophobicContact CG1-CG 4.22Å; V614-L618 VanDerWaalsContact O-CG 3.27Å; V614-L618 WeakPolarHBondContact O-CG 3.49Å; V614-L618 PolarHBondContact O-N 3.1Å; L615-L618 CarbonylContact O-C 3.47Å; L615-L618 PolarHBondContact O-N 2.9Å; L615-L618 VanDerWaalsContact O-N 3.14Å; P616-L618 VanDerWaalsContact C-N 3.27Å; P616-L618 PolarHBondContact O-N 2.92Å; L618-A623 WeakPolarHBondContact O-CB 3.18Å; L618-F828 HydrophobicContact CD1-CB 4.43Å; L618-F828 HydrophobicContact CD1-CD1 3.96Å; L618-F828 HydrophobicContact CD1-CG 4.35Å
619	L	62.2	Low	69.6	Low	94 Å²	94	71 Å²	71	49%	0.492	37%	0.366	S	S	.	.	S	Bend	trans	-95.3	6.6	-176.2	-67.5	178.6	0	0	0	114.6	L615 P616	L615-L619 HydrophobicContact CD1-CD1 3.76Å; L615-L619 HydrophobicContact CD1-CG 4Å; L615-L619 HydrophobicContact CD2-CD1 4.32Å; L615-L619 HydrophobicContact CG-CD1 3.71Å; L615-L619 HydrophobicContact CG-CG 4.27Å; L615-L619 WeakPolarHBondContact O-CB 3.28Å; L615-L619 VanDerWaalsContact O-CG 3.29Å; L615-L619 WeakPolarHBondContact O-CG 3.34Å; L615-L619 PolarHBondContact O-N 3.28Å; P616-L619 PolarHBondContact O-N 3.16Å
620	D	68.1	Low	70.6	Confident	63 Å²	63	74.6 Å²	74.6	34%	0.337	38%	0.384	S	S	.	.	S	Bend	trans	-55.5	154.8	177.8	-160.2	-10.6	0	0	0	112	P616 Q622 A623 K624 R836	P616-D620 PolarHBondContact O-N 2.82Å; P616-D620 VanDerWaalsContact O-N 3.16Å; D620-Q622 PolarHBondContact O-N 3.27Å; D620-Q622 VanDerWaalsContact O-N 3.14Å; D620-A623 WeakPolarHBondContact O-CA 3.49Å; D620-A623 WeakPolarHBondContact O-CB 3.36Å; D620-A623 PolarHBondContact O-N 3.04Å; D620-K624 PolarHBondContact O-N 3.48Å; D620-K624 VanDerWaalsContact O-N 3.14Å; D620-R836 IonicContact OD2-CZ 2.87Å; D620-R836 IonicContact OD2-NH1 3.85Å; D620-R836 IonicContact OD2-NH2 3.68Å; D620-R836 PolarHBondContact OD2-NH2 2.87Å
621	N	67.3	Low	71.8	Confident	114 Å²	114	74.1 Å²	74.1	61%	0.61	38%	0.383	S	S	*	.	H	α-helix	trans	-57.7	-33.9	-178.1	-75.7	-15	0	0	0	112	A623 K624 T625	N621-A623 VanDerWaalsContact C-N 3.33Å; N621-A623 PolarHBondContact O-N 3.13Å; N621-K624 PolarHBondContact O-N 3.16Å; N621-T625 PolarHBondContact O-N 3.07Å; N621-T625 PolarHBondContact O-OG1 2.85Å
622	Q	66.5	Low	73	Confident	131 Å²	131	74.2 Å²	74.2	61%	0.612	38%	0.375	S	S	*	.	H	α-helix	trans	-66.3	-33	174.9	-62.6	-60.9	-33	0	0	113.1	D620 T625 S626	D620-Q622 PolarHBondContact O-N 3.27Å; D620-Q622 VanDerWaalsContact O-N 3.14Å; Q622-T625 WeakPolarHBondContact CA-OG1 3.44Å; Q622-T625 PolarHBondContact O-OG1 3.15Å; Q622-S626 VanDerWaalsContact O-CB 3.28Å; Q622-S626 WeakPolarHBondContact O-CB 3.35Å; Q622-S626 PolarHBondContact O-N 3.22Å; Q622-S626 PolarHBondContact O-OG 3.32Å
623	A	69.2	Low	74.1	Confident	34 Å²	34	80.3 Å²	80.3	28%	0.281	40%	0.396	S	S	.	.	H	α-helix	trans	-71.7	-38.1	175.4	0	0	0	0	0	110.6	L618 D620 N621 S626 L627	L618-A623 WeakPolarHBondContact O-CB 3.18Å; D620-A623 WeakPolarHBondContact O-CA 3.49Å; D620-A623 WeakPolarHBondContact O-CB 3.36Å; D620-A623 PolarHBondContact O-N 3.04Å; N621-A623 VanDerWaalsContact C-N 3.33Å; N621-A623 PolarHBondContact O-N 3.13Å; A623-S626 PolarHBondContact O-N 2.91Å; A623-L627 WeakPolarHBondContact O-CB 3.35Å; A623-L627 PolarHBondContact O-N 3.01Å
624	K	76	Confident	75.4	Confident	106 Å²	106	80.7 Å²	80.7	46%	0.461	39%	0.392	S	S	.	.	H	α-helix	trans	-62.1	-43.9	173.6	-65.4	-177.9	-178.1	177.3	0	112.3	D620 N621 L627 R628	D620-K624 PolarHBondContact O-N 3.48Å; D620-K624 VanDerWaalsContact O-N 3.14Å; N621-K624 PolarHBondContact O-N 3.16Å; K624-L627 PolarHBondContact O-N 3.47Å; K624-R628 WeakPolarHBondContact O-CB 3.18Å; K624-R628 PolarHBondContact O-N 3.14Å
625	T	77.5	Confident	76.7	Confident	59 Å²	59	80.8 Å²	80.8	36%	0.362	39%	0.392	S	S	.	.	H	α-helix	trans	-66.7	-43.3	176.8	53.9	0	0	0	0	111.7	N621 Q622 L627 R628 Q629	N621-T625 PolarHBondContact O-N 3.07Å; N621-T625 PolarHBondContact O-OG1 2.85Å; Q622-T625 WeakPolarHBondContact CA-OG1 3.44Å; Q622-T625 PolarHBondContact O-OG1 3.15Å; T625-L627 PolarHBondContact O-N 3.31Å; T625-R628 WeakPolarHBondContact O-CB 3.35Å; T625-R628 PolarHBondContact O-N 3.43Å; T625-Q629 WeakPolarHBondContact O-CG 3.14Å; T625-Q629 PolarHBondContact O-N 3.3Å
626	S	77.5	Confident	77.9	Confident	43 Å²	43	80.7 Å²	80.7	30%	0.301	39%	0.392	S	S	.	.	H	α-helix	trans	-62.2	-43.2	176	-58.6	0	0	0	0	111.5	Q622 A623 Q629 I630	Q622-S626 VanDerWaalsContact O-CB 3.28Å; Q622-S626 WeakPolarHBondContact O-CB 3.35Å; Q622-S626 PolarHBondContact O-N 3.22Å; Q622-S626 PolarHBondContact O-OG 3.32Å; A623-S626 PolarHBondContact O-N 2.91Å; S626-Q629 WeakPolarHBondContact O-CB 3.39Å; S626-Q629 PolarHBondContact O-N 3.41Å; S626-I630 VanDerWaalsContact O-CG1 3.3Å; S626-I630 WeakPolarHBondContact O-CG1 3.08Å; S626-I630 PolarHBondContact O-N 3.12Å
627	L	81.2	Confident	79.2	Confident	84 Å²	84	80 Å²	80	44%	0.44	39%	0.388	S	S	.	.	H	α-helix	trans	-64	-41.4	176.5	-176.3	62.8	0	0	0	111.3	L521 A623 K624 T625 Q629 I630 V631	L521-L627 HydrophobicContact CD2-CD1 4.46Å; L521-L627 HydrophobicContact CD2-CD2 3.47Å; L521-L627 VanDerWaalsContact CD2-CD2 3.47Å; L521-L627 HydrophobicContact CD2-CG 3.66Å; A623-L627 WeakPolarHBondContact O-CB 3.35Å; A623-L627 PolarHBondContact O-N 3.01Å; K624-L627 PolarHBondContact O-N 3.47Å; T625-L627 PolarHBondContact O-N 3.31Å; L627-Q629 VanDerWaalsContact C-N 3.32Å; L627-Q629 PolarHBondContact O-N 3.37Å; L627-I630 PolarHBondContact O-N 3.09Å; L627-V631 WeakPolarHBondContact O-CG2 3.4Å; L627-V631 PolarHBondContact O-N 3.23Å
628	R	86.3	Confident	80.5	Confident	127 Å²	127	77.4 Å²	77.4	48%	0.479	38%	0.377	S	S	.	.	H	α-helix	trans	-58.9	-43.3	172.7	-169.4	-172.6	-59.1	-166.4	0.9	111.4	L521 V525 K624 T625 V631 R632	L521-R628 HydrophobicContact CD1-CB 4.4Å; V525-R628 HydrophobicContact CG2-CG 3.61Å; K624-R628 WeakPolarHBondContact O-CB 3.18Å; K624-R628 PolarHBondContact O-N 3.14Å; T625-R628 WeakPolarHBondContact O-CB 3.35Å; T625-R628 PolarHBondContact O-N 3.43Å; R628-V631 PolarHBondContact O-N 3.44Å; R628-R632 WeakPolarHBondContact O-CB 3.47Å; R628-R632 PolarHBondContact O-N 2.97Å
629	Q	84.9	Confident	81.8	Confident	133 Å²	133	75.1 Å²	75.1	62%	0.621	37%	0.365	S	S	*	.	H	α-helix	trans	-64.5	-41	176.2	-73.1	174.4	-1.9	0	0	112.2	T625 S626 L627 R632 W633	T625-Q629 WeakPolarHBondContact O-CG 3.14Å; T625-Q629 PolarHBondContact O-N 3.3Å; S626-Q629 WeakPolarHBondContact O-CB 3.39Å; S626-Q629 PolarHBondContact O-N 3.41Å; L627-Q629 VanDerWaalsContact C-N 3.32Å; L627-Q629 PolarHBondContact O-N 3.37Å; Q629-R632 PolarHBondContact O-N 2.66Å; Q629-W633 WeakPolarHBondContact O-CB 3.36Å; Q629-W633 PolarHBondContact O-N 3.02Å
630	I	86.9	Confident	83	Confident	91 Å²	91	80.3 Å²	80.3	47%	0.467	38%	0.378	S	S	.	.	H	α-helix	trans	-63.3	-46.4	176.2	-69.3	164	0	0	0	110.6	S626 L627 R632 W633 W634	S626-I630 VanDerWaalsContact O-CG1 3.3Å; S626-I630 WeakPolarHBondContact O-CG1 3.08Å; S626-I630 PolarHBondContact O-N 3.12Å; L627-I630 PolarHBondContact O-N 3.09Å; I630-R632 VanDerWaalsContact C-N 3.34Å; I630-R632 PolarHBondContact O-N 2.95Å; I630-W633 PolarHBondContact O-N 3.38Å; I630-W634 WeakPolarHBondContact O-CB 3.36Å; I630-W634 PolarHBondContact O-N 3.38Å
631	V	88.9	Confident	84	Confident	33 Å²	33	82.9 Å²	82.9	20%	0.2	39%	0.392	C	S	.	.	H	α-helix	trans	-63.6	-41.3	176.7	175.1	0	0	0	0	110.6	L521 V525 L627 R628 W634 C635	L521-V631 HydrophobicContact CD2-CG2 4.06Å; L521-V631 HydrophobicContact CG-CG2 4.41Å; V525-V631 HydrophobicContact CB-CG1 4.14Å; V525-V631 HydrophobicContact CG1-CG1 4.17Å; V525-V631 HydrophobicContact CG2-CB 4.2Å; V525-V631 HydrophobicContact CG2-CG1 3.97Å; L627-V631 WeakPolarHBondContact O-CG2 3.4Å; L627-V631 PolarHBondContact O-N 3.23Å; R628-V631 PolarHBondContact O-N 3.44Å; V631-W634 PolarHBondContact O-N 2.98Å; V631-C635 WeakPolarHBondContact O-CB 3.44Å; V631-C635 PolarHBondContact O-N 3.33Å; V631-C635 PolarHBondContact O-SG 2.95Å
632	R	90	Very high	85	Confident	111 Å²	111	78.9 Å²	78.9	42%	0.419	37%	0.37	S	S	.	.	H	α-helix	trans	-61.3	-45.2	174.3	-173.3	177.5	-178.3	118.3	7.8	111.7	V525 R628 Q629 I630 C635 L636 D651	V525-R632 VanDerWaalsContact CG1-CA 3.5Å; V525-R632 HydrophobicContact CG1-CB 3.8Å; V525-R632 HydrophobicContact CG1-CG 4.24Å; R628-R632 WeakPolarHBondContact O-CB 3.47Å; R628-R632 PolarHBondContact O-N 2.97Å; Q629-R632 PolarHBondContact O-N 2.66Å; I630-R632 VanDerWaalsContact C-N 3.34Å; I630-R632 PolarHBondContact O-N 2.95Å; R632-C635 PolarHBondContact O-N 3.14Å; R632-L636 HydrophobicContact CG-CD1 4.23Å; R632-L636 WeakPolarHBondContact O-CB 3.43Å; R632-L636 WeakPolarHBondContact O-CG 3.36Å; R632-L636 PolarHBondContact O-N 2.83Å; R632-D651 IonicContact CZ-OD2 2.64Å; R632-D651 IonicContact NH2-OD1 3.94Å; R632-D651 PolarHBondContact NH2-OD1 2.83Å; R632-D651 IonicContact NH2-OD2 2.68Å; R632-D651 PolarHBondContact NH2-OD2 2.75Å
633	W	90.1	Very high	85.8	Confident	178 Å²	178	74.6 Å²	74.6	67%	0.674	36%	0.361	S	S	*	.	H	α-helix	trans	-61.5	-45.1	177.3	-177.7	83.5	0	0	0	111.5	Q629 I630 C635 L636 C637	Q629-W633 WeakPolarHBondContact O-CB 3.36Å; Q629-W633 PolarHBondContact O-N 3.02Å; I630-W633 PolarHBondContact O-N 3.38Å; W633-C635 PolarHBondContact O-N 3.13Å; W633-L636 WeakPolarHBondContact O-CB 3.47Å; W633-L636 PolarHBondContact O-N 3.45Å; W633-C637 VanDerWaalsContact CE2-SG 3.59Å; W633-C637 PolarHBondContact O-N 2.99Å; W633-C637 PolarHBondContact O-SG 3.12Å; W633-C637 VanDerWaalsContact O-SG 3.36Å
634	W	93.5	Very high	86.5	Confident	65 Å²	65	73.2 Å²	73.2	25%	0.246	35%	0.349	C	S	.	.	H	α-helix	trans	-59.3	-46.2	173.9	179.1	87.7	0	0	0	111.6	I630 V631 L636 C637 V638 I783 L784 S787	I630-W634 WeakPolarHBondContact O-CB 3.36Å; I630-W634 PolarHBondContact O-N 3.38Å; V631-W634 PolarHBondContact O-N 2.98Å; W634-L636 VanDerWaalsContact C-N 3.31Å; W634-L636 PolarHBondContact O-N 3.37Å; W634-C637 PolarHBondContact O-N 3.08Å; W634-V638 HydrophobicContact CD2-CG2 3.97Å; W634-V638 HydrophobicContact CE3-CG2 4.47Å; W634-V638 HydrophobicContact CG-CG2 4.42Å; W634-V638 HydrophobicContact CH2-CG2 4.23Å; W634-V638 HydrophobicContact CZ2-CG2 3.71Å; W634-V638 WeakPolarHBondContact O-CG2 3.49Å; W634-V638 PolarHBondContact O-N 3.49Å; W634-I783 HydrophobicContact CZ2-CG2 4.18Å; W634-L784 HydrophobicContact CH2-CB 4.28Å; W634-L784 HydrophobicContact CH2-CD1 3.61Å; W634-L784 HydrophobicContact CZ2-CD1 4.37Å; W634-L784 HydrophobicContact CZ3-CD1 4.18Å; W634-S787 WeakPolarHBondContact CZ2-OG 3.25Å
635	C	91	Very high	86.9	Confident	3 Å²	3	72.7 Å²	72.7	2%	0.02	34%	0.344	C	S	.	.	H	α-helix	trans	-62.6	-38.2	177.3	-65.4	0	0	0	0	111.7	V525 V631 R632 W633 S639 L648 L649	V525-C635 HydrophobicContact CG1-CB 4.5Å; V631-C635 WeakPolarHBondContact O-CB 3.44Å; V631-C635 PolarHBondContact O-N 3.33Å; V631-C635 PolarHBondContact O-SG 2.95Å; R632-C635 PolarHBondContact O-N 3.14Å; W633-C635 PolarHBondContact O-N 3.13Å; C635-S639 WeakPolarHBondContact O-CB 3.29Å; C635-S639 PolarHBondContact O-N 3.17Å; C635-S639 PolarHBondContact O-OG 3.09Å; C635-L648 HydrophobicContact CB-CD2 3.74Å; C635-L649 HydrophobicContact CB-CD1 3.55Å
636	L	90.4	Very high	87	Confident	51 Å²	51	70.7 Å²	70.7	27%	0.267	33%	0.333	S	S	.	.	H	α-helix	trans	-62.6	-46.8	173.7	-74.9	167.8	0	0	0	111.4	R632 W633 W634 S639 W640 L649	R632-L636 HydrophobicContact CG-CD1 4.23Å; R632-L636 WeakPolarHBondContact O-CB 3.43Å; R632-L636 WeakPolarHBondContact O-CG 3.36Å; R632-L636 PolarHBondContact O-N 2.83Å; W633-L636 WeakPolarHBondContact O-CB 3.47Å; W633-L636 PolarHBondContact O-N 3.45Å; W634-L636 VanDerWaalsContact C-N 3.31Å; W634-L636 PolarHBondContact O-N 3.37Å; L636-S639 PolarHBondContact O-OG 2.95Å; L636-W640 WeakPolarHBondContact O-CB 3.27Å; L636-W640 PolarHBondContact O-N 3.26Å; L636-L649 HydrophobicContact CD2-CD2 3.47Å; L636-L649 VanDerWaalsContact CD2-CD2 3.47Å; L636-L649 HydrophobicContact CG-CD2 3.82Å
637	C	91.4	Very high	87.3	Confident	48 Å²	48	70.7 Å²	70.7	32%	0.324	33%	0.326	S	S	.	.	H	α-helix	trans	-62.4	-48.4	178.5	-70	0	0	0	0	112.4	W633 W634 W640 L641	W633-C637 VanDerWaalsContact CE2-SG 3.59Å; W633-C637 PolarHBondContact O-N 2.99Å; W633-C637 PolarHBondContact O-SG 3.12Å; W633-C637 VanDerWaalsContact O-SG 3.36Å; W634-C637 PolarHBondContact O-N 3.08Å; C637-W640 PolarHBondContact O-N 2.92Å; C637-L641 WeakPolarHBondContact O-CB 3.49Å; C637-L641 PolarHBondContact O-N 3.2Å
638	V	91.3	Very high	87.5	Confident	8 Å²	8	67 Å²	67	5%	0.048	31%	0.307	C	S	.	.	H	α-helix	trans	-70.5	-39.5	-178.3	176.3	0	0	0	0	111.5	W634 W640 L641 L642 L780 I783	W634-V638 HydrophobicContact CD2-CG2 3.97Å; W634-V638 HydrophobicContact CE3-CG2 4.47Å; W634-V638 HydrophobicContact CG-CG2 4.42Å; W634-V638 HydrophobicContact CH2-CG2 4.23Å; W634-V638 HydrophobicContact CZ2-CG2 3.71Å; W634-V638 WeakPolarHBondContact O-CG2 3.49Å; W634-V638 PolarHBondContact O-N 3.49Å; V638-W640 VanDerWaalsContact C-N 3.33Å; V638-W640 PolarHBondContact O-N 2.83Å; V638-L641 PolarHBondContact O-N 2.82Å; V638-L642 HydrophobicContact CG1-CD1 3.97Å; V638-L642 PolarHBondContact O-N 3.49Å; V638-L780 HydrophobicContact CG1-CD1 3.51Å; V638-I783 HydrophobicContact CG1-CB 4.5Å; V638-I783 HydrophobicContact CG1-CD1 4.47Å; V638-I783 HydrophobicContact CG1-CG2 3.92Å; V638-I783 HydrophobicContact CG2-CG2 3.73Å
639	S	88.4	Confident	87.3	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.007	29%	0.288	C	S	.	.	H	α-helix	trans	-70.2	-30	177.6	70.8	0	0	0	0	112.9	C635 L636 G643 L644 R645	C635-S639 WeakPolarHBondContact O-CB 3.29Å; C635-S639 PolarHBondContact O-N 3.17Å; C635-S639 PolarHBondContact O-OG 3.09Å; L636-S639 PolarHBondContact O-OG 2.95Å; S639-G643 CarbonylContact O-C 3.57Å; S639-G643 VanDerWaalsContact O-CA 3.25Å; S639-G643 WeakPolarHBondContact O-CA 3.48Å; S639-G643 PolarHBondContact O-N 3.24Å; S639-L644 PolarHBondContact O-N 2.88Å; S639-R645 PolarHBondContact O-N 3.47Å
640	W	86.9	Confident	86.8	Confident	203 Å²	203	56.8 Å²	56.8	77%	0.769	27%	0.273	S	S	*	.	H	α-helix	trans	-67.2	-47.2	168.3	179.5	79.1	0	0	0	111.1	L636 C637 V638 L642 G643	L636-W640 WeakPolarHBondContact O-CB 3.27Å; L636-W640 PolarHBondContact O-N 3.26Å; C637-W640 PolarHBondContact O-N 2.92Å; V638-W640 VanDerWaalsContact C-N 3.33Å; V638-W640 PolarHBondContact O-N 2.83Å; W640-L642 PolarHBondContact O-N 2.87Å; W640-G643 PolarHBondContact O-N 3.31Å
641	L	89.3	Confident	86.2	Confident	118 Å²	118	55.6 Å²	55.6	62%	0.618	27%	0.268	S	S	*	.	H	α-helix	trans	-60.4	-40.4	-179.8	-175.6	65.1	0	0	0	113.1	C637 V638 I783	C637-L641 WeakPolarHBondContact O-CB 3.49Å; C637-L641 PolarHBondContact O-N 3.2Å; V638-L641 PolarHBondContact O-N 2.82Å; L641-I783 HydrophobicContact CD2-CD1 4.1Å
642	L	88.4	Confident	85.4	Confident	30 Å²	30	57.4 Å²	57.4	16%	0.157	28%	0.276	C	S	.	.	H	α-helix	trans	-93.7	-5.9	-180	-66.8	171.4	0	0	0	113.8	V638 W640 L644 R776 L780 I783	V638-L642 HydrophobicContact CG1-CD1 3.97Å; V638-L642 PolarHBondContact O-N 3.49Å; W640-L642 PolarHBondContact O-N 2.87Å; L642-L644 VanDerWaalsContact C-N 3.28Å; L642-L644 HydrophobicContact CB-CB 4.42Å; L642-L644 HydrophobicContact CB-CD1 4.03Å; L642-L644 HydrophobicContact CB-CG 4.02Å; L642-L644 HydrophobicContact CD1-CD1 4.14Å; L642-L644 PolarHBondContact O-N 2.85Å; L642-R776 VanDerWaalsContact O-CD 3.32Å; L642-R776 WeakPolarHBondContact O-CD 3.26Å; L642-R776 PolarHBondContact O-NH1 2.73Å; L642-L780 HydrophobicContact CD1-CB 3.67Å; L642-L780 HydrophobicContact CD1-CD1 4.15Å; L642-I783 HydrophobicContact CD1-CD1 4.12Å; L642-I783 HydrophobicContact CD2-CD1 4.29Å; L642-I783 HydrophobicContact CG-CD1 4.25Å
643	G	83.4	Confident	84.5	Confident	41 Å²	41	57.4 Å²	57.4	42%	0.423	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.2	37.4	-171.4	0	0	0	0	0	113.3	S639 W640 R776	S639-G643 CarbonylContact O-C 3.57Å; S639-G643 VanDerWaalsContact O-CA 3.25Å; S639-G643 WeakPolarHBondContact O-CA 3.48Å; S639-G643 PolarHBondContact O-N 3.24Å; W640-G643 PolarHBondContact O-N 3.31Å; G643-R776 PolarHBondContact O-NH1 3.49Å
644	L	83.9	Confident	83.7	Confident	4 Å²	4	50.8 Å²	50.8	2%	0.021	27%	0.266	C	S	.	.			trans	-107.7	18.3	179.6	-71.7	177.5	0	0	0	112.8	S639 L642 S646 Y647 L648 F773 R776 L780	S639-L644 PolarHBondContact O-N 2.88Å; L642-L644 VanDerWaalsContact C-N 3.28Å; L642-L644 HydrophobicContact CB-CB 4.42Å; L642-L644 HydrophobicContact CB-CD1 4.03Å; L642-L644 HydrophobicContact CB-CG 4.02Å; L642-L644 HydrophobicContact CD1-CD1 4.14Å; L642-L644 PolarHBondContact O-N 2.85Å; L644-S646 VanDerWaalsContact C-N 3.31Å; L644-S646 PolarHBondContact O-N 3.4Å; L644-Y647 WeakPolarHBondContact O-CB 3.47Å; L644-Y647 PolarHBondContact O-N 2.86Å; L644-L648 PolarHBondContact O-N 2.99Å; L644-F773 HydrophobicContact CD2-CD2 3.88Å; L644-F773 HydrophobicContact CD2-CE2 3.8Å; L644-R776 HydrophobicContact CD1-CB 3.85Å; L644-R776 HydrophobicContact CD2-CB 4.03Å; L644-R776 HydrophobicContact CG-CB 4.02Å; L644-L780 HydrophobicContact CD1-CB 4.31Å; L644-L780 HydrophobicContact CD1-CD2 4.38Å
645	R	83.6	Confident	82.6	Confident	96 Å²	96	51.1 Å²	51.1	36%	0.362	28%	0.278	S	S	.	.	H	α-helix	trans	-62	-34.8	-174.5	-174.7	170.4	173.1	-154.9	-0.7	113.8	S639 Y647 L649 G650 D651 I652	S639-R645 PolarHBondContact O-N 3.47Å; R645-Y647 VanDerWaalsContact C-N 3.32Å; R645-Y647 PolarHBondContact O-N 3.2Å; R645-L649 PolarHBondContact O-N 3.25Å; R645-G650 PolarHBondContact O-N 3.41Å; R645-D651 IonicContact NH2-OD2 3.68Å; R645-I652 HydrophobicContact CB-CD1 3.66Å; R645-I652 HydrophobicContact CG-CD1 3.68Å; R645-I652 HydrophobicContact CG-CG1 4.05Å
646	S	80.2	Confident	81.2	Confident	17 Å²	17	55.4 Å²	55.4	12%	0.119	31%	0.306	C	S	.	.	H	α-helix	trans	-65.7	-31.4	172.3	55.2	0	0	0	0	113.4	R527 L644 K768	R527-S646 PolarHBondContact NH1-O 3.13Å; L644-S646 VanDerWaalsContact C-N 3.31Å; L644-S646 PolarHBondContact O-N 3.4Å; S646-K768 PolarHBondContact OG-O 3.23Å
647	Y	83.6	Confident	80	Confident	42 Å²	42	55.2 Å²	55.2	17%	0.165	32%	0.316	C	S	.	.	H	α-helix	trans	-81.1	-46.5	179.7	176	-105.1	0	0	0	111.7	V530 L644 R645 Y767 F773	V530-Y647 HydrophobicContact CG1-CE1 4.1Å; V530-Y647 HydrophobicContact CG2-CE1 4.37Å; V530-Y647 WeakPolarHBondContact CG2-O 3.41Å; L644-Y647 WeakPolarHBondContact O-CB 3.47Å; L644-Y647 PolarHBondContact O-N 2.86Å; R645-Y647 VanDerWaalsContact C-N 3.32Å; R645-Y647 PolarHBondContact O-N 3.2Å; Y647-Y767 HydrophobicContact CD2-CD1 4.13Å; Y647-Y767 AromaticContact CD2-CD2 3.74Å; Y647-Y767 HydrophobicContact CD2-CD2 3.74Å; Y647-Y767 HydrophobicContact CD2-CE1 4.25Å; Y647-Y767 AromaticContact CD2-CE2 3.87Å; Y647-Y767 HydrophobicContact CD2-CE2 3.87Å; Y647-Y767 AromaticContact CD2-CG 3.88Å; Y647-Y767 HydrophobicContact CD2-CG 3.88Å; Y647-Y767 HydrophobicContact CE2-CE1 4.3Å; Y647-Y767 HydrophobicContact CE2-CE2 4.36Å; Y647-F773 HydrophobicContact CD2-CE2 4.18Å; Y647-F773 AromaticContact CD2-CZ 3.79Å; Y647-F773 HydrophobicContact CD2-CZ 3.79Å; Y647-F773 AromaticContact CE2-CZ 3.9Å; Y647-F773 HydrophobicContact CE2-CZ 3.9Å; Y647-F773 HydrophobicContact CG-CE2 4.19Å; Y647-F773 HydrophobicContact CG-CZ 4.18Å
648	L	84.6	Confident	79.1	Confident	7 Å²	7	54.5 Å²	54.5	4%	0.037	31%	0.309	C	S	.	.	H	α-helix	trans	-81.1	-44.1	-170.9	-162.3	72.3	0	0	0	114	L526 R527 V530 C635 L644 L780	L526-L648 HydrophobicContact CD2-CD1 3.33Å; L526-L648 HydrophobicContact CD2-CD2 4.18Å; L526-L648 HydrophobicContact CD2-CG 3.46Å; L526-L648 VanDerWaalsContact CD2-CG 3.46Å; R527-L648 WeakPolarHBondContact CB-O 3.44Å; R527-L648 PolarHBondContact N-O 2.96Å; V530-L648 HydrophobicContact CG1-CD1 4.43Å; C635-L648 HydrophobicContact CB-CD2 3.74Å; L644-L648 PolarHBondContact O-N 2.99Å; L648-L780 HydrophobicContact CD1-CD2 4.22Å
649	L	83.5	Confident	78.1	Confident	16 Å²	16	59.9 Å²	59.9	8%	0.084	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111	-34.6	-174.7	-90.9	71.4	0	0	0	113.4	C635 L636 R645 D651	C635-L649 HydrophobicContact CB-CD1 3.55Å; L636-L649 HydrophobicContact CD2-CD2 3.47Å; L636-L649 VanDerWaalsContact CD2-CD2 3.47Å; L636-L649 HydrophobicContact CG-CD2 3.82Å; R645-L649 PolarHBondContact O-N 3.25Å; L649-D651 WeakPolarHBondContact CD2-OD2 3.3Å; L649-D651 PolarHBondContact O-N 3.11Å
650	G	74	Confident	77.5	Confident	30 Å²	30	60.7 Å²	60.7	31%	0.309	34%	0.336	S	S	.	.			trans	76.6	-0.4	-175.7	0	0	0	0	0	115.3	R645 I652	R645-G650 PolarHBondContact O-N 3.41Å; G650-I652 PolarHBondContact O-N 2.85Å
651	D	73.2	Confident	77	Confident	66 Å²	66	51.4 Å²	51.4	35%	0.353	30%	0.302	S	S	.	.			trans	-61.8	-11.1	-178.1	-69.2	-3.8	0	0	0	116.1	R632 R645 L649	R632-D651 IonicContact CZ-OD2 2.64Å; R632-D651 IonicContact NH2-OD1 3.94Å; R632-D651 PolarHBondContact NH2-OD1 2.83Å; R632-D651 IonicContact NH2-OD2 2.68Å; R632-D651 PolarHBondContact NH2-OD2 2.75Å; R645-D651 IonicContact NH2-OD2 3.68Å; L649-D651 WeakPolarHBondContact CD2-OD2 3.3Å; L649-D651 PolarHBondContact O-N 3.11Å
652	I	72.4	Confident	76	Confident	71 Å²	71	47.6 Å²	47.6	36%	0.364	28%	0.284	S	S	.	.	S	Bend	trans	-94.7	120	-174.7	-60.8	167.6	0	0	0	109.1	R645 G650	R645-I652 HydrophobicContact CB-CD1 3.66Å; R645-I652 HydrophobicContact CG-CD1 3.68Å; R645-I652 HydrophobicContact CG-CG1 4.05Å; G650-I652 PolarHBondContact O-N 2.85Å
653	P	70.6	Confident	75	Confident	110 Å²	110	52.4 Å²	52.4	71%	0.714	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-64	136.3	172.1	26.6	-33	0	0	0	110.7
654	F	73.7	Confident	74.2	Confident	39 Å²	39	57.1 Å²	57.1	17%	0.171	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-71.6	134.1	178.3	-56.9	-65.7	0	0	0	110.8	I660 Y670 P766	F654-I660 HydrophobicContact CD1-CG2 3.89Å; F654-I660 HydrophobicContact CE1-CG2 4.01Å; F654-I660 HydrophobicContact CG-CG2 4.27Å; F654-I660 HydrophobicContact CZ-CG2 4.49Å; F654-Y670 HydrophobicContact CB-CD1 3.39Å; F654-Y670 HydrophobicContact CB-CD2 3.89Å; F654-Y670 HydrophobicContact CB-CE1 3.52Å; F654-Y670 HydrophobicContact CB-CE2 4.01Å; F654-Y670 HydrophobicContact CB-CG 3.58Å; F654-Y670 HydrophobicContact CD2-CD2 4.08Å; F654-Y670 AromaticContact CD2-CE2 3.86Å; F654-Y670 HydrophobicContact CD2-CE2 3.86Å; F654-Y670 HydrophobicContact CG-CD1 4.49Å; F654-Y670 HydrophobicContact CG-CD2 4.18Å; F654-Y670 HydrophobicContact CG-CE2 4.29Å; F654-Y670 HydrophobicContact CG-CG 4.27Å; F654-Y670 WeakPolarHBondContact O-CE1 3.38Å; F654-P766 WeakPolarHBondContact CZ-O 3.43Å
655	S	69.8	Low	73.4	Confident	72 Å²	72	59.3 Å²	59.3	50%	0.503	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-86.1	144.9	171.7	-62.3	0	0	0	0	110	G657 D658	S655-G657 PolarHBondContact O-N 3.37Å; S655-D658 PolarHBondContact N-OD2 3.46Å; S655-D658 WeakPolarHBondContact O-CB 3.43Å; S655-D658 PolarHBondContact O-N 3.1Å; S655-D658 VanDerWaalsContact O-N 3.07Å
656	P	62.9	Low	72.9	Confident	93 Å²	93	58.2 Å²	58.2	60%	0.604	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	123.3	176.5	21.8	-30.8	0	0	0	110.3
657	G	65.1	Low	72.4	Confident	47 Å²	47	62 Å²	62	49%	0.485	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	103.5	-7.5	-174.6	0	0	0	0	0	115.9	S655 Y670	S655-G657 PolarHBondContact O-N 3.37Å; G657-Y670 PolarHBondContact N-O 3.27Å; G657-Y670 VanDerWaalsContact N-O 3.08Å
658	D	71.9	Confident	72	Confident	34 Å²	34	62.5 Å²	62.5	18%	0.182	37%	0.372	C	S	.	.			trans	-68.4	129.9	172.7	-82.6	-27.2	0	0	0	111.5	S655 I660 Y670 K768	S655-D658 PolarHBondContact N-OD2 3.46Å; S655-D658 WeakPolarHBondContact O-CB 3.43Å; S655-D658 PolarHBondContact O-N 3.1Å; S655-D658 VanDerWaalsContact O-N 3.07Å; D658-I660 PolarHBondContact O-N 3.37Å; D658-Y670 WeakPolarHBondContact O-CB 3.26Å; D658-Y670 PolarHBondContact O-N 3.46Å; D658-K768 HydrophobicContact CB-CD 4.4Å; D658-K768 VanDerWaalsContact CG-NZ 3.35Å; D658-K768 WeakPolarHBondContact OD1-CE 3.12Å; D658-K768 IonicContact OD1-NZ 2.84Å; D658-K768 PolarHBondContact OD1-NZ 3.02Å; D658-K768 IonicContact OD2-NZ 3.89Å; D658-K768 PolarHBondContact OD2-NZ 3.17Å
659	F	71.3	Confident	71.4	Confident	121 Å²	121	65.5 Å²	65.5	53%	0.531	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	115.9	172.7	-67.6	-83.2	0	0	0	110.8
660	I	76.1	Confident	70.7	Confident	17 Å²	17	67.8 Å²	67.8	9%	0.087	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	142.1	175.3	54.2	158	0	0	0	110.5	F654 D658 E667 V668 Y670 P766 Y767	F654-I660 HydrophobicContact CD1-CG2 3.89Å; F654-I660 HydrophobicContact CE1-CG2 4.01Å; F654-I660 HydrophobicContact CG-CG2 4.27Å; F654-I660 HydrophobicContact CZ-CG2 4.49Å; D658-I660 PolarHBondContact O-N 3.37Å; I660-E667 WeakPolarHBondContact O-CA 3.46Å; I660-V668 HydrophobicContact CD1-CG2 3.99Å; I660-V668 HydrophobicContact CG1-CG2 3.72Å; I660-V668 WeakPolarHBondContact CG1-O 3.49Å; I660-V668 PolarHBondContact N-O 3.35Å; I660-V668 PolarHBondContact O-N 3.46Å; I660-Y670 HydrophobicContact CD1-CD2 4.08Å; I660-P766 HydrophobicContact CB-CB 4.11Å; I660-P766 HydrophobicContact CD1-CB 3.9Å; I660-P766 HydrophobicContact CD1-CG 4.29Å; I660-Y767 WeakPolarHBondContact CA-O 3.5Å
661	V	74.5	Confident	70.3	Confident	9 Å²	9	75.1 Å²	75.1	6%	0.055	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	122.7	174.4	-175.9	0	0	0	0	108.7	T666 E667 Y764 Y767 R769	V661-T666 WeakPolarHBondContact CA-O 3.46Å; V661-E667 HydrophobicContact CG2-CG 4.25Å; V661-Y764 VanDerWaalsContact O-CE1 3.25Å; V661-Y764 WeakPolarHBondContact O-CE1 3.31Å; V661-Y764 PolarHBondContact O-OH 3.32Å; V661-Y767 HydrophobicContact CB-CE1 4.14Å; V661-Y767 HydrophobicContact CB-CE2 4.33Å; V661-Y767 HydrophobicContact CG1-CE1 4.39Å; V661-Y767 HydrophobicContact CG2-CD2 4.48Å; V661-Y767 HydrophobicContact CG2-CE2 3.98Å; V661-Y767 PolarHBondContact N-O 3.46Å; V661-R769 HydrophobicContact CG2-CB 3.82Å
662	T	68.7	Low	69.6	Low	38 Å²	38	77.9 Å²	77.9	23%	0.233	43%	0.433	C	S	.	.			trans	-81.3	172.4	173.1	69.6	0	0	0	0	111.7	N664 G665 T666 V668 Y764	T662-N664 PolarHBondContact O-N 2.92Å; T662-N664 PolarHBondContact OG1-N 2.91Å; T662-G665 PolarHBondContact O-N 3.34Å; T662-T666 PolarHBondContact N-O 2.87Å; T662-T666 PolarHBondContact OG1-O 3.4Å; T662-T666 PolarHBondContact OG1-OG1 3.34Å; T662-V668 HydrophobicContact CG2-CB 4.5Å; T662-V668 HydrophobicContact CG2-CG1 4.18Å; T662-V668 HydrophobicContact CG2-CG2 3.53Å; T662-Y764 PolarHBondContact O-OH 2.71Å
663	E	67.2	Low	68.7	Low	130 Å²	130	81.8 Å²	81.8	61%	0.607	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-34.2	177	-176.6	171.9	-166.6	0	0	112.8	G665 Y764	E663-G665 PolarHBondContact O-N 3.33Å; E663-Y764 HydrophobicContact CB-CD1 3.87Å; E663-Y764 HydrophobicContact CB-CE1 4.43Å; E663-Y764 HydrophobicContact CB-CG 3.99Å; E663-Y764 HydrophobicContact CG-CG 4.34Å
664	N	66.8	Low	67.2	Low	141 Å²	141	86.6 Å²	86.6	75%	0.754	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	3.1	179	-62.5	-14.1	0	0	0	113.1	T662 T666	T662-N664 PolarHBondContact O-N 2.92Å; T662-N664 PolarHBondContact OG1-N 2.91Å; N664-T666 HydrophobicContact CB-CG2 4.48Å; N664-T666 PolarHBondContact O-N 3.01Å
665	G	68.4	Low	65.4	Low	49 Å²	49	91.6 Å²	91.6	51%	0.505	48%	0.476	S	S	.	.	S	Bend	trans	75.8	6.3	-177.6	0	0	0	0	0	114.5	T662 E663	T662-G665 PolarHBondContact O-N 3.34Å; E663-G665 PolarHBondContact O-N 3.33Å
666	T	72.9	Confident	63.9	Low	73 Å²	73	93.4 Å²	93.4	45%	0.448	48%	0.484	S	S	.	.			trans	-82.4	140.4	178.9	59.7	0	0	0	0	111.2	V661 T662 N664	V661-T666 WeakPolarHBondContact CA-O 3.46Å; T662-T666 PolarHBondContact N-O 2.87Å; T662-T666 PolarHBondContact OG1-O 3.4Å; T662-T666 PolarHBondContact OG1-OG1 3.34Å; N664-T666 HydrophobicContact CB-CG2 4.48Å; N664-T666 PolarHBondContact O-N 3.01Å
667	E	70.1	Confident	62.4	Low	96 Å²	96	98 Å²	98	45%	0.449	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	109.9	177.9	-68.6	177	-168.6	0	0	109.2	I660 V661 R769	I660-E667 WeakPolarHBondContact O-CA 3.46Å; V661-E667 HydrophobicContact CG2-CG 4.25Å; E667-R769 WeakPolarHBondContact OE1-CD 3.49Å; E667-R769 IonicContact OE1-CZ 3.57Å; E667-R769 IonicContact OE1-NE 3.3Å; E667-R769 IonicContact OE1-NH1 3.34Å; E667-R769 PolarHBondContact OE1-NH1 3.36Å
668	V	75.2	Confident	60.8	Low	54 Å²	54	99.7 Å²	99.7	33%	0.327	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	142.2	177.7	-61.8	0	0	0	0	110.4	I660 T662 Y670	I660-V668 HydrophobicContact CD1-CG2 3.99Å; I660-V668 HydrophobicContact CG1-CG2 3.72Å; I660-V668 WeakPolarHBondContact CG1-O 3.49Å; I660-V668 PolarHBondContact N-O 3.35Å; I660-V668 PolarHBondContact O-N 3.46Å; T662-V668 HydrophobicContact CG2-CB 4.5Å; T662-V668 HydrophobicContact CG2-CG1 4.18Å; T662-V668 HydrophobicContact CG2-CG2 3.53Å; V668-Y670 PolarHBondContact O-N 2.92Å
669	P	70.9	Confident	58.6	Low	70 Å²	70	106.1 Å²	106.1	46%	0.455	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	128.9	173.2	27.5	-32.9	0	0	0	109.9	K671	P669-K671 PolarHBondContact O-N 2.96Å
670	Y	69.4	Low	56.5	Low	63 Å²	63	107.3 Å²	107.3	25%	0.247	55%	0.553	C	S	.	*	P	Polyproline II helix	trans	-64.3	121.4	176.6	179.3	-103.1	0	0	0	110.2	F654 G657 D658 I660 V668 Q672	F654-Y670 HydrophobicContact CB-CD1 3.39Å; F654-Y670 HydrophobicContact CB-CD2 3.89Å; F654-Y670 HydrophobicContact CB-CE1 3.52Å; F654-Y670 HydrophobicContact CB-CE2 4.01Å; F654-Y670 HydrophobicContact CB-CG 3.58Å; F654-Y670 HydrophobicContact CD2-CD2 4.08Å; F654-Y670 AromaticContact CD2-CE2 3.86Å; F654-Y670 HydrophobicContact CD2-CE2 3.86Å; F654-Y670 HydrophobicContact CG-CD1 4.49Å; F654-Y670 HydrophobicContact CG-CD2 4.18Å; F654-Y670 HydrophobicContact CG-CE2 4.29Å; F654-Y670 HydrophobicContact CG-CG 4.27Å; F654-Y670 WeakPolarHBondContact O-CE1 3.38Å; G657-Y670 PolarHBondContact N-O 3.27Å; G657-Y670 VanDerWaalsContact N-O 3.08Å; D658-Y670 WeakPolarHBondContact O-CB 3.26Å; D658-Y670 PolarHBondContact O-N 3.46Å; I660-Y670 HydrophobicContact CD1-CD2 4.08Å; V668-Y670 PolarHBondContact O-N 2.92Å; Y670-Q672 HydrophobicContact CE1-CB 3.96Å; Y670-Q672 HydrophobicContact CE1-CG 4.45Å
671	K	65.4	Low	54.2	Low	184 Å²	184	110.5 Å²	110.5	80%	0.8	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-100.5	118.3	167.7	-67.2	-178.7	-179.1	177.6	0	107.5	P669 R673	P669-K671 PolarHBondContact O-N 2.96Å; K671-R673 PolarHBondContact O-N 3.44Å
672	Q	57.5	Low	51.9	Low	124 Å²	124	117.8 Å²	117.8	58%	0.579	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-64.5	120.3	173.6	-170.3	165.1	-7	0	0	108.8	Y670 R674	Y670-Q672 HydrophobicContact CE1-CB 3.96Å; Y670-Q672 HydrophobicContact CE1-CG 4.45Å; Q672-R674 PolarHBondContact O-N 2.94Å
673	R	55	Low	49.9	Very low	153 Å²	153	123.5 Å²	123.5	58%	0.577	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-61.3	121.4	173.3	-163.2	177.4	-171.3	-172.3	2.7	107.3	K671 N675	K671-R673 PolarHBondContact O-N 3.44Å; R673-N675 PolarHBondContact O-N 2.81Å
674	R	38.9	Very low	48	Very low	212 Å²	212	124.5 Å²	124.5	80%	0.8	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-67	123	165.7	-74.7	-179.8	178.7	171	-0.9	106	Q672 T676	Q672-R674 PolarHBondContact O-N 2.94Å; R674-T676 VanDerWaalsContact C-N 3.3Å; R674-T676 PolarHBondContact O-N 2.87Å
675	N	36.3	Very low	45.8	Very low	144 Å²	144	121.5 Å²	121.5	77%	0.77	64%	0.643	S	S	*	*			trans	-60.9	96.9	166.9	-75.3	-1.1	0	0	0	107.7	R673 H677	R673-N675 PolarHBondContact O-N 2.81Å; N675-H677 PolarHBondContact O-N 3.31Å
676	T	36.7	Very low	43.7	Very low	109 Å²	109	127.2 Å²	127.2	67%	0.669	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	36.4	177.2	41	0	0	0	0	112.4	R674	R674-T676 VanDerWaalsContact C-N 3.3Å; R674-T676 PolarHBondContact O-N 2.87Å
677	H	31.1	Very low	41.2	Very low	190 Å²	190	129 Å²	129	88%	0.88	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.2	13.3	167.9	-75.9	-55.5	0	0	0	113.7	N675	N675-H677 PolarHBondContact O-N 3.31Å
678	A	32.4	Very low	39	Very low	83 Å²	83	127.8 Å²	127.8	69%	0.686	69%	0.685	S	S	*	*	S	Bend	trans	-125	1.6	174.2	0	0	0	0	0	115.7
679	Q	26.9	Very low	36.4	Very low	169 Å²	169	130.6 Å²	130.6	79%	0.79	71%	0.707	S	S	*	*			trans	-142.1	60.5	-179.5	-69.4	-175.8	-14.9	0	0	112.1
680	T	26	Very low	33.9	Very low	145 Å²	145	135.9 Å²	135.9	89%	0.89	73%	0.728	S	S	*	*			trans	-104.8	64.1	145.7	43.6	0	0	0	0	107.9
681	S	28.1	Very low	31.6	Very low	85 Å²	85	138.5 Å²	138.5	59%	0.594	76%	0.756	S	S	*	*	S	Bend	trans	-145.3	131.1	150.1	56.9	0	0	0	0	105.4
682	N	26.7	Very low	29.4	Very low	161 Å²	161	136.7 Å²	136.7	86%	0.861	75%	0.753	S	S	*	*			trans	94.2	66.3	180	-45.2	-23.4	0	0	0	115.5
683	L	26.3	Very low	27.6	Very low	158 Å²	158	139 Å²	139	83%	0.827	76%	0.764	S	S	*	*			trans	-106.4	117.8	140.6	-101.1	138	0	0	0	107.7
684	N	26.3	Very low	25.9	Very low	152 Å²	152	136.7 Å²	136.7	81%	0.813	77%	0.771	S	S	*	*			trans	172.9	81.1	146.7	-84.6	-8.4	0	0	0	105.4
685	S	21.9	Very low	25	Very low	78 Å²	78	131.5 Å²	131.5	55%	0.545	77%	0.767	S	S	.	*				45.8	106	81.6	73.8	0	0	0	0	114.2
686	H	24	Very low	24.2	Very low	169 Å²	169	131.6 Å²	131.6	78%	0.782	76%	0.763	S	S	*	*				166.8	100	125.5	-86.7	-60.2	0	0	0	107.9
687	S	21	Very low	23.3	Very low	110 Å²	110	135.7 Å²	135.7	77%	0.769	77%	0.766	S	S	*	*				54.3	101	86.6	72.7	0	0	0	0	113.3
688	G	22.4	Very low	22.8	Very low	70 Å²	70	134.1 Å²	134.1	72%	0.722	76%	0.763	S	S	*	*			trans	-173.1	88.1	172.5	0	0	0	0	0	112.7
689	S	20.8	Very low	22.3	Very low	113 Å²	113	137.5 Å²	137.5	79%	0.79	77%	0.769	S	S	*	*			trans	43.8	113.5	149.7	58.5	0	0	0	0	121.8
690	M	18.4	Very low	22.3	Very low	182 Å²	182	134.1 Å²	134.1	90%	0.897	76%	0.761	S	S	*	*				13.1	116.7	120	-170.4	-178.1	81.9	0	0	118.1
691	S	21.9	Very low	22.1	Very low	118 Å²	118	133 Å²	133	83%	0.825	75%	0.749	S	S	*	*				-176.1	150.3	129	52.4	0	0	0	0	113.1
692	I	19.7	Very low	21.8	Very low	146 Å²	146	136.6 Å²	136.6	75%	0.749	76%	0.757	S	S	*	*			trans	-67.5	159.3	-177.5	-72.4	159.5	0	0	0	112.7
693	E	19.2	Very low	21.7	Very low	173 Å²	173	135.3 Å²	135.3	81%	0.808	75%	0.75	S	S	*	*			trans	96.7	119.9	151.7	-94.6	156.2	-150.7	0	0	121.5
694	S	19	Very low	21.5	Very low	103 Å²	103	134 Å²	134	72%	0.72	74%	0.743	S	S	*	*			trans	-53.8	128	155.4	48.8	0	0	0	0	113.2
695	S	20.4	Very low	21.4	Very low	104 Å²	104	132.8 Å²	132.8	73%	0.727	74%	0.737	S	S	*	*			trans	178	123.3	132.7	-86.6	0	0	0	0	112.3
696	Q	18.7	Very low	21.5	Very low	146 Å²	146	136 Å²	136	68%	0.682	75%	0.746	S	S	*	*				47.1	126.5	128.9	-64.3	-178	-4.2	0	0	120.7
697	R	17.5	Very low	21.5	Very low	195 Å²	195	132.4 Å²	132.4	74%	0.736	74%	0.74	S	S	*	*				78.6	137	128.1	-89.2	-169.1	-82	-164.8	-4.6	119
698	I	20.9	Very low	21.6	Very low	157 Å²	157	132.5 Å²	132.5	81%	0.805	74%	0.737	S	S	*	*			trans	108	111	148.6	-62.5	141.8	0	0	0	116.4
699	L	21.3	Very low	21.6	Very low	154 Å²	154	135.6 Å²	135.6	81%	0.806	74%	0.737	S	S	*	*			trans	-34.5	178.3	149.5	-117.6	72.7	0	0	0	114.2
700	P	27.7	Very low	21.7	Very low	98 Å²	98	136.7 Å²	136.7	64%	0.636	73%	0.733	S	S	*	*			cis	-140.4	-171.9	-1.9	28.5	-2.8	0	0	0	114.4
701	N	21.7	Very low	21.9	Very low	120 Å²	120	137.8 Å²	137.8	64%	0.642	73%	0.728	S	S	*	*			trans	123.6	102.7	151.2	-71.7	11.4	0	0	0	112.9
702	E	21.7	Very low	21.9	Very low	162 Å²	162	136 Å²	136	76%	0.757	72%	0.721	S	S	*	*				81.7	134.1	98	-76.8	-176.1	147.3	0	0	110
703	L	23.8	Very low	22.2	Very low	134 Å²	134	134.7 Å²	134.7	70%	0.702	72%	0.722	S	S	*	*			cis	-167	153.9	2.5	-152.7	73.4	0	0	0	105.4
704	D	23.1	Very low	22.2	Very low	129 Å²	129	133.6 Å²	133.6	69%	0.69	72%	0.721	S	S	*	*			trans	86.6	128.9	151.5	-62.2	-24.9	0	0	0	124.8
705	D	24.7	Very low	22.5	Very low	128 Å²	128	136.4 Å²	136.4	68%	0.684	73%	0.727	S	S	*	*			trans	79.8	90.1	156.7	-60.1	-17.6	0	0	0	119.6
706	I	23.2	Very low	22.5	Very low	145 Å²	145	136.1 Å²	136.1	74%	0.744	73%	0.726	S	S	*	*				61.6	109.9	83.8	-59.3	168.4	0	0	0	109.5
707	S	24.2	Very low	22.7	Very low	94 Å²	94	134.8 Å²	134.8	66%	0.657	73%	0.732	S	S	*	*				178.4	135.8	52.7	15.7	0	0	0	0	110.8
708	T	22.5	Very low	22.9	Very low	112 Å²	112	130.8 Å²	130.8	69%	0.687	73%	0.734	S	S	*	*				83.5	101.2	126.6	-43.9	0	0	0	0	119.5
709	D	23.1	Very low	23	Very low	135 Å²	135	128.6 Å²	128.6	72%	0.722	73%	0.733	S	S	*	*				77.3	137.4	125.9	-64.4	-0.2	0	0	0	119.4
710	L	22.8	Very low	23.1	Very low	135 Å²	135	126.7 Å²	126.7	71%	0.707	73%	0.733	S	S	*	*			cis	-167.9	136.5	3	-156.2	64.3	0	0	0	107.3
711	Y	22.4	Very low	22.8	Very low	206 Å²	206	127 Å²	127	81%	0.808	74%	0.737	S	S	*	*			trans	50.6	106.2	144.7	-83.2	-109.7	0	0	0	121.3
712	A	23	Very low	22.8	Very low	81 Å²	81	132.4 Å²	132.4	67%	0.669	75%	0.75	S	S	*	*				23.9	152.2	99.6	0	0	0	0	0	118.6
713	P	26.3	Very low	22.9	Very low	118 Å²	118	128.1 Å²	128.1	77%	0.766	75%	0.749	S	S	*	*			cis	-147.4	168.2	29.9	38.1	-15.9	0	0	0	118.2
714	N	19.2	Very low	22.8	Very low	149 Å²	149	131.1 Å²	131.1	80%	0.797	76%	0.759	S	S	*	*			trans	-35.7	141.5	150.3	-52.1	-53.5	0	0	0	113.3
715	L	23.6	Very low	22.7	Very low	162 Å²	162	132 Å²	132	85%	0.848	76%	0.763	S	S	*	*				-174.8	138.7	107.4	-144.2	67.1	0	0	0	111.9
716	S	20.8	Very low	22.6	Very low	99 Å²	99	131.9 Å²	131.9	69%	0.692	77%	0.767	S	S	*	*			trans	-33.3	133.6	168.1	53.7	0	0	0	0	117.2
717	S	23.1	Very low	22.5	Very low	117 Å²	117	130.1 Å²	130.1	82%	0.818	77%	0.767	S	S	*	*				-159.7	114.8	124.2	43.2	0	0	0	0	110.4
718	S	21.7	Very low	22.4	Very low	111 Å²	111	133 Å²	133	78%	0.776	77%	0.774	S	S	*	*			trans	-68.7	128.4	163.8	33.3	0	0	0	0	109.5
719	S	22.3	Very low	22.4	Very low	112 Å²	112	135.1 Å²	135.1	78%	0.783	78%	0.781	S	S	*	*				154.3	145.1	123.9	53.9	0	0	0	0	113.9
720	S	24.3	Very low	22.2	Very low	114 Å²	114	136.5 Å²	136.5	80%	0.797	79%	0.788	S	S	*	*			trans	86.8	96.7	164.9	76.6	0	0	0	0	117.6
721	S	22	Very low	22.3	Very low	104 Å²	104	135.8 Å²	135.8	73%	0.727	79%	0.791	S	S	*	*			trans	-44.4	134.7	161	57.3	0	0	0	0	114.1
722	Y	21.9	Very low	22.2	Very low	234 Å²	234	135.3 Å²	135.3	92%	0.918	79%	0.794	S	S	*	*				-157.6	113.9	128.9	-103.3	-76.1	0	0	0	109.6
723	G	22.8	Very low	22.1	Very low	71 Å²	71	141.4 Å²	141.4	73%	0.732	80%	0.8	S	S	*	*			trans	60.2	111	148.2	0	0	0	0	0	119.2
724	Q	22.3	Very low	22	Very low	198 Å²	198	144.5 Å²	144.5	93%	0.925	80%	0.804	S	S	*	*			trans	-156.8	131.5	131.7	-127.8	167.2	-38.1	0	0	112.6
725	I	20.2	Very low	22.1	Very low	147 Å²	147	145 Å²	145	75%	0.754	80%	0.801	S	S	*	*			trans	-82.6	145.5	170.8	-62.7	165.6	0	0	0	107.2
726	T	21.9	Very low	22.1	Very low	126 Å²	126	142.2 Å²	142.2	77%	0.773	80%	0.796	S	S	*	*			trans	114.3	141.8	151.6	66.4	0	0	0	0	120.6
727	S	22.9	Very low	22	Very low	108 Å²	108	146 Å²	146	76%	0.755	80%	0.803	S	S	*	*			trans	83	105.9	174.8	75.5	0	0	0	0	115.4
728	I	21.3	Very low	22.1	Very low	154 Å²	154	149 Å²	149	79%	0.79	81%	0.809	S	S	*	*				60.2	107.5	69.9	-57.9	174.1	0	0	0	112
729	N	22.2	Very low	22	Very low	156 Å²	156	151.6 Å²	151.6	83%	0.834	81%	0.808	S	S	*	*			trans	-167.9	115.7	138.7	-90.7	-19.3	0	0	0	111.1
730	N	19.9	Very low	22	Very low	164 Å²	164	153 Å²	153	88%	0.877	80%	0.802	S	S	*	*			trans	-93.4	144.3	163.4	-87.4	-12	0	0	0	109.3
731	P	23.9	Very low	22	Very low	120 Å²	120	155.7 Å²	155.7	78%	0.779	81%	0.808	S	S	*	*			trans	-140.9	128.7	142.6	30.4	-11.3	0	0	0	115.6
732	F	21.4	Very low	22	Very low	197 Å²	197	158.5 Å²	158.5	86%	0.864	81%	0.809	S	S	*	*			trans	6.4	130.5	147.3	-76.3	-93.9	0	0	0	124.4
733	R	20.2	Very low	22.1	Very low	208 Å²	208	156.2 Å²	156.2	79%	0.785	81%	0.807	S	S	*	*				49.3	121.4	117.1	-164	-178.9	-163	169.7	5.7	122.1
734	E	24.5	Very low	22.2	Very low	183 Å²	183	160.6 Å²	160.6	86%	0.855	81%	0.813	S	S	*	*			trans	-177.9	115.8	141.4	-101.4	166.6	-164.5	0	0	108.2
735	Q	20.3	Very low	22.2	Very low	159 Å²	159	159.1 Å²	159.1	74%	0.743	81%	0.812	S	S	*	*				82.2	118.9	70.9	-98.5	179.6	-19.2	0	0	117.6
736	S	23.3	Very low	22.3	Very low	104 Å²	104	159.1 Å²	159.1	73%	0.727	81%	0.813	S	S	*	*			trans	74.1	119.2	147.7	54.4	0	0	0	0	124.3
737	Q	19.6	Very low	22.5	Very low	180 Å²	180	160.1 Å²	160.1	84%	0.841	81%	0.814	S	S	*	*			trans	75.1	118.5	134	-67.6	-175.5	-24.1	0	0	122
738	L	25.3	Very low	22.6	Very low	180 Å²	180	164.9 Å²	164.9	94%	0.942	82%	0.824	S	S	*	*				-168	135.8	121.7	-104	153	0	0	0	112
739	E	20.5	Very low	22.8	Very low	164 Å²	164	161.5 Å²	161.5	77%	0.766	82%	0.819	S	S	*	*			trans	-88.8	166.8	-171.5	-66.6	164.8	133	0	0	114
740	H	20.6	Very low	22.9	Very low	142 Å²	142	160.4 Å²	160.4	66%	0.657	81%	0.813	S	S	*	*			trans	72.2	96	161.3	-71.3	-69.2	0	0	0	119.8
741	N	24.5	Very low	23.3	Very low	171 Å²	171	156 Å²	156	91%	0.914	80%	0.799	S	S	*	*				-149	113.5	123.1	-95	-31.5	0	0	0	109.7
742	E	22.4	Very low	23.4	Very low	163 Å²	163	155.4 Å²	155.4	76%	0.762	79%	0.79	S	S	*	*			trans	-71.7	161.3	170.2	-74	166.7	117.2	0	0	111.4
743	Q	23.6	Very low	23.9	Very low	186 Å²	186	152.7 Å²	152.7	87%	0.869	78%	0.775	S	S	*	*			trans	85.6	77.7	171.7	-64.9	169.2	-23	0	0	117.6
744	N	24.8	Very low	24.4	Very low	162 Å²	162	150.1 Å²	150.1	87%	0.866	78%	0.776	S	S	*	*				-176.1	87.3	124.5	-95.4	-23.6	0	0	0	109.9
745	N	22.8	Very low	24.6	Very low	168 Å²	168	148.3 Å²	148.3	90%	0.898	77%	0.773	S	S	*	*			trans	-91.8	96.4	165.9	-94.9	-7.5	0	0	0	108
746	D	23.2	Very low	25.3	Very low	146 Å²	146	148.3 Å²	148.3	78%	0.781	78%	0.778	S	S	*	*			trans	-167.8	99.1	153.1	-90.1	-28.7	0	0	0	106.6
747	N	25.7	Very low	25.9	Very low	147 Å²	147	149.6 Å²	149.6	79%	0.786	78%	0.777	S	S	*	*			trans	167.1	80.6	143.2	-80.7	-39.2	0	0	0	110.2	A749	N747-A749 VanDerWaalsContact C-N 3.31Å; N747-A749 PolarHBondContact O-N 2.98Å
748	H	24.1	Very low	26.8	Very low	209 Å²	209	149.1 Å²	149.1	97%	0.968	78%	0.78	S	S	*	*			trans	-58.1	92.3	149.7	-87.5	-72.9	0	0	0	109.3
749	A	26.4	Very low	27.6	Very low	82 Å²	82	145.2 Å²	145.2	68%	0.678	76%	0.764	S	S	*	*			trans	-165.8	44.9	164	0	0	0	0	0	111	N747	N747-A749 VanDerWaalsContact C-N 3.31Å; N747-A749 PolarHBondContact O-N 2.98Å
750	N	23.8	Very low	28.7	Very low	133 Å²	133	141.9 Å²	141.9	71%	0.711	75%	0.751	S	S	*	*			trans	-145.1	62.2	-179.1	-75.7	-52	0	0	0	111.9
751	A	27.9	Very low	29.9	Very low	71 Å²	71	140.3 Å²	140.3	59%	0.587	74%	0.743	S	S	*	*			trans	-154.3	150	160.6	0	0	0	0	0	108
752	D	26.4	Very low	31	Very low	109 Å²	109	137 Å²	137	58%	0.583	73%	0.728	S	S	*	*			trans	80.2	59.8	168.1	-44.6	-23.8	0	0	0	117.7	R763	D752-R763 PolarHBondContact O-NH1 3.45Å; D752-R763 PolarHBondContact O-NH2 2.93Å; D752-R763 VanDerWaalsContact O-NH2 3.08Å
753	Y	31.6	Very low	32.6	Very low	139 Å²	139	134.8 Å²	134.8	55%	0.545	71%	0.713	S	S	.	*	S	Bend	trans	-133.6	94.2	146.6	-79.9	-80.6	0	0	0	106.8
754	D	30.8	Very low	34.4	Very low	154 Å²	154	128.4 Å²	128.4	82%	0.824	68%	0.681	S	S	*	*	S	Bend	trans	143	67.4	166.5	-76.3	-14	0	0	0	107.2
755	N	28.6	Very low	36.4	Very low	145 Å²	145	123.9 Å²	123.9	78%	0.775	66%	0.657	S	S	*	*	S	Bend	trans	-148.2	137.2	159.2	-82.7	-39.5	0	0	0	107	D757	N755-D757 PolarHBondContact O-N 2.92Å
756	D	35	Very low	38.6	Very low	159 Å²	159	117.5 Å²	117.5	85%	0.85	62%	0.624	S	S	*	*	S	Bend	trans	-56.6	109.1	-167.5	-60.6	-69.9	0	0	0	113.2
757	D	35.5	Very low	41.2	Very low	132 Å²	132	112.5 Å²	112.5	71%	0.706	60%	0.595	S	S	*	*			trans	-162.6	84.2	154.6	-100.4	-28.3	0	0	0	107.8	N755 T759	N755-D757 PolarHBondContact O-N 2.92Å; D757-T759 PolarHBondContact O-N 3.32Å
758	D	39.1	Very low	43.6	Very low	170 Å²	170	109.6 Å²	109.6	91%	0.909	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	13.4	172.8	-90.5	-28.1	0	0	0	113.2
759	T	41.7	Very low	46	Very low	98 Å²	98	104.8 Å²	104.8	60%	0.601	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.1	-16.4	-171	33.6	0	0	0	0	114.5	D757 F761	D757-T759 PolarHBondContact O-N 3.32Å; T759-F761 VanDerWaalsContact O-CD2 3.29Å; T759-F761 WeakPolarHBondContact O-CD2 3.38Å; T759-F761 PolarHBondContact O-N 2.7Å
760	D	43.4	Very low	48.2	Very low	93 Å²	93	101.9 Å²	101.9	50%	0.497	53%	0.527	S	S	.	.			trans	-85.2	82.3	176.8	-167.2	6.7	0	0	0	112	T762	D760-T762 PolarHBondContact O-N 3.08Å; D760-T762 VanDerWaalsContact O-N 3.09Å; D760-T762 WeakPolarHBondContact OD1-CB 3.25Å; D760-T762 PolarHBondContact OD1-N 3.44Å; D760-T762 VanDerWaalsContact OD1-N 3.15Å; D760-T762 PolarHBondContact OD1-OG1 3.29Å
761	F	46.4	Very low	50.8	Low	110 Å²	110	101.8 Å²	101.8	48%	0.482	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-2.3	176.1	-67.9	-83.1	0	0	0	113.9	P528 T759	P528-F761 HydrophobicContact CB-CD1 4.47Å; P528-F761 HydrophobicContact CG-CD1 4.13Å; T759-F761 VanDerWaalsContact O-CD2 3.29Å; T759-F761 WeakPolarHBondContact O-CD2 3.38Å; T759-F761 PolarHBondContact O-N 2.7Å
762	T	48.4	Very low	53.3	Low	100 Å²	100	106.4 Å²	106.4	61%	0.613	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-17.3	-173	74.1	0	0	0	0	114.2	D760 Y764	D760-T762 PolarHBondContact O-N 3.08Å; D760-T762 VanDerWaalsContact O-N 3.09Å; D760-T762 WeakPolarHBondContact OD1-CB 3.25Å; D760-T762 PolarHBondContact OD1-N 3.44Å; D760-T762 VanDerWaalsContact OD1-N 3.15Å; D760-T762 PolarHBondContact OD1-OG1 3.29Å; T762-Y764 PolarHBondContact O-N 2.87Å
763	R	55.7	Low	56	Low	117 Å²	117	102.1 Å²	102.1	44%	0.442	51%	0.509	S	S	.	.	S	Bend	trans	-73.3	126.6	-175.2	-147.2	166.1	-173.5	-168.7	-1.6	112.1	D752 I765	D752-R763 PolarHBondContact O-NH1 3.45Å; D752-R763 PolarHBondContact O-NH2 2.93Å; D752-R763 VanDerWaalsContact O-NH2 3.08Å; R763-I765 WeakPolarHBondContact O-CG1 3.29Å; R763-I765 PolarHBondContact O-N 3.46Å
764	Y	60.9	Low	58.5	Low	52 Å²	52	103.2 Å²	103.2	20%	0.204	52%	0.517	C	S	.	.			trans	-67.8	125.5	178.8	178.2	-90.1	0	0	0	110.7	V661 T662 E663 T762 Y767	V661-Y764 VanDerWaalsContact O-CE1 3.25Å; V661-Y764 WeakPolarHBondContact O-CE1 3.31Å; V661-Y764 PolarHBondContact O-OH 3.32Å; T662-Y764 PolarHBondContact O-OH 2.71Å; E663-Y764 HydrophobicContact CB-CD1 3.87Å; E663-Y764 HydrophobicContact CB-CE1 4.43Å; E663-Y764 HydrophobicContact CB-CG 3.99Å; E663-Y764 HydrophobicContact CG-CG 4.34Å; T762-Y764 PolarHBondContact O-N 2.87Å; Y764-Y767 HydrophobicContact CE2-CE1 4.44Å; Y764-Y767 VanDerWaalsContact OH-CE1 3.28Å; Y764-Y767 WeakPolarHBondContact OH-CE1 3.28Å
765	I	67.5	Low	61.3	Low	68 Å²	68	101.6 Å²	101.6	35%	0.349	51%	0.507	S	S	.	.			trans	-110.4	127.8	177.8	-35	172.7	0	0	0	108.3	R527 P528 R763	R527-I765 HydrophobicContact CG-CD1 4.28Å; R527-I765 PolarHBondContact NH2-O 3.45Å; P528-I765 HydrophobicContact CB-CD1 4.26Å; P528-I765 HydrophobicContact CG-CD1 4.12Å; R763-I765 WeakPolarHBondContact O-CG1 3.29Å; R763-I765 PolarHBondContact O-N 3.46Å
766	P	69.7	Low	64.2	Low	34 Å²	34	98.2 Å²	98.2	22%	0.221	48%	0.484	C	S	.	.			trans	-67.3	144.4	-172.1	23.8	-35.2	0	0	0	114	R527 F654 I660	R527-P766 VanDerWaalsContact CZ-O 3.31Å; R527-P766 PolarHBondContact NH1-O 3.17Å; R527-P766 VanDerWaalsContact NH1-O 3.08Å; R527-P766 PolarHBondContact NH2-O 3.47Å; F654-P766 WeakPolarHBondContact CZ-O 3.43Å; I660-P766 HydrophobicContact CB-CB 4.11Å; I660-P766 HydrophobicContact CD1-CB 3.9Å; I660-P766 HydrophobicContact CD1-CG 4.29Å
767	Y	77.3	Confident	66.7	Low	41 Å²	41	92.7 Å²	92.7	16%	0.161	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	153.1	177.6	64.8	-87.9	0	0	0	112.8	R527 Y647 I660 V661 Y764 F773	R527-Y767 VanDerWaalsContact NH1-CB 3.32Å; Y647-Y767 HydrophobicContact CD2-CD1 4.13Å; Y647-Y767 AromaticContact CD2-CD2 3.74Å; Y647-Y767 HydrophobicContact CD2-CD2 3.74Å; Y647-Y767 HydrophobicContact CD2-CE1 4.25Å; Y647-Y767 AromaticContact CD2-CE2 3.87Å; Y647-Y767 HydrophobicContact CD2-CE2 3.87Å; Y647-Y767 AromaticContact CD2-CG 3.88Å; Y647-Y767 HydrophobicContact CD2-CG 3.88Å; Y647-Y767 HydrophobicContact CE2-CE1 4.3Å; Y647-Y767 HydrophobicContact CE2-CE2 4.36Å; I660-Y767 WeakPolarHBondContact CA-O 3.5Å; V661-Y767 HydrophobicContact CB-CE1 4.14Å; V661-Y767 HydrophobicContact CB-CE2 4.33Å; V661-Y767 HydrophobicContact CG1-CE1 4.39Å; V661-Y767 HydrophobicContact CG2-CD2 4.48Å; V661-Y767 HydrophobicContact CG2-CE2 3.98Å; V661-Y767 PolarHBondContact N-O 3.46Å; Y764-Y767 HydrophobicContact CE2-CE1 4.44Å; Y764-Y767 VanDerWaalsContact OH-CE1 3.28Å; Y764-Y767 WeakPolarHBondContact OH-CE1 3.28Å; Y767-F773 HydrophobicContact CD2-CE2 4.37Å; Y767-F773 HydrophobicContact CD2-CZ 4.29Å; Y767-F773 HydrophobicContact CE2-CE1 4.11Å; Y767-F773 AromaticContact CE2-CE2 3.91Å; Y767-F773 HydrophobicContact CE2-CE2 3.91Å; Y767-F773 AromaticContact CE2-CZ 3.48Å; Y767-F773 HydrophobicContact CE2-CZ 3.48Å; Y767-F773 VanDerWaalsContact CE2-CZ 3.48Å
768	K	76.1	Confident	69.3	Low	86 Å²	86	89.9 Å²	89.9	37%	0.374	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	120.8	172.9	-177.3	173.5	-178.7	166	0	110.4	S646 D658	S646-K768 PolarHBondContact OG-O 3.23Å; D658-K768 HydrophobicContact CB-CD 4.4Å; D658-K768 VanDerWaalsContact CG-NZ 3.35Å; D658-K768 WeakPolarHBondContact OD1-CE 3.12Å; D658-K768 IonicContact OD1-NZ 2.84Å; D658-K768 PolarHBondContact OD1-NZ 3.02Å; D658-K768 IonicContact OD2-NZ 3.89Å; D658-K768 PolarHBondContact OD2-NZ 3.17Å
769	R	74	Confident	71.8	Confident	108 Å²	108	82.7 Å²	82.7	41%	0.408	41%	0.407	S	S	.	.			trans	-85.8	111.9	174.2	-165.6	-175.4	-166.7	179.9	4.8	109.6	V661 E667 F773	V661-R769 HydrophobicContact CG2-CB 3.82Å; E667-R769 WeakPolarHBondContact OE1-CD 3.49Å; E667-R769 IonicContact OE1-CZ 3.57Å; E667-R769 IonicContact OE1-NE 3.3Å; E667-R769 IonicContact OE1-NH1 3.34Å; E667-R769 PolarHBondContact OE1-NH1 3.36Å; R769-F773 HydrophobicContact CG-CB 3.74Å; R769-F773 HydrophobicContact CG-CD1 4.13Å; R769-F773 HydrophobicContact CG-CD2 4.05Å; R769-F773 HydrophobicContact CG-CG 3.73Å
770	G	72.5	Confident	74.1	Confident	21 Å²	21	79 Å²	79	22%	0.216	38%	0.384	C	S	.	.			trans	-76.4	161.4	176.2	0	0	0	0	0	113.3	F772 F773	G770-F772 PolarHBondContact O-N 2.94Å; G770-F773 WeakPolarHBondContact O-CB 3.19Å; G770-F773 PolarHBondContact O-N 3.36Å
771	N	78.3	Confident	76.3	Confident	130 Å²	130	78.5 Å²	78.5	70%	0.695	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	134.8	171.5	-63.5	-3.2	0	0	0	110.4	R776	N771-R776 PolarHBondContact O-NE 3.3Å; N771-R776 PolarHBondContact O-NH2 3.28Å
772	F	80.2	Confident	78.5	Confident	168 Å²	168	78.7 Å²	78.7	74%	0.737	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	39.1	-173.8	-55.9	-81.2	0	0	0	114.9	G770 K774 L775 R776	G770-F772 PolarHBondContact O-N 2.94Å; F772-K774 VanDerWaalsContact C-N 3.33Å; F772-K774 PolarHBondContact O-N 3.1Å; F772-L775 HydrophobicContact CB-CB 4.23Å; F772-L775 PolarHBondContact O-N 2.94Å; F772-L775 VanDerWaalsContact O-N 3.1Å; F772-R776 PolarHBondContact O-N 3.3Å; F772-R776 VanDerWaalsContact O-N 3.11Å
773	F	83.2	Confident	80.6	Confident	19 Å²	19	76 Å²	76	8%	0.083	37%	0.368	C	S	.	.	H	α-helix	trans	-49.9	-44.5	-177.6	-172.8	-113	0	0	0	114.9	L644 Y647 Y767 R769 G770 L775 R776 I777	L644-F773 HydrophobicContact CD2-CD2 3.88Å; L644-F773 HydrophobicContact CD2-CE2 3.8Å; Y647-F773 HydrophobicContact CD2-CE2 4.18Å; Y647-F773 AromaticContact CD2-CZ 3.79Å; Y647-F773 HydrophobicContact CD2-CZ 3.79Å; Y647-F773 AromaticContact CE2-CZ 3.9Å; Y647-F773 HydrophobicContact CE2-CZ 3.9Å; Y647-F773 HydrophobicContact CG-CE2 4.19Å; Y647-F773 HydrophobicContact CG-CZ 4.18Å; Y767-F773 HydrophobicContact CD2-CE2 4.37Å; Y767-F773 HydrophobicContact CD2-CZ 4.29Å; Y767-F773 HydrophobicContact CE2-CE1 4.11Å; Y767-F773 AromaticContact CE2-CE2 3.91Å; Y767-F773 HydrophobicContact CE2-CE2 3.91Å; Y767-F773 AromaticContact CE2-CZ 3.48Å; Y767-F773 HydrophobicContact CE2-CZ 3.48Å; Y767-F773 VanDerWaalsContact CE2-CZ 3.48Å; R769-F773 HydrophobicContact CG-CB 3.74Å; R769-F773 HydrophobicContact CG-CD1 4.13Å; R769-F773 HydrophobicContact CG-CD2 4.05Å; R769-F773 HydrophobicContact CG-CG 3.73Å; G770-F773 WeakPolarHBondContact O-CB 3.19Å; G770-F773 PolarHBondContact O-N 3.36Å; F773-L775 PolarHBondContact O-N 3.34Å; F773-R776 PolarHBondContact O-N 3.28Å; F773-I777 HydrophobicContact CD1-CD1 3.66Å; F773-I777 HydrophobicContact CE1-CD1 3.2Å; F773-I777 HydrophobicContact CE1-CG1 4.27Å; F773-I777 HydrophobicContact CE2-CD1 4.18Å; F773-I777 HydrophobicContact CE2-CG1 4.49Å; F773-I777 HydrophobicContact CG-CD1 4.34Å; F773-I777 HydrophobicContact CZ-CD1 3.49Å; F773-I777 VanDerWaalsContact CZ-CD1 3.49Å; F773-I777 HydrophobicContact CZ-CG1 4.24Å; F773-I777 PolarHBondContact O-N 3.16Å
774	K	85.1	Confident	82.3	Confident	162 Å²	162	74 Å²	74	70%	0.704	37%	0.365	S	S	*	.	H	α-helix	trans	-61.5	-43.9	179.1	-69.3	-175.6	178.9	-178.9	0	112.3	F772 R776 I777 T778	F772-K774 VanDerWaalsContact C-N 3.33Å; F772-K774 PolarHBondContact O-N 3.1Å; K774-R776 VanDerWaalsContact C-N 3.31Å; K774-R776 PolarHBondContact O-N 2.98Å; K774-I777 PolarHBondContact O-N 3.34Å; K774-T778 PolarHBondContact O-N 3.13Å; K774-T778 PolarHBondContact O-OG1 3.46Å
775	L	88.9	Confident	83.7	Confident	120 Å²	120	73.7 Å²	73.7	63%	0.628	37%	0.366	S	S	*	.	H	α-helix	trans	-64	-38.4	178	-175	69.4	0	0	0	111.4	F772 F773 T778 G779	F772-L775 HydrophobicContact CB-CB 4.23Å; F772-L775 PolarHBondContact O-N 2.94Å; F772-L775 VanDerWaalsContact O-N 3.1Å; F773-L775 PolarHBondContact O-N 3.34Å; L775-T778 VanDerWaalsContact CA-OG1 3.31Å; L775-T778 WeakPolarHBondContact CA-OG1 3.46Å; L775-T778 PolarHBondContact O-N 3.36Å; L775-T778 PolarHBondContact O-OG1 2.92Å; L775-G779 PolarHBondContact O-N 3.26Å
776	R	89.3	Confident	84.8	Confident	74 Å²	74	74 Å²	74	28%	0.279	37%	0.372	S	S	.	.	H	α-helix	trans	-66.2	-39.3	175.5	-63.8	174.8	-176.9	-145.2	4.8	111.7	L642 G643 L644 N771 F772 F773 K774 G779 L780	L642-R776 VanDerWaalsContact O-CD 3.32Å; L642-R776 WeakPolarHBondContact O-CD 3.26Å; L642-R776 PolarHBondContact O-NH1 2.73Å; G643-R776 PolarHBondContact O-NH1 3.49Å; L644-R776 HydrophobicContact CD1-CB 3.85Å; L644-R776 HydrophobicContact CD2-CB 4.03Å; L644-R776 HydrophobicContact CG-CB 4.02Å; N771-R776 PolarHBondContact O-NE 3.3Å; N771-R776 PolarHBondContact O-NH2 3.28Å; F772-R776 PolarHBondContact O-N 3.3Å; F772-R776 VanDerWaalsContact O-N 3.11Å; F773-R776 PolarHBondContact O-N 3.28Å; K774-R776 VanDerWaalsContact C-N 3.31Å; K774-R776 PolarHBondContact O-N 2.98Å; R776-G779 PolarHBondContact O-N 3.34Å; R776-L780 PolarHBondContact O-N 3.43Å
777	I	87.3	Confident	85.9	Confident	44 Å²	44	74 Å²	74	23%	0.226	37%	0.372	C	S	.	.	H	α-helix	trans	-66.1	-44.6	174.2	-70	172.3	0	0	0	111.3	F773 K774 G779 L780 I781	F773-I777 HydrophobicContact CD1-CD1 3.66Å; F773-I777 HydrophobicContact CE1-CD1 3.2Å; F773-I777 HydrophobicContact CE1-CG1 4.27Å; F773-I777 HydrophobicContact CE2-CD1 4.18Å; F773-I777 HydrophobicContact CE2-CG1 4.49Å; F773-I777 HydrophobicContact CG-CD1 4.34Å; F773-I777 HydrophobicContact CZ-CD1 3.49Å; F773-I777 VanDerWaalsContact CZ-CD1 3.49Å; F773-I777 HydrophobicContact CZ-CG1 4.24Å; F773-I777 PolarHBondContact O-N 3.16Å; K774-I777 PolarHBondContact O-N 3.34Å; I777-G779 PolarHBondContact O-N 2.87Å; I777-L780 WeakPolarHBondContact O-CA 3.41Å; I777-L780 WeakPolarHBondContact O-CB 3.42Å; I777-L780 PolarHBondContact O-N 2.86Å; I777-L780 VanDerWaalsContact O-N 3.07Å; I777-I781 HydrophobicContact CG2-CD1 4.08Å; I777-I781 WeakPolarHBondContact O-CG1 3.49Å; I777-I781 PolarHBondContact O-N 3.22Å
778	T	89.5	Confident	86.5	Confident	73 Å²	73	73.4 Å²	73.4	45%	0.448	37%	0.372	S	S	.	.	H	α-helix	trans	-61.8	-38.4	175.6	51.2	0	0	0	0	111	K774 L775 I781 L782	K774-T778 PolarHBondContact O-N 3.13Å; K774-T778 PolarHBondContact O-OG1 3.46Å; L775-T778 VanDerWaalsContact CA-OG1 3.31Å; L775-T778 WeakPolarHBondContact CA-OG1 3.46Å; L775-T778 PolarHBondContact O-N 3.36Å; L775-T778 PolarHBondContact O-OG1 2.92Å; T778-I781 PolarHBondContact O-N 3.21Å; T778-L782 WeakPolarHBondContact O-CG 3.43Å; T778-L782 PolarHBondContact O-N 3.02Å
779	G	91.7	Very high	87.3	Confident	18 Å²	18	70.5 Å²	70.5	19%	0.186	36%	0.36	C	S	.	.	H	α-helix	trans	-60.9	-42	170.9	0	0	0	0	0	112.6	L775 R776 I777 L782 I783	L775-G779 PolarHBondContact O-N 3.26Å; R776-G779 PolarHBondContact O-N 3.34Å; I777-G779 PolarHBondContact O-N 2.87Å; G779-L782 PolarHBondContact O-N 2.91Å; G779-I783 WeakPolarHBondContact O-CB 3.44Å; G779-I783 VanDerWaalsContact O-CG1 3.24Å; G779-I783 WeakPolarHBondContact O-CG1 3.41Å; G779-I783 PolarHBondContact O-N 3.05Å
780	L	91.6	Very high	88.2	Confident	21 Å²	21	68.8 Å²	68.8	11%	0.11	36%	0.364	C	S	.	.	H	α-helix	trans	-60.2	-45.9	174.8	178	66.2	0	0	0	111.5	V638 L642 L644 L648 R776 I777 I783 L784	V638-L780 HydrophobicContact CG1-CD1 3.51Å; L642-L780 HydrophobicContact CD1-CB 3.67Å; L642-L780 HydrophobicContact CD1-CD1 4.15Å; L644-L780 HydrophobicContact CD1-CB 4.31Å; L644-L780 HydrophobicContact CD1-CD2 4.38Å; L648-L780 HydrophobicContact CD1-CD2 4.22Å; R776-L780 PolarHBondContact O-N 3.43Å; I777-L780 WeakPolarHBondContact O-CA 3.41Å; I777-L780 WeakPolarHBondContact O-CB 3.42Å; I777-L780 PolarHBondContact O-N 2.86Å; I777-L780 VanDerWaalsContact O-N 3.07Å; L780-I783 PolarHBondContact O-N 3.4Å; L780-L784 VanDerWaalsContact O-CB 3.29Å; L780-L784 WeakPolarHBondContact O-CB 3.03Å; L780-L784 PolarHBondContact O-N 2.97Å
781	I	89.3	Confident	89	Confident	83 Å²	83	72.6 Å²	72.6	43%	0.426	38%	0.378	S	S	.	.	H	α-helix	trans	-64.5	-42.4	178.6	-66	168.7	0	0	0	110.6	I777 T778 L784 I785	I777-I781 HydrophobicContact CG2-CD1 4.08Å; I777-I781 WeakPolarHBondContact O-CG1 3.49Å; I777-I781 PolarHBondContact O-N 3.22Å; T778-I781 PolarHBondContact O-N 3.21Å; I781-L784 WeakPolarHBondContact O-CB 3.4Å; I781-L784 PolarHBondContact O-N 3.45Å; I781-I785 HydrophobicContact CG2-CD1 3.78Å; I781-I785 HydrophobicContact CG2-CG1 4.4Å; I781-I785 WeakPolarHBondContact O-CB 2.96Å; I781-I785 VanDerWaalsContact O-CG1 3.29Å; I781-I785 WeakPolarHBondContact O-CG1 3.28Å; I781-I785 PolarHBondContact O-N 2.97Å
782	L	91.8	Very high	89.6	Confident	113 Å²	113	66.9 Å²	66.9	59%	0.592	35%	0.349	S	S	*	.	H	α-helix	trans	-64.4	-42.1	175.8	-71.8	169.8	0	0	0	111.9	T778 G779 L784 I785 T786	T778-L782 WeakPolarHBondContact O-CG 3.43Å; T778-L782 PolarHBondContact O-N 3.02Å; G779-L782 PolarHBondContact O-N 2.91Å; L782-L784 VanDerWaalsContact C-N 3.34Å; L782-I785 PolarHBondContact O-N 3.5Å; L782-T786 WeakPolarHBondContact O-CB 3.41Å; L782-T786 VanDerWaalsContact O-CG2 3.28Å; L782-T786 WeakPolarHBondContact O-CG2 3.25Å; L782-T786 PolarHBondContact O-N 2.97Å; L782-T786 PolarHBondContact O-OG1 3.47Å
783	I	93.1	Very high	90.1	Very high	45 Å²	45	60.4 Å²	60.4	23%	0.231	32%	0.322	C	S	.	.	H	α-helix	trans	-65.9	-37.5	175.6	-69.1	170.5	0	0	0	111	W634 V638 L641 L642 G779 L780 T786 S787	W634-I783 HydrophobicContact CZ2-CG2 4.18Å; V638-I783 HydrophobicContact CG1-CB 4.5Å; V638-I783 HydrophobicContact CG1-CD1 4.47Å; V638-I783 HydrophobicContact CG1-CG2 3.92Å; V638-I783 HydrophobicContact CG2-CG2 3.73Å; L641-I783 HydrophobicContact CD2-CD1 4.1Å; L642-I783 HydrophobicContact CD1-CD1 4.12Å; L642-I783 HydrophobicContact CD2-CD1 4.29Å; L642-I783 HydrophobicContact CG-CD1 4.25Å; G779-I783 WeakPolarHBondContact O-CB 3.44Å; G779-I783 VanDerWaalsContact O-CG1 3.24Å; G779-I783 WeakPolarHBondContact O-CG1 3.41Å; G779-I783 PolarHBondContact O-N 3.05Å; L780-I783 PolarHBondContact O-N 3.4Å; I783-T786 VanDerWaalsContact CA-OG1 3.29Å; I783-T786 WeakPolarHBondContact CA-OG1 3.43Å; I783-T786 PolarHBondContact O-OG1 3.49Å; I783-T786 VanDerWaalsContact O-OG1 3.05Å; I783-S787 WeakPolarHBondContact O-CB 3.22Å; I783-S787 PolarHBondContact O-N 2.95Å; I783-S787 PolarHBondContact O-OG 2.88Å
784	L	90.9	Very high	90.4	Very high	73 Å²	73	63 Å²	63	38%	0.382	34%	0.34	S	S	.	.	H	α-helix	trans	-64.6	-48.4	174.1	-177	92.1	0	0	0	111.2	W634 L780 I781 L782 T786 S787 L788	W634-L784 HydrophobicContact CH2-CB 4.28Å; W634-L784 HydrophobicContact CH2-CD1 3.61Å; W634-L784 HydrophobicContact CZ2-CD1 4.37Å; W634-L784 HydrophobicContact CZ3-CD1 4.18Å; L780-L784 VanDerWaalsContact O-CB 3.29Å; L780-L784 WeakPolarHBondContact O-CB 3.03Å; L780-L784 PolarHBondContact O-N 2.97Å; I781-L784 WeakPolarHBondContact O-CB 3.4Å; I781-L784 PolarHBondContact O-N 3.45Å; L782-L784 VanDerWaalsContact C-N 3.34Å; L784-T786 PolarHBondContact O-N 3.45Å; L784-S787 PolarHBondContact O-N 3.41Å; L784-S787 PolarHBondContact O-OG 2.92Å; L784-L788 HydrophobicContact CD2-CD1 4.42Å; L784-L788 HydrophobicContact CG-CD1 4.18Å; L784-L788 WeakPolarHBondContact O-CB 3.48Å; L784-L788 VanDerWaalsContact O-CG 3.26Å; L784-L788 WeakPolarHBondContact O-CG 3.36Å; L784-L788 PolarHBondContact O-N 3.5Å
785	I	90.6	Very high	90.5	Very high	47 Å²	47	59 Å²	59	24%	0.241	33%	0.329	C	S	.	.	H	α-helix	trans	-62.5	-46.7	179.5	-71.5	168.3	0	0	0	110	L573 I781 L782 S787 L788 I789	L573-I785 HydrophobicContact CD1-CG2 3.95Å; I781-I785 HydrophobicContact CG2-CD1 3.78Å; I781-I785 HydrophobicContact CG2-CG1 4.4Å; I781-I785 WeakPolarHBondContact O-CB 2.96Å; I781-I785 VanDerWaalsContact O-CG1 3.29Å; I781-I785 WeakPolarHBondContact O-CG1 3.28Å; I781-I785 PolarHBondContact O-N 2.97Å; L782-I785 PolarHBondContact O-N 3.5Å; I785-S787 PolarHBondContact O-N 3.29Å; I785-L788 PolarHBondContact O-N 3.28Å; I785-I789 HydrophobicContact CG2-CD1 3.71Å; I785-I789 HydrophobicContact CG2-CG1 4.47Å; I785-I789 WeakPolarHBondContact O-CD1 3.43Å; I785-I789 VanDerWaalsContact O-CG1 3.23Å; I785-I789 WeakPolarHBondContact O-CG1 3.22Å; I785-I789 PolarHBondContact O-N 3.13Å
786	T	91.4	Very high	90.3	Very high	75 Å²	75	54.7 Å²	54.7	46%	0.46	31%	0.306	S	S	.	.	H	α-helix	trans	-64.8	-38.4	177.4	52.1	0	0	0	0	112.2	L782 I783 L784 I789 C790	L782-T786 WeakPolarHBondContact O-CB 3.41Å; L782-T786 VanDerWaalsContact O-CG2 3.28Å; L782-T786 WeakPolarHBondContact O-CG2 3.25Å; L782-T786 PolarHBondContact O-N 2.97Å; L782-T786 PolarHBondContact O-OG1 3.47Å; I783-T786 VanDerWaalsContact CA-OG1 3.29Å; I783-T786 WeakPolarHBondContact CA-OG1 3.43Å; I783-T786 PolarHBondContact O-OG1 3.49Å; I783-T786 VanDerWaalsContact O-OG1 3.05Å; L784-T786 PolarHBondContact O-N 3.45Å; T786-I789 PolarHBondContact O-N 3.45Å; T786-C790 WeakPolarHBondContact O-CB 3.35Å; T786-C790 PolarHBondContact O-N 2.85Å; T786-C790 PolarHBondContact O-SG 3.39Å
787	S	92.2	Very high	90.3	Very high	33 Å²	33	53.2 Å²	53.2	23%	0.231	30%	0.303	C	S	.	.	H	α-helix	trans	-66.6	-38	175.4	73.9	0	0	0	0	112.2	W634 I783 L784 I785 C790 L791	W634-S787 WeakPolarHBondContact CZ2-OG 3.25Å; I783-S787 WeakPolarHBondContact O-CB 3.22Å; I783-S787 PolarHBondContact O-N 2.95Å; I783-S787 PolarHBondContact O-OG 2.88Å; L784-S787 PolarHBondContact O-N 3.41Å; L784-S787 PolarHBondContact O-OG 2.92Å; I785-S787 PolarHBondContact O-N 3.29Å; S787-C790 PolarHBondContact O-N 2.97Å; S787-L791 VanDerWaalsContact O-CB 3.25Å; S787-L791 WeakPolarHBondContact O-CB 3.17Å; S787-L791 PolarHBondContact O-N 2.99Å
788	L	90.1	Very high	90.3	Very high	28 Å²	28	54.5 Å²	54.5	15%	0.147	31%	0.31	C	S	.	.	H	α-helix	trans	-66.2	-40.2	173.9	-72.5	172.8	0	0	0	112.2	L518 M574 L784 I785 L791 S792	L518-L788 HydrophobicContact CD2-CD2 4.44Å; M574-L788 HydrophobicContact CE-CD2 4.36Å; L784-L788 HydrophobicContact CD2-CD1 4.42Å; L784-L788 HydrophobicContact CG-CD1 4.18Å; L784-L788 WeakPolarHBondContact O-CB 3.48Å; L784-L788 VanDerWaalsContact O-CG 3.26Å; L784-L788 WeakPolarHBondContact O-CG 3.36Å; L784-L788 PolarHBondContact O-N 3.5Å; I785-L788 PolarHBondContact O-N 3.28Å; L788-L791 PolarHBondContact O-N 3.28Å; L788-S792 WeakPolarHBondContact O-CB 3.22Å; L788-S792 PolarHBondContact O-N 3.47Å
789	I	92.3	Very high	90.1	Very high	26 Å²	26	51.1 Å²	51.1	13%	0.133	29%	0.289	C	S	.	.	H	α-helix	trans	-62.5	-47.5	173.7	-68	160.8	0	0	0	110.1	L573 L577 P578 I785 T786 L791 S792 L793	L573-I789 WeakPolarHBondContact O-CG1 3.41Å; L577-I789 HydrophobicContact CD2-CD1 3.62Å; L577-I789 HydrophobicContact CD2-CG1 4.15Å; L577-I789 HydrophobicContact CD2-CG2 4.32Å; P578-I789 HydrophobicContact CG-CG2 4.4Å; I785-I789 HydrophobicContact CG2-CD1 3.71Å; I785-I789 HydrophobicContact CG2-CG1 4.47Å; I785-I789 WeakPolarHBondContact O-CD1 3.43Å; I785-I789 VanDerWaalsContact O-CG1 3.23Å; I785-I789 WeakPolarHBondContact O-CG1 3.22Å; I785-I789 PolarHBondContact O-N 3.13Å; T786-I789 PolarHBondContact O-N 3.45Å; I789-L791 PolarHBondContact O-N 3.17Å; I789-S792 PolarHBondContact O-N 3.02Å; I789-L793 HydrophobicContact CG2-CD1 4.09Å; I789-L793 WeakPolarHBondContact O-CB 3.43Å; I789-L793 WeakPolarHBondContact O-CG 3.25Å; I789-L793 PolarHBondContact O-N 3.02Å
790	C	92.1	Very high	89.8	Confident	72 Å²	72	50.4 Å²	50.4	49%	0.486	28%	0.281	S	S	.	.	H	α-helix	trans	-62.5	-40.7	176.9	-72.7	0	0	0	0	112.4	T786 S787 L793 T794	T786-C790 WeakPolarHBondContact O-CB 3.35Å; T786-C790 PolarHBondContact O-N 2.85Å; T786-C790 PolarHBondContact O-SG 3.39Å; S787-C790 PolarHBondContact O-N 2.97Å; C790-L793 PolarHBondContact O-N 3.47Å; C790-T794 WeakPolarHBondContact O-CB 3.47Å; C790-T794 PolarHBondContact O-N 2.96Å; C790-T794 PolarHBondContact O-OG1 3.03Å
791	L	90.2	Very high	89.6	Confident	100 Å²	100	50.7 Å²	50.7	52%	0.524	29%	0.289	S	S	.	.	H	α-helix	trans	-62.8	-46	174.9	-174.8	155.7	0	0	0	110.2	S787 L788 I789 T794 V795	S787-L791 VanDerWaalsContact O-CB 3.25Å; S787-L791 WeakPolarHBondContact O-CB 3.17Å; S787-L791 PolarHBondContact O-N 2.99Å; L788-L791 PolarHBondContact O-N 3.28Å; I789-L791 PolarHBondContact O-N 3.17Å; L791-T794 WeakPolarHBondContact O-CB 3.39Å; L791-T794 PolarHBondContact O-N 2.8Å; L791-T794 VanDerWaalsContact O-N 3.17Å; L791-V795 HydrophobicContact CD2-CG2 3.86Å; L791-V795 WeakPolarHBondContact O-CG2 3.44Å; L791-V795 PolarHBondContact O-N 2.79Å
792	S	90.7	Very high	89.4	Confident	11 Å²	11	48.7 Å²	48.7	8%	0.077	28%	0.279	C	S	.	.	H	α-helix	trans	-61.4	-47.2	177.2	-178.9	0	0	0	0	112.3	M574 L788 I789 T794 V795 L796	M574-S792 WeakPolarHBondContact O-CB 3.49Å; M574-S792 PolarHBondContact O-OG 3.34Å; L788-S792 WeakPolarHBondContact O-CB 3.22Å; L788-S792 PolarHBondContact O-N 3.47Å; I789-S792 PolarHBondContact O-N 3.02Å; S792-T794 PolarHBondContact O-N 3.39Å; S792-V795 PolarHBondContact O-N 3.31Å; S792-V795 VanDerWaalsContact O-N 3.11Å; S792-L796 WeakPolarHBondContact O-CG 3.33Å; S792-L796 PolarHBondContact O-N 2.8Å
793	L	91.6	Very high	89	Confident	31 Å²	31	43.3 Å²	43.3	16%	0.162	25%	0.251	C	S	.	.	H	α-helix	trans	-55	-42.8	173.1	-77.4	168.5	0	0	0	111.4	P578 V581 I582 I789 C790 L796 I797	P578-L793 HydrophobicContact CB-CD2 3.7Å; P578-L793 HydrophobicContact CB-CG 3.93Å; P578-L793 HydrophobicContact CG-CG 4.42Å; P578-L793 WeakPolarHBondContact O-CD2 2.88Å; V581-L793 HydrophobicContact CB-CD2 4.16Å; V581-L793 HydrophobicContact CG1-CD1 4.15Å; V581-L793 HydrophobicContact CG1-CD2 3.91Å; I582-L793 HydrophobicContact CD1-CD2 4.09Å; I582-L793 HydrophobicContact CG1-CD2 3.8Å; I789-L793 HydrophobicContact CG2-CD1 4.09Å; I789-L793 WeakPolarHBondContact O-CB 3.43Å; I789-L793 WeakPolarHBondContact O-CG 3.25Å; I789-L793 PolarHBondContact O-N 3.02Å; C790-L793 PolarHBondContact O-N 3.47Å; L793-L796 PolarHBondContact O-N 3.39Å; L793-I797 HydrophobicContact CD2-CD1 4.39Å; L793-I797 VanDerWaalsContact O-CB 3.32Å; L793-I797 WeakPolarHBondContact O-CB 3.29Å; L793-I797 VanDerWaalsContact O-CG1 3.23Å; L793-I797 WeakPolarHBondContact O-CG1 3.43Å; L793-I797 PolarHBondContact O-N 3.22Å
794	T	88.8	Confident	88.6	Confident	75 Å²	75	43.1 Å²	43.1	46%	0.46	25%	0.247	S	C	.	.	H	α-helix	trans	-65.3	-43.6	177.4	-54.1	0	0	0	0	111.3	C790 L791 S792 L796 L798	C790-T794 WeakPolarHBondContact O-CB 3.47Å; C790-T794 PolarHBondContact O-N 2.96Å; C790-T794 PolarHBondContact O-OG1 3.03Å; L791-T794 WeakPolarHBondContact O-CB 3.39Å; L791-T794 PolarHBondContact O-N 2.8Å; L791-T794 VanDerWaalsContact O-N 3.17Å; S792-T794 PolarHBondContact O-N 3.39Å; T794-L796 VanDerWaalsContact C-N 3.33Å; T794-L796 PolarHBondContact O-N 2.96Å; T794-L798 HydrophobicContact CG2-CB 4.01Å; T794-L798 HydrophobicContact CG2-CD2 3.92Å; T794-L798 WeakPolarHBondContact O-CA 3.44Å; T794-L798 WeakPolarHBondContact O-CB 3.27Å; T794-L798 PolarHBondContact O-N 3.32Å
795	V	86.3	Confident	88.2	Confident	78 Å²	78	44.1 Å²	44.1	47%	0.473	25%	0.252	S	S	.	.	H	α-helix	trans	-66.6	-33.6	178.8	171.6	0	0	0	0	112.1	L791 S792 P799	L791-V795 HydrophobicContact CD2-CG2 3.86Å; L791-V795 WeakPolarHBondContact O-CG2 3.44Å; L791-V795 PolarHBondContact O-N 2.79Å; S792-V795 PolarHBondContact O-N 3.31Å; S792-V795 VanDerWaalsContact O-N 3.11Å; V795-P799 WeakPolarHBondContact O-CD 3.47Å; V795-P799 VanDerWaalsContact O-CG 3.31Å; V795-P799 WeakPolarHBondContact O-CG 3.43Å
796	L	85.8	Confident	87.7	Confident	29 Å²	29	44.6 Å²	44.6	15%	0.152	26%	0.255	C	S	.	.	H	α-helix	trans	-78.8	-39.4	177.5	-69.8	172.9	0	0	0	112.9	P578 T579 I582 S792 L793 T794	P578-L796 HydrophobicContact CB-CD1 3.94Å; T579-L796 HydrophobicContact CG2-CD1 4.35Å; I582-L796 HydrophobicContact CD1-CB 3.91Å; I582-L796 HydrophobicContact CD1-CD1 4.21Å; S792-L796 WeakPolarHBondContact O-CG 3.33Å; S792-L796 PolarHBondContact O-N 2.8Å; L793-L796 PolarHBondContact O-N 3.39Å; T794-L796 VanDerWaalsContact C-N 3.33Å; T794-L796 PolarHBondContact O-N 2.96Å
797	I	88.7	Confident	87	Confident	43 Å²	43	43.3 Å²	43.3	22%	0.221	25%	0.245	C	C	.	.	H	α-helix	trans	-88.6	-48	-175	-59.9	168.6	0	0	0	111.8	I582 F586 F589 L793 G801	I582-I797 HydrophobicContact CD1-CD1 4.14Å; I582-I797 HydrophobicContact CD1-CG1 3.69Å; I582-I797 HydrophobicContact CG1-CD1 3.77Å; I582-I797 HydrophobicContact CG1-CG1 3.81Å; F586-I797 HydrophobicContact CD2-CD1 4.24Å; F586-I797 HydrophobicContact CE2-CD1 4Å; F589-I797 HydrophobicContact CE1-CG1 4.42Å; F589-I797 HydrophobicContact CZ-CB 4.49Å; F589-I797 HydrophobicContact CZ-CG2 4.29Å; L793-I797 HydrophobicContact CD2-CD1 4.39Å; L793-I797 VanDerWaalsContact O-CB 3.32Å; L793-I797 WeakPolarHBondContact O-CB 3.29Å; L793-I797 VanDerWaalsContact O-CG1 3.23Å; L793-I797 WeakPolarHBondContact O-CG1 3.43Å; L793-I797 PolarHBondContact O-N 3.22Å; I797-G801 WeakPolarHBondContact O-CA 3.43Å; I797-G801 PolarHBondContact O-N 3.4Å
798	L	87.7	Confident	86.3	Confident	70 Å²	70	45.8 Å²	45.8	37%	0.366	26%	0.255	S	S	.	.	H	α-helix	trans	-64.7	-48.8	-165.5	-170.4	73.2	0	0	0	112.9	T794 I802 L831	T794-L798 HydrophobicContact CG2-CB 4.01Å; T794-L798 HydrophobicContact CG2-CD2 3.92Å; T794-L798 WeakPolarHBondContact O-CA 3.44Å; T794-L798 WeakPolarHBondContact O-CB 3.27Å; T794-L798 PolarHBondContact O-N 3.32Å; L798-I802 HydrophobicContact CD1-CD1 3.81Å; L798-I802 HydrophobicContact CD1-CG1 4.25Å; L798-I802 HydrophobicContact CD2-CD1 4.47Å; L798-I802 HydrophobicContact CG-CD1 3.73Å; L798-I802 HydrophobicContact CG-CG1 4.43Å; L798-I802 WeakPolarHBondContact O-CB 3.26Å; L798-I802 WeakPolarHBondContact O-CG1 3.46Å; L798-I802 PolarHBondContact O-N 3.41Å; L798-L831 HydrophobicContact CD2-CD1 3.8Å; L798-L831 HydrophobicContact CD2-CD2 4.26Å
799	P	86.3	Confident	85.9	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.013	28%	0.282	C	S	.	.	H	α-helix	trans	-64.7	-50.5	179.7	-20.2	34.4	0	0	0	111.5	V795 G801 I802 G803 L824 G827 F828	V795-P799 WeakPolarHBondContact O-CD 3.47Å; V795-P799 VanDerWaalsContact O-CG 3.31Å; V795-P799 WeakPolarHBondContact O-CG 3.43Å; P799-G801 VanDerWaalsContact C-N 3.34Å; P799-G801 PolarHBondContact O-N 2.91Å; P799-I802 PolarHBondContact O-N 2.87Å; P799-G803 PolarHBondContact O-N 3.15Å; P799-L824 HydrophobicContact CB-CD1 4.31Å; P799-G827 WeakPolarHBondContact O-CA 3.31Å; P799-F828 HydrophobicContact CB-CD1 4.19Å; P799-F828 HydrophobicContact CB-CD2 4.18Å; P799-F828 HydrophobicContact CB-CE1 4.1Å; P799-F828 HydrophobicContact CB-CE2 4.11Å; P799-F828 HydrophobicContact CB-CG 4.22Å; P799-F828 HydrophobicContact CB-CZ 4.05Å; P799-F828 HydrophobicContact CG-CD1 4.14Å; P799-F828 HydrophobicContact CG-CE1 3.7Å; P799-F828 HydrophobicContact CG-CE2 4.4Å; P799-F828 HydrophobicContact CG-CZ 3.84Å
800	V	85.1	Confident	85	Confident	4 Å²	4	57.2 Å²	57.2	2%	0.024	31%	0.309	C	S	.	.	H	α-helix	trans	-65.7	-38.8	-179	176.5	0	0	0	0	111.2	F589 F592 G803 R804 L824	F589-V800 HydrophobicContact CE1-CG1 4.45Å; F589-V800 HydrophobicContact CE2-CB 4.37Å; F589-V800 HydrophobicContact CE2-CG1 4.03Å; F589-V800 HydrophobicContact CZ-CB 3.72Å; F589-V800 HydrophobicContact CZ-CG1 3.7Å; F592-V800 HydrophobicContact CD1-CG1 4.43Å; F592-V800 HydrophobicContact CE1-CB 4.4Å; F592-V800 HydrophobicContact CE1-CG1 3.93Å; F592-V800 HydrophobicContact CE1-CG2 4.36Å; F592-V800 HydrophobicContact CZ-CG2 4.18Å; V800-G803 PolarHBondContact O-N 2.83Å; V800-R804 HydrophobicContact CG1-CG 4.35Å; V800-R804 WeakPolarHBondContact O-CB 3.35Å; V800-R804 VanDerWaalsContact O-CG 3.31Å; V800-R804 WeakPolarHBondContact O-CG 3.49Å; V800-R804 PolarHBondContact O-N 3.1Å; V800-L824 HydrophobicContact CG2-CB 4.47Å; V800-L824 HydrophobicContact CG2-CD1 3.48Å; V800-L824 VanDerWaalsContact CG2-CD1 3.48Å
801	G	86.1	Confident	83.9	Confident	26 Å²	26	57.1 Å²	57.1	27%	0.268	31%	0.308	S	S	.	.	H	α-helix	trans	-64.2	-49.8	177	0	0	0	0	0	113.3	I797 P799 G803 R804 L805	I797-G801 WeakPolarHBondContact O-CA 3.43Å; I797-G801 PolarHBondContact O-N 3.4Å; P799-G801 VanDerWaalsContact C-N 3.34Å; P799-G801 PolarHBondContact O-N 2.91Å; G801-G803 VanDerWaalsContact C-N 3.27Å; G801-G803 PolarHBondContact O-N 3.32Å; G801-R804 PolarHBondContact O-N 3.49Å; G801-L805 WeakPolarHBondContact O-CB 3.47Å; G801-L805 PolarHBondContact O-N 2.72Å
802	I	86	Confident	82.8	Confident	41 Å²	41	55.8 Å²	55.8	21%	0.21	32%	0.319	C	S	.	.	H	α-helix	trans	-59.9	-42.3	173.9	-68.6	172.1	0	0	0	110	L798 P799 L805 L806 V830	L798-I802 HydrophobicContact CD1-CD1 3.81Å; L798-I802 HydrophobicContact CD1-CG1 4.25Å; L798-I802 HydrophobicContact CD2-CD1 4.47Å; L798-I802 HydrophobicContact CG-CD1 3.73Å; L798-I802 HydrophobicContact CG-CG1 4.43Å; L798-I802 WeakPolarHBondContact O-CB 3.26Å; L798-I802 WeakPolarHBondContact O-CG1 3.46Å; L798-I802 PolarHBondContact O-N 3.41Å; P799-I802 PolarHBondContact O-N 2.87Å; I802-L805 PolarHBondContact O-N 3.23Å; I802-L806 VanDerWaalsContact O-CB 3.28Å; I802-L806 WeakPolarHBondContact O-CB 3.35Å; I802-L806 PolarHBondContact O-N 2.91Å; I802-V830 HydrophobicContact CG2-CB 3.95Å; I802-V830 HydrophobicContact CG2-CG1 3.79Å; I802-V830 HydrophobicContact CG2-CG2 4.45Å
803	G	83.2	Confident	81.2	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-57.7	-50.9	176.4	0	0	0	0	0	114.1	P799 V800 G801 L805 L806 L807 A823	P799-G803 PolarHBondContact O-N 3.15Å; V800-G803 PolarHBondContact O-N 2.83Å; G801-G803 VanDerWaalsContact C-N 3.27Å; G801-G803 PolarHBondContact O-N 3.32Å; G803-L805 VanDerWaalsContact C-N 3.35Å; G803-L805 PolarHBondContact O-N 3.27Å; G803-L806 PolarHBondContact O-N 3.47Å; G803-L807 WeakPolarHBondContact O-CB 3.23Å; G803-L807 WeakPolarHBondContact O-CG 3.46Å; G803-L807 PolarHBondContact O-N 2.83Å; G803-A823 WeakPolarHBondContact CA-O 3.36Å
804	R	83.8	Confident	79.5	Confident	41 Å²	41	61.6 Å²	61.6	16%	0.155	37%	0.371	C	S	.	.	H	α-helix	trans	-61.6	-42.8	176.8	-72.2	-179	-170.4	-69.4	3.4	111.2	V800 G801 L807 L808 D820 A823	V800-R804 HydrophobicContact CG1-CG 4.35Å; V800-R804 WeakPolarHBondContact O-CB 3.35Å; V800-R804 VanDerWaalsContact O-CG 3.31Å; V800-R804 WeakPolarHBondContact O-CG 3.49Å; V800-R804 PolarHBondContact O-N 3.1Å; G801-R804 PolarHBondContact O-N 3.49Å; R804-L807 PolarHBondContact O-N 3.45Å; R804-L808 WeakPolarHBondContact O-CB 3.24Å; R804-L808 VanDerWaalsContact O-CG 3.31Å; R804-L808 WeakPolarHBondContact O-CG 3.45Å; R804-L808 PolarHBondContact O-N 3.15Å; R804-D820 IonicContact CZ-OD1 3.62Å; R804-D820 IonicContact CZ-OD2 2.73Å; R804-D820 IonicContact NH1-OD1 3.51Å; R804-D820 PolarHBondContact NH1-OD1 3.32Å; R804-D820 IonicContact NH1-OD2 2.82Å; R804-D820 IonicContact NH2-OD1 2.95Å; R804-D820 PolarHBondContact NH2-OD1 2.93Å; R804-D820 IonicContact NH2-OD2 3.57Å; R804-D820 PolarHBondContact NH2-OD2 3.19Å; R804-A823 HydrophobicContact CG-CB 4.09Å
805	L	83.5	Confident	77.9	Confident	94 Å²	94	61.6 Å²	61.6	49%	0.492	37%	0.374	S	S	.	.	H	α-helix	trans	-63.9	-42.5	176.8	-179.6	63.8	0	0	0	112	G801 I802 G803 L808 K809	G801-L805 WeakPolarHBondContact O-CB 3.47Å; G801-L805 PolarHBondContact O-N 2.72Å; I802-L805 PolarHBondContact O-N 3.23Å; G803-L805 VanDerWaalsContact C-N 3.35Å; G803-L805 PolarHBondContact O-N 3.27Å; L805-L808 PolarHBondContact O-N 3.26Å; L805-K809 WeakPolarHBondContact O-CG 3.34Å; L805-K809 PolarHBondContact O-N 2.98Å
806	L	80.3	Confident	76.5	Confident	58 Å²	58	60.4 Å²	60.4	30%	0.304	37%	0.367	S	S	.	.	H	α-helix	trans	-61.8	-45.7	176.6	-179.1	68.8	0	0	0	110.8	I802 G803 K809 L810 V830	I802-L806 VanDerWaalsContact O-CB 3.28Å; I802-L806 WeakPolarHBondContact O-CB 3.35Å; I802-L806 PolarHBondContact O-N 2.91Å; G803-L806 PolarHBondContact O-N 3.47Å; L806-K809 PolarHBondContact O-N 2.98Å; L806-L810 HydrophobicContact CD1-CD1 3.82Å; L806-L810 HydrophobicContact CD1-CG 4.26Å; L806-L810 HydrophobicContact CD2-CD1 4.28Å; L806-L810 HydrophobicContact CG-CD1 3.68Å; L806-L810 HydrophobicContact CG-CG 4.45Å; L806-L810 WeakPolarHBondContact O-CB 3.19Å; L806-L810 WeakPolarHBondContact O-CG 3.42Å; L806-L810 PolarHBondContact O-N 2.83Å; L806-V830 HydrophobicContact CD2-CG2 3.99Å
807	L	76.4	Confident	75	Confident	48 Å²	48	61.2 Å²	61.2	25%	0.251	38%	0.375	S	S	.	.	H	α-helix	trans	-64.4	-40.3	177.4	-72.9	174.1	0	0	0	112.5	G803 R804 K809 L810 S811 I822 A823	G803-L807 WeakPolarHBondContact O-CB 3.23Å; G803-L807 WeakPolarHBondContact O-CG 3.46Å; G803-L807 PolarHBondContact O-N 2.83Å; R804-L807 PolarHBondContact O-N 3.45Å; L807-K809 VanDerWaalsContact C-N 3.33Å; L807-K809 PolarHBondContact O-N 3.39Å; L807-L810 PolarHBondContact O-N 3.35Å; L807-S811 WeakPolarHBondContact O-CB 3.25Å; L807-S811 PolarHBondContact O-N 3.48Å; L807-I822 HydrophobicContact CD1-CB 4.36Å; L807-I822 HydrophobicContact CD1-CG2 4.15Å; L807-I822 HydrophobicContact CD2-CG2 3.9Å; L807-A823 HydrophobicContact CD1-CB 3.87Å
808	L	77.9	Confident	73.6	Confident	84 Å²	84	66.7 Å²	66.7	44%	0.44	40%	0.397	S	S	.	.	H	α-helix	trans	-59	-44	173.6	-78.3	168.7	0	0	0	111.9	R804 L805 G812 T816	R804-L808 WeakPolarHBondContact O-CB 3.24Å; R804-L808 VanDerWaalsContact O-CG 3.31Å; R804-L808 WeakPolarHBondContact O-CG 3.45Å; R804-L808 PolarHBondContact O-N 3.15Å; L805-L808 PolarHBondContact O-N 3.26Å; L808-G812 PolarHBondContact O-N 3.31Å; L808-T816 HydrophobicContact CD1-CG2 4.22Å; L808-T816 HydrophobicContact CD2-CG2 3.29Å; L808-T816 HydrophobicContact CG-CG2 3.5Å; L808-T816 VanDerWaalsContact CG-CG2 3.5Å
809	K	81	Confident	72.6	Confident	162 Å²	162	66.1 Å²	66.1	70%	0.704	39%	0.393	S	S	*	.	H	α-helix	trans	-71.2	-40	179.4	-74.4	-176.6	178.9	-176.7	0	113.2	L805 L806 L807	L805-K809 WeakPolarHBondContact O-CG 3.34Å; L805-K809 PolarHBondContact O-N 2.98Å; L806-K809 PolarHBondContact O-N 2.98Å; L807-K809 VanDerWaalsContact C-N 3.33Å; L807-K809 PolarHBondContact O-N 3.39Å
810	L	73.8	Confident	72.1	Confident	133 Å²	133	66.4 Å²	66.4	70%	0.696	39%	0.394	S	S	*	.	H	α-helix	trans	-77.4	-41.7	-177.5	-76.8	169	0	0	0	112.8	L806 L807	L806-L810 HydrophobicContact CD1-CD1 3.82Å; L806-L810 HydrophobicContact CD1-CG 4.26Å; L806-L810 HydrophobicContact CD2-CD1 4.28Å; L806-L810 HydrophobicContact CG-CD1 3.68Å; L806-L810 HydrophobicContact CG-CG 4.45Å; L806-L810 WeakPolarHBondContact O-CB 3.19Å; L806-L810 WeakPolarHBondContact O-CG 3.42Å; L806-L810 PolarHBondContact O-N 2.83Å; L807-L810 PolarHBondContact O-N 3.35Å
811	S	69	Low	71.6	Confident	69 Å²	69	67.1 Å²	67.1	48%	0.483	40%	0.399	S	S	.	.	H	α-helix	trans	-83.6	-23.9	-171	-169.1	0	0	0	0	113	L807 T813	L807-S811 WeakPolarHBondContact O-CB 3.25Å; L807-S811 PolarHBondContact O-N 3.48Å; S811-T813 PolarHBondContact O-N 3.41Å; S811-T813 PolarHBondContact OG-OG1 3.15Å
812	G	67.6	Low	70.9	Confident	72 Å²	72	68.3 Å²	68.3	74%	0.742	40%	0.398	S	S	*	.			trans	60.7	-9	-178.6	0	0	0	0	0	115.2	L808	L808-G812 PolarHBondContact O-N 3.31Å
813	T	56.8	Low	70.6	Confident	87 Å²	87	66.4 Å²	66.4	53%	0.534	39%	0.388	S	S	.	.	S	Bend	trans	-99.9	126.4	178.8	61.2	0	0	0	0	108.8	S811 S815	S811-T813 PolarHBondContact O-N 3.41Å; S811-T813 PolarHBondContact OG-OG1 3.15Å; T813-S815 PolarHBondContact O-N 3.38Å
814	G	55.4	Low	70.4	Confident	78 Å²	78	68.6 Å²	68.6	80%	0.804	40%	0.4	S	S	*	.	S	Bend	trans	-68.2	16.9	-172.8	0	0	0	0	0	116.3
815	S	55.1	Low	70	Confident	75 Å²	75	67.3 Å²	67.3	52%	0.524	40%	0.396	S	S	.	.			trans	-108.6	85.2	179.7	176.2	0	0	0	0	111.2	T813 S817	T813-S815 PolarHBondContact O-N 3.38Å; S815-S817 PolarHBondContact O-N 3.26Å
816	T	56.4	Low	69.6	Low	52 Å²	52	63.4 Å²	63.4	32%	0.319	38%	0.379	S	S	.	.			trans	-73.9	-10.4	171.5	52.7	0	0	0	0	113.7	L808 K818	L808-T816 HydrophobicContact CD1-CG2 4.22Å; L808-T816 HydrophobicContact CD2-CG2 3.29Å; L808-T816 HydrophobicContact CG-CG2 3.5Å; L808-T816 VanDerWaalsContact CG-CG2 3.5Å; T816-K818 VanDerWaalsContact C-N 3.3Å; T816-K818 PolarHBondContact O-N 3.3Å; T816-K818 VanDerWaalsContact O-N 3.14Å
817	S	55.3	Low	69.8	Low	47 Å²	47	60.7 Å²	60.7	33%	0.329	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-7.5	-158	-175	0	0	0	0	116.2	R593 S815	R593-S817 PolarHBondContact NH1-OG 2.79Å; S815-S817 PolarHBondContact O-N 3.26Å
818	K	58.8	Low	70.1	Confident	158 Å²	158	60.5 Å²	60.5	69%	0.687	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-28.7	-166.3	-70.7	-166.3	176.3	-174.3	0	116.1	T816	T816-K818 VanDerWaalsContact C-N 3.3Å; T816-K818 PolarHBondContact O-N 3.3Å; T816-K818 VanDerWaalsContact O-N 3.14Å
819	H	67.3	Low	69.9	Low	58 Å²	58	58.7 Å²	58.7	27%	0.269	36%	0.355	S	S	.	.			trans	-151.4	94.9	-178.6	-54.9	-86.3	0	0	0	113.6	D603 V821 I822 A823	D603-H819 IonicContact OD1-CE1 3.3Å; D603-H819 IonicContact OD1-ND1 2.79Å; D603-H819 PolarHBondContact OD1-ND1 3.38Å; D603-H819 VanDerWaalsContact OD1-ND1 3.14Å; H819-V821 PolarHBondContact O-N 3.21Å; H819-I822 HydrophobicContact CB-CB 4.32Å; H819-I822 HydrophobicContact CB-CD1 3.63Å; H819-I822 HydrophobicContact CB-CG1 3.7Å; H819-I822 PolarHBondContact O-N 3.28Å; H819-A823 PolarHBondContact O-N 3.04Å
820	D	76.2	Confident	69.9	Low	8 Å²	8	53 Å²	53	4%	0.043	33%	0.333	C	S	.	.	H	α-helix	trans	-67.9	-20.8	175.9	-70.5	-14.4	0	0	0	112.9	F592 R593 R804 I822 A823 L824	F592-D820 WeakPolarHBondContact CA-OD2 3.13Å; R593-D820 PolarHBondContact N-OD2 3.1Å; R804-D820 IonicContact CZ-OD1 3.62Å; R804-D820 IonicContact CZ-OD2 2.73Å; R804-D820 IonicContact NH1-OD1 3.51Å; R804-D820 PolarHBondContact NH1-OD1 3.32Å; R804-D820 IonicContact NH1-OD2 2.82Å; R804-D820 IonicContact NH2-OD1 2.95Å; R804-D820 PolarHBondContact NH2-OD1 2.93Å; R804-D820 IonicContact NH2-OD2 3.57Å; R804-D820 PolarHBondContact NH2-OD2 3.19Å; D820-I822 VanDerWaalsContact C-N 3.33Å; D820-I822 PolarHBondContact O-N 3.49Å; D820-A823 WeakPolarHBondContact O-CB 3.34Å; D820-A823 PolarHBondContact O-N 3.2Å; D820-L824 WeakPolarHBondContact O-CB 3.35Å; D820-L824 PolarHBondContact O-N 3.15Å
821	V	72.9	Confident	70.3	Confident	19 Å²	19	48.5 Å²	48.5	12%	0.115	31%	0.31	C	S	.	.	H	α-helix	trans	-61.9	-40.7	172.3	-176.9	0	0	0	0	111	I594 L606 H819 A823 L824 V825	I594-V821 HydrophobicContact CB-CG2 4.45Å; I594-V821 HydrophobicContact CG1-CG2 4.3Å; I594-V821 HydrophobicContact CG2-CG2 3.89Å; L606-V821 HydrophobicContact CB-CG1 3.84Å; H819-V821 PolarHBondContact O-N 3.21Å; V821-A823 VanDerWaalsContact C-N 3.34Å; V821-L824 WeakPolarHBondContact O-CB 3.3Å; V821-L824 PolarHBondContact O-N 3.05Å; V821-V825 WeakPolarHBondContact O-CG2 3.3Å; V821-V825 PolarHBondContact O-N 3.41Å
822	I	73	Confident	70.6	Confident	50 Å²	50	45.3 Å²	45.3	26%	0.256	29%	0.288	S	S	.	.	H	α-helix	trans	-65.3	-42.6	176	-58.2	178.2	0	0	0	110	L606 L807 H819 D820 L824 V825 G826	L606-I822 HydrophobicContact CD1-CD1 3.89Å; L606-I822 HydrophobicContact CD1-CG1 3.27Å; L606-I822 HydrophobicContact CD2-CG1 3.89Å; L606-I822 HydrophobicContact CG-CG1 4.21Å; L807-I822 HydrophobicContact CD1-CB 4.36Å; L807-I822 HydrophobicContact CD1-CG2 4.15Å; L807-I822 HydrophobicContact CD2-CG2 3.9Å; H819-I822 HydrophobicContact CB-CB 4.32Å; H819-I822 HydrophobicContact CB-CD1 3.63Å; H819-I822 HydrophobicContact CB-CG1 3.7Å; H819-I822 PolarHBondContact O-N 3.28Å; D820-I822 VanDerWaalsContact C-N 3.33Å; D820-I822 PolarHBondContact O-N 3.49Å; I822-L824 VanDerWaalsContact C-N 3.33Å; I822-L824 PolarHBondContact O-N 3.24Å; I822-V825 PolarHBondContact O-N 2.85Å; I822-G826 PolarHBondContact O-N 3.31Å
823	A	78.2	Confident	70.9	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.008	27%	0.274	C	S	.	.	H	α-helix	trans	-59.2	-46.6	175.2	0	0	0	0	0	110.3	G803 R804 L807 H819 D820 V821 V825 G826 G827	G803-A823 WeakPolarHBondContact CA-O 3.36Å; R804-A823 HydrophobicContact CG-CB 4.09Å; L807-A823 HydrophobicContact CD1-CB 3.87Å; H819-A823 PolarHBondContact O-N 3.04Å; D820-A823 WeakPolarHBondContact O-CB 3.34Å; D820-A823 PolarHBondContact O-N 3.2Å; V821-A823 VanDerWaalsContact C-N 3.34Å; A823-V825 PolarHBondContact O-N 3.48Å; A823-G826 PolarHBondContact O-N 2.93Å; A823-G827 PolarHBondContact O-N 2.98Å
824	L	79.3	Confident	72	Confident	46 Å²	46	46.2 Å²	46.2	24%	0.241	27%	0.271	C	S	.	.	H	α-helix	trans	-57.9	-49	178.1	-169.9	77.1	0	0	0	112.2	L610 P799 V800 D820 V821 I822 G827 F828	L610-L824 HydrophobicContact CD2-CD2 4.07Å; P799-L824 HydrophobicContact CB-CD1 4.31Å; V800-L824 HydrophobicContact CG2-CB 4.47Å; V800-L824 HydrophobicContact CG2-CD1 3.48Å; V800-L824 VanDerWaalsContact CG2-CD1 3.48Å; D820-L824 WeakPolarHBondContact O-CB 3.35Å; D820-L824 PolarHBondContact O-N 3.15Å; V821-L824 WeakPolarHBondContact O-CB 3.3Å; V821-L824 PolarHBondContact O-N 3.05Å; I822-L824 VanDerWaalsContact C-N 3.33Å; I822-L824 PolarHBondContact O-N 3.24Å; L824-G827 PolarHBondContact O-N 2.67Å; L824-F828 HydrophobicContact CD1-CD2 4.16Å; L824-F828 HydrophobicContact CD1-CE2 3.6Å; L824-F828 HydrophobicContact CD1-CZ 4.46Å; L824-F828 HydrophobicContact CD2-CE2 4.21Å; L824-F828 HydrophobicContact CG-CD2 3.87Å; L824-F828 HydrophobicContact CG-CE2 3.67Å; L824-F828 VanDerWaalsContact O-CD2 3.31Å; L824-F828 WeakPolarHBondContact O-CD2 3.31Å; L824-F828 PolarHBondContact O-N 3.13Å
825	V	76.4	Confident	72.8	Confident	14 Å²	14	46.8 Å²	46.8	9%	0.085	26%	0.255	C	S	.	.	H	α-helix	trans	-62.4	-46.7	177.9	172.7	0	0	0	0	111.2	I609 L610 V614 V821 I822 A823 G827 F828 T829	I609-V825 HydrophobicContact CG2-CG1 3.83Å; L610-V825 HydrophobicContact CB-CG2 3.98Å; L610-V825 HydrophobicContact CD1-CG2 4.16Å; V614-V825 HydrophobicContact CG2-CG1 4.2Å; V821-V825 WeakPolarHBondContact O-CG2 3.3Å; V821-V825 PolarHBondContact O-N 3.41Å; I822-V825 PolarHBondContact O-N 2.85Å; A823-V825 PolarHBondContact O-N 3.48Å; V825-G827 VanDerWaalsContact C-N 3.28Å; V825-G827 PolarHBondContact O-N 3.36Å; V825-F828 PolarHBondContact O-N 2.97Å; V825-T829 WeakPolarHBondContact O-CB 3.21Å; V825-T829 VanDerWaalsContact O-CG2 3.27Å; V825-T829 WeakPolarHBondContact O-CG2 3.45Å; V825-T829 PolarHBondContact O-N 3.39Å; V825-T829 PolarHBondContact O-OG1 3.38Å
826	G	74.8	Confident	73.5	Confident	13 Å²	13	48.2 Å²	48.2	13%	0.134	25%	0.249	C	C	.	.	H	α-helix	trans	-60	-38.7	175	0	0	0	0	0	112.6	I822 A823 T829 V830	I822-G826 PolarHBondContact O-N 3.31Å; A823-G826 PolarHBondContact O-N 2.93Å; G826-T829 WeakPolarHBondContact CA-OG1 3.39Å; G826-T829 PolarHBondContact O-OG1 2.88Å; G826-V830 VanDerWaalsContact O-CG2 3.3Å; G826-V830 WeakPolarHBondContact O-CG2 3.41Å; G826-V830 PolarHBondContact O-N 2.87Å; G826-V830 VanDerWaalsContact O-N 3.15Å
827	G	83.5	Confident	74.1	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-63.1	-53.4	176	0	0	0	0	0	113.6	P799 A823 L824 V825 T829 V830 L831	P799-G827 WeakPolarHBondContact O-CA 3.31Å; A823-G827 PolarHBondContact O-N 2.98Å; L824-G827 PolarHBondContact O-N 2.67Å; V825-G827 VanDerWaalsContact C-N 3.28Å; V825-G827 PolarHBondContact O-N 3.36Å; G827-T829 VanDerWaalsContact C-N 3.34Å; G827-T829 PolarHBondContact O-N 2.95Å; G827-V830 PolarHBondContact O-N 3.23Å; G827-L831 WeakPolarHBondContact O-CB 3.17Å; G827-L831 PolarHBondContact O-N 3.02Å
828	F	82.7	Confident	74.9	Confident	44 Å²	44	50.4 Å²	50.4	19%	0.193	26%	0.261	C	S	.	.	H	α-helix	trans	-65.7	-36	-179.8	-80.7	-61.9	0	0	0	112.8	L610 V614 L618 P799 L824 V825 L831 G832	L610-F828 HydrophobicContact CD1-CD2 3.97Å; V614-F828 HydrophobicContact CG1-CB 3.55Å; V614-F828 HydrophobicContact CG1-CG 4.44Å; L618-F828 HydrophobicContact CD1-CB 4.43Å; L618-F828 HydrophobicContact CD1-CD1 3.96Å; L618-F828 HydrophobicContact CD1-CG 4.35Å; P799-F828 HydrophobicContact CB-CD1 4.19Å; P799-F828 HydrophobicContact CB-CD2 4.18Å; P799-F828 HydrophobicContact CB-CE1 4.1Å; P799-F828 HydrophobicContact CB-CE2 4.11Å; P799-F828 HydrophobicContact CB-CG 4.22Å; P799-F828 HydrophobicContact CB-CZ 4.05Å; P799-F828 HydrophobicContact CG-CD1 4.14Å; P799-F828 HydrophobicContact CG-CE1 3.7Å; P799-F828 HydrophobicContact CG-CE2 4.4Å; P799-F828 HydrophobicContact CG-CZ 3.84Å; L824-F828 HydrophobicContact CD1-CD2 4.16Å; L824-F828 HydrophobicContact CD1-CE2 3.6Å; L824-F828 HydrophobicContact CD1-CZ 4.46Å; L824-F828 HydrophobicContact CD2-CE2 4.21Å; L824-F828 HydrophobicContact CG-CD2 3.87Å; L824-F828 HydrophobicContact CG-CE2 3.67Å; L824-F828 VanDerWaalsContact O-CD2 3.31Å; L824-F828 WeakPolarHBondContact O-CD2 3.31Å; L824-F828 PolarHBondContact O-N 3.13Å; V825-F828 PolarHBondContact O-N 2.97Å; F828-L831 PolarHBondContact O-N 2.71Å; F828-G832 PolarHBondContact O-N 3.2Å
829	T	75.2	Confident	75.3	Confident	47 Å²	47	46.4 Å²	46.4	29%	0.288	25%	0.251	S	S	.	.	H	α-helix	trans	-64.5	-46.4	176	49.7	0	0	0	0	111.6	V614 V825 G826 G827 G832 I833	V614-T829 HydrophobicContact CG2-CG2 3.64Å; V825-T829 WeakPolarHBondContact O-CB 3.21Å; V825-T829 VanDerWaalsContact O-CG2 3.27Å; V825-T829 WeakPolarHBondContact O-CG2 3.45Å; V825-T829 PolarHBondContact O-N 3.39Å; V825-T829 PolarHBondContact O-OG1 3.38Å; G826-T829 WeakPolarHBondContact CA-OG1 3.39Å; G826-T829 PolarHBondContact O-OG1 2.88Å; G827-T829 VanDerWaalsContact C-N 3.34Å; G827-T829 PolarHBondContact O-N 2.95Å; T829-G832 PolarHBondContact O-N 2.75Å; T829-I833 VanDerWaalsContact O-CG1 3.24Å; T829-I833 WeakPolarHBondContact O-CG1 3.28Å; T829-I833 PolarHBondContact O-N 3.2Å
830	V	81.1	Confident	75.2	Confident	41 Å²	41	46.9 Å²	46.9	25%	0.248	26%	0.26	C	S	.	.	H	α-helix	trans	-62.6	-46.6	175.1	171.9	0	0	0	0	111.1	I802 L806 G826 G827 G832 I833 I834	I802-V830 HydrophobicContact CG2-CB 3.95Å; I802-V830 HydrophobicContact CG2-CG1 3.79Å; I802-V830 HydrophobicContact CG2-CG2 4.45Å; L806-V830 HydrophobicContact CD2-CG2 3.99Å; G826-V830 VanDerWaalsContact O-CG2 3.3Å; G826-V830 WeakPolarHBondContact O-CG2 3.41Å; G826-V830 PolarHBondContact O-N 2.87Å; G826-V830 VanDerWaalsContact O-N 3.15Å; G827-V830 PolarHBondContact O-N 3.23Å; V830-G832 VanDerWaalsContact C-N 3.34Å; V830-G832 PolarHBondContact O-N 3.39Å; V830-I833 PolarHBondContact O-N 3.46Å; V830-I834 HydrophobicContact CG1-CD1 3.78Å; V830-I834 HydrophobicContact CG1-CG1 4.44Å; V830-I834 VanDerWaalsContact O-CG1 3.31Å; V830-I834 WeakPolarHBondContact O-CG1 3.33Å; V830-I834 PolarHBondContact O-N 3.17Å
831	L	81	Confident	74.7	Confident	39 Å²	39	50.7 Å²	50.7	20%	0.204	28%	0.279	C	S	.	.	H	α-helix	trans	-61.1	-43.1	179.2	-175.7	63	0	0	0	111.8	L798 G827 F828 I834 L835	L798-L831 HydrophobicContact CD2-CD1 3.8Å; L798-L831 HydrophobicContact CD2-CD2 4.26Å; G827-L831 WeakPolarHBondContact O-CB 3.17Å; G827-L831 PolarHBondContact O-N 3.02Å; F828-L831 PolarHBondContact O-N 2.71Å; L831-I834 PolarHBondContact O-N 2.9Å; L831-L835 HydrophobicContact CG-CD1 4.11Å; L831-L835 WeakPolarHBondContact O-CB 3.29Å; L831-L835 WeakPolarHBondContact O-CG 3.32Å; L831-L835 PolarHBondContact O-N 3.34Å
832	G	76.3	Confident	74.4	Confident	3 Å²	3	53.6 Å²	53.6	3%	0.031	30%	0.299	C	S	.	.	H	α-helix	trans	-67.4	-35.6	177.3	0	0	0	0	0	113.1	F828 T829 V830 L835 R836	F828-G832 PolarHBondContact O-N 3.2Å; T829-G832 PolarHBondContact O-N 2.75Å; V830-G832 VanDerWaalsContact C-N 3.34Å; V830-G832 PolarHBondContact O-N 3.39Å; G832-L835 PolarHBondContact O-N 2.86Å; G832-R836 WeakPolarHBondContact O-CG 3.25Å; G832-R836 PolarHBondContact O-N 3.32Å
833	I	74.4	Confident	74	Confident	88 Å²	88	58 Å²	58	45%	0.451	32%	0.318	S	S	.	.	H	α-helix	trans	-64	-44.8	171.6	-69.6	164.6	0	0	0	110.3	F617 T829 V830 R836 L837	F617-I833 HydrophobicContact CZ-CG1 4.34Å; T829-I833 VanDerWaalsContact O-CG1 3.24Å; T829-I833 WeakPolarHBondContact O-CG1 3.28Å; T829-I833 PolarHBondContact O-N 3.2Å; V830-I833 PolarHBondContact O-N 3.46Å; I833-R836 PolarHBondContact O-N 3.46Å; I833-L837 HydrophobicContact CG2-CD1 3.68Å; I833-L837 HydrophobicContact CG2-CG 4.21Å; I833-L837 WeakPolarHBondContact O-CB 3.16Å; I833-L837 WeakPolarHBondContact O-CG 3.33Å; I833-L837 PolarHBondContact O-N 2.94Å
834	I	77.9	Confident	73.2	Confident	90 Å²	90	63.6 Å²	63.6	46%	0.462	35%	0.347	S	S	.	.	H	α-helix	trans	-60.7	-47	176.7	-68.2	166.8	0	0	0	110.5	V830 L831 R836 L837 A838	V830-I834 HydrophobicContact CG1-CD1 3.78Å; V830-I834 HydrophobicContact CG1-CG1 4.44Å; V830-I834 VanDerWaalsContact O-CG1 3.31Å; V830-I834 WeakPolarHBondContact O-CG1 3.33Å; V830-I834 PolarHBondContact O-N 3.17Å; L831-I834 PolarHBondContact O-N 2.9Å; I834-R836 VanDerWaalsContact C-N 3.28Å; I834-R836 PolarHBondContact O-N 3.16Å; I834-L837 PolarHBondContact O-N 2.96Å; I834-A838 WeakPolarHBondContact O-CB 3.5Å; I834-A838 PolarHBondContact O-N 3.5Å
835	L	73.3	Confident	72.4	Confident	89 Å²	89	67.9 Å²	67.9	47%	0.466	36%	0.364	S	S	.	.	H	α-helix	trans	-58.8	-38	177.9	-77.8	163.6	0	0	0	112.3	L831 G832 P839	L831-L835 HydrophobicContact CG-CD1 4.11Å; L831-L835 WeakPolarHBondContact O-CB 3.29Å; L831-L835 WeakPolarHBondContact O-CG 3.32Å; L831-L835 PolarHBondContact O-N 3.34Å; G832-L835 PolarHBondContact O-N 2.86Å; L835-P839 VanDerWaalsContact O-CD 3.27Å; L835-P839 WeakPolarHBondContact O-CD 3.36Å
836	R	70.1	Confident	71.9	Confident	106 Å²	106	71 Å²	71	40%	0.4	39%	0.387	S	S	.	.	H	α-helix	trans	-76.5	-33	176.1	-72	-173.4	-176.9	-139.3	-4.6	113.6	F617 D620 G832 I833 I834 P839	F617-R836 VanDerWaalsContact CD2-CZ 3.46Å; F617-R836 HydrophobicContact CZ-CG 4.44Å; F617-R836 PolarHBondContact O-NH2 3.49Å; D620-R836 IonicContact OD2-CZ 2.87Å; D620-R836 IonicContact OD2-NH1 3.85Å; D620-R836 IonicContact OD2-NH2 3.68Å; D620-R836 PolarHBondContact OD2-NH2 2.87Å; G832-R836 WeakPolarHBondContact O-CG 3.25Å; G832-R836 PolarHBondContact O-N 3.32Å; I833-R836 PolarHBondContact O-N 3.46Å; I834-R836 VanDerWaalsContact C-N 3.28Å; I834-R836 PolarHBondContact O-N 3.16Å; R836-P839 WeakPolarHBondContact O-CD 3.18Å; R836-P839 WeakPolarHBondContact O-CG 3.49Å
837	L	69.3	Low	71.3	Confident	98 Å²	98	71.3 Å²	71.3	51%	0.513	39%	0.39	S	S	.	.	H	α-helix	trans	-78	-27.1	176.8	-72.4	175.9	0	0	0	112.6	I833 I834 C840 I841	I833-L837 HydrophobicContact CG2-CD1 3.68Å; I833-L837 HydrophobicContact CG2-CG 4.21Å; I833-L837 WeakPolarHBondContact O-CB 3.16Å; I833-L837 WeakPolarHBondContact O-CG 3.33Å; I833-L837 PolarHBondContact O-N 2.94Å; I834-L837 PolarHBondContact O-N 2.96Å; L837-C840 WeakPolarHBondContact O-CA 3.43Å; L837-C840 VanDerWaalsContact O-CB 3.27Å; L837-C840 WeakPolarHBondContact O-CB 3.35Å; L837-C840 PolarHBondContact O-N 3.32Å; L837-I841 WeakPolarHBondContact O-CG1 3.44Å; L837-I841 PolarHBondContact O-N 3.26Å; L837-I841 VanDerWaalsContact O-N 3.15Å
838	A	70.7	Confident	70.2	Confident	46 Å²	46	75 Å²	75	38%	0.38	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	-48.9	-179.8	0	0	0	0	0	113.9	I834 C840 I841 P842	I834-A838 WeakPolarHBondContact O-CB 3.5Å; I834-A838 PolarHBondContact O-N 3.5Å; A838-C840 VanDerWaalsContact C-N 3.25Å; A838-C840 PolarHBondContact O-N 3.39Å; A838-I841 WeakPolarHBondContact O-CB 3.3Å; A838-I841 PolarHBondContact O-N 3.14Å; A838-P842 WeakPolarHBondContact O-CD 3.34Å
839	P	67.1	Low	68.9	Low	75 Å²	75	77.2 Å²	77.2	49%	0.487	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-20.7	175	25.3	-34	0	0	0	113.8	L835 R836 P842 H843	L835-P839 VanDerWaalsContact O-CD 3.27Å; L835-P839 WeakPolarHBondContact O-CD 3.36Å; R836-P839 WeakPolarHBondContact O-CD 3.18Å; R836-P839 WeakPolarHBondContact O-CG 3.49Å; P839-P842 WeakPolarHBondContact O-CD 3.36Å; P839-P842 WeakPolarHBondContact O-CG 3.48Å; P839-H843 PolarHBondContact O-CD2 2.94Å
840	C	65.7	Low	68.1	Low	68 Å²	68	83.2 Å²	83.2	46%	0.459	45%	0.445	S	S	.	.	H	α-helix	trans	-79.2	-22.5	176	-56.4	0	0	0	0	113.5	L837 A838 H843 L844	L837-C840 WeakPolarHBondContact O-CA 3.43Å; L837-C840 VanDerWaalsContact O-CB 3.27Å; L837-C840 WeakPolarHBondContact O-CB 3.35Å; L837-C840 PolarHBondContact O-N 3.32Å; A838-C840 VanDerWaalsContact C-N 3.25Å; A838-C840 PolarHBondContact O-N 3.39Å; C840-H843 WeakPolarHBondContact O-CB 3.38Å; C840-H843 PolarHBondContact O-N 2.98Å; C840-L844 PolarHBondContact O-N 3.44Å
841	I	66.3	Low	66.9	Low	87 Å²	87	85.9 Å²	85.9	45%	0.446	46%	0.457	S	S	.	.	H	α-helix	trans	-56.1	-51.6	-178.9	-65.6	173.8	0	0	0	112.7	L837 A838 H843 L844 F845	L837-I841 WeakPolarHBondContact O-CG1 3.44Å; L837-I841 PolarHBondContact O-N 3.26Å; L837-I841 VanDerWaalsContact O-N 3.15Å; A838-I841 WeakPolarHBondContact O-CB 3.3Å; A838-I841 PolarHBondContact O-N 3.14Å; I841-H843 VanDerWaalsContact C-N 3.27Å; I841-H843 PolarHBondContact O-N 3.36Å; I841-L844 WeakPolarHBondContact O-CB 3.25Å; I841-L844 PolarHBondContact O-N 3.25Å; I841-L844 VanDerWaalsContact O-N 3.12Å; I841-F845 HydrophobicContact CG2-CD2 3.7Å; I841-F845 HydrophobicContact CG2-CE2 3.51Å; I841-F845 VanDerWaalsContact O-CD2 3.29Å; I841-F845 WeakPolarHBondContact O-CD2 3.27Å; I841-F845 PolarHBondContact O-N 3.06Å; I841-F845 VanDerWaalsContact O-N 3.09Å
842	P	66.1	Low	65.6	Low	81 Å²	81	88.6 Å²	88.6	53%	0.526	48%	0.475	S	S	.	.	H	α-helix	trans	-61.9	-35.1	178.3	20.4	-31	0	0	0	112.5	A838 P839 S846	A838-P842 WeakPolarHBondContact O-CD 3.34Å; P839-P842 WeakPolarHBondContact O-CD 3.36Å; P839-P842 WeakPolarHBondContact O-CG 3.48Å; P842-S846 PolarHBondContact O-N 3.41Å; P842-S846 VanDerWaalsContact O-N 3.16Å
843	H	64.2	Low	64.4	Low	142 Å²	142	96.2 Å²	96.2	66%	0.657	51%	0.512	S	S	*	.	H	α-helix	trans	-66.1	-38.8	174	-70.8	-59.5	0	0	0	112.5	P839 C840 I841 S846 G847	P839-H843 PolarHBondContact O-CD2 2.94Å; C840-H843 WeakPolarHBondContact O-CB 3.38Å; C840-H843 PolarHBondContact O-N 2.98Å; I841-H843 VanDerWaalsContact C-N 3.27Å; I841-H843 PolarHBondContact O-N 3.36Å; H843-S846 PolarHBondContact O-N 3.33Å; H843-S846 PolarHBondContact O-OG 3.44Å; H843-G847 PolarHBondContact O-N 2.88Å
844	L	61.2	Low	63.3	Low	119 Å²	119	95.8 Å²	95.8	62%	0.623	51%	0.51	S	S	*	.	H	α-helix	trans	-62.2	-47.3	176.3	-169.1	81.4	0	0	0	111.3	C840 I841 S846 G847 I848	C840-L844 PolarHBondContact O-N 3.44Å; I841-L844 WeakPolarHBondContact O-CB 3.25Å; I841-L844 PolarHBondContact O-N 3.25Å; I841-L844 VanDerWaalsContact O-N 3.12Å; L844-S846 VanDerWaalsContact C-N 3.3Å; L844-S846 PolarHBondContact O-N 2.86Å; L844-G847 WeakPolarHBondContact O-CA 3.36Å; L844-G847 PolarHBondContact O-N 3.48Å; L844-I848 PolarHBondContact O-N 2.98Å
845	F	63.9	Low	61.8	Low	135 Å²	135	97.5 Å²	97.5	59%	0.592	52%	0.519	S	S	*	.	H	α-helix	trans	-61.2	-37.8	178.3	-81.1	-71.9	0	0	0	112.4	I841 G847 I848	I841-F845 HydrophobicContact CG2-CD2 3.7Å; I841-F845 HydrophobicContact CG2-CE2 3.51Å; I841-F845 VanDerWaalsContact O-CD2 3.29Å; I841-F845 WeakPolarHBondContact O-CD2 3.27Å; I841-F845 PolarHBondContact O-N 3.06Å; I841-F845 VanDerWaalsContact O-N 3.09Å; F845-G847 PolarHBondContact O-N 3.01Å; F845-I848 HydrophobicContact CD1-CD1 3.64Å; F845-I848 HydrophobicContact CE1-CD1 4.11Å; F845-I848 HydrophobicContact CG-CD1 4.44Å; F845-I848 PolarHBondContact O-N 3.48Å
846	S	65.8	Low	60.5	Low	80 Å²	80	96.5 Å²	96.5	56%	0.559	53%	0.53	S	S	*	.	H	α-helix	trans	-64.6	-20.7	174.3	77.5	0	0	0	0	113.8	P842 H843 L844	P842-S846 PolarHBondContact O-N 3.41Å; P842-S846 VanDerWaalsContact O-N 3.16Å; H843-S846 PolarHBondContact O-N 3.33Å; H843-S846 PolarHBondContact O-OG 3.44Å; L844-S846 VanDerWaalsContact C-N 3.3Å; L844-S846 PolarHBondContact O-N 2.86Å
847	G	62	Low	59.2	Low	20 Å²	20	97.3 Å²	97.3	21%	0.206	54%	0.538	C	S	.	.	H	α-helix	trans	-92.1	-18.6	-178.6	0	0	0	0	0	115.5	H843 L844 F845 P849 R850 I851	H843-G847 PolarHBondContact O-N 2.88Å; L844-G847 WeakPolarHBondContact O-CA 3.36Å; L844-G847 PolarHBondContact O-N 3.48Å; F845-G847 PolarHBondContact O-N 3.01Å; G847-P849 VanDerWaalsContact C-CD 3.42Å; G847-R850 WeakPolarHBondContact O-CB 3.45Å; G847-R850 PolarHBondContact O-N 2.93Å; G847-I851 PolarHBondContact O-N 3.31Å
848	I	59.5	Low	57.6	Low	76 Å²	76	97.7 Å²	97.7	39%	0.39	55%	0.549	S	S	.	.	H	α-helix	trans	-53.6	-43.5	-177.5	-65.1	174.9	0	0	0	113.2	L844 F845 R850 I851 V852	L844-I848 PolarHBondContact O-N 2.98Å; F845-I848 HydrophobicContact CD1-CD1 3.64Å; F845-I848 HydrophobicContact CE1-CD1 4.11Å; F845-I848 HydrophobicContact CG-CD1 4.44Å; F845-I848 PolarHBondContact O-N 3.48Å; I848-R850 PolarHBondContact O-N 3.27Å; I848-I851 PolarHBondContact O-N 2.89Å; I848-I851 VanDerWaalsContact O-N 3.13Å; I848-V852 HydrophobicContact CG2-CG2 4.25Å; I848-V852 WeakPolarHBondContact O-CG2 3.42Å; I848-V852 PolarHBondContact O-N 3.33Å; I848-V852 VanDerWaalsContact O-N 3.14Å
849	P	55.9	Low	56.1	Low	91 Å²	91	98.3 Å²	98.3	59%	0.591	56%	0.56	S	S	*	*	H	α-helix	trans	-59.2	-32	178.7	-21.5	31.7	0	0	0	113	G847	G847-P849 VanDerWaalsContact C-CD 3.42Å
850	R	57.8	Low	54.8	Low	173 Å²	173	100.4 Å²	100.4	65%	0.653	58%	0.577	S	S	*	*	H	α-helix	trans	-76.4	-28.8	-179.1	-58.6	-176.6	-170.9	-175	0.7	112.6	G847 I848	G847-R850 WeakPolarHBondContact O-CB 3.45Å; G847-R850 PolarHBondContact O-N 2.93Å; I848-R850 PolarHBondContact O-N 3.27Å
851	I	55.7	Low	53.3	Low	97 Å²	97	103.1 Å²	103.1	50%	0.497	59%	0.586	S	S	.	*	H	α-helix	trans	-79.6	-38.2	179	-62.7	171.5	0	0	0	111	G847 I848 M853 L854 I855	G847-I851 PolarHBondContact O-N 3.31Å; I848-I851 PolarHBondContact O-N 2.89Å; I848-I851 VanDerWaalsContact O-N 3.13Å; I851-M853 VanDerWaalsContact C-N 3.27Å; I851-M853 PolarHBondContact O-N 3.39Å; I851-L854 VanDerWaalsContact O-CB 3.27Å; I851-L854 WeakPolarHBondContact O-CB 3.22Å; I851-L854 PolarHBondContact O-N 2.83Å; I851-I855 HydrophobicContact CG2-CD1 4.33Å; I851-I855 PolarHBondContact O-N 2.72Å
852	V	53.8	Low	51.8	Low	96 Å²	96	106.7 Å²	106.7	58%	0.582	60%	0.604	S	S	*	*	H	α-helix	trans	-59.7	-37.6	178.4	172.9	0	0	0	0	111.7	I848 L854 I855	I848-V852 HydrophobicContact CG2-CG2 4.25Å; I848-V852 WeakPolarHBondContact O-CG2 3.42Å; I848-V852 PolarHBondContact O-N 3.33Å; I848-V852 VanDerWaalsContact O-N 3.14Å; V852-L854 PolarHBondContact O-N 2.85Å; V852-L854 VanDerWaalsContact O-N 3.16Å; V852-I855 PolarHBondContact O-N 3.43Å
853	M	52.3	Low	50.4	Low	163 Å²	163	108.5 Å²	108.5	80%	0.803	62%	0.618	S	S	*	*	H	α-helix	trans	-59	-26.1	173.5	-97.5	-168.2	158.4	0	0	113.7	I851	I851-M853 VanDerWaalsContact C-N 3.27Å; I851-M853 PolarHBondContact O-N 3.39Å
854	L	50.2	Low	48.8	Very low	80 Å²	80	114 Å²	114	42%	0.419	63%	0.634	S	S	.	*	H	α-helix	trans	-90.4	-30.5	-170.4	-138.1	146.5	0	0	0	112.1	I851 V852 G856 L916	I851-L854 VanDerWaalsContact O-CB 3.27Å; I851-L854 WeakPolarHBondContact O-CB 3.22Å; I851-L854 PolarHBondContact O-N 2.83Å; V852-L854 PolarHBondContact O-N 2.85Å; V852-L854 VanDerWaalsContact O-N 3.16Å; L854-G856 VanDerWaalsContact C-N 3.31Å; L854-L916 HydrophobicContact CD1-CD1 4.38Å; L854-L916 HydrophobicContact CD2-CD1 3.63Å; L854-L916 HydrophobicContact CG-CD1 4.3Å
855	I	46.5	Very low	47.7	Very low	125 Å²	125	113.9 Å²	113.9	64%	0.641	64%	0.643	S	S	*	*	H	α-helix	trans	-69.5	-30.5	176.2	-63.8	171.9	0	0	0	111	I851 V852 Q857	I851-I855 HydrophobicContact CG2-CD1 4.33Å; I851-I855 PolarHBondContact O-N 2.72Å; V852-I855 PolarHBondContact O-N 3.43Å; I855-Q857 PolarHBondContact O-N 2.87Å; I855-Q857 VanDerWaalsContact O-N 3.13Å
856	G	45.7	Very low	46.6	Very low	68 Å²	68	116.9 Å²	116.9	70%	0.701	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	-10.7	-178.9	0	0	0	0	0	116.3	L854	L854-G856 VanDerWaalsContact C-N 3.31Å
857	Q	44.4	Very low	45.4	Very low	124 Å²	124	117.6 Å²	117.6	58%	0.579	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.6	27.1	-175.3	-81.3	-178.1	-22.1	0	0	113.7	I855 G859	I855-Q857 PolarHBondContact O-N 2.87Å; I855-Q857 VanDerWaalsContact O-N 3.13Å; Q857-G859 VanDerWaalsContact C-N 3.26Å; Q857-G859 PolarHBondContact O-N 2.87Å
858	S	35.9	Very low	44.4	Very low	106 Å²	106	123 Å²	123	74%	0.741	68%	0.676	S	S	*	*			trans	-78.9	46.5	-172.2	-174.1	0	0	0	0	115.7
859	G	38.4	Very low	43.8	Very low	59 Å²	59	129 Å²	129	61%	0.608	69%	0.694	S	S	*	*	S	Bend	trans	-131	98	172.2	0	0	0	0	0	112.1	Q857	Q857-G859 VanDerWaalsContact C-N 3.26Å; Q857-G859 PolarHBondContact O-N 2.87Å
860	S	39.6	Very low	43.7	Very low	119 Å²	119	128.8 Å²	128.8	83%	0.832	69%	0.691	S	S	*	*			trans	122.6	16.2	161.1	76.8	0	0	0	0	119.5	I862	S860-I862 VanDerWaalsContact C-N 3.29Å; S860-I862 PolarHBondContact O-N 3.14Å
861	L	34.4	Very low	42.8	Very low	125 Å²	125	127.5 Å²	127.5	65%	0.654	69%	0.69	S	S	*	*			trans	-82.3	43.3	-176.4	-67.7	165.1	0	0	0	116	L916	L861-L916 HydrophobicContact CD1-CD1 4.29Å; L861-L916 HydrophobicContact CD1-CD2 3.67Å; L861-L916 HydrophobicContact CD2-CD2 3.83Å; L861-L916 HydrophobicContact CG-CD2 4.26Å
862	I	34.3	Very low	42.3	Very low	161 Å²	161	129.7 Å²	129.7	83%	0.826	69%	0.692	S	S	*	*			trans	-118.1	92	177.2	-56.3	170.4	0	0	0	109.9	S860	S860-I862 VanDerWaalsContact C-N 3.29Å; S860-I862 PolarHBondContact O-N 3.14Å
863	S	37.5	Very low	41.9	Very low	119 Å²	119	130.6 Å²	130.6	83%	0.832	69%	0.692	S	S	*	*			trans	-144.6	127.9	152.2	63.9	0	0	0	0	110.7
864	W	31.1	Very low	41.5	Very low	259 Å²	259	130.5 Å²	130.5	98%	0.981	68%	0.683	S	S	*	*			trans	-112	118.1	-166	-129.7	58.9	0	0	0	107.9
865	S	37.3	Very low	41.2	Very low	115 Å²	115	129.3 Å²	129.3	80%	0.804	68%	0.679	S	S	*	*			trans	-143.6	97.6	172.2	62.5	0	0	0	0	111.3
866	R	41.3	Very low	41.1	Very low	199 Å²	199	134.9 Å²	134.9	75%	0.751	69%	0.692	S	S	*	*			trans	-139.3	142	157.9	-75.6	-161.5	174.9	-164.5	-0.6	111.4
867	P	40.4	Very low	41	Very low	95 Å²	95	139.3 Å²	139.3	62%	0.617	70%	0.699	S	S	*	*			trans	-73.4	134.5	175.4	29.3	-32.9	0	0	0	111.4
868	L	41.3	Very low	41.1	Very low	132 Å²	132	135.5 Å²	135.5	69%	0.691	69%	0.693	S	S	*	*			trans	-77.6	120.3	171.9	-74.1	160.7	0	0	0	109.7	V870	L868-V870 HydrophobicContact CB-CG2 3.77Å
869	R	46.1	Very low	41.4	Very low	204 Å²	204	134.7 Å²	134.7	77%	0.77	68%	0.683	S	S	*	*			trans	-89.6	99.1	169.9	-60.8	-177.8	-170.7	-171.1	1	107.5
870	V	53.1	Low	41.5	Very low	86 Å²	86	134 Å²	134	52%	0.521	67%	0.668	S	S	.	*			trans	-95.5	-30.2	-163.5	-171.5	0	0	0	0	114.4	L868	L868-V870 HydrophobicContact CB-CG2 3.77Å
871	F	38.5	Very low	41.6	Very low	145 Å²	145	132.4 Å²	132.4	64%	0.636	66%	0.656	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-138.7	129.2	-176	-82.2	-80.9	0	0	0	114.8	I883	F871-I883 PolarHBondContact O-N 2.9Å
872	R	45.8	Very low	42.4	Very low	144 Å²	144	131.3 Å²	131.3	54%	0.543	65%	0.647	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-126	100.3	168.4	-152.2	179.8	-146.9	-147.4	1.8	107.1	T880 E882	R872-T880 HydrophobicContact CG-CG2 3.91Å; R872-T880 VanDerWaalsContact CZ-CB 3.47Å; R872-T880 VanDerWaalsContact NE-CB 3.29Å; R872-T880 PolarHBondContact NE-OG1 2.94Å; R872-T880 PolarHBondContact NH1-OG1 2.87Å; R872-T880 PolarHBondContact NH2-OG1 3.26Å; R872-T880 VanDerWaalsContact NH2-OG1 3.11Å; R872-E882 HydrophobicContact CG-CG 4.2Å; R872-E882 IonicContact CZ-OE1 3.25Å; R872-E882 VanDerWaalsContact CZ-OE1 3.27Å; R872-E882 IonicContact NE-OE1 2.85Å; R872-E882 PolarHBondContact NE-OE1 3.39Å; R872-E882 VanDerWaalsContact NE-OE1 3.11Å; R872-E882 IonicContact NH2-OE1 3.94Å; R872-E882 PolarHBondContact NH2-OE1 3.46Å
873	I	44.8	Very low	43.1	Very low	114 Å²	114	129 Å²	129	59%	0.585	64%	0.635	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-83.9	135.8	-179.1	-64.6	165.7	0	0	0	108.8
874	W	45.4	Very low	43.4	Very low	161 Å²	161	127.6 Å²	127.6	61%	0.61	62%	0.622	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-83.7	123	-175.9	-141.6	82.5	0	0	0	110.3
875	T	42.8	Very low	43.8	Very low	55 Å²	55	121 Å²	121	34%	0.337	61%	0.605	S	S	.	*	P	Polyproline II helix	trans	-91.8	150.6	162.2	69.8	0	0	0	0	109.7	L877 G878 T879	T875-L877 PolarHBondContact O-N 2.9Å; T875-G878 PolarHBondContact O-N 3.47Å; T875-T879 PolarHBondContact OG1-O 2.99Å; T875-T879 PolarHBondContact OG1-OG1 3.4Å; T875-T879 VanDerWaalsContact OG1-OG1 3.08Å
876	R	45.2	Very low	43.8	Very low	243 Å²	243	126.2 Å²	126.2	92%	0.917	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.6	-10.8	-176.3	-133.2	-179.8	-170.4	-174	3.2	114.9
877	L	44.4	Very low	43.4	Very low	161 Å²	161	127.1 Å²	127.1	84%	0.843	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	9	-178.1	-74.9	148.5	0	0	0	113.4	T875 T879	T875-L877 PolarHBondContact O-N 2.9Å; L877-T879 VanDerWaalsContact C-N 3.29Å; L877-T879 PolarHBondContact O-N 3.23Å
878	G	46.3	Very low	43.3	Very low	44 Å²	44	128.5 Å²	128.5	45%	0.454	62%	0.619	S	S	.	*	S	Bend	trans	77.1	8.2	175	0	0	0	0	0	115.1	T875	T875-G878 PolarHBondContact O-N 3.47Å
879	T	41.4	Very low	42.9	Very low	88 Å²	88	126.6 Å²	126.6	54%	0.54	62%	0.622	S	S	.	*			trans	-94.3	139.8	172.7	59.9	0	0	0	0	110.9	T875 L877	T875-T879 PolarHBondContact OG1-O 2.99Å; T875-T879 PolarHBondContact OG1-OG1 3.4Å; T875-T879 VanDerWaalsContact OG1-OG1 3.08Å; L877-T879 VanDerWaalsContact C-N 3.29Å; L877-T879 PolarHBondContact O-N 3.23Å
880	T	40.3	Very low	42.3	Very low	45 Å²	45	124.8 Å²	124.8	28%	0.276	63%	0.627	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.6	118.8	-169.9	51.1	0	0	0	0	111.2	R872	R872-T880 HydrophobicContact CG-CG2 3.91Å; R872-T880 VanDerWaalsContact CZ-CB 3.47Å; R872-T880 VanDerWaalsContact NE-CB 3.29Å; R872-T880 PolarHBondContact NE-OG1 2.94Å; R872-T880 PolarHBondContact NH1-OG1 2.87Å; R872-T880 PolarHBondContact NH2-OG1 3.26Å; R872-T880 VanDerWaalsContact NH2-OG1 3.11Å
881	C	41.5	Very low	41.3	Very low	86 Å²	86	126.4 Å²	126.4	58%	0.581	64%	0.639	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-87.2	128.8	169	-60.3	0	0	0	0	109.4
882	E	51.4	Low	41.1	Very low	102 Å²	102	128 Å²	128	48%	0.477	65%	0.651	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.3	122.4	179.8	-70.3	-175.3	-172.9	0	0	110.5	R872	R872-E882 HydrophobicContact CG-CG 4.2Å; R872-E882 IonicContact CZ-OE1 3.25Å; R872-E882 VanDerWaalsContact CZ-OE1 3.27Å; R872-E882 IonicContact NE-OE1 2.85Å; R872-E882 PolarHBondContact NE-OE1 3.39Å; R872-E882 VanDerWaalsContact NE-OE1 3.11Å; R872-E882 IonicContact NH2-OE1 3.94Å; R872-E882 PolarHBondContact NH2-OE1 3.46Å
883	I	49.3	Very low	40.3	Very low	111 Å²	111	124.9 Å²	124.9	57%	0.569	66%	0.656	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-103.6	110.2	169.1	-62.5	168	0	0	0	107.7	F871	F871-I883 PolarHBondContact O-N 2.9Å
884	T	44.7	Very low	39.8	Very low	91 Å²	91	124.6 Å²	124.6	56%	0.558	66%	0.661	S	S	*	*			trans	-98.9	115.2	175.8	57.5	0	0	0	0	110.4	R886	T884-R886 PolarHBondContact O-N 2.98Å
885	I	39.3	Very low	39.2	Very low	120 Å²	120	124.2 Å²	124.2	62%	0.615	67%	0.668	S	S	*	*			trans	-87.5	104.1	167.5	-60.9	169.4	0	0	0	107.6	R887	I885-R887 PolarHBondContact O-N 3.47Å
886	R	36.8	Very low	39.1	Very low	225 Å²	225	128.4 Å²	128.4	85%	0.849	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-71.4	116.7	167.4	-91.8	-173.7	-172.5	-173.6	3.1	108.1	T884	T884-R886 PolarHBondContact O-N 2.98Å
887	R	33.6	Very low	38.7	Very low	217 Å²	217	122.8 Å²	122.8	82%	0.819	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-67.4	135.1	157.7	-76.6	-166.6	179.1	-156	0.7	108	I885 A889	I885-R887 PolarHBondContact O-N 3.47Å; R887-A889 PolarHBondContact O-N 2.87Å
888	P	36.5	Very low	38.4	Very low	125 Å²	125	121 Å²	121	81%	0.812	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-60.5	123.4	174.8	23.3	-30	0	0	0	108.7	L890	P888-L890 PolarHBondContact O-N 3.46Å
889	A	34.8	Very low	38	Very low	91 Å²	91	123.8 Å²	123.8	75%	0.752	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-67	123.4	167.9	0	0	0	0	0	107.2	R887	R887-A889 PolarHBondContact O-N 2.87Å
890	L	31.6	Very low	38.1	Very low	166 Å²	166	130.5 Å²	130.5	87%	0.869	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-56.8	130.9	161.5	-87.4	136.6	0	0	0	107.3	P888 M892	P888-L890 PolarHBondContact O-N 3.46Å; L890-M892 PolarHBondContact O-N 3.4Å
891	P	32.4	Very low	38.2	Very low	120 Å²	120	138 Å²	138	78%	0.779	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-61.5	126	-176.9	22.5	-30.6	0	0	0	109.6	A893	P891-A893 PolarHBondContact O-N 2.85Å
892	M	34.5	Very low	38.1	Very low	179 Å²	179	142.7 Å²	142.7	88%	0.882	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-59.7	118.8	161.9	-74.5	-176.3	-59.2	0	0	106.8	L890	L890-M892 PolarHBondContact O-N 3.4Å
893	A	30.2	Very low	37.6	Very low	79 Å²	79	141.1 Å²	141.1	65%	0.653	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-55.2	133.1	165.5	0	0	0	0	0	108	P891 M895	P891-A893 PolarHBondContact O-N 2.85Å; A893-M895 PolarHBondContact O-N 3.43Å
894	P	32.8	Very low	37.2	Very low	107 Å²	107	144.4 Å²	144.4	70%	0.695	74%	0.737	S	S	*	*			trans	-63.6	107.3	-176.5	24.2	-31.7	0	0	0	109.6	I896	P894-I896 PolarHBondContact O-N 3.01Å
895	M	34	Very low	36.8	Very low	154 Å²	154	147 Å²	147	76%	0.759	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-66.1	6.7	173	-69.5	-166.3	-157.3	0	0	113.7	A893 D897 L898	A893-M895 PolarHBondContact O-N 3.43Å; M895-D897 PolarHBondContact O-N 2.91Å; M895-L898 PolarHBondContact O-N 3.36Å
896	I	39.2	Very low	37.1	Very low	142 Å²	142	144.2 Å²	144.2	73%	0.728	73%	0.734	S	S	*	*	G	3₁₀ helix	trans	-62.3	-31.7	-176.8	-64.6	172.9	0	0	0	111	P894	P894-I896 PolarHBondContact O-N 3.01Å
897	D	37.5	Very low	37.6	Very low	126 Å²	126	137.9 Å²	137.9	67%	0.674	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-85.2	-11.6	-176.9	-104.3	-13.4	0	0	0	115.6	M895	M895-D897 PolarHBondContact O-N 2.91Å
898	L	37.9	Very low	38.3	Very low	122 Å²	122	131.2 Å²	131.2	64%	0.639	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	-28.8	174.1	-79.3	162.8	0	0	0	112.2	M895 R900 R901 Y902	M895-L898 PolarHBondContact O-N 3.36Å; L898-R900 PolarHBondContact O-N 3.38Å; L898-R901 PolarHBondContact O-N 2.95Å; L898-Y902 PolarHBondContact O-N 3.39Å
899	N	38	Very low	38.6	Very low	103 Å²	103	131.1 Å²	131.1	55%	0.551	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.6	-20.6	-178.5	-159.7	38.5	0	0	0	113
900	R	43	Very low	39.5	Very low	229 Å²	229	130.6 Å²	130.6	86%	0.864	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	-21.3	178.3	-152.9	177.3	-150.8	-170	5.7	113.6	L898	L898-R900 PolarHBondContact O-N 3.38Å
901	R	43.8	Very low	40.9	Very low	204 Å²	204	127.4 Å²	127.4	77%	0.77	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.1	-21.7	-175.6	-103.9	-177	-96.2	-143.4	-2.7	114.8	L898	L898-R901 PolarHBondContact O-N 2.95Å
902	Y	39.6	Very low	42	Very low	184 Å²	184	125 Å²	125	72%	0.722	64%	0.644	S	S	*	*	S	Bend	trans	-140	75.5	177.1	-65.9	-80	0	0	0	111.3	L898 F904	L898-Y902 PolarHBondContact O-N 3.39Å; Y902-F904 PolarHBondContact O-N 2.85Å
903	G	41	Very low	43.3	Very low	68 Å²	68	118 Å²	118	70%	0.701	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.2	88.2	178.9	0	0	0	0	0	112.6
904	F	40.1	Very low	44.9	Very low	180 Å²	180	118.5 Å²	118.5	79%	0.789	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-171.9	-20	152	-166.2	-115.6	0	0	0	112.6	Y902	Y902-F904 PolarHBondContact O-N 2.85Å
905	Q	37.3	Very low	46.2	Very low	145 Å²	145	121 Å²	121	68%	0.678	61%	0.605	S	S	*	*	S	Bend	trans	-86.5	-18.6	-173.5	-116.2	163.9	-18.4	0	0	115.1	H909	Q905-H909 PolarHBondContact O-CD2 2.93Å
906	S	45	Very low	47.7	Very low	62 Å²	62	115.6 Å²	115.6	43%	0.434	58%	0.579	S	S	.	*	H	α-helix	trans	-73.5	-33.8	-170.8	-167.4	0	0	0	0	114.9	V908 H909 T910	S906-V908 PolarHBondContact O-N 3.32Å; S906-H909 PolarHBondContact O-N 2.9Å; S906-T910 PolarHBondContact O-N 3.38Å
907	T	47.3	Very low	48.7	Very low	92 Å²	92	113.5 Å²	113.5	56%	0.564	57%	0.566	S	S	*	*	H	α-helix	trans	-73.8	-27.1	-175.9	48.2	0	0	0	0	114	T910 N911	T907-T910 PolarHBondContact O-OG1 3.38Å; T907-N911 PolarHBondContact O-N 2.92Å
908	V	47.9	Very low	50	Low	78 Å²	78	111 Å²	111	47%	0.473	55%	0.553	S	S	.	*	H	α-helix	trans	-73.6	-37.8	175.9	179	0	0	0	0	110.5	S906 T910 I912	S906-V908 PolarHBondContact O-N 3.32Å; V908-T910 PolarHBondContact O-N 3.35Å; V908-I912 HydrophobicContact CG1-CD1 3.65Å; V908-I912 WeakPolarHBondContact O-CD1 3.32Å; V908-I912 VanDerWaalsContact O-CG1 3.28Å; V908-I912 WeakPolarHBondContact O-CG1 3.19Å; V908-I912 PolarHBondContact O-N 3.2Å
909	H	43.8	Very low	51.4	Low	123 Å²	123	109.9 Å²	109.9	57%	0.569	54%	0.541	S	S	*	.	H	α-helix	trans	-66.9	-33.4	177.4	-71.7	-62.7	0	0	0	113.3	Q905 S906 G913	Q905-H909 PolarHBondContact O-CD2 2.93Å; S906-H909 PolarHBondContact O-N 2.9Å; H909-G913 PolarHBondContact O-N 3.39Å
910	T	53.3	Low	52.9	Low	80 Å²	80	109.7 Å²	109.7	49%	0.491	54%	0.539	S	S	.	.	H	α-helix	trans	-72.4	-44.2	179	53.6	0	0	0	0	112.9	S906 T907 V908 G913 I914	S906-T910 PolarHBondContact O-N 3.38Å; T907-T910 PolarHBondContact O-OG1 3.38Å; V908-T910 PolarHBondContact O-N 3.35Å; T910-G913 PolarHBondContact O-N 3.08Å; T910-I914 PolarHBondContact O-N 3.17Å
911	N	60.2	Low	54	Low	98 Å²	98	104.9 Å²	104.9	52%	0.524	52%	0.521	S	S	.	.	H	α-helix	trans	-67.5	-40.1	-179.4	-79.4	-16.7	0	0	0	112.5	T907 G913 I914 Y915	T907-N911 PolarHBondContact O-N 2.92Å; N911-G913 VanDerWaalsContact C-N 3.3Å; N911-G913 PolarHBondContact O-N 2.99Å; N911-I914 PolarHBondContact O-N 3.42Å; N911-Y915 WeakPolarHBondContact O-CD2 3.39Å; N911-Y915 PolarHBondContact O-N 3.12Å
912	I	56.2	Low	55.2	Low	70 Å²	70	99.4 Å²	99.4	36%	0.359	51%	0.506	S	S	.	.	H	α-helix	trans	-63.6	-39.1	176.1	-66	168.7	0	0	0	110.6	V908 I914 Y915 L916	V908-I912 HydrophobicContact CG1-CD1 3.65Å; V908-I912 WeakPolarHBondContact O-CD1 3.32Å; V908-I912 VanDerWaalsContact O-CG1 3.28Å; V908-I912 WeakPolarHBondContact O-CG1 3.19Å; V908-I912 PolarHBondContact O-N 3.2Å; I912-I914 VanDerWaalsContact C-N 3.31Å; I912-I914 PolarHBondContact O-N 3.18Å; I912-Y915 PolarHBondContact O-N 3.27Å; I912-L916 VanDerWaalsContact O-CB 3.26Å; I912-L916 WeakPolarHBondContact O-CB 3.38Å; I912-L916 PolarHBondContact O-N 2.85Å
913	G	60.8	Low	56.8	Low	32 Å²	32	95.7 Å²	95.7	33%	0.33	50%	0.498	S	S	.	.	H	α-helix	trans	-56.9	-41	176.6	0	0	0	0	0	113.3	H909 T910 N911 Q917	H909-G913 PolarHBondContact O-N 3.39Å; T910-G913 PolarHBondContact O-N 3.08Å; N911-G913 VanDerWaalsContact C-N 3.3Å; N911-G913 PolarHBondContact O-N 2.99Å; G913-Q917 WeakPolarHBondContact O-CB 3.44Å; G913-Q917 PolarHBondContact O-N 2.92Å
914	I	64.3	Low	58.4	Low	89 Å²	89	95.4 Å²	95.4	46%	0.456	48%	0.479	S	S	.	.	H	α-helix	trans	-69.7	-45.7	-179.3	-62.3	167.7	0	0	0	111.3	T910 N911 I912 Q917 N918	T910-I914 PolarHBondContact O-N 3.17Å; N911-I914 PolarHBondContact O-N 3.42Å; I912-I914 VanDerWaalsContact C-N 3.31Å; I912-I914 PolarHBondContact O-N 3.18Å; I914-Q917 PolarHBondContact O-N 3.19Å; I914-N918 PolarHBondContact O-N 3.04Å
915	Y	60.9	Low	59.9	Low	159 Å²	159	88.9 Å²	88.9	62%	0.624	45%	0.453	S	S	*	.	H	α-helix	trans	-64.3	-46.2	177.7	-72.7	-68.7	0	0	0	111.4	N911 I912 Q917 N918 Y919	N911-Y915 WeakPolarHBondContact O-CD2 3.39Å; N911-Y915 PolarHBondContact O-N 3.12Å; I912-Y915 PolarHBondContact O-N 3.27Å; Y915-Q917 VanDerWaalsContact C-N 3.29Å; Y915-Q917 PolarHBondContact O-N 3.44Å; Y915-N918 PolarHBondContact O-N 3.2Å; Y915-Y919 VanDerWaalsContact O-CD2 3.25Å; Y915-Y919 WeakPolarHBondContact O-CD2 3.42Å; Y915-Y919 PolarHBondContact O-N 3.4Å
916	L	64.8	Low	61.6	Low	41 Å²	41	88.9 Å²	88.9	22%	0.215	45%	0.447	C	S	.	.	H	α-helix	trans	-57.5	-43.8	174.9	-171.9	83.9	0	0	0	111.1	L854 L861 I912 N918 Y919 L920	L854-L916 HydrophobicContact CD1-CD1 4.38Å; L854-L916 HydrophobicContact CD2-CD1 3.63Å; L854-L916 HydrophobicContact CG-CD1 4.3Å; L861-L916 HydrophobicContact CD1-CD1 4.29Å; L861-L916 HydrophobicContact CD1-CD2 3.67Å; L861-L916 HydrophobicContact CD2-CD2 3.83Å; L861-L916 HydrophobicContact CG-CD2 4.26Å; I912-L916 VanDerWaalsContact O-CB 3.26Å; I912-L916 WeakPolarHBondContact O-CB 3.38Å; I912-L916 PolarHBondContact O-N 2.85Å; L916-N918 VanDerWaalsContact C-N 3.33Å; L916-N918 PolarHBondContact O-N 3.14Å; L916-Y919 PolarHBondContact O-N 3.02Å; L916-L920 WeakPolarHBondContact O-CB 3.46Å; L916-L920 PolarHBondContact O-N 3.25Å
917	Q	59.9	Low	63.1	Low	98 Å²	98	91 Å²	91	46%	0.458	45%	0.452	S	S	.	.	H	α-helix	trans	-62.5	-38.5	178.2	-175	-179.5	5.2	0	0	112.4	G913 I914 Y915 R921	G913-Q917 WeakPolarHBondContact O-CB 3.44Å; G913-Q917 PolarHBondContact O-N 2.92Å; I914-Q917 PolarHBondContact O-N 3.19Å; Y915-Q917 VanDerWaalsContact C-N 3.29Å; Y915-Q917 PolarHBondContact O-N 3.44Å; Q917-R921 VanDerWaalsContact O-CB 3.25Å; Q917-R921 WeakPolarHBondContact O-CB 3.39Å; Q917-R921 PolarHBondContact O-N 2.99Å
918	N	65.5	Low	64.6	Low	75 Å²	75	92.3 Å²	92.3	40%	0.401	45%	0.447	S	S	.	.	H	α-helix	trans	-70.9	-46.1	178	-73.6	-13.9	0	0	0	112	I914 Y915 L916 R921 I922	I914-N918 PolarHBondContact O-N 3.04Å; Y915-N918 PolarHBondContact O-N 3.2Å; L916-N918 VanDerWaalsContact C-N 3.33Å; L916-N918 PolarHBondContact O-N 3.14Å; N918-R921 WeakPolarHBondContact O-CB 3.45Å; N918-R921 PolarHBondContact O-N 2.87Å; N918-I922 WeakPolarHBondContact O-CG1 3.41Å; N918-I922 PolarHBondContact O-N 2.98Å
919	Y	66.4	Low	65.9	Low	98 Å²	98	90 Å²	90	38%	0.384	43%	0.432	S	S	.	.	H	α-helix	trans	-62.8	-44.2	175	-80.6	-75.4	0	0	0	111.8	Y915 L916 R921 I922 I923	Y915-Y919 VanDerWaalsContact O-CD2 3.25Å; Y915-Y919 WeakPolarHBondContact O-CD2 3.42Å; Y915-Y919 PolarHBondContact O-N 3.4Å; L916-Y919 PolarHBondContact O-N 3.02Å; Y919-R921 VanDerWaalsContact C-N 3.3Å; Y919-R921 PolarHBondContact O-N 2.77Å; Y919-I922 PolarHBondContact O-N 3.13Å; Y919-I923 VanDerWaalsContact O-CG1 3.32Å; Y919-I923 WeakPolarHBondContact O-CG1 3.2Å; Y919-I923 PolarHBondContact O-N 2.88Å
920	L	70	Confident	67.5	Low	98 Å²	98	90.7 Å²	90.7	51%	0.513	43%	0.433	S	S	.	.	H	α-helix	trans	-61.3	-39.7	176	-171.9	72.7	0	0	0	111.2	L916 I923 I924	L916-L920 WeakPolarHBondContact O-CB 3.46Å; L916-L920 PolarHBondContact O-N 3.25Å; L920-I923 PolarHBondContact O-N 3.36Å; L920-I924 HydrophobicContact CD1-CD1 4.33Å; L920-I924 HydrophobicContact CD2-CD1 4.27Å; L920-I924 HydrophobicContact CG-CD1 3.79Å; L920-I924 HydrophobicContact CG-CG1 4.41Å; L920-I924 VanDerWaalsContact O-CB 3.32Å; L920-I924 WeakPolarHBondContact O-CB 3.46Å; L920-I924 WeakPolarHBondContact O-CG1 3.43Å; L920-I924 PolarHBondContact O-N 2.93Å
921	R	65	Low	68.8	Low	129 Å²	129	89.8 Å²	89.8	49%	0.487	43%	0.43	S	S	.	.	H	α-helix	trans	-62.5	-44.7	175.5	-176.9	-172.6	-63.9	-131.6	6.5	111.8	Q917 N918 Y919 I924 N925	Q917-R921 VanDerWaalsContact O-CB 3.25Å; Q917-R921 WeakPolarHBondContact O-CB 3.39Å; Q917-R921 PolarHBondContact O-N 2.99Å; N918-R921 WeakPolarHBondContact O-CB 3.45Å; N918-R921 PolarHBondContact O-N 2.87Å; Y919-R921 VanDerWaalsContact C-N 3.3Å; Y919-R921 PolarHBondContact O-N 2.77Å; R921-I924 PolarHBondContact O-N 3.46Å; R921-N925 WeakPolarHBondContact O-CB 3.39Å; R921-N925 PolarHBondContact O-N 2.82Å
922	I	70.2	Confident	69.9	Low	89 Å²	89	85.8 Å²	85.8	46%	0.456	41%	0.408	S	S	.	.	H	α-helix	trans	-62.6	-50.2	177.8	-67.9	165.5	0	0	0	109.5	N918 Y919 I924 N925 W926	N918-I922 WeakPolarHBondContact O-CG1 3.41Å; N918-I922 PolarHBondContact O-N 2.98Å; Y919-I922 PolarHBondContact O-N 3.13Å; I922-I924 VanDerWaalsContact C-N 3.34Å; I922-I924 PolarHBondContact O-N 3.23Å; I922-N925 PolarHBondContact O-N 3.49Å; I922-N925 VanDerWaalsContact O-N 3.14Å; I922-W926 PolarHBondContact O-N 3.47Å
923	I	73.2	Confident	71	Confident	106 Å²	106	84.3 Å²	84.3	54%	0.544	41%	0.407	S	S	.	.	H	α-helix	trans	-59.4	-43.5	178.5	-67.2	167.7	0	0	0	111.3	Y919 L920 W926 L927	Y919-I923 VanDerWaalsContact O-CG1 3.32Å; Y919-I923 WeakPolarHBondContact O-CG1 3.2Å; Y919-I923 PolarHBondContact O-N 2.88Å; L920-I923 PolarHBondContact O-N 3.36Å; I923-W926 PolarHBondContact O-N 2.96Å; I923-L927 WeakPolarHBondContact O-CB 3.22Å; I923-L927 PolarHBondContact O-N 2.82Å
924	I	74.2	Confident	72.1	Confident	61 Å²	61	85.9 Å²	85.9	31%	0.313	41%	0.409	S	S	.	.	H	α-helix	trans	-64.1	-41.2	176.5	-71.8	168.9	0	0	0	111.2	L920 R921 I922 L927 R928	L920-I924 HydrophobicContact CD1-CD1 4.33Å; L920-I924 HydrophobicContact CD2-CD1 4.27Å; L920-I924 HydrophobicContact CG-CD1 3.79Å; L920-I924 HydrophobicContact CG-CG1 4.41Å; L920-I924 VanDerWaalsContact O-CB 3.32Å; L920-I924 WeakPolarHBondContact O-CB 3.46Å; L920-I924 WeakPolarHBondContact O-CG1 3.43Å; L920-I924 PolarHBondContact O-N 2.93Å; R921-I924 PolarHBondContact O-N 3.46Å; I922-I924 VanDerWaalsContact C-N 3.34Å; I922-I924 PolarHBondContact O-N 3.23Å; I924-L927 PolarHBondContact O-N 3.43Å; I924-R928 HydrophobicContact CG2-CG 4.4Å; I924-R928 WeakPolarHBondContact O-CB 3.45Å; I924-R928 VanDerWaalsContact O-CG 3.25Å; I924-R928 WeakPolarHBondContact O-CG 3.28Å; I924-R928 PolarHBondContact O-N 3.48Å
925	N	71.2	Confident	73.1	Confident	44 Å²	44	83.5 Å²	83.5	24%	0.235	40%	0.398	C	S	.	.	H	α-helix	trans	-64.3	-42.9	176.3	-83.7	4.8	0	0	0	111.2	R921 I922 R928 L929	R921-N925 WeakPolarHBondContact O-CB 3.39Å; R921-N925 PolarHBondContact O-N 2.82Å; I922-N925 PolarHBondContact O-N 3.49Å; I922-N925 VanDerWaalsContact O-N 3.14Å; N925-R928 PolarHBondContact O-N 3.38Å; N925-L929 WeakPolarHBondContact O-CB 3.4Å; N925-L929 PolarHBondContact O-N 3.37Å
926	W	74.3	Confident	74.2	Confident	145 Å²	145	77 Å²	77	55%	0.549	38%	0.375	S	S	.	.	H	α-helix	trans	-61.6	-43.9	173.3	-82.3	103.7	0	0	0	112.3	I922 I923 R928 L929 F930	I922-W926 PolarHBondContact O-N 3.47Å; I923-W926 PolarHBondContact O-N 2.96Å; W926-R928 VanDerWaalsContact C-N 3.34Å; W926-R928 PolarHBondContact O-N 3.26Å; W926-L929 PolarHBondContact O-N 2.97Å; W926-F930 VanDerWaalsContact O-CB 3.29Å; W926-F930 WeakPolarHBondContact O-CB 3.33Å; W926-F930 PolarHBondContact O-N 2.87Å
927	L	76.1	Confident	75	Confident	105 Å²	105	80.5 Å²	80.5	55%	0.55	39%	0.393	S	S	.	.	H	α-helix	trans	-61.4	-42.5	175.7	-176.9	67	0	0	0	111.4	I923 I924 F930 C931	I923-L927 WeakPolarHBondContact O-CB 3.22Å; I923-L927 PolarHBondContact O-N 2.82Å; I924-L927 PolarHBondContact O-N 3.43Å; L927-F930 WeakPolarHBondContact O-CB 3.43Å; L927-F930 PolarHBondContact O-N 3.4Å; L927-C931 PolarHBondContact O-N 2.79Å; L927-C931 PolarHBondContact O-SG 2.91Å
928	R	77.9	Confident	76.2	Confident	121 Å²	121	76.8 Å²	76.8	46%	0.457	38%	0.381	S	S	.	.	H	α-helix	trans	-65.4	-44	175.9	-74.4	171	175.6	169.3	0.2	112.3	I924 N925 W926 F930 C931 I932 C1014	I924-R928 HydrophobicContact CG2-CG 4.4Å; I924-R928 WeakPolarHBondContact O-CB 3.45Å; I924-R928 VanDerWaalsContact O-CG 3.25Å; I924-R928 WeakPolarHBondContact O-CG 3.28Å; I924-R928 PolarHBondContact O-N 3.48Å; N925-R928 PolarHBondContact O-N 3.38Å; W926-R928 VanDerWaalsContact C-N 3.34Å; W926-R928 PolarHBondContact O-N 3.26Å; R928-F930 VanDerWaalsContact C-N 3.3Å; R928-F930 PolarHBondContact O-N 3.3Å; R928-C931 PolarHBondContact O-N 3.09Å; R928-I932 WeakPolarHBondContact O-CG1 3.41Å; R928-I932 PolarHBondContact O-N 3.15Å; R928-C1014 HydrophobicContact CB-CB 3.99Å; R928-C1014 WeakPolarHBondContact CB-SG 3.45Å
929	L	75.4	Confident	77.3	Confident	30 Å²	30	77.4 Å²	77.4	16%	0.157	38%	0.384	C	S	.	.	H	α-helix	trans	-64.9	-38	177.5	-166.5	71.1	0	0	0	110.8	N925 W926 I932 A933 R1009 L1017	N925-L929 WeakPolarHBondContact O-CB 3.4Å; N925-L929 PolarHBondContact O-N 3.37Å; W926-L929 PolarHBondContact O-N 2.97Å; L929-I932 PolarHBondContact O-N 3Å; L929-A933 WeakPolarHBondContact O-CB 3.34Å; L929-A933 PolarHBondContact O-N 3.22Å; L929-R1009 HydrophobicContact CD2-CG 4.35Å; L929-L1017 HydrophobicContact CD1-CD2 4.27Å
930	F	77.5	Confident	78.4	Confident	136 Å²	136	73.2 Å²	73.2	60%	0.596	37%	0.368	S	S	*	.	H	α-helix	trans	-61.5	-47.2	172	179.2	-98.6	0	0	0	111.5	W926 L927 R928 I932 A933 V934	W926-F930 VanDerWaalsContact O-CB 3.29Å; W926-F930 WeakPolarHBondContact O-CB 3.33Å; W926-F930 PolarHBondContact O-N 2.87Å; L927-F930 WeakPolarHBondContact O-CB 3.43Å; L927-F930 PolarHBondContact O-N 3.4Å; R928-F930 VanDerWaalsContact C-N 3.3Å; R928-F930 PolarHBondContact O-N 3.3Å; F930-I932 VanDerWaalsContact C-N 3.32Å; F930-I932 PolarHBondContact O-N 2.9Å; F930-A933 WeakPolarHBondContact O-CB 3.08Å; F930-A933 PolarHBondContact O-N 3.08Å; F930-A933 VanDerWaalsContact O-N 3.15Å; F930-V934 HydrophobicContact CD1-CG2 4.25Å; F930-V934 HydrophobicContact CE1-CG2 3.85Å; F930-V934 HydrophobicContact CE2-CG2 4.41Å; F930-V934 HydrophobicContact CZ-CG2 3.93Å; F930-V934 WeakPolarHBondContact O-CG2 3.12Å; F930-V934 PolarHBondContact O-N 3.45Å
931	C	81.2	Confident	79.3	Confident	62 Å²	62	68.7 Å²	68.7	42%	0.419	34%	0.344	S	S	.	.	H	α-helix	trans	-59.2	-42.2	174.3	-68.1	0	0	0	0	112.2	L927 R928 A933 V934 I935	L927-C931 PolarHBondContact O-N 2.79Å; L927-C931 PolarHBondContact O-SG 2.91Å; R928-C931 PolarHBondContact O-N 3.09Å; C931-A933 VanDerWaalsContact C-N 3.34Å; C931-V934 PolarHBondContact O-N 3.38Å; C931-I935 VanDerWaalsContact O-CG1 3.28Å; C931-I935 WeakPolarHBondContact O-CG1 3.29Å; C931-I935 PolarHBondContact O-N 2.92Å
932	I	82.7	Confident	80.5	Confident	13 Å²	13	63.7 Å²	63.7	7%	0.067	33%	0.328	C	S	.	.	H	α-helix	trans	-65.6	-39.1	176.5	-64.6	166.4	0	0	0	110.7	R928 L929 F930 I935 C936 C1014 L1017 I1021	R928-I932 WeakPolarHBondContact O-CG1 3.41Å; R928-I932 PolarHBondContact O-N 3.15Å; L929-I932 PolarHBondContact O-N 3Å; F930-I932 VanDerWaalsContact C-N 3.32Å; F930-I932 PolarHBondContact O-N 2.9Å; I932-I935 PolarHBondContact O-N 2.94Å; I932-C936 WeakPolarHBondContact O-CB 3.29Å; I932-C936 PolarHBondContact O-N 3.35Å; I932-C936 PolarHBondContact O-SG 3.2Å; I932-C1014 HydrophobicContact CD1-CB 3.8Å; I932-L1017 HydrophobicContact CB-CD2 4.45Å; I932-L1017 HydrophobicContact CD1-CB 4.21Å; I932-L1017 HydrophobicContact CD1-CD2 3.98Å; I932-L1017 HydrophobicContact CD1-CG 4.49Å; I932-L1017 HydrophobicContact CG2-CD2 3.67Å; I932-L1017 HydrophobicContact CG2-CG 4.18Å; I932-I1021 HydrophobicContact CG2-CD1 4.27Å
933	A	79.4	Confident	81.4	Confident	40 Å²	40	60.4 Å²	60.4	33%	0.331	31%	0.314	S	S	.	.	H	α-helix	trans	-62.7	-43.1	174.3	0	0	0	0	0	111.8	L929 F930 C931 I935 C936 L937	L929-A933 WeakPolarHBondContact O-CB 3.34Å; L929-A933 PolarHBondContact O-N 3.22Å; F930-A933 WeakPolarHBondContact O-CB 3.08Å; F930-A933 PolarHBondContact O-N 3.08Å; F930-A933 VanDerWaalsContact O-N 3.15Å; C931-A933 VanDerWaalsContact C-N 3.34Å; A933-I935 VanDerWaalsContact C-N 3.28Å; A933-I935 PolarHBondContact O-N 3.24Å; A933-C936 PolarHBondContact O-N 3.27Å; A933-L937 WeakPolarHBondContact O-CA 3.47Å; A933-L937 VanDerWaalsContact O-CB 3.25Å; A933-L937 WeakPolarHBondContact O-CB 3.25Å; A933-L937 PolarHBondContact O-N 3Å
934	V	83.9	Confident	82.3	Confident	64 Å²	64	56.6 Å²	56.6	39%	0.388	30%	0.295	S	S	.	.	I	π-helix	trans	-60.6	-38.8	173.9	172.4	0	0	0	0	111.1	F930 C931 G938 I939	F930-V934 HydrophobicContact CD1-CG2 4.25Å; F930-V934 HydrophobicContact CE1-CG2 3.85Å; F930-V934 HydrophobicContact CE2-CG2 4.41Å; F930-V934 HydrophobicContact CZ-CG2 3.93Å; F930-V934 WeakPolarHBondContact O-CG2 3.12Å; F930-V934 PolarHBondContact O-N 3.45Å; C931-V934 PolarHBondContact O-N 3.38Å; V934-G938 CarbonylContact O-C 3.58Å; V934-G938 WeakPolarHBondContact O-CA 3.42Å; V934-G938 PolarHBondContact O-N 3.25Å; V934-I939 PolarHBondContact O-N 3.07Å
935	I	86.4	Confident	83	Confident	40 Å²	40	53.7 Å²	53.7	21%	0.205	28%	0.28	C	S	.	.	I	π-helix	trans	-67.9	-48.6	175.6	-68.1	165.5	0	0	0	111.2	C931 I932 A933 I939 L940 L1018 L1025	C931-I935 VanDerWaalsContact O-CG1 3.28Å; C931-I935 WeakPolarHBondContact O-CG1 3.29Å; C931-I935 PolarHBondContact O-N 2.92Å; I932-I935 PolarHBondContact O-N 2.94Å; A933-I935 VanDerWaalsContact C-N 3.28Å; A933-I935 PolarHBondContact O-N 3.24Å; I935-I939 HydrophobicContact CG1-CD1 4.23Å; I935-I939 PolarHBondContact O-N 3.27Å; I935-L940 WeakPolarHBondContact O-CB 3.49Å; I935-L940 PolarHBondContact O-N 3.34Å; I935-L1018 HydrophobicContact CD1-CD1 4.39Å; I935-L1025 HydrophobicContact CG2-CD1 3.46Å; I935-L1025 VanDerWaalsContact CG2-CD1 3.46Å; I935-L1025 HydrophobicContact CG2-CD2 3.99Å; I935-L1025 HydrophobicContact CG2-CG 4.27Å
936	C	83	Confident	83.9	Confident	21 Å²	21	53 Å²	53	14%	0.142	28%	0.276	C	S	.	.	I	π-helix	trans	-75.3	-38	-174.3	-62.3	0	0	0	0	113.7	I932 A933 P941 I1021	I932-C936 WeakPolarHBondContact O-CB 3.29Å; I932-C936 PolarHBondContact O-N 3.35Å; I932-C936 PolarHBondContact O-SG 3.2Å; A933-C936 PolarHBondContact O-N 3.27Å; C936-P941 WeakPolarHBondContact O-CD 3.34Å; C936-P941 WeakPolarHBondContact O-CG 3.18Å; C936-I1021 WeakPolarHBondContact SG-CD1 3.37Å
937	L	82.3	Confident	84.6	Confident	116 Å²	116	47 Å²	47	61%	0.607	25%	0.254	S	S	*	.	I	π-helix	trans	-99.8	-22	-175.1	-60.3	178.2	0	0	0	112.2	A933 W972	A933-L937 WeakPolarHBondContact O-CA 3.47Å; A933-L937 VanDerWaalsContact O-CB 3.25Å; A933-L937 WeakPolarHBondContact O-CB 3.25Å; A933-L937 PolarHBondContact O-N 3Å; L937-W972 PolarHBondContact O-NE1 3.31Å
938	G	84.2	Confident	85.2	Confident	20 Å²	20	43.3 Å²	43.3	21%	0.206	24%	0.235	C	C	.	.	I	π-helix	trans	-104.1	-68.3	178.9	0	0	0	0	0	112.8	V934 T942	V934-G938 CarbonylContact O-C 3.58Å; V934-G938 WeakPolarHBondContact O-CA 3.42Å; V934-G938 PolarHBondContact O-N 3.25Å; G938-T942 WeakPolarHBondContact O-CG2 3.22Å; G938-T942 PolarHBondContact O-N 3.16Å; G938-T942 PolarHBondContact O-OG1 3.44Å; G938-T942 VanDerWaalsContact O-OG1 3.08Å
939	I	88.5	Confident	85.6	Confident	88 Å²	88	38.2 Å²	38.2	45%	0.451	22%	0.217	S	C	.	.	I	π-helix	trans	-73.2	-44.2	-169.3	-60.2	171.5	0	0	0	112.7	V934 I935 T942 A943	V934-I939 PolarHBondContact O-N 3.07Å; I935-I939 HydrophobicContact CG1-CD1 4.23Å; I935-I939 PolarHBondContact O-N 3.27Å; I939-T942 WeakPolarHBondContact CA-OG1 3.2Å; I939-T942 PolarHBondContact O-N 2.68Å; I939-T942 PolarHBondContact O-OG1 3.17Å; I939-A943 VanDerWaalsContact O-CB 3.3Å; I939-A943 WeakPolarHBondContact O-CB 3.31Å; I939-A943 PolarHBondContact O-N 3.02Å
940	L	89.2	Confident	86.2	Confident	10 Å²	10	38.1 Å²	38.1	5%	0.052	22%	0.215	C	C	.	.	H	α-helix	trans	-63.6	-46.9	-177.7	171.5	70.8	0	0	0	111.6	I935 A943 L944 L979 I1021 L1024 I1028	I935-L940 WeakPolarHBondContact O-CB 3.49Å; I935-L940 PolarHBondContact O-N 3.34Å; L940-A943 PolarHBondContact O-N 2.96Å; L940-L944 WeakPolarHBondContact O-CB 3.08Å; L940-L944 PolarHBondContact O-N 3.44Å; L940-L979 HydrophobicContact CD2-CD2 4.3Å; L940-I1021 HydrophobicContact CD2-CG2 4.28Å; L940-L1024 HydrophobicContact CD1-CD2 3.75Å; L940-L1024 HydrophobicContact CD1-CG 3.89Å; L940-L1024 HydrophobicContact CD2-CD2 3.78Å; L940-L1024 HydrophobicContact CG-CD2 4.37Å; L940-I1028 HydrophobicContact CD1-CD1 3.56Å
941	P	89.5	Confident	86.7	Confident	2 Å²	2	32.3 Å²	32.3	1%	0.013	19%	0.19	C	C	.	.	H	α-helix	trans	-64.8	-42.1	175.7	-24.3	36.1	0	0	0	112.7	C936 A943 L944 G945 G975 I976 L979	C936-P941 WeakPolarHBondContact O-CD 3.34Å; C936-P941 WeakPolarHBondContact O-CG 3.18Å; P941-A943 PolarHBondContact O-N 3.25Å; P941-L944 PolarHBondContact O-N 3.02Å; P941-G945 PolarHBondContact O-N 3.33Å; P941-G975 VanDerWaalsContact O-CA 3.28Å; P941-G975 WeakPolarHBondContact O-CA 3.47Å; P941-I976 HydrophobicContact CB-CG1 3.71Å; P941-I976 HydrophobicContact CG-CG1 3.97Å; P941-L979 HydrophobicContact CG-CD2 4.21Å
942	T	89.6	Confident	86.9	Confident	25 Å²	25	34.1 Å²	34.1	15%	0.153	19%	0.191	C	C	.	.	H	α-helix	trans	-61.5	-44.3	177.1	49.5	0	0	0	0	112.1	G938 I939 G945 L946 F968 W972	G938-T942 WeakPolarHBondContact O-CG2 3.22Å; G938-T942 PolarHBondContact O-N 3.16Å; G938-T942 PolarHBondContact O-OG1 3.44Å; G938-T942 VanDerWaalsContact O-OG1 3.08Å; I939-T942 WeakPolarHBondContact CA-OG1 3.2Å; I939-T942 PolarHBondContact O-N 2.68Å; I939-T942 PolarHBondContact O-OG1 3.17Å; T942-G945 PolarHBondContact O-N 3.33Å; T942-L946 WeakPolarHBondContact O-CB 3.17Å; T942-L946 PolarHBondContact O-N 3.5Å; T942-F968 HydrophobicContact CG2-CD2 4.02Å; T942-F968 HydrophobicContact CG2-CE2 3.53Å; T942-F968 HydrophobicContact CG2-CZ 3.9Å; T942-W972 HydrophobicContact CG2-CB 3.63Å; T942-W972 HydrophobicContact CG2-CG 4.07Å
943	A	90.9	Very high	86.9	Confident	19 Å²	19	36 Å²	36	16%	0.157	20%	0.201	C	C	.	.	H	α-helix	trans	-64	-42.3	178.2	0	0	0	0	0	111.8	I939 L940 P941 L947 I1028	I939-A943 VanDerWaalsContact O-CB 3.3Å; I939-A943 WeakPolarHBondContact O-CB 3.31Å; I939-A943 PolarHBondContact O-N 3.02Å; L940-A943 PolarHBondContact O-N 2.96Å; P941-A943 PolarHBondContact O-N 3.25Å; A943-L947 WeakPolarHBondContact O-CB 3.15Å; A943-L947 PolarHBondContact O-N 3.24Å; A943-I1028 HydrophobicContact CB-CG2 3.69Å
944	L	90.5	Very high	87	Confident	26 Å²	26	34.2 Å²	34.2	14%	0.136	19%	0.186	C	C	.	.	H	α-helix	trans	-64.6	-47.2	176.3	-176.5	69.6	0	0	0	111.7	L940 P941 L946 L947 I948 H978 L979 I1028	L940-L944 WeakPolarHBondContact O-CB 3.08Å; L940-L944 PolarHBondContact O-N 3.44Å; P941-L944 PolarHBondContact O-N 3.02Å; L944-L946 VanDerWaalsContact C-N 3.34Å; L944-L946 PolarHBondContact O-N 3.42Å; L944-L947 PolarHBondContact O-N 2.99Å; L944-I948 HydrophobicContact CD1-CD1 4.18Å; L944-I948 HydrophobicContact CG-CD1 3.98Å; L944-I948 WeakPolarHBondContact O-CG1 3.4Å; L944-I948 PolarHBondContact O-N 2.98Å; L944-H978 HydrophobicContact CD2-CB 4.26Å; L944-L979 HydrophobicContact CD2-CB 3.9Å; L944-L979 HydrophobicContact CD2-CD1 4.32Å; L944-I1028 HydrophobicContact CB-CD1 4.44Å; L944-I1028 HydrophobicContact CD1-CD1 4.08Å
945	G	89.2	Confident	86.9	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-64.8	-38.4	-179.7	0	0	0	0	0	112.4	P941 T942 N949 H971	P941-G945 PolarHBondContact O-N 3.33Å; T942-G945 PolarHBondContact O-N 3.33Å; G945-N949 VanDerWaalsContact O-CB 3.22Å; G945-N949 WeakPolarHBondContact O-CB 3.22Å; G945-N949 PolarHBondContact O-N 3Å; G945-H971 WeakPolarHBondContact CA-O 3.35Å
946	L	90	Very high	86.5	Confident	30 Å²	30	39.6 Å²	39.6	16%	0.157	21%	0.206	C	C	.	.	H	α-helix	trans	-64.7	-43.8	174.2	-171	68.8	0	0	0	111.5	T942 L944 N949 F950 I966 L1032	T942-L946 WeakPolarHBondContact O-CB 3.17Å; T942-L946 PolarHBondContact O-N 3.5Å; L944-L946 VanDerWaalsContact C-N 3.34Å; L944-L946 PolarHBondContact O-N 3.42Å; L946-N949 PolarHBondContact O-N 2.83Å; L946-F950 HydrophobicContact CD1-CD2 4.34Å; L946-F950 HydrophobicContact CD1-CE1 4.19Å; L946-F950 HydrophobicContact CD1-CE2 3.62Å; L946-F950 HydrophobicContact CD1-CZ 3.52Å; L946-F950 HydrophobicContact CD2-CE2 3.89Å; L946-F950 HydrophobicContact CD2-CZ 4.44Å; L946-F950 HydrophobicContact CG-CD2 3.96Å; L946-F950 HydrophobicContact CG-CE2 3.45Å; L946-F950 VanDerWaalsContact CG-CE2 3.45Å; L946-F950 HydrophobicContact CG-CZ 3.93Å; L946-F950 WeakPolarHBondContact O-CD2 3.32Å; L946-F950 WeakPolarHBondContact O-CG 3.4Å; L946-F950 PolarHBondContact O-N 2.71Å; L946-I966 HydrophobicContact CD1-CD1 4.44Å; L946-I966 HydrophobicContact CD1-CG2 3.94Å; L946-L1032 HydrophobicContact CB-CD1 4.37Å; L946-L1032 HydrophobicContact CD2-CD1 3.69Å; L946-L1032 HydrophobicContact CD2-CD2 3.78Å; L946-L1032 HydrophobicContact CD2-CG 4.31Å; L946-L1032 HydrophobicContact CG-CD1 3.92Å
947	L	90.1	Very high	86	Confident	18 Å²	18	46.5 Å²	46.5	9%	0.094	23%	0.229	C	C	.	.	H	α-helix	trans	-60.3	-49.7	177.5	179.1	64	0	0	0	111.8	A943 L944 N949 F950 I951 I1028 S1031 Y1058	A943-L947 WeakPolarHBondContact O-CB 3.15Å; A943-L947 PolarHBondContact O-N 3.24Å; L944-L947 PolarHBondContact O-N 2.99Å; L947-N949 VanDerWaalsContact C-N 3.32Å; L947-N949 PolarHBondContact O-N 2.88Å; L947-F950 PolarHBondContact O-N 2.91Å; L947-I951 HydrophobicContact CD1-CD1 3.69Å; L947-I951 HydrophobicContact CD1-CG1 4.31Å; L947-I951 HydrophobicContact CG-CD1 3.84Å; L947-I951 WeakPolarHBondContact O-CG1 3.41Å; L947-I951 PolarHBondContact O-N 2.86Å; L947-I1028 HydrophobicContact CD2-CG2 4.43Å; L947-S1031 WeakPolarHBondContact CD1-OG 3.26Å; L947-Y1058 HydrophobicContact CD1-CD1 4.41Å
948	I	88.4	Confident	85.5	Confident	28 Å²	28	43 Å²	43	14%	0.144	21%	0.211	C	C	.	.	H	α-helix	trans	-64.7	-39.5	179.4	-63.2	171.2	0	0	0	110.3	L944 F950 I951 F952 F974 H978	L944-I948 HydrophobicContact CD1-CD1 4.18Å; L944-I948 HydrophobicContact CG-CD1 3.98Å; L944-I948 WeakPolarHBondContact O-CG1 3.4Å; L944-I948 PolarHBondContact O-N 2.98Å; I948-F950 PolarHBondContact O-N 3.34Å; I948-I951 PolarHBondContact O-N 3.24Å; I948-F952 HydrophobicContact CG2-CD2 3.84Å; I948-F952 PolarHBondContact O-N 3.3Å; I948-F974 HydrophobicContact CB-CE1 3.76Å; I948-F974 HydrophobicContact CG2-CE1 3.41Å; I948-F974 VanDerWaalsContact CG2-CE1 3.41Å; I948-F974 HydrophobicContact CG2-CZ 3.8Å; I948-H978 HydrophobicContact CD1-CB 3.57Å; I948-H978 VanDerWaalsContact CD1-CG 3.48Å
949	N	86.5	Confident	84.8	Confident	14 Å²	14	44 Å²	44	8%	0.075	22%	0.221	C	C	.	.	I	π-helix	trans	-60	-44.7	176.2	-177.5	57.9	0	0	0	111.8	G945 L946 L947 I953 V954 H971	G945-N949 VanDerWaalsContact O-CB 3.22Å; G945-N949 WeakPolarHBondContact O-CB 3.22Å; G945-N949 PolarHBondContact O-N 3Å; L946-N949 PolarHBondContact O-N 2.83Å; L947-N949 VanDerWaalsContact C-N 3.32Å; L947-N949 PolarHBondContact O-N 2.88Å; N949-I953 PolarHBondContact O-N 2.94Å; N949-I953 WeakPolarHBondContact OD1-CB 3.41Å; N949-I953 WeakPolarHBondContact OD1-CG2 3.38Å; N949-V954 WeakPolarHBondContact ND2-CG2 3.48Å; N949-V954 WeakPolarHBondContact O-CG2 3.47Å; N949-V954 PolarHBondContact O-N 2.96Å; N949-H971 PolarHBondContact ND2-CE1 3.5Å
950	F	87.9	Confident	83.8	Confident	28 Å²	28	43.6 Å²	43.6	12%	0.123	22%	0.224	C	C	.	.	I	π-helix	trans	-69.5	-33.5	177.9	-68.3	-33.5	0	0	0	114	L946 L947 I948 V954 I966 L1032 Y1058	L946-F950 HydrophobicContact CD1-CD2 4.34Å; L946-F950 HydrophobicContact CD1-CE1 4.19Å; L946-F950 HydrophobicContact CD1-CE2 3.62Å; L946-F950 HydrophobicContact CD1-CZ 3.52Å; L946-F950 HydrophobicContact CD2-CE2 3.89Å; L946-F950 HydrophobicContact CD2-CZ 4.44Å; L946-F950 HydrophobicContact CG-CD2 3.96Å; L946-F950 HydrophobicContact CG-CE2 3.45Å; L946-F950 VanDerWaalsContact CG-CE2 3.45Å; L946-F950 HydrophobicContact CG-CZ 3.93Å; L946-F950 WeakPolarHBondContact O-CD2 3.32Å; L946-F950 WeakPolarHBondContact O-CG 3.4Å; L946-F950 PolarHBondContact O-N 2.71Å; L947-F950 PolarHBondContact O-N 2.91Å; I948-F950 PolarHBondContact O-N 3.34Å; F950-V954 HydrophobicContact CD1-CG2 3.96Å; F950-I966 HydrophobicContact CZ-CD1 4Å; F950-L1032 HydrophobicContact CD2-CD1 3.98Å; F950-L1032 HydrophobicContact CE2-CD1 4.08Å; F950-Y1058 HydrophobicContact CB-CD1 3.93Å; F950-Y1058 HydrophobicContact CB-CD2 3.99Å; F950-Y1058 HydrophobicContact CB-CE1 4.32Å; F950-Y1058 HydrophobicContact CB-CE2 4.36Å; F950-Y1058 HydrophobicContact CB-CG 3.76Å; F950-Y1058 HydrophobicContact CD2-CD1 4.46Å; F950-Y1058 HydrophobicContact CD2-CD2 4.48Å; F950-Y1058 AromaticContact CD2-CE1 4Å; F950-Y1058 HydrophobicContact CD2-CE1 4Å; F950-Y1058 HydrophobicContact CD2-CE2 4Å; F950-Y1058 AromaticContact CD2-CZ 3.74Å; F950-Y1058 HydrophobicContact CG-CD2 4.37Å; F950-Y1058 HydrophobicContact CG-CE2 4.3Å
951	I	88	Confident	82.7	Confident	14 Å²	14	52.6 Å²	52.6	7%	0.072	26%	0.263	C	S	.	.	I	π-helix	trans	-78.4	-44.9	179.7	-67	169.8	0	0	0	111.8	L947 I948 P1059 F1062	L947-I951 HydrophobicContact CD1-CD1 3.69Å; L947-I951 HydrophobicContact CD1-CG1 4.31Å; L947-I951 HydrophobicContact CG-CD1 3.84Å; L947-I951 WeakPolarHBondContact O-CG1 3.41Å; L947-I951 PolarHBondContact O-N 2.86Å; I948-I951 PolarHBondContact O-N 3.24Å; I951-P1059 WeakPolarHBondContact O-CG 3.28Å; I951-F1062 HydrophobicContact CD1-CB 4.08Å; I951-F1062 HydrophobicContact CD1-CD2 3.86Å; I951-F1062 HydrophobicContact CD1-CG 4.06Å; I951-F1062 HydrophobicContact CG1-CB 4.25Å; I951-F1062 HydrophobicContact CG2-CB 3.85Å; I951-F1062 HydrophobicContact CG2-CD1 3.61Å; I951-F1062 HydrophobicContact CG2-CD2 4.33Å; I951-F1062 HydrophobicContact CG2-CE1 4.24Å; I951-F1062 HydrophobicContact CG2-CG 3.66Å
952	F	85.4	Confident	82.1	Confident	100 Å²	100	59.8 Å²	59.8	44%	0.439	29%	0.294	S	S	.	.	I	π-helix	trans	-109.9	-37.7	-168.1	-65.8	-75.5	0	0	0	114	I948 F956 F1062	I948-F952 HydrophobicContact CG2-CD2 3.84Å; I948-F952 PolarHBondContact O-N 3.3Å; F952-F956 WeakPolarHBondContact O-CD2 3.3Å; F952-F956 WeakPolarHBondContact O-CE2 3.22Å; F952-F1062 HydrophobicContact CE1-CE1 4.14Å; F952-F1062 HydrophobicContact CE2-CE1 4.37Å; F952-F1062 HydrophobicContact CE2-CZ 4.42Å; F952-F1062 HydrophobicContact CZ-CD1 4.27Å; F952-F1062 AromaticContact CZ-CE1 3.54Å; F952-F1062 HydrophobicContact CZ-CE1 3.54Å; F952-F1062 AromaticContact CZ-CZ 3.85Å; F952-F1062 HydrophobicContact CZ-CZ 3.85Å
953	I	82.2	Confident	81.4	Confident	53 Å²	53	63.1 Å²	63.1	27%	0.272	31%	0.314	S	S	.	.	I	π-helix	trans	-94.8	-50.8	-168	-63.8	174.5	0	0	0	112.3	N949 P955 F956 R957 F974	N949-I953 PolarHBondContact O-N 2.94Å; N949-I953 WeakPolarHBondContact OD1-CB 3.41Å; N949-I953 WeakPolarHBondContact OD1-CG2 3.38Å; I953-P955 VanDerWaalsContact C-CD 3.47Å; I953-F956 PolarHBondContact O-N 3.35Å; I953-F956 VanDerWaalsContact O-N 3.1Å; I953-R957 HydrophobicContact CG2-CB 4.09Å; I953-R957 WeakPolarHBondContact O-CB 3.4Å; I953-R957 PolarHBondContact O-N 3.02Å; I953-F974 HydrophobicContact CD1-CE1 3.94Å; I953-F974 HydrophobicContact CD1-CE2 3.77Å; I953-F974 HydrophobicContact CD1-CZ 3.39Å; I953-F974 HydrophobicContact CG1-CZ 4.48Å
954	V	81.9	Confident	80.5	Confident	3 Å²	3	64.7 Å²	64.7	2%	0.018	32%	0.319	C	S	.	.	H	α-helix	trans	-52.3	-44.9	-177.7	169.4	0	0	0	0	113.7	N949 F950 F956 I958 I964 R1055	N949-V954 WeakPolarHBondContact ND2-CG2 3.48Å; N949-V954 WeakPolarHBondContact O-CG2 3.47Å; N949-V954 PolarHBondContact O-N 2.96Å; F950-V954 HydrophobicContact CD1-CG2 3.96Å; V954-F956 VanDerWaalsContact C-N 3.29Å; V954-F956 PolarHBondContact O-N 2.84Å; V954-I958 PolarHBondContact O-N 3.39Å; V954-I964 HydrophobicContact CG1-CD1 3.69Å; V954-R1055 HydrophobicContact CG1-CB 4.43Å; V954-R1055 HydrophobicContact CG1-CG 3.92Å
955	P	81.5	Confident	79.7	Confident	33 Å²	33	70.7 Å²	70.7	21%	0.214	35%	0.35	C	S	.	.	H	α-helix	trans	-64.8	-29	179.8	25.1	-36	0	0	0	113.8	I953 P1059	I953-P955 VanDerWaalsContact C-CD 3.47Å; P955-P1059 HydrophobicContact CB-CG 4.25Å; P955-P1059 HydrophobicContact CG-CG 3.89Å
956	F	78.5	Confident	79	Confident	184 Å²	184	75.2 Å²	75.2	81%	0.807	37%	0.373	S	S	*	.	H	α-helix	trans	-93.1	-29.7	-179.5	-60.8	-60	0	0	0	113.8	F952 I953 V954	F952-F956 WeakPolarHBondContact O-CD2 3.3Å; F952-F956 WeakPolarHBondContact O-CE2 3.22Å; I953-F956 PolarHBondContact O-N 3.35Å; I953-F956 VanDerWaalsContact O-N 3.1Å; V954-F956 VanDerWaalsContact C-N 3.29Å; V954-F956 PolarHBondContact O-N 2.84Å
957	R	72.1	Confident	78.3	Confident	165 Å²	165	74.7 Å²	74.7	62%	0.623	38%	0.375	S	S	*	.	H	α-helix	trans	-87	-33.1	-170.2	-169.6	179.5	-175	-157.8	2.1	114.2	I953	I953-R957 HydrophobicContact CG2-CB 4.09Å; I953-R957 WeakPolarHBondContact O-CB 3.4Å; I953-R957 PolarHBondContact O-N 3.02Å
958	I	70.3	Confident	77.9	Confident	44 Å²	44	79.8 Å²	79.8	23%	0.226	40%	0.397	C	S	.	.	S	Bend	trans	-118.6	118.9	-164.5	-55.4	168.9	0	0	0	110.5	V954 K962 I964	V954-I958 PolarHBondContact O-N 3.39Å; I958-K962 HydrophobicContact CG2-CB 3.72Å; I958-K962 WeakPolarHBondContact CG2-O 3.41Å; I958-I964 HydrophobicContact CD1-CG1 3.99Å; I958-I964 HydrophobicContact CD1-CG2 4.44Å
959	G	70.4	Confident	77.4	Confident	40 Å²	40	85 Å²	85	41%	0.412	42%	0.415	S	S	.	.			trans	-58.4	153.8	173.8	0	0	0	0	0	112.9	K961 K962 R1055	G959-K961 PolarHBondContact O-N 3.45Å; G959-K962 PolarHBondContact O-N 3.19Å; G959-R1055 PolarHBondContact O-NH1 2.91Å
960	P	67	Low	76.9	Confident	79 Å²	79	86.8 Å²	86.8	51%	0.513	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-21.4	-161.5	20.8	-33.5	0	0	0	115.9
961	K	66.9	Low	76.6	Confident	200 Å²	200	86.2 Å²	86.2	87%	0.87	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	1.8	-175.6	-62.6	-173.4	176.5	-175	0	115.4	G959	G959-K961 PolarHBondContact O-N 3.45Å
962	K	75.7	Confident	76.5	Confident	152 Å²	152	87.1 Å²	87.1	66%	0.661	42%	0.423	S	S	*	.	S	Bend	trans	-95.7	133.4	-179	-71.5	-171.3	178.5	-174.9	0	111.3	I958 G959 R1055	I958-K962 HydrophobicContact CG2-CB 3.72Å; I958-K962 WeakPolarHBondContact CG2-O 3.41Å; G959-K962 PolarHBondContact O-N 3.19Å; K962-R1055 VanDerWaalsContact O-CZ 3.23Å; K962-R1055 PolarHBondContact O-NH1 3.12Å; K962-R1055 PolarHBondContact O-NH2 2.86Å
963	T	75.3	Confident	76.1	Confident	96 Å²	96	82.6 Å²	82.6	59%	0.589	40%	0.403	S	S	*	.			trans	-66.7	153.4	178.7	55	0	0	0	0	112.3
964	I	72.5	Confident	76.1	Confident	51 Å²	51	82.4 Å²	82.4	26%	0.262	40%	0.401	S	S	.	.			trans	-98.2	113.4	179.7	-56.2	169.6	0	0	0	108.2	V954 I958 I966 R1055	V954-I964 HydrophobicContact CG1-CD1 3.69Å; I958-I964 HydrophobicContact CD1-CG1 3.99Å; I958-I964 HydrophobicContact CD1-CG2 4.44Å; I964-I966 HydrophobicContact CG2-CG1 4.07Å; I964-R1055 HydrophobicContact CD1-CG 4.16Å
965	I	73.1	Confident	76.4	Confident	153 Å²	153	82.3 Å²	82.3	79%	0.785	40%	0.4	S	S	*	.			trans	-87.8	120.5	170.3	-58.9	172.6	0	0	0	107.5
966	I	74.8	Confident	76.5	Confident	94 Å²	94	82.3 Å²	82.3	48%	0.482	40%	0.398	S	S	.	.			trans	-98.9	102.2	-178.5	-59.6	175.9	0	0	0	108.2	L946 F950 I964 H971	L946-I966 HydrophobicContact CD1-CD1 4.44Å; L946-I966 HydrophobicContact CD1-CG2 3.94Å; F950-I966 HydrophobicContact CZ-CD1 4Å; I964-I966 HydrophobicContact CG2-CG1 4.07Å; I966-H971 VanDerWaalsContact CG2-CD2 3.41Å; I966-H971 WeakPolarHBondContact CG2-CD2 3.5Å
967	G	75.8	Confident	76.8	Confident	20 Å²	20	76.6 Å²	76.6	21%	0.206	37%	0.374	C	S	.	.			trans	-81.7	120.8	172.4	0	0	0	0	0	111	W969 E970 H971	G967-W969 VanDerWaalsContact C-N 3.32Å; G967-W969 PolarHBondContact O-N 2.96Å; G967-E970 PolarHBondContact O-N 2.83Å; G967-H971 PolarHBondContact O-CD2 3.43Å; G967-H971 PolarHBondContact O-N 2.8Å
968	F	81.4	Confident	77.4	Confident	124 Å²	124	71 Å²	71	54%	0.544	36%	0.355	S	S	.	.	H	α-helix	trans	-54.9	-47.7	177.1	173.5	-94.1	0	0	0	112.1	T942 W972	T942-F968 HydrophobicContact CG2-CD2 4.02Å; T942-F968 HydrophobicContact CG2-CE2 3.53Å; T942-F968 HydrophobicContact CG2-CZ 3.9Å; F968-W972 VanDerWaalsContact O-CB 3.3Å; F968-W972 WeakPolarHBondContact O-CB 3.24Å; F968-W972 PolarHBondContact O-N 3.18Å
969	W	77.5	Confident	78.2	Confident	138 Å²	138	70.5 Å²	70.5	52%	0.523	35%	0.353	S	S	.	.	H	α-helix	trans	-65.4	-43.3	-177.2	-67	110.3	0	0	0	112.6	L602 I609 G967 H971 W972 I973	L602-W969 HydrophobicContact CD1-CB 4.37Å; I609-W969 HydrophobicContact CD1-CE3 4.4Å; G967-W969 VanDerWaalsContact C-N 3.32Å; G967-W969 PolarHBondContact O-N 2.96Å; W969-H971 PolarHBondContact O-N 3Å; W969-W972 AromaticContact CE3-CE3 3.69Å; W969-W972 HydrophobicContact CE3-CE3 3.69Å; W969-W972 HydrophobicContact CE3-CZ3 4.04Å; W969-W972 AromaticContact CZ3-CE3 3.86Å; W969-W972 HydrophobicContact CZ3-CE3 3.86Å; W969-W972 AromaticContact CZ3-CZ3 3.87Å; W969-W972 HydrophobicContact CZ3-CZ3 3.87Å; W969-W972 PolarHBondContact O-N 3.34Å; W969-I973 WeakPolarHBondContact O-CD1 3.46Å; W969-I973 VanDerWaalsContact O-CG1 3.29Å; W969-I973 WeakPolarHBondContact O-CG1 3.49Å; W969-I973 PolarHBondContact O-N 3.36Å; W969-I973 VanDerWaalsContact O-N 3.13Å
970	E	76.6	Confident	78.9	Confident	52 Å²	52	75 Å²	75	24%	0.243	36%	0.361	C	S	.	.	H	α-helix	trans	-58.3	-48.1	179.9	-63.3	179.2	-163.3	0	0	111.5	G967 F974	G967-E970 PolarHBondContact O-N 2.83Å; E970-F974 VanDerWaalsContact O-CB 3.25Å; E970-F974 WeakPolarHBondContact O-CB 3.27Å; E970-F974 PolarHBondContact O-N 3.3Å; E970-F974 VanDerWaalsContact O-N 3.16Å
971	H	82.1	Confident	79.8	Confident	16 Å²	16	74.8 Å²	74.8	7%	0.074	36%	0.358	C	S	.	.	H	α-helix	trans	-73.6	-33.3	-179.7	-61	-49	0	0	0	113	G945 N949 I966 G967 W969 G975	G945-H971 WeakPolarHBondContact CA-O 3.35Å; N949-H971 PolarHBondContact ND2-CE1 3.5Å; I966-H971 VanDerWaalsContact CG2-CD2 3.41Å; I966-H971 WeakPolarHBondContact CG2-CD2 3.5Å; G967-H971 PolarHBondContact O-CD2 3.43Å; G967-H971 PolarHBondContact O-N 2.8Å; W969-H971 PolarHBondContact O-N 3Å; H971-G975 PolarHBondContact O-N 3.49Å
972	W	85.3	Confident	80.6	Confident	33 Å²	33	68.9 Å²	68.9	13%	0.125	34%	0.339	C	S	.	.	H	α-helix	trans	-59.8	-49.6	176.1	177.1	61.4	0	0	0	112	I609 V613 L937 T942 F968 W969 G975 I976	I609-W972 HydrophobicContact CD1-CZ3 4.24Å; I609-W972 HydrophobicContact CG1-CZ3 4.01Å; V613-W972 HydrophobicContact CG2-CH2 3.99Å; L937-W972 PolarHBondContact O-NE1 3.31Å; T942-W972 HydrophobicContact CG2-CB 3.63Å; T942-W972 HydrophobicContact CG2-CG 4.07Å; F968-W972 VanDerWaalsContact O-CB 3.3Å; F968-W972 WeakPolarHBondContact O-CB 3.24Å; F968-W972 PolarHBondContact O-N 3.18Å; W969-W972 AromaticContact CE3-CE3 3.69Å; W969-W972 HydrophobicContact CE3-CE3 3.69Å; W969-W972 HydrophobicContact CE3-CZ3 4.04Å; W969-W972 AromaticContact CZ3-CE3 3.86Å; W969-W972 HydrophobicContact CZ3-CE3 3.86Å; W969-W972 AromaticContact CZ3-CZ3 3.87Å; W969-W972 HydrophobicContact CZ3-CZ3 3.87Å; W969-W972 PolarHBondContact O-N 3.34Å; W972-G975 PolarHBondContact O-N 3.27Å; W972-I976 HydrophobicContact CD2-CD1 4.02Å; W972-I976 HydrophobicContact CE3-CD1 4.49Å; W972-I976 HydrophobicContact CH2-CD1 3.82Å; W972-I976 HydrophobicContact CZ2-CD1 3.27Å; W972-I976 HydrophobicContact CZ3-CD1 4.4Å; W972-I976 PolarHBondContact O-N 3.47Å
973	I	77.8	Confident	81	Confident	5 Å²	5	64.7 Å²	64.7	3%	0.026	32%	0.323	C	S	.	.	H	α-helix	trans	-69.8	-46.3	-176.8	-62.1	152.3	0	0	0	110.6	S605 M608 I609 W969 G975 I976 M977	S605-I973 WeakPolarHBondContact O-CD1 3.33Å; M608-I973 HydrophobicContact CB-CG2 3.79Å; M608-I973 HydrophobicContact CE-CG2 4.23Å; M608-I973 HydrophobicContact SD-CG2 4.36Å; I609-I973 HydrophobicContact CD1-CD1 3.47Å; I609-I973 VanDerWaalsContact CD1-CD1 3.47Å; I609-I973 HydrophobicContact CD1-CG1 4.03Å; I609-I973 HydrophobicContact CG1-CD1 3.49Å; I609-I973 VanDerWaalsContact CG1-CD1 3.49Å; I609-I973 HydrophobicContact CG1-CG1 3.63Å; W969-I973 WeakPolarHBondContact O-CD1 3.46Å; W969-I973 VanDerWaalsContact O-CG1 3.29Å; W969-I973 WeakPolarHBondContact O-CG1 3.49Å; W969-I973 PolarHBondContact O-N 3.36Å; W969-I973 VanDerWaalsContact O-N 3.13Å; I973-G975 PolarHBondContact O-N 3.44Å; I973-I976 PolarHBondContact O-N 3.32Å; I973-M977 PolarHBondContact O-N 3.01Å
974	F	81.3	Confident	81.5	Confident	49 Å²	49	64.9 Å²	64.9	22%	0.215	32%	0.32	C	S	.	.	H	α-helix	trans	-55.2	-41.3	174.7	-173.9	-104.5	0	0	0	110.4	I948 I953 E970 M977 H978	I948-F974 HydrophobicContact CB-CE1 3.76Å; I948-F974 HydrophobicContact CG2-CE1 3.41Å; I948-F974 VanDerWaalsContact CG2-CE1 3.41Å; I948-F974 HydrophobicContact CG2-CZ 3.8Å; I953-F974 HydrophobicContact CD1-CE1 3.94Å; I953-F974 HydrophobicContact CD1-CE2 3.77Å; I953-F974 HydrophobicContact CD1-CZ 3.39Å; I953-F974 HydrophobicContact CG1-CZ 4.48Å; E970-F974 VanDerWaalsContact O-CB 3.25Å; E970-F974 WeakPolarHBondContact O-CB 3.27Å; E970-F974 PolarHBondContact O-N 3.3Å; E970-F974 VanDerWaalsContact O-N 3.16Å; F974-M977 PolarHBondContact O-N 3.48Å; F974-H978 AromaticContact CD1-CE1 3.97Å; F974-H978 AromaticContact CD1-ND1 3.84Å; F974-H978 AromaticContact CD2-CE1 3.63Å; F974-H978 AromaticContact CD2-ND1 3.97Å; F974-H978 AromaticContact CE1-CE1 3.51Å; F974-H978 AromaticContact CE1-ND1 3.74Å; F974-H978 AromaticContact CE2-CE1 3.14Å; F974-H978 WeakPolarHBondContact CE2-CE1 3.31Å; F974-H978 AromaticContact CE2-ND1 3.89Å; F974-H978 AromaticContact CG-ND1 3.95Å; F974-H978 AromaticContact CZ-CE1 3.03Å; F974-H978 WeakPolarHBondContact CZ-CE1 3.34Å; F974-H978 AromaticContact CZ-ND1 3.74Å; F974-H978 AromaticContact CZ-NE2 3.63Å; F974-H978 PolarHBondContact O-N 2.98Å; F974-H978 VanDerWaalsContact O-N 3.1Å; F974-H978 PolarHBondContact O-ND1 3.49Å
975	G	87.9	Confident	82.1	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-60.6	-45.8	172.1	0	0	0	0	0	114.5	P941 H971 W972 I973 M977 H978 L979	P941-G975 VanDerWaalsContact O-CA 3.28Å; P941-G975 WeakPolarHBondContact O-CA 3.47Å; H971-G975 PolarHBondContact O-N 3.49Å; W972-G975 PolarHBondContact O-N 3.27Å; I973-G975 PolarHBondContact O-N 3.44Å; G975-M977 VanDerWaalsContact C-N 3.32Å; G975-M977 PolarHBondContact O-N 3.04Å; G975-H978 PolarHBondContact O-N 2.95Å; G975-L979 VanDerWaalsContact O-CB 3.24Å; G975-L979 WeakPolarHBondContact O-CB 3.47Å; G975-L979 PolarHBondContact O-N 3.31Å
976	I	85.1	Confident	82.5	Confident	33 Å²	33	61.6 Å²	61.6	17%	0.169	30%	0.304	C	S	.	.	H	α-helix	trans	-59.7	-45	176.3	-73.1	179	0	0	0	110.7	V613 P941 W972 I973 H978 L979 K980	V613-I976 HydrophobicContact CG2-CD1 4.3Å; P941-I976 HydrophobicContact CB-CG1 3.71Å; P941-I976 HydrophobicContact CG-CG1 3.97Å; W972-I976 HydrophobicContact CD2-CD1 4.02Å; W972-I976 HydrophobicContact CE3-CD1 4.49Å; W972-I976 HydrophobicContact CH2-CD1 3.82Å; W972-I976 HydrophobicContact CZ2-CD1 3.27Å; W972-I976 HydrophobicContact CZ3-CD1 4.4Å; W972-I976 PolarHBondContact O-N 3.47Å; I973-I976 PolarHBondContact O-N 3.32Å; I976-H978 PolarHBondContact O-N 3.41Å; I976-L979 PolarHBondContact O-N 3.34Å; I976-K980 WeakPolarHBondContact O-CB 3.4Å; I976-K980 PolarHBondContact O-N 3.42Å
977	M	83.1	Confident	82.9	Confident	64 Å²	64	60.4 Å²	60.4	32%	0.315	30%	0.299	S	S	.	.	H	α-helix	trans	-59.3	-48.5	179.9	-170.1	-174	77.4	0	0	110.9	M608 I973 F974 G975 K980 V981	M608-M977 HydrophobicContact CE-CB 4.27Å; M608-M977 HydrophobicContact CE-CG 4.17Å; M608-M977 HydrophobicContact CE-SD 3.51Å; M608-M977 VanDerWaalsContact CE-SD 3.51Å; I973-M977 PolarHBondContact O-N 3.01Å; F974-M977 PolarHBondContact O-N 3.48Å; G975-M977 VanDerWaalsContact C-N 3.32Å; G975-M977 PolarHBondContact O-N 3.04Å; M977-K980 PolarHBondContact O-N 3.41Å; M977-V981 WeakPolarHBondContact O-CG2 3.48Å; M977-V981 PolarHBondContact O-N 2.85Å; M977-V981 VanDerWaalsContact O-N 3.13Å
978	H	85.8	Confident	83.2	Confident	48 Å²	48	65.8 Å²	65.8	22%	0.222	32%	0.322	C	S	.	.	H	α-helix	trans	-67.3	-41.1	179	-72.4	76.7	0	0	0	112.1	L944 I948 F974 G975 I976 K980 V981 V982	L944-H978 HydrophobicContact CD2-CB 4.26Å; I948-H978 HydrophobicContact CD1-CB 3.57Å; I948-H978 VanDerWaalsContact CD1-CG 3.48Å; F974-H978 AromaticContact CD1-CE1 3.97Å; F974-H978 AromaticContact CD1-ND1 3.84Å; F974-H978 AromaticContact CD2-CE1 3.63Å; F974-H978 AromaticContact CD2-ND1 3.97Å; F974-H978 AromaticContact CE1-CE1 3.51Å; F974-H978 AromaticContact CE1-ND1 3.74Å; F974-H978 AromaticContact CE2-CE1 3.14Å; F974-H978 WeakPolarHBondContact CE2-CE1 3.31Å; F974-H978 AromaticContact CE2-ND1 3.89Å; F974-H978 AromaticContact CG-ND1 3.95Å; F974-H978 AromaticContact CZ-CE1 3.03Å; F974-H978 WeakPolarHBondContact CZ-CE1 3.34Å; F974-H978 AromaticContact CZ-ND1 3.74Å; F974-H978 AromaticContact CZ-NE2 3.63Å; F974-H978 PolarHBondContact O-N 2.98Å; F974-H978 VanDerWaalsContact O-N 3.1Å; F974-H978 PolarHBondContact O-ND1 3.49Å; G975-H978 PolarHBondContact O-N 2.95Å; I976-H978 PolarHBondContact O-N 3.41Å; H978-K980 VanDerWaalsContact C-N 3.29Å; H978-K980 PolarHBondContact O-N 3.3Å; H978-V981 PolarHBondContact O-N 3.4Å; H978-V982 WeakPolarHBondContact O-CB 3.43Å; H978-V982 VanDerWaalsContact O-CG2 3.26Å; H978-V982 WeakPolarHBondContact O-CG2 3.41Å; H978-V982 PolarHBondContact O-N 3.28Å
979	L	86.6	Confident	83.1	Confident	34 Å²	34	60.6 Å²	60.6	18%	0.178	30%	0.304	C	S	.	.	H	α-helix	trans	-59.3	-42.2	176.7	-175.8	64	0	0	0	111	L940 P941 L944 G975 I976 V982 I983	L940-L979 HydrophobicContact CD2-CD2 4.3Å; P941-L979 HydrophobicContact CG-CD2 4.21Å; L944-L979 HydrophobicContact CD2-CB 3.9Å; L944-L979 HydrophobicContact CD2-CD1 4.32Å; G975-L979 VanDerWaalsContact O-CB 3.24Å; G975-L979 WeakPolarHBondContact O-CB 3.47Å; G975-L979 PolarHBondContact O-N 3.31Å; I976-L979 PolarHBondContact O-N 3.34Å; L979-V982 PolarHBondContact O-N 2.92Å; L979-I983 HydrophobicContact CD1-CD1 4.22Å; L979-I983 HydrophobicContact CD1-CG1 4.5Å; L979-I983 HydrophobicContact CG-CD1 3.93Å; L979-I983 WeakPolarHBondContact O-CB 3.32Å; L979-I983 VanDerWaalsContact O-CG1 3.23Å; L979-I983 WeakPolarHBondContact O-CG1 3.45Å; L979-I983 PolarHBondContact O-N 2.86Å
980	K	85.6	Confident	83.1	Confident	134 Å²	134	58.1 Å²	58.1	58%	0.583	31%	0.305	S	S	*	.	H	α-helix	trans	-63.6	-44.8	177.6	-172.6	178.8	179.6	-178.8	0	112	I976 M977 H978 I983 L984	I976-K980 WeakPolarHBondContact O-CB 3.4Å; I976-K980 PolarHBondContact O-N 3.42Å; M977-K980 PolarHBondContact O-N 3.41Å; H978-K980 VanDerWaalsContact C-N 3.29Å; H978-K980 PolarHBondContact O-N 3.3Å; K980-I983 PolarHBondContact O-N 3.44Å; K980-L984 WeakPolarHBondContact O-CB 3.45Å; K980-L984 PolarHBondContact O-N 3.45Å
981	V	85.2	Confident	83	Confident	75 Å²	75	60.7 Å²	60.7	46%	0.455	33%	0.326	S	S	.	.	H	α-helix	trans	-63.4	-44.9	176.7	173.8	0	0	0	0	110.8	M977 H978 I983 L984 L985	M977-V981 WeakPolarHBondContact O-CG2 3.48Å; M977-V981 PolarHBondContact O-N 2.85Å; M977-V981 VanDerWaalsContact O-N 3.13Å; H978-V981 PolarHBondContact O-N 3.4Å; V981-I983 PolarHBondContact O-N 2.8Å; V981-L984 PolarHBondContact O-N 3.23Å; V981-L985 HydrophobicContact CG1-CD1 3.88Å; V981-L985 HydrophobicContact CG1-CG 4.32Å; V981-L985 WeakPolarHBondContact O-CB 3.39Å; V981-L985 WeakPolarHBondContact O-CG 3.19Å; V981-L985 PolarHBondContact O-N 2.77Å
982	V	84.4	Confident	82.8	Confident	76 Å²	76	66.9 Å²	66.9	46%	0.461	35%	0.349	S	S	.	.	H	α-helix	trans	-61	-46.8	177.6	170.9	0	0	0	0	110.8	H978 L979 L984 L985 T986	H978-V982 WeakPolarHBondContact O-CB 3.43Å; H978-V982 VanDerWaalsContact O-CG2 3.26Å; H978-V982 WeakPolarHBondContact O-CG2 3.41Å; H978-V982 PolarHBondContact O-N 3.28Å; L979-V982 PolarHBondContact O-N 2.92Å; V982-L984 PolarHBondContact O-N 3.11Å; V982-L985 PolarHBondContact O-N 3.49Å; V982-T986 HydrophobicContact CG1-CG2 4.36Å; V982-T986 VanDerWaalsContact O-CG2 3.22Å; V982-T986 WeakPolarHBondContact O-CG2 3.32Å; V982-T986 PolarHBondContact O-N 3.46Å; V982-T986 PolarHBondContact O-OG1 2.87Å
983	I	84.8	Confident	82.5	Confident	64 Å²	64	73.3 Å²	73.3	33%	0.328	37%	0.374	S	S	.	.	H	α-helix	trans	-58.6	-48.1	176.6	-70.3	166.7	0	0	0	110.3	L979 K980 V981 L985 T986 L987	L979-I983 HydrophobicContact CD1-CD1 4.22Å; L979-I983 HydrophobicContact CD1-CG1 4.5Å; L979-I983 HydrophobicContact CG-CD1 3.93Å; L979-I983 WeakPolarHBondContact O-CB 3.32Å; L979-I983 VanDerWaalsContact O-CG1 3.23Å; L979-I983 WeakPolarHBondContact O-CG1 3.45Å; L979-I983 PolarHBondContact O-N 2.86Å; K980-I983 PolarHBondContact O-N 3.44Å; V981-I983 PolarHBondContact O-N 2.8Å; I983-L985 PolarHBondContact O-N 2.88Å; I983-T986 WeakPolarHBondContact CA-OG1 3.45Å; I983-T986 PolarHBondContact O-N 3.07Å; I983-T986 PolarHBondContact O-OG1 2.99Å; I983-L987 HydrophobicContact CG2-CD1 3.82Å; I983-L987 HydrophobicContact CG2-CG 4.39Å; I983-L987 WeakPolarHBondContact O-CG 3.49Å; I983-L987 PolarHBondContact O-N 2.87Å
984	L	85	Confident	82.4	Confident	100 Å²	100	76.8 Å²	76.8	52%	0.524	39%	0.392	S	S	.	.	H	α-helix	trans	-59.8	-47.8	179.7	-179.3	62.6	0	0	0	112.3	K980 V981 V982 T986 L987 L988	K980-L984 WeakPolarHBondContact O-CB 3.45Å; K980-L984 PolarHBondContact O-N 3.45Å; V981-L984 PolarHBondContact O-N 3.23Å; V982-L984 PolarHBondContact O-N 3.11Å; L984-T986 VanDerWaalsContact C-N 3.3Å; L984-T986 PolarHBondContact O-N 3.42Å; L984-L987 PolarHBondContact O-N 3.29Å; L984-L988 HydrophobicContact CD1-CD1 4.04Å; L984-L988 HydrophobicContact CD1-CG 4.24Å; L984-L988 HydrophobicContact CG-CD1 3.97Å; L984-L988 WeakPolarHBondContact O-CG 3.24Å; L984-L988 PolarHBondContact O-N 3.16Å
985	L	85.1	Confident	82.5	Confident	114 Å²	114	77.9 Å²	77.9	60%	0.597	39%	0.394	S	S	*	.	H	α-helix	trans	-62.1	-38	177.9	-71.4	173.6	0	0	0	112	V981 V982 I983 L987 G989	V981-L985 HydrophobicContact CG1-CD1 3.88Å; V981-L985 HydrophobicContact CG1-CG 4.32Å; V981-L985 WeakPolarHBondContact O-CB 3.39Å; V981-L985 WeakPolarHBondContact O-CG 3.19Å; V981-L985 PolarHBondContact O-N 2.77Å; V982-L985 PolarHBondContact O-N 3.49Å; I983-L985 PolarHBondContact O-N 2.88Å; L985-L987 VanDerWaalsContact C-N 3.33Å; L985-G989 PolarHBondContact O-N 3.37Å; L985-G989 VanDerWaalsContact O-N 3.13Å
986	T	82.3	Confident	82.1	Confident	20 Å²	20	81.5 Å²	81.5	12%	0.123	41%	0.414	C	S	.	.	H	α-helix	trans	-68.5	-32.2	177.1	58.2	0	0	0	0	113	V982 I983 L984 L994 L998	V982-T986 HydrophobicContact CG1-CG2 4.36Å; V982-T986 VanDerWaalsContact O-CG2 3.22Å; V982-T986 WeakPolarHBondContact O-CG2 3.32Å; V982-T986 PolarHBondContact O-N 3.46Å; V982-T986 PolarHBondContact O-OG1 2.87Å; I983-T986 WeakPolarHBondContact CA-OG1 3.45Å; I983-T986 PolarHBondContact O-N 3.07Å; I983-T986 PolarHBondContact O-OG1 2.99Å; L984-T986 VanDerWaalsContact C-N 3.3Å; L984-T986 PolarHBondContact O-N 3.42Å; T986-L994 HydrophobicContact CG2-CD2 3.66Å; T986-L994 HydrophobicContact CG2-CG 4.35Å; T986-L998 WeakPolarHBondContact OG1-CD1 3.3Å
987	L	82.3	Confident	81.9	Confident	69 Å²	69	84.9 Å²	84.9	36%	0.361	42%	0.424	S	S	.	.	H	α-helix	trans	-78.2	-34.8	178	-68.1	173.6	0	0	0	112.5	I983 L984 L985 G989 R995 E999	I983-L987 HydrophobicContact CG2-CD1 3.82Å; I983-L987 HydrophobicContact CG2-CG 4.39Å; I983-L987 WeakPolarHBondContact O-CG 3.49Å; I983-L987 PolarHBondContact O-N 2.87Å; L984-L987 PolarHBondContact O-N 3.29Å; L985-L987 VanDerWaalsContact C-N 3.33Å; L987-G989 VanDerWaalsContact C-N 3.33Å; L987-R995 HydrophobicContact CD2-CG 4.4Å; L987-R995 PolarHBondContact O-NH1 3.37Å; L987-E999 HydrophobicContact CD2-CG 4.16Å
988	L	82.4	Confident	81.8	Confident	134 Å²	134	84 Å²	84	70%	0.702	42%	0.42	S	S	*	.	H	α-helix	trans	-75	-20.4	175.3	-70.7	172.6	0	0	0	113.4	L984	L984-L988 HydrophobicContact CD1-CD1 4.04Å; L984-L988 HydrophobicContact CD1-CG 4.24Å; L984-L988 HydrophobicContact CG-CD1 3.97Å; L984-L988 WeakPolarHBondContact O-CG 3.24Å; L984-L988 PolarHBondContact O-N 3.16Å
989	G	79.1	Confident	81.5	Confident	15 Å²	15	84.6 Å²	84.6	16%	0.155	42%	0.424	C	S	.	.	S	Bend	trans	-74.8	178.1	-179.2	0	0	0	0	0	114.5	L985 L987 R995	L985-G989 PolarHBondContact O-N 3.37Å; L985-G989 VanDerWaalsContact O-N 3.13Å; L987-G989 VanDerWaalsContact C-N 3.33Å; G989-R995 PolarHBondContact O-NH1 2.74Å
990	P	77.1	Confident	81	Confident	85 Å²	85	87.8 Å²	87.8	55%	0.552	44%	0.44	S	S	*	.	S	Bend	trans	-49.4	173.4	170.6	-28.5	34.2	0	0	0	114.6	W992	P990-W992 VanDerWaalsContact C-N 3.26Å; P990-W992 HydrophobicContact CG-CZ2 4.38Å; P990-W992 PolarHBondContact O-N 3.24Å; P990-W992 PolarHBondContact O-NE1 2.76Å
991	P	75.1	Confident	80.7	Confident	106 Å²	106	83.7 Å²	83.7	69%	0.688	42%	0.423	S	S	*	.	S	Bend	trans	-78.2	67.8	176.9	31.9	-35.2	0	0	0	112.5
992	W	76.8	Confident	80.4	Confident	147 Å²	147	85.9 Å²	85.9	56%	0.557	43%	0.427	S	S	*	.			trans	-72.2	157.6	173.7	-17	58.8	0	0	0	111.4	P990 L994 R995 N996	P990-W992 VanDerWaalsContact C-N 3.26Å; P990-W992 HydrophobicContact CG-CZ2 4.38Å; P990-W992 PolarHBondContact O-N 3.24Å; P990-W992 PolarHBondContact O-NE1 2.76Å; W992-L994 PolarHBondContact O-N 3.22Å; W992-L994 VanDerWaalsContact O-N 3.11Å; W992-R995 PolarHBondContact O-N 3.37Å; W992-R995 VanDerWaalsContact O-N 3.09Å; W992-N996 PolarHBondContact O-N 3.41Å; W992-N996 PolarHBondContact O-OD1 3.29Å
993	W	78.9	Confident	79.8	Confident	168 Å²	168	87.2 Å²	87.2	64%	0.636	43%	0.429	S	S	*	.	H	α-helix	trans	-50.6	-36.9	172.8	171.5	91.4	0	0	0	113.8	R997	W993-R997 HydrophobicContact CD2-CG 4.22Å; W993-R997 HydrophobicContact CH2-CG 4.4Å; W993-R997 HydrophobicContact CZ2-CG 3.99Å; W993-R997 VanDerWaalsContact O-CG 3.25Å; W993-R997 WeakPolarHBondContact O-CG 3.38Å; W993-R997 PolarHBondContact O-N 3.34Å
994	L	76.5	Confident	79.1	Confident	77 Å²	77	85.3 Å²	85.3	40%	0.403	42%	0.418	S	S	.	.	H	α-helix	trans	-69.5	-40.2	-179.4	-178.7	60.7	0	0	0	112.4	T986 W992 R997 L998	T986-L994 HydrophobicContact CG2-CD2 3.66Å; T986-L994 HydrophobicContact CG2-CG 4.35Å; W992-L994 PolarHBondContact O-N 3.22Å; W992-L994 VanDerWaalsContact O-N 3.11Å; L994-R997 PolarHBondContact O-N 3Å; L994-L998 HydrophobicContact CD1-CD1 4.43Å; L994-L998 HydrophobicContact CD1-CG 4.48Å; L994-L998 HydrophobicContact CG-CD1 4.18Å; L994-L998 WeakPolarHBondContact O-CG 3.33Å; L994-L998 PolarHBondContact O-N 3.42Å
995	R	83.8	Confident	78.5	Confident	73 Å²	73	83.6 Å²	83.6	28%	0.275	41%	0.409	S	S	.	.	H	α-helix	trans	-60.6	-52.7	177.4	175.4	176.2	168	177.6	-1.6	110.7	L987 G989 W992 R997 L998 E999	L987-R995 HydrophobicContact CD2-CG 4.4Å; L987-R995 PolarHBondContact O-NH1 3.37Å; G989-R995 PolarHBondContact O-NH1 2.74Å; W992-R995 PolarHBondContact O-N 3.37Å; W992-R995 VanDerWaalsContact O-N 3.09Å; R995-R997 PolarHBondContact O-N 2.88Å; R995-R997 VanDerWaalsContact O-N 3.15Å; R995-L998 PolarHBondContact O-N 3.48Å; R995-E999 HydrophobicContact CG-CG 4.45Å; R995-E999 WeakPolarHBondContact CG-OE1 3.15Å; R995-E999 IonicContact CZ-OE1 3.3Å; R995-E999 IonicContact NE-OE1 3.27Å; R995-E999 PolarHBondContact NE-OE1 2.9Å; R995-E999 IonicContact NH2-OE1 3.2Å; R995-E999 PolarHBondContact NH2-OE1 3.21Å; R995-E999 PolarHBondContact O-N 2.79Å
996	N	79.8	Confident	77.7	Confident	75 Å²	75	81.5 Å²	81.5	40%	0.401	40%	0.401	S	S	.	.	H	α-helix	trans	-58.7	-33	179.1	-60	10.5	0	0	0	111.7	W992 L1000	W992-N996 PolarHBondContact O-N 3.41Å; W992-N996 PolarHBondContact O-OD1 3.29Å; N996-L1000 WeakPolarHBondContact O-CD1 3.48Å; N996-L1000 WeakPolarHBondContact O-CG 3.32Å; N996-L1000 PolarHBondContact O-N 3.41Å
997	R	79.7	Confident	76.9	Confident	104 Å²	104	88 Å²	88	39%	0.392	43%	0.429	S	S	.	.	H	α-helix	trans	-71.4	-39.2	175.4	-73.3	-69.9	-175.7	-171.2	-1.7	113	W993 L994 R995 F1001	W993-R997 HydrophobicContact CD2-CG 4.22Å; W993-R997 HydrophobicContact CH2-CG 4.4Å; W993-R997 HydrophobicContact CZ2-CG 3.99Å; W993-R997 VanDerWaalsContact O-CG 3.25Å; W993-R997 WeakPolarHBondContact O-CG 3.38Å; W993-R997 PolarHBondContact O-N 3.34Å; L994-R997 PolarHBondContact O-N 3Å; R995-R997 PolarHBondContact O-N 2.88Å; R995-R997 VanDerWaalsContact O-N 3.15Å; R997-F1001 WeakPolarHBondContact O-CB 3.21Å; R997-F1001 PolarHBondContact O-N 3.47Å; R997-F1001 VanDerWaalsContact O-N 3.07Å
998	L	80.9	Confident	76	Confident	45 Å²	45	89.9 Å²	89.9	24%	0.236	44%	0.437	C	S	.	.	H	α-helix	trans	-69.4	-38.6	176.9	-74.1	169.4	0	0	0	111.8	T986 L994 R995 F1001 H1002	T986-L998 WeakPolarHBondContact OG1-CD1 3.3Å; L994-L998 HydrophobicContact CD1-CD1 4.43Å; L994-L998 HydrophobicContact CD1-CG 4.48Å; L994-L998 HydrophobicContact CG-CD1 4.18Å; L994-L998 WeakPolarHBondContact O-CG 3.33Å; L994-L998 PolarHBondContact O-N 3.42Å; R995-L998 PolarHBondContact O-N 3.48Å; L998-F1001 WeakPolarHBondContact O-CB 3.29Å; L998-F1001 PolarHBondContact O-N 3.36Å; L998-H1002 WeakPolarHBondContact O-CB 3.47Å; L998-H1002 PolarHBondContact O-N 3.28Å
999	E	81	Confident	75	Confident	62 Å²	62	89.9 Å²	89.9	29%	0.29	43%	0.427	S	S	.	.	H	α-helix	trans	-61.5	-50.2	174.5	-72.7	169.2	172.9	0	0	110.6	L987 R995 F1001 H1002 E1003	L987-E999 HydrophobicContact CD2-CG 4.16Å; R995-E999 HydrophobicContact CG-CG 4.45Å; R995-E999 WeakPolarHBondContact CG-OE1 3.15Å; R995-E999 IonicContact CZ-OE1 3.3Å; R995-E999 IonicContact NE-OE1 3.27Å; R995-E999 PolarHBondContact NE-OE1 2.9Å; R995-E999 IonicContact NH2-OE1 3.2Å; R995-E999 PolarHBondContact NH2-OE1 3.21Å; R995-E999 PolarHBondContact O-N 2.79Å; E999-F1001 PolarHBondContact O-N 2.89Å; E999-H1002 PolarHBondContact O-N 3.42Å; E999-H1002 VanDerWaalsContact O-N 3.08Å; E999-E1003 WeakPolarHBondContact O-CG 3.25Å; E999-E1003 PolarHBondContact O-N 2.91Å
1000	L	76	Confident	73.9	Confident	100 Å²	100	97.5 Å²	97.5	52%	0.524	46%	0.459	S	S	.	.	H	α-helix	trans	-58.6	-34.8	174.7	-71.2	170.9	0	0	0	113.1	N996 E1004	N996-L1000 WeakPolarHBondContact O-CD1 3.48Å; N996-L1000 WeakPolarHBondContact O-CG 3.32Å; N996-L1000 PolarHBondContact O-N 3.41Å; L1000-E1004 WeakPolarHBondContact O-CB 3.26Å; L1000-E1004 PolarHBondContact O-N 3.21Å
1001	F	78	Confident	72.9	Confident	49 Å²	49	99.9 Å²	99.9	22%	0.215	47%	0.467	C	S	.	.	H	α-helix	trans	-69.2	-43.5	175.9	-179.7	-88.8	0	0	0	111.6	R997 L998 E999 I1005 L1017 A1020 I1021	R997-F1001 WeakPolarHBondContact O-CB 3.21Å; R997-F1001 PolarHBondContact O-N 3.47Å; R997-F1001 VanDerWaalsContact O-N 3.07Å; L998-F1001 WeakPolarHBondContact O-CB 3.29Å; L998-F1001 PolarHBondContact O-N 3.36Å; E999-F1001 PolarHBondContact O-N 2.89Å; F1001-I1005 HydrophobicContact CD1-CD1 3.68Å; F1001-I1005 HydrophobicContact CE1-CD1 3.13Å; F1001-I1005 HydrophobicContact CE1-CG1 4.38Å; F1001-I1005 HydrophobicContact CE2-CD1 4.23Å; F1001-I1005 HydrophobicContact CG-CD1 4.42Å; F1001-I1005 HydrophobicContact CZ-CD1 3.44Å; F1001-I1005 VanDerWaalsContact CZ-CD1 3.44Å; F1001-I1005 WeakPolarHBondContact O-CG1 3.39Å; F1001-I1005 PolarHBondContact O-N 2.91Å; F1001-L1017 HydrophobicContact CD2-CD1 3.21Å; F1001-L1017 HydrophobicContact CD2-CG 4.09Å; F1001-L1017 HydrophobicContact CE2-CD1 3.06Å; F1001-L1017 HydrophobicContact CE2-CD2 4.38Å; F1001-L1017 HydrophobicContact CE2-CG 3.51Å; F1001-L1017 HydrophobicContact CG-CD1 4.06Å; F1001-L1017 HydrophobicContact CZ-CD1 3.85Å; F1001-L1017 HydrophobicContact CZ-CG 4.25Å; F1001-A1020 HydrophobicContact CD2-CB 4.37Å; F1001-I1021 HydrophobicContact CD2-CG1 4.39Å; F1001-I1021 HydrophobicContact CE2-CD1 3.42Å; F1001-I1021 VanDerWaalsContact CE2-CD1 3.42Å; F1001-I1021 HydrophobicContact CE2-CG1 3.68Å; F1001-I1021 HydrophobicContact CZ-CD1 3.81Å; F1001-I1021 HydrophobicContact CZ-CG1 4.27Å
1002	H	78.8	Confident	72.3	Confident	120 Å²	120	95.3 Å²	95.3	56%	0.556	44%	0.438	S	S	*	.	H	α-helix	trans	-65.3	-45.4	179	-177.9	73.4	0	0	0	111.8	L998 E999 E1004 I1005 T1006	L998-H1002 WeakPolarHBondContact O-CB 3.47Å; L998-H1002 PolarHBondContact O-N 3.28Å; E999-H1002 PolarHBondContact O-N 3.42Å; E999-H1002 VanDerWaalsContact O-N 3.08Å; H1002-E1004 PolarHBondContact O-N 3.48Å; H1002-I1005 PolarHBondContact O-N 3.18Å; H1002-T1006 WeakPolarHBondContact O-CB 3.43Å; H1002-T1006 WeakPolarHBondContact O-CG2 3.24Å; H1002-T1006 PolarHBondContact O-N 3.36Å; H1002-T1006 PolarHBondContact O-OG1 3.23Å
1003	E	72.3	Confident	71.8	Confident	105 Å²	105	95.3 Å²	95.3	49%	0.491	44%	0.438	S	S	.	.	H	α-helix	trans	-60.6	-43.5	176.9	-73.2	175.5	179.7	0	0	112.3	E999 I1005 T1006 H1007	E999-E1003 WeakPolarHBondContact O-CG 3.25Å; E999-E1003 PolarHBondContact O-N 2.91Å; E1003-I1005 PolarHBondContact O-N 2.96Å; E1003-T1006 PolarHBondContact O-N 3.27Å; E1003-T1006 PolarHBondContact O-OG1 3.24Å; E1003-H1007 WeakPolarHBondContact O-CB 3.36Å; E1003-H1007 PolarHBondContact O-N 2.94Å
1004	E	70.9	Confident	71.2	Confident	24 Å²	24	88 Å²	88	11%	0.112	41%	0.412	C	S	.	.	H	α-helix	trans	-65.6	-37.8	179	-173.9	100.7	-170	0	0	111.5	L1000 H1002 H1008 R1013 R1016	L1000-E1004 WeakPolarHBondContact O-CB 3.26Å; L1000-E1004 PolarHBondContact O-N 3.21Å; H1002-E1004 PolarHBondContact O-N 3.48Å; E1004-H1008 CarbonylContact O-C 3.57Å; E1004-H1008 VanDerWaalsContact O-C 3.3Å; E1004-H1008 WeakPolarHBondContact O-CA 3.15Å; E1004-H1008 WeakPolarHBondContact O-CB 3.48Å; E1004-H1008 PolarHBondContact O-N 3.34Å; E1004-H1008 VanDerWaalsContact O-N 3.16Å; E1004-R1013 PolarHBondContact OE1-N 3.35Å; E1004-R1016 IonicContact OE2-CZ 2.7Å; E1004-R1016 IonicContact OE2-NH1 3.11Å; E1004-R1016 PolarHBondContact OE2-NH1 3.26Å
1005	I	71.3	Confident	70.8	Confident	64 Å²	64	91.3 Å²	91.3	33%	0.328	43%	0.427	S	S	.	.	H	α-helix	trans	-72.1	-41.9	178.4	-70.9	176.7	0	0	0	112.2	F1001 H1002 E1003 L1017	F1001-I1005 HydrophobicContact CD1-CD1 3.68Å; F1001-I1005 HydrophobicContact CE1-CD1 3.13Å; F1001-I1005 HydrophobicContact CE1-CG1 4.38Å; F1001-I1005 HydrophobicContact CE2-CD1 4.23Å; F1001-I1005 HydrophobicContact CG-CD1 4.42Å; F1001-I1005 HydrophobicContact CZ-CD1 3.44Å; F1001-I1005 VanDerWaalsContact CZ-CD1 3.44Å; F1001-I1005 WeakPolarHBondContact O-CG1 3.39Å; F1001-I1005 PolarHBondContact O-N 2.91Å; H1002-I1005 PolarHBondContact O-N 3.18Å; E1003-I1005 PolarHBondContact O-N 2.96Å; I1005-L1017 HydrophobicContact CD1-CD1 4.24Å; I1005-L1017 HydrophobicContact CG1-CD1 4.12Å; I1005-L1017 HydrophobicContact CG1-CD2 4.48Å
1006	T	67.8	Low	70.1	Confident	69 Å²	69	93.8 Å²	93.8	42%	0.423	44%	0.437	S	S	.	.	H	α-helix	trans	-77.6	-47.5	-174.5	50.6	0	0	0	0	112.1	H1002 E1003	H1002-T1006 WeakPolarHBondContact O-CB 3.43Å; H1002-T1006 WeakPolarHBondContact O-CG2 3.24Å; H1002-T1006 PolarHBondContact O-N 3.36Å; H1002-T1006 PolarHBondContact O-OG1 3.23Å; E1003-T1006 PolarHBondContact O-N 3.27Å; E1003-T1006 PolarHBondContact O-OG1 3.24Å
1007	H	65.6	Low	69.8	Low	156 Å²	156	90.6 Å²	90.6	72%	0.722	42%	0.42	S	S	*	.	H	α-helix	trans	-96.5	-33.2	-172.5	-66.9	55.6	0	0	0	112.9	E1003	E1003-H1007 WeakPolarHBondContact O-CB 3.36Å; E1003-H1007 PolarHBondContact O-N 2.94Å
1008	H	63.8	Low	69.5	Low	110 Å²	110	89 Å²	89	51%	0.509	42%	0.418	S	S	.	.			trans	-111.8	34.6	-171.3	-63	87	0	0	0	114.1	E1004 Q1010 D1011 A1012	E1004-H1008 CarbonylContact O-C 3.57Å; E1004-H1008 VanDerWaalsContact O-C 3.3Å; E1004-H1008 WeakPolarHBondContact O-CA 3.15Å; E1004-H1008 WeakPolarHBondContact O-CB 3.48Å; E1004-H1008 PolarHBondContact O-N 3.34Å; E1004-H1008 VanDerWaalsContact O-N 3.16Å; H1008-Q1010 VanDerWaalsContact C-N 3.3Å; H1008-Q1010 PolarHBondContact O-N 3.18Å; H1008-Q1010 VanDerWaalsContact O-N 3.14Å; H1008-D1011 PolarHBondContact O-N 3.36Å; H1008-A1012 WeakPolarHBondContact O-CA 3.22Å; H1008-A1012 WeakPolarHBondContact O-CB 3.29Å; H1008-A1012 PolarHBondContact O-N 2.78Å
1009	R	62.2	Low	69.2	Low	134 Å²	134	93.8 Å²	93.8	51%	0.506	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-37.2	-172.8	-173.2	179.6	176.5	87.9	1.1	114.9	L929	L929-R1009 HydrophobicContact CD2-CG 4.35Å
1010	Q	55.4	Low	68.9	Low	174 Å²	174	92.6 Å²	92.6	81%	0.813	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-34.8	-174.7	-64.7	-177.3	0.7	0	0	113.3	H1008	H1008-Q1010 VanDerWaalsContact C-N 3.3Å; H1008-Q1010 PolarHBondContact O-N 3.18Å; H1008-Q1010 VanDerWaalsContact O-N 3.14Å
1011	D	57.2	Low	69.1	Low	135 Å²	135	88.5 Å²	88.5	72%	0.722	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.4	6.6	-179.5	-74.5	-28.3	0	0	0	113.4	H1008 R1013	H1008-D1011 PolarHBondContact O-N 3.36Å; D1011-R1013 PolarHBondContact O-N 3.26Å
1012	A	60.9	Low	69.1	Low	10 Å²	10	87.7 Å²	87.7	8%	0.083	42%	0.415	C	S	.	.			trans	-49.4	114	-176.2	0	0	0	0	0	110.9	H1008 C1014	H1008-A1012 WeakPolarHBondContact O-CA 3.22Å; H1008-A1012 WeakPolarHBondContact O-CB 3.29Å; H1008-A1012 PolarHBondContact O-N 2.78Å; A1012-C1014 VanDerWaalsContact C-N 3.32Å; A1012-C1014 PolarHBondContact O-N 2.95Å
1013	R	66.3	Low	69.4	Low	147 Å²	147	85 Å²	85	56%	0.555	41%	0.408	S	S	*	.			trans	-72	91.8	177.9	-77.9	-176.2	-75.2	-157.7	-27.8	108.9	E1004 D1011 M1015 R1016 L1017	E1004-R1013 PolarHBondContact OE1-N 3.35Å; D1011-R1013 PolarHBondContact O-N 3.26Å; R1013-M1015 PolarHBondContact O-N 3.34Å; R1013-R1016 HydrophobicContact CB-CB 4.05Å; R1013-R1016 VanDerWaalsContact NH2-NH1 3.13Å; R1013-R1016 WeakPolarHBondContact O-CA 3.33Å; R1013-R1016 WeakPolarHBondContact O-CB 3.2Å; R1013-R1016 PolarHBondContact O-N 3.17Å; R1013-L1017 PolarHBondContact O-N 2.79Å
1014	C	67.9	Low	69.9	Low	14 Å²	14	83.5 Å²	83.5	10%	0.095	40%	0.403	C	S	.	.	H	α-helix	trans	-47.8	-35.5	-179.1	-64.7	0	0	0	0	113.3	R928 I932 A1012 L1017 L1018	R928-C1014 HydrophobicContact CB-CB 3.99Å; R928-C1014 WeakPolarHBondContact CB-SG 3.45Å; I932-C1014 HydrophobicContact CD1-CB 3.8Å; A1012-C1014 VanDerWaalsContact C-N 3.32Å; A1012-C1014 PolarHBondContact O-N 2.95Å; C1014-L1017 PolarHBondContact O-N 3.49Å; C1014-L1018 WeakPolarHBondContact O-CB 3.31Å; C1014-L1018 PolarHBondContact O-N 2.85Å
1015	M	67.2	Low	70.6	Confident	147 Å²	147	84.5 Å²	84.5	72%	0.724	41%	0.409	S	S	*	.	H	α-helix	trans	-66.5	-38.6	176	-73.5	-62.3	-163.2	0	0	113.6	R1013 W1019	R1013-M1015 PolarHBondContact O-N 3.34Å; M1015-W1019 VanDerWaalsContact O-CB 3.23Å; M1015-W1019 WeakPolarHBondContact O-CB 3.48Å; M1015-W1019 PolarHBondContact O-N 3.42Å
1016	R	69.4	Low	71.4	Confident	125 Å²	125	85.6 Å²	85.6	47%	0.472	42%	0.418	S	S	.	.	H	α-helix	trans	-66.3	-43.5	175.7	179.5	-170.3	-75	-172.8	-22.8	110.3	E1004 R1013 W1019 A1020	E1004-R1016 IonicContact OE2-CZ 2.7Å; E1004-R1016 IonicContact OE2-NH1 3.11Å; E1004-R1016 PolarHBondContact OE2-NH1 3.26Å; R1013-R1016 HydrophobicContact CB-CB 4.05Å; R1013-R1016 VanDerWaalsContact NH2-NH1 3.13Å; R1013-R1016 WeakPolarHBondContact O-CA 3.33Å; R1013-R1016 WeakPolarHBondContact O-CB 3.2Å; R1013-R1016 PolarHBondContact O-N 3.17Å; R1016-W1019 PolarHBondContact O-N 3.44Å; R1016-A1020 PolarHBondContact O-N 3.22Å
1017	L	72.7	Confident	72.4	Confident	9 Å²	9	86.3 Å²	86.3	5%	0.047	42%	0.423	C	S	.	.	H	α-helix	trans	-63	-48.9	179.5	-159.9	71.2	0	0	0	111.4	L929 I932 F1001 I1005 R1013 C1014 W1019 A1020 I1021	L929-L1017 HydrophobicContact CD1-CD2 4.27Å; I932-L1017 HydrophobicContact CB-CD2 4.45Å; I932-L1017 HydrophobicContact CD1-CB 4.21Å; I932-L1017 HydrophobicContact CD1-CD2 3.98Å; I932-L1017 HydrophobicContact CD1-CG 4.49Å; I932-L1017 HydrophobicContact CG2-CD2 3.67Å; I932-L1017 HydrophobicContact CG2-CG 4.18Å; F1001-L1017 HydrophobicContact CD2-CD1 3.21Å; F1001-L1017 HydrophobicContact CD2-CG 4.09Å; F1001-L1017 HydrophobicContact CE2-CD1 3.06Å; F1001-L1017 HydrophobicContact CE2-CD2 4.38Å; F1001-L1017 HydrophobicContact CE2-CG 3.51Å; F1001-L1017 HydrophobicContact CG-CD1 4.06Å; F1001-L1017 HydrophobicContact CZ-CD1 3.85Å; F1001-L1017 HydrophobicContact CZ-CG 4.25Å; I1005-L1017 HydrophobicContact CD1-CD1 4.24Å; I1005-L1017 HydrophobicContact CG1-CD1 4.12Å; I1005-L1017 HydrophobicContact CG1-CD2 4.48Å; R1013-L1017 PolarHBondContact O-N 2.79Å; C1014-L1017 PolarHBondContact O-N 3.49Å; L1017-W1019 VanDerWaalsContact C-N 3.31Å; L1017-W1019 PolarHBondContact O-N 3.48Å; L1017-A1020 WeakPolarHBondContact O-CB 3.25Å; L1017-A1020 PolarHBondContact O-N 2.73Å; L1017-I1021 PolarHBondContact O-N 3.33Å
1018	L	75	Confident	73.6	Confident	69 Å²	69	79.5 Å²	79.5	36%	0.361	39%	0.391	S	S	.	.	H	α-helix	trans	-60.4	-40.8	175.9	-176.8	65.6	0	0	0	111.7	I935 C1014 A1020 I1021 A1022	I935-L1018 HydrophobicContact CD1-CD1 4.39Å; C1014-L1018 WeakPolarHBondContact O-CB 3.31Å; C1014-L1018 PolarHBondContact O-N 2.85Å; L1018-A1020 VanDerWaalsContact C-N 3.34Å; L1018-A1020 PolarHBondContact O-N 2.91Å; L1018-I1021 PolarHBondContact O-N 3.25Å; L1018-A1022 WeakPolarHBondContact O-CB 3.23Å; L1018-A1022 PolarHBondContact O-N 2.94Å
1019	W	73	Confident	74.9	Confident	147 Å²	147	75.8 Å²	75.8	56%	0.557	38%	0.383	S	S	*	.	H	α-helix	trans	-70.6	-29.2	179.9	-159.6	74.4	0	0	0	113.1	M1015 R1016 L1017 I1021 P1023	M1015-W1019 VanDerWaalsContact O-CB 3.23Å; M1015-W1019 WeakPolarHBondContact O-CB 3.48Å; M1015-W1019 PolarHBondContact O-N 3.42Å; R1016-W1019 PolarHBondContact O-N 3.44Å; L1017-W1019 VanDerWaalsContact C-N 3.31Å; L1017-W1019 PolarHBondContact O-N 3.48Å; W1019-I1021 VanDerWaalsContact C-N 3.35Å; W1019-P1023 VanDerWaalsContact O-CD 3.3Å; W1019-P1023 WeakPolarHBondContact O-CD 3.28Å
1020	A	75.4	Confident	76.2	Confident	37 Å²	37	73.9 Å²	73.9	31%	0.306	38%	0.382	S	S	.	.	H	α-helix	trans	-66.1	-37.1	173.4	0	0	0	0	0	112.1	F1001 R1016 L1017 L1018	F1001-A1020 HydrophobicContact CD2-CB 4.37Å; R1016-A1020 PolarHBondContact O-N 3.22Å; L1017-A1020 WeakPolarHBondContact O-CB 3.25Å; L1017-A1020 PolarHBondContact O-N 2.73Å; L1018-A1020 VanDerWaalsContact C-N 3.34Å; L1018-A1020 PolarHBondContact O-N 2.91Å
1021	I	79.3	Confident	77.9	Confident	14 Å²	14	67.9 Å²	67.9	7%	0.072	36%	0.359	C	S	.	.	H	α-helix	trans	-90.5	-22	-179.1	-53.4	153.2	0	0	0	112	I932 C936 L940 F1001 L1017 L1018 W1019 P1023 L1024 L1025	I932-I1021 HydrophobicContact CG2-CD1 4.27Å; C936-I1021 WeakPolarHBondContact SG-CD1 3.37Å; L940-I1021 HydrophobicContact CD2-CG2 4.28Å; F1001-I1021 HydrophobicContact CD2-CG1 4.39Å; F1001-I1021 HydrophobicContact CE2-CD1 3.42Å; F1001-I1021 VanDerWaalsContact CE2-CD1 3.42Å; F1001-I1021 HydrophobicContact CE2-CG1 3.68Å; F1001-I1021 HydrophobicContact CZ-CD1 3.81Å; F1001-I1021 HydrophobicContact CZ-CG1 4.27Å; L1017-I1021 PolarHBondContact O-N 3.33Å; L1018-I1021 PolarHBondContact O-N 3.25Å; W1019-I1021 VanDerWaalsContact C-N 3.35Å; I1021-P1023 VanDerWaalsContact C-CD 3.49Å; I1021-L1024 WeakPolarHBondContact O-CA 3.17Å; I1021-L1024 WeakPolarHBondContact O-CB 3.3Å; I1021-L1024 PolarHBondContact O-N 3.42Å; I1021-L1025 HydrophobicContact CB-CD1 4.35Å; I1021-L1025 HydrophobicContact CG2-CD1 3.67Å; I1021-L1025 HydrophobicContact CG2-CG 4.07Å; I1021-L1025 PolarHBondContact O-N 3.34Å
1022	A	79.4	Confident	79.5	Confident	31 Å²	31	63.4 Å²	63.4	26%	0.256	34%	0.336	S	S	.	.	H	α-helix	trans	-47.6	-48.4	-179.8	0	0	0	0	0	114.9	L1018 L1024 L1025 V1026	L1018-A1022 WeakPolarHBondContact O-CB 3.23Å; L1018-A1022 PolarHBondContact O-N 2.94Å; A1022-L1024 VanDerWaalsContact C-N 3.28Å; A1022-L1024 PolarHBondContact O-N 2.66Å; A1022-L1025 PolarHBondContact O-N 3.02Å; A1022-V1026 WeakPolarHBondContact O-CB 3.28Å; A1022-V1026 VanDerWaalsContact O-CG2 3.24Å; A1022-V1026 WeakPolarHBondContact O-CG2 3.39Å; A1022-V1026 PolarHBondContact O-N 2.68Å
1023	P	84	Confident	81	Confident	64 Å²	64	65.3 Å²	65.3	42%	0.416	35%	0.348	S	S	.	.	H	α-helix	trans	-62.9	-35.2	178.1	24.3	-34.1	0	0	0	112.3	W1019 I1021 T1027	W1019-P1023 VanDerWaalsContact O-CD 3.3Å; W1019-P1023 WeakPolarHBondContact O-CD 3.28Å; I1021-P1023 VanDerWaalsContact C-CD 3.49Å; P1023-T1027 VanDerWaalsContact O-CB 3.32Å; P1023-T1027 WeakPolarHBondContact O-CB 3.3Å; P1023-T1027 WeakPolarHBondContact O-CG2 3.32Å; P1023-T1027 PolarHBondContact O-N 3.2Å; P1023-T1027 PolarHBondContact O-OG1 3.36Å
1024	L	83.4	Confident	82.1	Confident	73 Å²	73	61.9 Å²	61.9	38%	0.382	34%	0.343	S	S	.	.	H	α-helix	trans	-67.5	-46	176.3	-175.9	67.3	0	0	0	111.3	L940 I1021 A1022 T1027 I1028	L940-L1024 HydrophobicContact CD1-CD2 3.75Å; L940-L1024 HydrophobicContact CD1-CG 3.89Å; L940-L1024 HydrophobicContact CD2-CD2 3.78Å; L940-L1024 HydrophobicContact CG-CD2 4.37Å; I1021-L1024 WeakPolarHBondContact O-CA 3.17Å; I1021-L1024 WeakPolarHBondContact O-CB 3.3Å; I1021-L1024 PolarHBondContact O-N 3.42Å; A1022-L1024 VanDerWaalsContact C-N 3.28Å; A1022-L1024 PolarHBondContact O-N 2.66Å; L1024-T1027 WeakPolarHBondContact CA-OG1 3.43Å; L1024-T1027 PolarHBondContact O-N 2.91Å; L1024-T1027 PolarHBondContact O-OG1 3.34Å; L1024-I1028 HydrophobicContact CD1-CD1 3.75Å; L1024-I1028 HydrophobicContact CD1-CG1 4.35Å; L1024-I1028 HydrophobicContact CG-CD1 3.83Å; L1024-I1028 WeakPolarHBondContact O-CB 3.32Å; L1024-I1028 VanDerWaalsContact O-CG1 3.28Å; L1024-I1028 WeakPolarHBondContact O-CG1 3.41Å; L1024-I1028 PolarHBondContact O-N 3.02Å
1025	L	85.8	Confident	83.2	Confident	46 Å²	46	61.5 Å²	61.5	24%	0.241	34%	0.341	C	S	.	.	H	α-helix	trans	-61.6	-44.1	175.5	-86.7	153.7	0	0	0	112.4	I935 I1021 A1022 G1029	I935-L1025 HydrophobicContact CG2-CD1 3.46Å; I935-L1025 VanDerWaalsContact CG2-CD1 3.46Å; I935-L1025 HydrophobicContact CG2-CD2 3.99Å; I935-L1025 HydrophobicContact CG2-CG 4.27Å; I1021-L1025 HydrophobicContact CB-CD1 4.35Å; I1021-L1025 HydrophobicContact CG2-CD1 3.67Å; I1021-L1025 HydrophobicContact CG2-CG 4.07Å; I1021-L1025 PolarHBondContact O-N 3.34Å; A1022-L1025 PolarHBondContact O-N 3.02Å; L1025-G1029 WeakPolarHBondContact O-CA 3.2Å; L1025-G1029 PolarHBondContact O-N 3.11Å
1026	V	88.9	Confident	84.2	Confident	86 Å²	86	60.2 Å²	60.2	52%	0.521	33%	0.328	S	S	.	.	H	α-helix	trans	-67.6	-44.7	179.9	171.3	0	0	0	0	110.5	A1022 G1029 L1030	A1022-V1026 WeakPolarHBondContact O-CB 3.28Å; A1022-V1026 VanDerWaalsContact O-CG2 3.24Å; A1022-V1026 WeakPolarHBondContact O-CG2 3.39Å; A1022-V1026 PolarHBondContact O-N 2.68Å; V1026-G1029 PolarHBondContact O-N 3.4Å; V1026-L1030 HydrophobicContact CG1-CD1 3.77Å; V1026-L1030 HydrophobicContact CG1-CG 4.26Å; V1026-L1030 VanDerWaalsContact O-CB 3.29Å; V1026-L1030 WeakPolarHBondContact O-CB 3.49Å; V1026-L1030 WeakPolarHBondContact O-CG 3.47Å; V1026-L1030 PolarHBondContact O-N 3.39Å
1027	T	88.1	Confident	85.2	Confident	84 Å²	84	58.3 Å²	58.3	52%	0.515	33%	0.327	S	S	.	.	H	α-helix	trans	-65.4	-45.4	179.4	49.2	0	0	0	0	112.3	P1023 L1024 L1030 S1031	P1023-T1027 VanDerWaalsContact O-CB 3.32Å; P1023-T1027 WeakPolarHBondContact O-CB 3.3Å; P1023-T1027 WeakPolarHBondContact O-CG2 3.32Å; P1023-T1027 PolarHBondContact O-N 3.2Å; P1023-T1027 PolarHBondContact O-OG1 3.36Å; L1024-T1027 WeakPolarHBondContact CA-OG1 3.43Å; L1024-T1027 PolarHBondContact O-N 2.91Å; L1024-T1027 PolarHBondContact O-OG1 3.34Å; T1027-L1030 PolarHBondContact O-N 3Å; T1027-S1031 VanDerWaalsContact O-CB 3.22Å; T1027-S1031 WeakPolarHBondContact O-CB 3.42Å; T1027-S1031 PolarHBondContact O-N 2.85Å
1028	I	90.2	Very high	86	Confident	13 Å²	13	61 Å²	61	7%	0.067	34%	0.342	C	S	.	.	H	α-helix	trans	-65.6	-43.5	176	-65.7	169.7	0	0	0	110.4	L940 A943 L944 L947 L1024 L1030 S1031 L1032	L940-I1028 HydrophobicContact CD1-CD1 3.56Å; A943-I1028 HydrophobicContact CB-CG2 3.69Å; L944-I1028 HydrophobicContact CB-CD1 4.44Å; L944-I1028 HydrophobicContact CD1-CD1 4.08Å; L947-I1028 HydrophobicContact CD2-CG2 4.43Å; L1024-I1028 HydrophobicContact CD1-CD1 3.75Å; L1024-I1028 HydrophobicContact CD1-CG1 4.35Å; L1024-I1028 HydrophobicContact CG-CD1 3.83Å; L1024-I1028 WeakPolarHBondContact O-CB 3.32Å; L1024-I1028 VanDerWaalsContact O-CG1 3.28Å; L1024-I1028 WeakPolarHBondContact O-CG1 3.41Å; L1024-I1028 PolarHBondContact O-N 3.02Å; I1028-L1030 PolarHBondContact O-N 3.11Å; I1028-S1031 PolarHBondContact O-N 3.21Å; I1028-L1032 WeakPolarHBondContact O-CB 3.26Å; I1028-L1032 PolarHBondContact O-N 2.7Å
1029	G	90.6	Very high	86.5	Confident	32 Å²	32	57.8 Å²	57.8	33%	0.33	32%	0.324	S	S	.	.	H	α-helix	trans	-61.6	-42.4	177.8	0	0	0	0	0	113	L1025 V1026 L1032 S1033	L1025-G1029 WeakPolarHBondContact O-CA 3.2Å; L1025-G1029 PolarHBondContact O-N 3.11Å; V1026-G1029 PolarHBondContact O-N 3.4Å; G1029-L1032 PolarHBondContact O-N 3.2Å; G1029-S1033 WeakPolarHBondContact O-CB 3.1Å; G1029-S1033 PolarHBondContact O-N 2.97Å; G1029-S1033 PolarHBondContact O-OG 3.47Å
1030	L	91.2	Very high	87.2	Confident	94 Å²	94	57.3 Å²	57.3	49%	0.492	32%	0.324	S	S	.	.	H	α-helix	trans	-66.3	-43.3	173.2	-72.8	173.4	0	0	0	111.5	V1026 T1027 I1028 L1032 S1033 V1034	V1026-L1030 HydrophobicContact CG1-CD1 3.77Å; V1026-L1030 HydrophobicContact CG1-CG 4.26Å; V1026-L1030 VanDerWaalsContact O-CB 3.29Å; V1026-L1030 WeakPolarHBondContact O-CB 3.49Å; V1026-L1030 WeakPolarHBondContact O-CG 3.47Å; V1026-L1030 PolarHBondContact O-N 3.39Å; T1027-L1030 PolarHBondContact O-N 3Å; I1028-L1030 PolarHBondContact O-N 3.11Å; L1030-L1032 PolarHBondContact O-N 3.39Å; L1030-S1033 PolarHBondContact O-N 3.09Å; L1030-V1034 HydrophobicContact CD2-CG2 4.42Å; L1030-V1034 VanDerWaalsContact O-CB 3.29Å; L1030-V1034 WeakPolarHBondContact O-CB 3.17Å; L1030-V1034 VanDerWaalsContact O-CG2 3.29Å; L1030-V1034 WeakPolarHBondContact O-CG2 3.18Å; L1030-V1034 PolarHBondContact O-N 3.48Å
1031	S	90.9	Very high	87.9	Confident	48 Å²	48	63 Å²	63	34%	0.336	34%	0.338	S	S	.	.	H	α-helix	trans	-63.9	-25.7	177.2	-163.6	0	0	0	0	112.8	L947 T1027 I1028 P1035	L947-S1031 WeakPolarHBondContact CD1-OG 3.26Å; T1027-S1031 VanDerWaalsContact O-CB 3.22Å; T1027-S1031 WeakPolarHBondContact O-CB 3.42Å; T1027-S1031 PolarHBondContact O-N 2.85Å; I1028-S1031 PolarHBondContact O-N 3.21Å; S1031-P1035 WeakPolarHBondContact O-CD 3Å; S1031-P1035 WeakPolarHBondContact O-CG 3.43Å
1032	L	90.6	Very high	88.2	Confident	42 Å²	42	64.8 Å²	64.8	22%	0.22	35%	0.347	C	S	.	.	H	α-helix	trans	-84.5	-44	174.1	-166.4	73.9	0	0	0	112.5	L946 F950 I1028 G1029 L1030 Y1058	L946-L1032 HydrophobicContact CB-CD1 4.37Å; L946-L1032 HydrophobicContact CD2-CD1 3.69Å; L946-L1032 HydrophobicContact CD2-CD2 3.78Å; L946-L1032 HydrophobicContact CD2-CG 4.31Å; L946-L1032 HydrophobicContact CG-CD1 3.92Å; F950-L1032 HydrophobicContact CD2-CD1 3.98Å; F950-L1032 HydrophobicContact CE2-CD1 4.08Å; I1028-L1032 WeakPolarHBondContact O-CB 3.26Å; I1028-L1032 PolarHBondContact O-N 2.7Å; G1029-L1032 PolarHBondContact O-N 3.2Å; L1030-L1032 PolarHBondContact O-N 3.39Å; L1032-Y1058 HydrophobicContact CD1-CE1 4.35Å; L1032-Y1058 PolarHBondContact O-OH 3.14Å
1033	S	90.9	Very high	88.5	Confident	50 Å²	50	64 Å²	64	35%	0.35	34%	0.34	S	S	.	.	H	α-helix	trans	-80.5	-38	-173	55.2	0	0	0	0	114.2	G1029 L1030 Y1036 L1037	G1029-S1033 WeakPolarHBondContact O-CB 3.1Å; G1029-S1033 PolarHBondContact O-N 2.97Å; G1029-S1033 PolarHBondContact O-OG 3.47Å; L1030-S1033 PolarHBondContact O-N 3.09Å; S1033-Y1036 PolarHBondContact O-N 2.95Å; S1033-L1037 WeakPolarHBondContact O-CG 3.49Å; S1033-L1037 PolarHBondContact O-N 2.91Å
1034	V	90.7	Very high	88.5	Confident	74 Å²	74	65.5 Å²	65.5	45%	0.448	35%	0.35	S	S	.	.	H	α-helix	trans	-64	-49.6	-177.5	171.9	0	0	0	0	112.2	L1030 Y1036 L1037 L1038	L1030-V1034 HydrophobicContact CD2-CG2 4.42Å; L1030-V1034 VanDerWaalsContact O-CB 3.29Å; L1030-V1034 WeakPolarHBondContact O-CB 3.17Å; L1030-V1034 VanDerWaalsContact O-CG2 3.29Å; L1030-V1034 WeakPolarHBondContact O-CG2 3.18Å; L1030-V1034 PolarHBondContact O-N 3.48Å; V1034-Y1036 VanDerWaalsContact C-N 3.28Å; V1034-Y1036 PolarHBondContact O-N 3.09Å; V1034-L1037 PolarHBondContact O-N 3.41Å; V1034-L1038 VanDerWaalsContact O-CB 3.31Å; V1034-L1038 WeakPolarHBondContact O-CB 3.4Å; V1034-L1038 PolarHBondContact O-N 3.08Å
1035	P	90	Very high	88.6	Confident	6 Å²	6	69.1 Å²	69.1	4%	0.039	37%	0.369	C	S	.	.	H	α-helix	trans	-63	-36	177.6	-22.5	34.9	0	0	0	112.6	S1031 L1038 A1039 I1057 Y1058 L1061	S1031-P1035 WeakPolarHBondContact O-CD 3Å; S1031-P1035 WeakPolarHBondContact O-CG 3.43Å; P1035-L1038 PolarHBondContact O-N 3.39Å; P1035-A1039 VanDerWaalsContact O-CB 3.3Å; P1035-A1039 WeakPolarHBondContact O-CB 3.44Å; P1035-A1039 PolarHBondContact O-N 2.77Å; P1035-I1057 HydrophobicContact CB-CG2 4.08Å; P1035-Y1058 HydrophobicContact CB-CD1 3.67Å; P1035-Y1058 HydrophobicContact CB-CD2 3.99Å; P1035-Y1058 HydrophobicContact CB-CE1 3.59Å; P1035-Y1058 HydrophobicContact CB-CE2 3.94Å; P1035-Y1058 HydrophobicContact CB-CG 3.87Å; P1035-Y1058 HydrophobicContact CG-CD1 3.73Å; P1035-Y1058 HydrophobicContact CG-CE1 3.66Å; P1035-Y1058 HydrophobicContact CG-CG 4.37Å; P1035-L1061 HydrophobicContact CB-CD1 3.7Å; P1035-L1061 HydrophobicContact CG-CD1 3.62Å
1036	Y	89.2	Confident	88.5	Confident	120 Å²	120	72.5 Å²	72.5	47%	0.471	39%	0.386	S	S	.	.	H	α-helix	trans	-63.1	-51.1	176.4	177.6	-93.1	0	0	0	111.4	S1033 V1034 L1038 A1039 Y1040 F1054	S1033-Y1036 PolarHBondContact O-N 2.95Å; V1034-Y1036 VanDerWaalsContact C-N 3.28Å; V1034-Y1036 PolarHBondContact O-N 3.09Å; Y1036-L1038 VanDerWaalsContact C-N 3.3Å; Y1036-L1038 PolarHBondContact O-N 3.36Å; Y1036-A1039 PolarHBondContact O-N 3.48Å; Y1036-Y1040 PolarHBondContact O-N 3.49Å; Y1036-F1054 AromaticContact CD2-CD1 3.9Å; Y1036-F1054 HydrophobicContact CD2-CD1 3.9Å; Y1036-F1054 AromaticContact CD2-CE1 3.27Å; Y1036-F1054 HydrophobicContact CD2-CE1 3.27Å; Y1036-F1054 AromaticContact CD2-CZ 3.98Å; Y1036-F1054 HydrophobicContact CD2-CZ 3.98Å; Y1036-F1054 HydrophobicContact CE2-CD1 4.34Å; Y1036-F1054 AromaticContact CE2-CE1 3.49Å; Y1036-F1054 HydrophobicContact CE2-CE1 3.49Å; Y1036-F1054 VanDerWaalsContact CE2-CE1 3.49Å; Y1036-F1054 AromaticContact CE2-CZ 3.69Å; Y1036-F1054 HydrophobicContact CE2-CZ 3.69Å; Y1036-F1054 AromaticContact CG-CE1 3.93Å; Y1036-F1054 HydrophobicContact CG-CE1 3.93Å; Y1036-F1054 WeakPolarHBondContact O-CE1 3.41Å
1037	L	90.2	Very high	88.2	Confident	86 Å²	86	73.2 Å²	73.2	45%	0.45	40%	0.401	S	S	.	.	H	α-helix	trans	-60.3	-43.4	176.5	-70.8	171.8	0	0	0	110.8	S1033 V1034 A1039 Y1040 Y1041	S1033-L1037 WeakPolarHBondContact O-CG 3.49Å; S1033-L1037 PolarHBondContact O-N 2.91Å; V1034-L1037 PolarHBondContact O-N 3.41Å; L1037-A1039 PolarHBondContact O-N 3.28Å; L1037-Y1040 PolarHBondContact O-N 3.43Å; L1037-Y1041 HydrophobicContact CB-CD2 4.5Å; L1037-Y1041 HydrophobicContact CB-CE2 4.46Å; L1037-Y1041 HydrophobicContact CD2-CE2 4.27Å; L1037-Y1041 WeakPolarHBondContact O-CD2 3.37Å; L1037-Y1041 PolarHBondContact O-N 3.36Å
1038	L	89	Confident	87.8	Confident	66 Å²	66	71.3 Å²	71.3	35%	0.346	39%	0.391	S	S	.	.	H	α-helix	trans	-60.2	-45.8	178.5	-167.9	71.1	0	0	0	111.5	V1034 P1035 Y1036 Y1040 Y1041 I1042 I1057 L1061	V1034-L1038 VanDerWaalsContact O-CB 3.31Å; V1034-L1038 WeakPolarHBondContact O-CB 3.4Å; V1034-L1038 PolarHBondContact O-N 3.08Å; P1035-L1038 PolarHBondContact O-N 3.39Å; Y1036-L1038 VanDerWaalsContact C-N 3.3Å; Y1036-L1038 PolarHBondContact O-N 3.36Å; L1038-Y1040 PolarHBondContact O-N 2.76Å; L1038-Y1041 PolarHBondContact O-N 3.07Å; L1038-I1042 HydrophobicContact CD1-CD1 3.62Å; L1038-I1042 HydrophobicContact CD1-CG1 4.12Å; L1038-I1042 HydrophobicContact CD2-CD1 4.11Å; L1038-I1042 HydrophobicContact CG-CD1 3.53Å; L1038-I1042 HydrophobicContact CG-CG1 4.17Å; L1038-I1042 WeakPolarHBondContact O-CB 3.25Å; L1038-I1042 VanDerWaalsContact O-CG1 3.22Å; L1038-I1042 WeakPolarHBondContact O-CG1 3.36Å; L1038-I1042 PolarHBondContact O-N 3.45Å; L1038-I1057 HydrophobicContact CB-CG2 4.45Å; L1038-I1057 HydrophobicContact CD2-CG2 3.94Å; L1038-L1061 HydrophobicContact CD2-CD1 4.01Å; L1038-L1061 HydrophobicContact CD2-CD2 4.27Å; L1038-L1061 HydrophobicContact CD2-CG 4.49Å
1039	A	86.2	Confident	87.4	Confident	0 Å²	0	76.5 Å²	76.5	0%	0	42%	0.419	C	S	.	.	H	α-helix	trans	-62.9	-40.7	177	0	0	0	0	0	112.6	P1035 Y1036 L1037 S1043 A1053 F1054 I1057	P1035-A1039 VanDerWaalsContact O-CB 3.3Å; P1035-A1039 WeakPolarHBondContact O-CB 3.44Å; P1035-A1039 PolarHBondContact O-N 2.77Å; Y1036-A1039 PolarHBondContact O-N 3.48Å; L1037-A1039 PolarHBondContact O-N 3.28Å; A1039-S1043 WeakPolarHBondContact O-CB 3.14Å; A1039-S1043 PolarHBondContact O-N 2.78Å; A1039-A1053 HydrophobicContact CB-CB 4.28Å; A1039-F1054 HydrophobicContact CB-CD1 3.27Å; A1039-F1054 HydrophobicContact CB-CE1 3.47Å; A1039-F1054 VanDerWaalsContact CB-CE1 3.47Å; A1039-F1054 HydrophobicContact CB-CG 3.93Å; A1039-F1054 HydrophobicContact CB-CZ 4.25Å; A1039-I1057 VanDerWaalsContact CA-CD1 3.42Å; A1039-I1057 HydrophobicContact CB-CD1 3.57Å
1040	Y	87.6	Confident	86.7	Confident	138 Å²	138	77.5 Å²	77.5	54%	0.541	42%	0.421	S	S	.	.	H	α-helix	trans	-63.3	-42.5	177.4	-174.4	-96	0	0	0	112.5	Y1036 L1037 L1038 P1044	Y1036-Y1040 PolarHBondContact O-N 3.49Å; L1037-Y1040 PolarHBondContact O-N 3.43Å; L1038-Y1040 PolarHBondContact O-N 2.76Å; Y1040-P1044 WeakPolarHBondContact O-CD 3.47Å
1041	Y	89.4	Confident	86.1	Confident	156 Å²	156	76.9 Å²	76.9	61%	0.612	42%	0.415	S	S	*	.	H	α-helix	trans	-81.3	-30.9	179.9	-70.6	-66.2	0	0	0	113.8	L1037 L1038 P1044	L1037-Y1041 HydrophobicContact CB-CD2 4.5Å; L1037-Y1041 HydrophobicContact CB-CE2 4.46Å; L1037-Y1041 HydrophobicContact CD2-CE2 4.27Å; L1037-Y1041 WeakPolarHBondContact O-CD2 3.37Å; L1037-Y1041 PolarHBondContact O-N 3.36Å; L1038-Y1041 PolarHBondContact O-N 3.07Å; Y1041-P1044 WeakPolarHBondContact O-CD 3.12Å; Y1041-P1044 WeakPolarHBondContact O-CG 3.49Å
1042	I	86.3	Confident	85.6	Confident	51 Å²	51	76.3 Å²	76.3	26%	0.262	41%	0.41	S	S	.	.	H	α-helix	trans	-79.8	-32.4	179.2	-69.6	-174	0	0	0	112.2	L1038 L1045 I1046	L1038-I1042 HydrophobicContact CD1-CD1 3.62Å; L1038-I1042 HydrophobicContact CD1-CG1 4.12Å; L1038-I1042 HydrophobicContact CD2-CD1 4.11Å; L1038-I1042 HydrophobicContact CG-CD1 3.53Å; L1038-I1042 HydrophobicContact CG-CG1 4.17Å; L1038-I1042 WeakPolarHBondContact O-CB 3.25Å; L1038-I1042 VanDerWaalsContact O-CG1 3.22Å; L1038-I1042 WeakPolarHBondContact O-CG1 3.36Å; L1038-I1042 PolarHBondContact O-N 3.45Å; I1042-L1045 WeakPolarHBondContact O-CA 3.09Å; I1042-L1045 WeakPolarHBondContact O-CB 3.41Å; I1042-L1045 PolarHBondContact O-N 3.47Å; I1042-I1046 HydrophobicContact CG2-CD1 3.29Å; I1042-I1046 HydrophobicContact CG2-CG1 3.75Å; I1042-I1046 PolarHBondContact O-N 2.96Å; I1042-I1046 VanDerWaalsContact O-N 3.08Å
1043	S	85.1	Confident	85.1	Confident	14 Å²	14	75 Å²	75	10%	0.098	41%	0.405	C	S	.	.	H	α-helix	trans	-50.2	-51.1	-179.8	168.6	0	0	0	0	113.9	A1039 L1045 I1046 A1047 S1048 S1050	A1039-S1043 WeakPolarHBondContact O-CB 3.14Å; A1039-S1043 PolarHBondContact O-N 2.78Å; S1043-L1045 PolarHBondContact O-N 2.86Å; S1043-I1046 PolarHBondContact O-N 3.49Å; S1043-A1047 PolarHBondContact O-N 2.96Å; S1043-S1048 PolarHBondContact O-N 3.21Å; S1043-S1048 PolarHBondContact OG-O 3.41Å; S1043-S1050 WeakPolarHBondContact OG-CA 3.39Å; S1043-S1050 PolarHBondContact OG-N 3.43Å
1044	P	85.3	Confident	84.7	Confident	97 Å²	97	74.7 Å²	74.7	63%	0.63	40%	0.398	S	S	*	.	H	α-helix	trans	-67.1	-23.4	176.6	25	-33.5	0	0	0	113.2	Y1040 Y1041	Y1040-P1044 WeakPolarHBondContact O-CD 3.47Å; Y1041-P1044 WeakPolarHBondContact O-CD 3.12Å; Y1041-P1044 WeakPolarHBondContact O-CG 3.49Å
1045	L	84.9	Confident	84.2	Confident	149 Å²	149	71.5 Å²	71.5	78%	0.78	38%	0.378	S	S	*	.	H	α-helix	trans	-73.1	-33.9	177.5	-124	77.7	0	0	0	112.8	I1042 S1043	I1042-L1045 WeakPolarHBondContact O-CA 3.09Å; I1042-L1045 WeakPolarHBondContact O-CB 3.41Å; I1042-L1045 PolarHBondContact O-N 3.47Å; S1043-L1045 PolarHBondContact O-N 2.86Å
1046	I	84.2	Confident	84	Confident	117 Å²	117	77.5 Å²	77.5	60%	0.6	40%	0.4	S	S	*	.	H	α-helix	trans	-95.2	-1.9	-177.4	-58.5	-177.4	0	0	0	111.6	I1042 S1043 S1048	I1042-I1046 HydrophobicContact CG2-CD1 3.29Å; I1042-I1046 HydrophobicContact CG2-CG1 3.75Å; I1042-I1046 PolarHBondContact O-N 2.96Å; I1042-I1046 VanDerWaalsContact O-N 3.08Å; S1043-I1046 PolarHBondContact O-N 3.49Å; I1046-S1048 PolarHBondContact O-N 2.91Å; I1046-S1048 VanDerWaalsContact O-N 3.15Å
1047	A	82.6	Confident	84.1	Confident	100 Å²	100	72.8 Å²	72.8	83%	0.826	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	33.6	-171	0	0	0	0	0	112.4	S1043	S1043-A1047 PolarHBondContact O-N 2.96Å
1048	S	79.1	Confident	84.1	Confident	44 Å²	44	69.2 Å²	69.2	31%	0.308	36%	0.364	S	S	.	.			trans	-109.3	145.4	-179.4	-175.5	0	0	0	0	109.8	S1043 I1046 S1050	S1043-S1048 PolarHBondContact O-N 3.21Å; S1043-S1048 PolarHBondContact OG-O 3.41Å; I1046-S1048 PolarHBondContact O-N 2.91Å; I1046-S1048 VanDerWaalsContact O-N 3.15Å; S1048-S1050 PolarHBondContact O-N 3.34Å
1049	D	80.9	Confident	84.2	Confident	122 Å²	122	67.7 Å²	67.7	65%	0.652	36%	0.357	S	S	*	.			trans	-52.8	130.5	175.6	-65.2	-33	0	0	0	109.9	E1051 V1052 A1053	D1049-E1051 PolarHBondContact O-N 2.93Å; D1049-E1051 VanDerWaalsContact O-N 3.1Å; D1049-V1052 HydrophobicContact CB-CG2 4.17Å; D1049-V1052 PolarHBondContact O-N 3.42Å; D1049-A1053 PolarHBondContact O-N 3.2Å
1050	S	77.4	Confident	84.4	Confident	54 Å²	54	73.6 Å²	73.6	38%	0.378	38%	0.383	S	S	.	.	H	α-helix	trans	-54	-36.2	-178.1	59.1	0	0	0	0	111.5	S1043 S1048 V1052 A1053 F1054	S1043-S1050 WeakPolarHBondContact OG-CA 3.39Å; S1043-S1050 PolarHBondContact OG-N 3.43Å; S1048-S1050 PolarHBondContact O-N 3.34Å; S1050-V1052 VanDerWaalsContact C-N 3.33Å; S1050-V1052 PolarHBondContact O-N 2.85Å; S1050-A1053 PolarHBondContact O-N 2.86Å; S1050-F1054 VanDerWaalsContact C-CD2 3.48Å; S1050-F1054 WeakPolarHBondContact O-CD2 3.28Å; S1050-F1054 WeakPolarHBondContact O-CG 3.43Å; S1050-F1054 PolarHBondContact O-N 3.03Å
1051	E	77.2	Confident	84.6	Confident	80 Å²	80	69.4 Å²	69.4	37%	0.374	37%	0.37	S	S	.	.	H	α-helix	trans	-60	-36	176.4	-62.6	-164	-173	0	0	114.5	D1049 R1055	D1049-E1051 PolarHBondContact O-N 2.93Å; D1049-E1051 VanDerWaalsContact O-N 3.1Å; E1051-R1055 WeakPolarHBondContact O-CD 3.36Å; E1051-R1055 VanDerWaalsContact O-CG 3.25Å; E1051-R1055 WeakPolarHBondContact O-CG 3.14Å; E1051-R1055 PolarHBondContact O-N 3.03Å; E1051-R1055 PolarHBondContact O-NE 2.98Å; E1051-R1055 VanDerWaalsContact O-NE 3.08Å; E1051-R1055 IonicContact OE2-NH2 3.3Å; E1051-R1055 PolarHBondContact OE2-NH2 2.69Å
1052	V	80.4	Confident	84.7	Confident	37 Å²	37	65.1 Å²	65.1	22%	0.224	36%	0.355	C	S	.	.	H	α-helix	trans	-73.9	-42.8	179.3	178.5	0	0	0	0	109.3	D1049 S1050 F1054 R1055 Y1056	D1049-V1052 HydrophobicContact CB-CG2 4.17Å; D1049-V1052 PolarHBondContact O-N 3.42Å; S1050-V1052 VanDerWaalsContact C-N 3.33Å; S1050-V1052 PolarHBondContact O-N 2.85Å; V1052-F1054 PolarHBondContact O-N 3.08Å; V1052-R1055 PolarHBondContact O-N 3.05Å; V1052-R1055 VanDerWaalsContact O-N 3.17Å; V1052-Y1056 HydrophobicContact CG1-CD2 3.95Å; V1052-Y1056 HydrophobicContact CG1-CE2 3.88Å; V1052-Y1056 WeakPolarHBondContact O-CD2 3.3Å; V1052-Y1056 PolarHBondContact O-N 3.15Å
1053	A	81.6	Confident	84.9	Confident	15 Å²	15	65 Å²	65	12%	0.124	36%	0.362	C	S	.	.	H	α-helix	trans	-58.3	-46.2	176.1	0	0	0	0	0	111.5	A1039 D1049 S1050 R1055 Y1056 I1057	A1039-A1053 HydrophobicContact CB-CB 4.28Å; D1049-A1053 PolarHBondContact O-N 3.2Å; S1050-A1053 PolarHBondContact O-N 2.86Å; A1053-R1055 PolarHBondContact O-N 3.5Å; A1053-Y1056 PolarHBondContact O-N 3.45Å; A1053-I1057 HydrophobicContact CB-CD1 3.98Å; A1053-I1057 WeakPolarHBondContact O-CB 3.21Å; A1053-I1057 WeakPolarHBondContact O-CD1 3.31Å; A1053-I1057 WeakPolarHBondContact O-CG1 3.44Å; A1053-I1057 PolarHBondContact O-N 3.08Å; A1053-I1057 VanDerWaalsContact O-N 3.15Å
1054	F	81.9	Confident	85.3	Confident	43 Å²	43	68.7 Å²	68.7	19%	0.189	38%	0.38	C	S	.	.	H	α-helix	trans	-58.6	-32.5	177.3	-72.6	-62.3	0	0	0	113.3	Y1036 A1039 S1050 V1052 Y1058	Y1036-F1054 AromaticContact CD2-CD1 3.9Å; Y1036-F1054 HydrophobicContact CD2-CD1 3.9Å; Y1036-F1054 AromaticContact CD2-CE1 3.27Å; Y1036-F1054 HydrophobicContact CD2-CE1 3.27Å; Y1036-F1054 AromaticContact CD2-CZ 3.98Å; Y1036-F1054 HydrophobicContact CD2-CZ 3.98Å; Y1036-F1054 HydrophobicContact CE2-CD1 4.34Å; Y1036-F1054 AromaticContact CE2-CE1 3.49Å; Y1036-F1054 HydrophobicContact CE2-CE1 3.49Å; Y1036-F1054 VanDerWaalsContact CE2-CE1 3.49Å; Y1036-F1054 AromaticContact CE2-CZ 3.69Å; Y1036-F1054 HydrophobicContact CE2-CZ 3.69Å; Y1036-F1054 AromaticContact CG-CE1 3.93Å; Y1036-F1054 HydrophobicContact CG-CE1 3.93Å; Y1036-F1054 WeakPolarHBondContact O-CE1 3.41Å; A1039-F1054 HydrophobicContact CB-CD1 3.27Å; A1039-F1054 HydrophobicContact CB-CE1 3.47Å; A1039-F1054 VanDerWaalsContact CB-CE1 3.47Å; A1039-F1054 HydrophobicContact CB-CG 3.93Å; A1039-F1054 HydrophobicContact CB-CZ 4.25Å; S1050-F1054 VanDerWaalsContact C-CD2 3.48Å; S1050-F1054 WeakPolarHBondContact O-CD2 3.28Å; S1050-F1054 WeakPolarHBondContact O-CG 3.43Å; S1050-F1054 PolarHBondContact O-N 3.03Å; V1052-F1054 PolarHBondContact O-N 3.08Å; F1054-Y1058 VanDerWaalsContact O-CD2 3.31Å; F1054-Y1058 WeakPolarHBondContact O-CD2 2.98Å
1055	R	80.9	Confident	85.6	Confident	7 Å²	7	69.8 Å²	69.8	3%	0.026	38%	0.375	C	S	.	.	H	α-helix	trans	-76.5	-35.7	-175.5	-68.4	168.1	-151.3	-142.8	2.5	113.9	V954 G959 K962 I964 E1051 V1052 A1053 P1059	V954-R1055 HydrophobicContact CG1-CB 4.43Å; V954-R1055 HydrophobicContact CG1-CG 3.92Å; G959-R1055 PolarHBondContact O-NH1 2.91Å; K962-R1055 VanDerWaalsContact O-CZ 3.23Å; K962-R1055 PolarHBondContact O-NH1 3.12Å; K962-R1055 PolarHBondContact O-NH2 2.86Å; I964-R1055 HydrophobicContact CD1-CG 4.16Å; E1051-R1055 WeakPolarHBondContact O-CD 3.36Å; E1051-R1055 VanDerWaalsContact O-CG 3.25Å; E1051-R1055 WeakPolarHBondContact O-CG 3.14Å; E1051-R1055 PolarHBondContact O-N 3.03Å; E1051-R1055 PolarHBondContact O-NE 2.98Å; E1051-R1055 VanDerWaalsContact O-NE 3.08Å; E1051-R1055 IonicContact OE2-NH2 3.3Å; E1051-R1055 PolarHBondContact OE2-NH2 2.69Å; V1052-R1055 PolarHBondContact O-N 3.05Å; V1052-R1055 VanDerWaalsContact O-N 3.17Å; A1053-R1055 PolarHBondContact O-N 3.5Å; R1055-P1059 VanDerWaalsContact O-CD 3.3Å; R1055-P1059 WeakPolarHBondContact O-CD 3.46Å
1056	Y	85.7	Confident	85.9	Confident	132 Å²	132	66 Å²	66	52%	0.518	36%	0.355	S	S	.	.	H	α-helix	trans	-98.1	-21.8	-174	-65.4	-69.4	0	0	0	113.9	V1052 A1053 P1059 F1060	V1052-Y1056 HydrophobicContact CG1-CD2 3.95Å; V1052-Y1056 HydrophobicContact CG1-CE2 3.88Å; V1052-Y1056 WeakPolarHBondContact O-CD2 3.3Å; V1052-Y1056 PolarHBondContact O-N 3.15Å; A1053-Y1056 PolarHBondContact O-N 3.45Å; Y1056-P1059 WeakPolarHBondContact O-CD 3.4Å; Y1056-F1060 VanDerWaalsContact O-CB 3.25Å; Y1056-F1060 WeakPolarHBondContact O-CB 3.44Å; Y1056-F1060 PolarHBondContact O-N 2.58Å
1057	I	89.7	Confident	86.3	Confident	21 Å²	21	64.1 Å²	64.1	11%	0.108	35%	0.351	C	S	.	.	H	α-helix	trans	-69.6	-36.5	-178.4	-72.6	170.1	0	0	0	112.2	P1035 L1038 A1039 A1053 F1060 L1061	P1035-I1057 HydrophobicContact CB-CG2 4.08Å; L1038-I1057 HydrophobicContact CB-CG2 4.45Å; L1038-I1057 HydrophobicContact CD2-CG2 3.94Å; A1039-I1057 VanDerWaalsContact CA-CD1 3.42Å; A1039-I1057 HydrophobicContact CB-CD1 3.57Å; A1053-I1057 HydrophobicContact CB-CD1 3.98Å; A1053-I1057 WeakPolarHBondContact O-CB 3.21Å; A1053-I1057 WeakPolarHBondContact O-CD1 3.31Å; A1053-I1057 WeakPolarHBondContact O-CG1 3.44Å; A1053-I1057 PolarHBondContact O-N 3.08Å; A1053-I1057 VanDerWaalsContact O-N 3.15Å; I1057-F1060 PolarHBondContact O-N 2.89Å; I1057-L1061 HydrophobicContact CG2-CD1 3.82Å; I1057-L1061 HydrophobicContact CG2-CG 4.26Å; I1057-L1061 WeakPolarHBondContact O-CG 3.41Å; I1057-L1061 PolarHBondContact O-N 3.46Å
1058	Y	91.2	Very high	86.8	Confident	11 Å²	11	62 Å²	62	4%	0.043	33%	0.33	C	S	.	.	H	α-helix	trans	-62.6	-54.5	177.3	-80.4	-90.3	0	0	0	112.9	L947 F950 L1032 P1035 F1054 F1060 L1061 F1062	L947-Y1058 HydrophobicContact CD1-CD1 4.41Å; F950-Y1058 HydrophobicContact CB-CD1 3.93Å; F950-Y1058 HydrophobicContact CB-CD2 3.99Å; F950-Y1058 HydrophobicContact CB-CE1 4.32Å; F950-Y1058 HydrophobicContact CB-CE2 4.36Å; F950-Y1058 HydrophobicContact CB-CG 3.76Å; F950-Y1058 HydrophobicContact CD2-CD1 4.46Å; F950-Y1058 HydrophobicContact CD2-CD2 4.48Å; F950-Y1058 AromaticContact CD2-CE1 4Å; F950-Y1058 HydrophobicContact CD2-CE1 4Å; F950-Y1058 HydrophobicContact CD2-CE2 4Å; F950-Y1058 AromaticContact CD2-CZ 3.74Å; F950-Y1058 HydrophobicContact CG-CD2 4.37Å; F950-Y1058 HydrophobicContact CG-CE2 4.3Å; L1032-Y1058 HydrophobicContact CD1-CE1 4.35Å; L1032-Y1058 PolarHBondContact O-OH 3.14Å; P1035-Y1058 HydrophobicContact CB-CD1 3.67Å; P1035-Y1058 HydrophobicContact CB-CD2 3.99Å; P1035-Y1058 HydrophobicContact CB-CE1 3.59Å; P1035-Y1058 HydrophobicContact CB-CE2 3.94Å; P1035-Y1058 HydrophobicContact CB-CG 3.87Å; P1035-Y1058 HydrophobicContact CG-CD1 3.73Å; P1035-Y1058 HydrophobicContact CG-CE1 3.66Å; P1035-Y1058 HydrophobicContact CG-CG 4.37Å; F1054-Y1058 VanDerWaalsContact O-CD2 3.31Å; F1054-Y1058 WeakPolarHBondContact O-CD2 2.98Å; Y1058-F1060 VanDerWaalsContact C-N 3.28Å; Y1058-F1060 PolarHBondContact O-N 3Å; Y1058-L1061 PolarHBondContact O-N 2.88Å; Y1058-F1062 PolarHBondContact O-N 3.43Å
1059	P	90.8	Very high	87.4	Confident	33 Å²	33	62.7 Å²	62.7	21%	0.214	33%	0.332	C	S	.	.	H	α-helix	trans	-59.9	-37.2	175.5	-21.1	29.4	0	0	0	113	I951 P955 R1055 Y1056 F1062 A1063	I951-P1059 WeakPolarHBondContact O-CG 3.28Å; P955-P1059 HydrophobicContact CB-CG 4.25Å; P955-P1059 HydrophobicContact CG-CG 3.89Å; R1055-P1059 VanDerWaalsContact O-CD 3.3Å; R1055-P1059 WeakPolarHBondContact O-CD 3.46Å; Y1056-P1059 WeakPolarHBondContact O-CD 3.4Å; P1059-F1062 PolarHBondContact O-N 3.38Å; P1059-A1063 WeakPolarHBondContact O-CB 3.33Å; P1059-A1063 PolarHBondContact O-N 3.21Å
1060	F	90.7	Very high	87.8	Confident	124 Å²	124	62 Å²	62	54%	0.544	33%	0.328	S	S	.	.	H	α-helix	trans	-63.1	-48.8	178.8	176.4	-100.9	0	0	0	112.4	Y1056 I1057 Y1058 F1062 A1063 L1064	Y1056-F1060 VanDerWaalsContact O-CB 3.25Å; Y1056-F1060 WeakPolarHBondContact O-CB 3.44Å; Y1056-F1060 PolarHBondContact O-N 2.58Å; I1057-F1060 PolarHBondContact O-N 2.89Å; Y1058-F1060 VanDerWaalsContact C-N 3.28Å; Y1058-F1060 PolarHBondContact O-N 3Å; F1060-F1062 VanDerWaalsContact C-N 3.3Å; F1060-F1062 PolarHBondContact O-N 3.04Å; F1060-A1063 PolarHBondContact O-N 2.85Å; F1060-L1064 HydrophobicContact CD1-CD1 4.09Å; F1060-L1064 HydrophobicContact CE1-CD1 3.47Å; F1060-L1064 VanDerWaalsContact CE1-CD1 3.47Å; F1060-L1064 HydrophobicContact CE1-CG 4.23Å; F1060-L1064 HydrophobicContact CZ-CD1 3.76Å; F1060-L1064 HydrophobicContact CZ-CG 4.21Å; F1060-L1064 PolarHBondContact O-N 3.39Å
1061	L	91	Very high	88.6	Confident	50 Å²	50	64.4 Å²	64.4	26%	0.262	34%	0.336	S	S	.	.	H	α-helix	trans	-65.6	-35.3	177.4	-71	175	0	0	0	111.9	P1035 L1038 I1057 Y1058 L1064 F1065	P1035-L1061 HydrophobicContact CB-CD1 3.7Å; P1035-L1061 HydrophobicContact CG-CD1 3.62Å; L1038-L1061 HydrophobicContact CD2-CD1 4.01Å; L1038-L1061 HydrophobicContact CD2-CD2 4.27Å; L1038-L1061 HydrophobicContact CD2-CG 4.49Å; I1057-L1061 HydrophobicContact CG2-CD1 3.82Å; I1057-L1061 HydrophobicContact CG2-CG 4.26Å; I1057-L1061 WeakPolarHBondContact O-CG 3.41Å; I1057-L1061 PolarHBondContact O-N 3.46Å; Y1058-L1061 PolarHBondContact O-N 2.88Å; L1061-L1064 HydrophobicContact CD2-CD1 4.38Å; L1061-L1064 PolarHBondContact O-N 3.35Å; L1061-F1065 PolarHBondContact O-N 3.39Å
1062	F	91.2	Very high	89.2	Confident	67 Å²	67	65 Å²	65	29%	0.294	35%	0.345	S	S	.	.	H	α-helix	trans	-64.9	-43.3	173.2	-177	-105.1	0	0	0	112.1	I951 F952 Y1058 P1059 F1060 L1064 F1065 I1066	I951-F1062 HydrophobicContact CD1-CB 4.08Å; I951-F1062 HydrophobicContact CD1-CD2 3.86Å; I951-F1062 HydrophobicContact CD1-CG 4.06Å; I951-F1062 HydrophobicContact CG1-CB 4.25Å; I951-F1062 HydrophobicContact CG2-CB 3.85Å; I951-F1062 HydrophobicContact CG2-CD1 3.61Å; I951-F1062 HydrophobicContact CG2-CD2 4.33Å; I951-F1062 HydrophobicContact CG2-CE1 4.24Å; I951-F1062 HydrophobicContact CG2-CG 3.66Å; F952-F1062 HydrophobicContact CE1-CE1 4.14Å; F952-F1062 HydrophobicContact CE2-CE1 4.37Å; F952-F1062 HydrophobicContact CE2-CZ 4.42Å; F952-F1062 HydrophobicContact CZ-CD1 4.27Å; F952-F1062 AromaticContact CZ-CE1 3.54Å; F952-F1062 HydrophobicContact CZ-CE1 3.54Å; F952-F1062 AromaticContact CZ-CZ 3.85Å; F952-F1062 HydrophobicContact CZ-CZ 3.85Å; Y1058-F1062 PolarHBondContact O-N 3.43Å; P1059-F1062 PolarHBondContact O-N 3.38Å; F1060-F1062 VanDerWaalsContact C-N 3.3Å; F1060-F1062 PolarHBondContact O-N 3.04Å; F1062-L1064 VanDerWaalsContact C-N 3.34Å; F1062-L1064 PolarHBondContact O-N 3.04Å; F1062-F1065 WeakPolarHBondContact O-CB 3.37Å; F1062-F1065 PolarHBondContact O-N 3.15Å; F1062-F1065 VanDerWaalsContact O-N 3.17Å; F1062-I1066 HydrophobicContact CD1-CG1 4.38Å; F1062-I1066 HydrophobicContact CE1-CD1 4.35Å; F1062-I1066 HydrophobicContact CE1-CG1 3.98Å; F1062-I1066 HydrophobicContact CE2-CD1 4.43Å; F1062-I1066 HydrophobicContact CZ-CD1 3.99Å; F1062-I1066 HydrophobicContact CZ-CG1 4.09Å; F1062-I1066 WeakPolarHBondContact O-CG1 3.35Å; F1062-I1066 PolarHBondContact O-N 3.13Å
1063	A	90.9	Very high	89.6	Confident	49 Å²	49	67.7 Å²	67.7	41%	0.405	36%	0.358	S	S	.	.	H	α-helix	trans	-60.7	-42	174.9	0	0	0	0	0	111.8	P1059 F1060 F1065 I1066 C1067	P1059-A1063 WeakPolarHBondContact O-CB 3.33Å; P1059-A1063 PolarHBondContact O-N 3.21Å; F1060-A1063 PolarHBondContact O-N 2.85Å; A1063-F1065 VanDerWaalsContact C-N 3.33Å; A1063-F1065 PolarHBondContact O-N 3.07Å; A1063-I1066 PolarHBondContact O-N 2.78Å; A1063-C1067 PolarHBondContact O-N 3.31Å; A1063-C1067 PolarHBondContact O-SG 3.38Å; A1063-C1067 VanDerWaalsContact O-SG 3.34Å
1064	L	93.1	Very high	89.9	Confident	90 Å²	90	70 Å²	70	47%	0.471	37%	0.372	S	S	.	.	H	α-helix	trans	-61.2	-39.8	173.8	-73.4	-179.4	0	0	0	112.6	F1060 L1061 F1062 C1067 S1068	F1060-L1064 HydrophobicContact CD1-CD1 4.09Å; F1060-L1064 HydrophobicContact CE1-CD1 3.47Å; F1060-L1064 VanDerWaalsContact CE1-CD1 3.47Å; F1060-L1064 HydrophobicContact CE1-CG 4.23Å; F1060-L1064 HydrophobicContact CZ-CD1 3.76Å; F1060-L1064 HydrophobicContact CZ-CG 4.21Å; F1060-L1064 PolarHBondContact O-N 3.39Å; L1061-L1064 HydrophobicContact CD2-CD1 4.38Å; L1061-L1064 PolarHBondContact O-N 3.35Å; F1062-L1064 VanDerWaalsContact C-N 3.34Å; F1062-L1064 PolarHBondContact O-N 3.04Å; L1064-C1067 PolarHBondContact O-N 2.64Å; L1064-S1068 PolarHBondContact O-N 2.69Å
1065	F	91.5	Very high	90.2	Very high	120 Å²	120	72.9 Å²	72.9	53%	0.526	39%	0.389	S	S	.	.	H	α-helix	trans	-60.7	-47.5	174.2	173.9	-102.9	0	0	0	111.3	L1061 F1062 A1063 C1067 S1068 V1069	L1061-F1065 PolarHBondContact O-N 3.39Å; F1062-F1065 WeakPolarHBondContact O-CB 3.37Å; F1062-F1065 PolarHBondContact O-N 3.15Å; F1062-F1065 VanDerWaalsContact O-N 3.17Å; A1063-F1065 VanDerWaalsContact C-N 3.33Å; A1063-F1065 PolarHBondContact O-N 3.07Å; F1065-C1067 PolarHBondContact O-N 3.14Å; F1065-S1068 PolarHBondContact O-N 3.47Å; F1065-S1068 VanDerWaalsContact O-N 3.16Å; F1065-S1068 PolarHBondContact O-OG 3.49Å; F1065-V1069 HydrophobicContact CE1-CG2 4.12Å; F1065-V1069 HydrophobicContact CE2-CG2 4.11Å; F1065-V1069 HydrophobicContact CZ-CG2 3.88Å; F1065-V1069 WeakPolarHBondContact O-CG2 3.29Å; F1065-V1069 PolarHBondContact O-N 3.14Å
1066	I	91.4	Very high	90.5	Very high	70 Å²	70	74.4 Å²	74.4	36%	0.359	40%	0.397	S	S	.	.	H	α-helix	trans	-60.3	-44.9	176.6	-62.5	-60.6	0	0	0	111.4	F1062 A1063 S1068 V1069 L1070	F1062-I1066 HydrophobicContact CD1-CG1 4.38Å; F1062-I1066 HydrophobicContact CE1-CD1 4.35Å; F1062-I1066 HydrophobicContact CE1-CG1 3.98Å; F1062-I1066 HydrophobicContact CE2-CD1 4.43Å; F1062-I1066 HydrophobicContact CZ-CD1 3.99Å; F1062-I1066 HydrophobicContact CZ-CG1 4.09Å; F1062-I1066 WeakPolarHBondContact O-CG1 3.35Å; F1062-I1066 PolarHBondContact O-N 3.13Å; A1063-I1066 PolarHBondContact O-N 2.78Å; I1066-S1068 VanDerWaalsContact C-N 3.3Å; I1066-S1068 PolarHBondContact O-N 3.48Å; I1066-V1069 PolarHBondContact O-N 2.99Å; I1066-L1070 HydrophobicContact CG2-CD1 3.97Å; I1066-L1070 HydrophobicContact CG2-CG 4.3Å; I1066-L1070 WeakPolarHBondContact O-CG 3.36Å; I1066-L1070 PolarHBondContact O-N 3.49Å
1067	C	93.8	Very high	90.3	Very high	78 Å²	78	73.2 Å²	73.2	53%	0.527	40%	0.397	S	S	.	.	H	α-helix	trans	-59	-39.4	175.5	-70.1	0	0	0	0	112.5	A1063 L1064 F1065 L1070 L1071	A1063-C1067 PolarHBondContact O-N 3.31Å; A1063-C1067 PolarHBondContact O-SG 3.38Å; A1063-C1067 VanDerWaalsContact O-SG 3.34Å; L1064-C1067 PolarHBondContact O-N 2.64Å; F1065-C1067 PolarHBondContact O-N 3.14Å; C1067-L1070 PolarHBondContact O-N 3.1Å; C1067-L1071 VanDerWaalsContact O-CB 3.31Å; C1067-L1071 WeakPolarHBondContact O-CB 3.39Å; C1067-L1071 PolarHBondContact O-N 3.47Å
1068	S	93.3	Very high	90.1	Very high	56 Å²	56	77.2 Å²	77.2	39%	0.392	42%	0.417	S	S	.	.	H	α-helix	trans	-67.2	-37.5	178.1	77.6	0	0	0	0	113.1	L1064 F1065 I1066 L1071 T1072	L1064-S1068 PolarHBondContact O-N 2.69Å; F1065-S1068 PolarHBondContact O-N 3.47Å; F1065-S1068 VanDerWaalsContact O-N 3.16Å; F1065-S1068 PolarHBondContact O-OG 3.49Å; I1066-S1068 VanDerWaalsContact C-N 3.3Å; I1066-S1068 PolarHBondContact O-N 3.48Å; S1068-L1071 PolarHBondContact O-N 3.15Å; S1068-T1072 PolarHBondContact O-N 3.32Å; S1068-T1072 PolarHBondContact O-OG1 3.04Å
1069	V	91.4	Very high	90	Very high	58 Å²	58	84.1 Å²	84.1	35%	0.352	44%	0.443	S	S	.	.	H	α-helix	trans	-67.8	-47.3	175.3	173.7	0	0	0	0	109.8	F1065 I1066 L1071 T1072 L1073	F1065-V1069 HydrophobicContact CE1-CG2 4.12Å; F1065-V1069 HydrophobicContact CE2-CG2 4.11Å; F1065-V1069 HydrophobicContact CZ-CG2 3.88Å; F1065-V1069 WeakPolarHBondContact O-CG2 3.29Å; F1065-V1069 PolarHBondContact O-N 3.14Å; I1066-V1069 PolarHBondContact O-N 2.99Å; V1069-L1071 VanDerWaalsContact C-N 3.29Å; V1069-L1071 PolarHBondContact O-N 3.03Å; V1069-T1072 PolarHBondContact O-N 3.41Å; V1069-T1072 VanDerWaalsContact O-N 3.16Å; V1069-L1073 HydrophobicContact CG1-CD1 4.12Å; V1069-L1073 HydrophobicContact CG1-CG 4.45Å; V1069-L1073 WeakPolarHBondContact O-CG 3.46Å; V1069-L1073 PolarHBondContact O-N 3.02Å
1070	L	89.6	Confident	89.7	Confident	106 Å²	106	88.1 Å²	88.1	56%	0.555	45%	0.454	S	S	*	.	H	α-helix	trans	-60	-39.1	176.3	-69.1	176.3	0	0	0	111.9	I1066 C1067 L1073 C1074	I1066-L1070 HydrophobicContact CG2-CD1 3.97Å; I1066-L1070 HydrophobicContact CG2-CG 4.3Å; I1066-L1070 WeakPolarHBondContact O-CG 3.36Å; I1066-L1070 PolarHBondContact O-N 3.49Å; C1067-L1070 PolarHBondContact O-N 3.1Å; L1070-L1073 PolarHBondContact O-N 3.41Å; L1070-C1074 VanDerWaalsContact O-CB 3.29Å; L1070-C1074 WeakPolarHBondContact O-CB 3.42Å; L1070-C1074 PolarHBondContact O-N 2.95Å
1071	L	93.1	Very high	89.5	Confident	105 Å²	105	84.6 Å²	84.6	55%	0.55	44%	0.44	S	S	.	.	H	α-helix	trans	-64.2	-44.2	174.6	-178.6	63.9	0	0	0	111.8	C1067 S1068 V1069 L1073 C1074 I1075	C1067-L1071 VanDerWaalsContact O-CB 3.31Å; C1067-L1071 WeakPolarHBondContact O-CB 3.39Å; C1067-L1071 PolarHBondContact O-N 3.47Å; S1068-L1071 PolarHBondContact O-N 3.15Å; V1069-L1071 VanDerWaalsContact C-N 3.29Å; V1069-L1071 PolarHBondContact O-N 3.03Å; L1071-L1073 VanDerWaalsContact C-N 3.34Å; L1071-L1073 PolarHBondContact O-N 3.27Å; L1071-C1074 WeakPolarHBondContact O-CB 3.39Å; L1071-C1074 PolarHBondContact O-N 3.13Å; L1071-I1075 HydrophobicContact CD1-CD1 4.43Å; L1071-I1075 HydrophobicContact CG-CD1 4.11Å; L1071-I1075 VanDerWaalsContact O-CG1 3.32Å; L1071-I1075 WeakPolarHBondContact O-CG1 3.32Å; L1071-I1075 PolarHBondContact O-N 2.85Å
1072	T	91.2	Very high	89.4	Confident	93 Å²	93	85.5 Å²	85.5	57%	0.571	44%	0.441	S	S	*	.	H	α-helix	trans	-62.9	-42.4	177.6	-56.5	0	0	0	0	111.2	S1068 V1069 I1075 D1076	S1068-T1072 PolarHBondContact O-N 3.32Å; S1068-T1072 PolarHBondContact O-OG1 3.04Å; V1069-T1072 PolarHBondContact O-N 3.41Å; V1069-T1072 VanDerWaalsContact O-N 3.16Å; T1072-I1075 PolarHBondContact O-N 3.41Å; T1072-D1076 PolarHBondContact O-N 2.9Å
1073	L	87.8	Confident	89.2	Confident	94 Å²	94	85.2 Å²	85.2	49%	0.492	44%	0.442	S	S	.	.	H	α-helix	trans	-63	-42.5	174.2	-67.8	175	0	0	0	111.2	V1069 L1070 L1071 D1076 Q1077	V1069-L1073 HydrophobicContact CG1-CD1 4.12Å; V1069-L1073 HydrophobicContact CG1-CG 4.45Å; V1069-L1073 WeakPolarHBondContact O-CG 3.46Å; V1069-L1073 PolarHBondContact O-N 3.02Å; L1070-L1073 PolarHBondContact O-N 3.41Å; L1071-L1073 VanDerWaalsContact C-N 3.34Å; L1071-L1073 PolarHBondContact O-N 3.27Å; L1073-D1076 PolarHBondContact O-N 2.95Å; L1073-Q1077 VanDerWaalsContact O-CG 3.3Å; L1073-Q1077 WeakPolarHBondContact O-CG 3.4Å; L1073-Q1077 PolarHBondContact O-N 3.45Å
1074	C	87.2	Confident	89	Confident	63 Å²	63	87.3 Å²	87.3	43%	0.426	44%	0.443	S	S	.	.	H	α-helix	trans	-60.8	-46.1	176.2	-173.7	0	0	0	0	111.9	L1070 L1071 D1076 Q1077 I1078	L1070-C1074 VanDerWaalsContact O-CB 3.29Å; L1070-C1074 WeakPolarHBondContact O-CB 3.42Å; L1070-C1074 PolarHBondContact O-N 2.95Å; L1071-C1074 WeakPolarHBondContact O-CB 3.39Å; L1071-C1074 PolarHBondContact O-N 3.13Å; C1074-D1076 VanDerWaalsContact C-N 3.32Å; C1074-D1076 PolarHBondContact O-N 3.07Å; C1074-Q1077 PolarHBondContact O-N 2.91Å; C1074-I1078 VanDerWaalsContact O-CG1 3.32Å; C1074-I1078 WeakPolarHBondContact O-CG1 3.46Å; C1074-I1078 PolarHBondContact O-N 2.81Å
1075	I	89.1	Confident	88.7	Confident	103 Å²	103	83.4 Å²	83.4	53%	0.528	42%	0.423	S	S	.	.	H	α-helix	trans	-59.5	-43.7	175.8	-68.5	165.4	0	0	0	110.9	L1071 T1072 I1078 R1079	L1071-I1075 HydrophobicContact CD1-CD1 4.43Å; L1071-I1075 HydrophobicContact CG-CD1 4.11Å; L1071-I1075 VanDerWaalsContact O-CG1 3.32Å; L1071-I1075 WeakPolarHBondContact O-CG1 3.32Å; L1071-I1075 PolarHBondContact O-N 2.85Å; T1072-I1075 PolarHBondContact O-N 3.41Å; I1075-I1078 PolarHBondContact O-N 3.31Å; I1075-R1079 WeakPolarHBondContact O-CB 3.24Å; I1075-R1079 PolarHBondContact O-N 3.37Å
1076	D	86.2	Confident	88.5	Confident	39 Å²	39	79.4 Å²	79.4	21%	0.209	41%	0.405	C	S	.	.	H	α-helix	trans	-66.5	-37.7	178.6	-166.6	47.9	0	0	0	112.1	T1072 L1073 C1074 R1079 R1080	T1072-D1076 PolarHBondContact O-N 2.9Å; L1073-D1076 PolarHBondContact O-N 2.95Å; C1074-D1076 VanDerWaalsContact C-N 3.32Å; C1074-D1076 PolarHBondContact O-N 3.07Å; D1076-R1079 PolarHBondContact O-N 3.03Å; D1076-R1079 IonicContact OD1-CZ 3.68Å; D1076-R1079 VanDerWaalsContact OD1-CZ 3.3Å; D1076-R1079 IonicContact OD1-NE 3.7Å; D1076-R1079 PolarHBondContact OD1-NE 3.47Å; D1076-R1079 IonicContact OD1-NH2 2.68Å; D1076-R1079 PolarHBondContact OD1-NH2 3.03Å; D1076-R1080 WeakPolarHBondContact O-CG 3.39Å; D1076-R1080 PolarHBondContact O-N 3.2Å; D1076-R1080 IonicContact OD2-CZ 3.73Å; D1076-R1080 IonicContact OD2-NE 2.98Å; D1076-R1080 IonicContact OD2-NH1 3.42Å; D1076-R1080 PolarHBondContact OD2-NH1 2.79Å; D1076-R1080 IonicContact OD2-NH2 3.18Å
1077	Q	82.8	Confident	88.2	Confident	108 Å²	108	77.4 Å²	77.4	51%	0.505	40%	0.395	S	S	.	.	H	α-helix	trans	-63.3	-44.4	172.9	-67.3	-62.9	11.6	0	0	112.2	L1073 C1074 R1079 R1080 L1081	L1073-Q1077 VanDerWaalsContact O-CG 3.3Å; L1073-Q1077 WeakPolarHBondContact O-CG 3.4Å; L1073-Q1077 PolarHBondContact O-N 3.45Å; C1074-Q1077 PolarHBondContact O-N 2.91Å; Q1077-R1079 VanDerWaalsContact C-N 3.3Å; Q1077-R1079 PolarHBondContact O-N 2.8Å; Q1077-R1080 PolarHBondContact O-N 3.13Å; Q1077-L1081 WeakPolarHBondContact O-CB 3.14Å; Q1077-L1081 PolarHBondContact O-N 3.12Å
1078	I	85.4	Confident	87.8	Confident	104 Å²	104	79.2 Å²	79.2	53%	0.533	40%	0.396	S	S	.	.	H	α-helix	trans	-61.9	-41	176.4	-68.2	166.1	0	0	0	110.4	C1074 I1075 L1081 Y1082	C1074-I1078 VanDerWaalsContact O-CG1 3.32Å; C1074-I1078 WeakPolarHBondContact O-CG1 3.46Å; C1074-I1078 PolarHBondContact O-N 2.81Å; I1075-I1078 PolarHBondContact O-N 3.31Å; I1078-L1081 PolarHBondContact O-N 3.04Å; I1078-Y1082 WeakPolarHBondContact O-CB 3.29Å; I1078-Y1082 PolarHBondContact O-N 2.86Å
1079	R	88	Confident	87.4	Confident	156 Å²	156	82.7 Å²	82.7	59%	0.589	40%	0.404	S	S	*	.	H	α-helix	trans	-62.1	-44.5	176	-176.9	177.4	68.9	157.1	2.6	111.8	I1075 D1076 Q1077 Y1082 L1083	I1075-R1079 WeakPolarHBondContact O-CB 3.24Å; I1075-R1079 PolarHBondContact O-N 3.37Å; D1076-R1079 PolarHBondContact O-N 3.03Å; D1076-R1079 IonicContact OD1-CZ 3.68Å; D1076-R1079 VanDerWaalsContact OD1-CZ 3.3Å; D1076-R1079 IonicContact OD1-NE 3.7Å; D1076-R1079 PolarHBondContact OD1-NE 3.47Å; D1076-R1079 IonicContact OD1-NH2 2.68Å; D1076-R1079 PolarHBondContact OD1-NH2 3.03Å; Q1077-R1079 VanDerWaalsContact C-N 3.3Å; Q1077-R1079 PolarHBondContact O-N 2.8Å; R1079-Y1082 PolarHBondContact O-N 3.4Å; R1079-L1083 HydrophobicContact CG-CD1 4.38Å; R1079-L1083 WeakPolarHBondContact O-CG 3.31Å; R1079-L1083 PolarHBondContact O-N 3.41Å
1080	R	86.1	Confident	87.2	Confident	118 Å²	118	82 Å²	82	45%	0.445	40%	0.395	S	S	.	.	H	α-helix	trans	-61.3	-44.5	175.5	-75.7	-169.9	-77.2	-119.1	12.4	111.5	D1076 Q1077 L1083 H1084	D1076-R1080 WeakPolarHBondContact O-CG 3.39Å; D1076-R1080 PolarHBondContact O-N 3.2Å; D1076-R1080 IonicContact OD2-CZ 3.73Å; D1076-R1080 IonicContact OD2-NE 2.98Å; D1076-R1080 IonicContact OD2-NH1 3.42Å; D1076-R1080 PolarHBondContact OD2-NH1 2.79Å; D1076-R1080 IonicContact OD2-NH2 3.18Å; Q1077-R1080 PolarHBondContact O-N 3.13Å; R1080-L1083 PolarHBondContact O-N 3.41Å; R1080-H1084 WeakPolarHBondContact O-CB 3.26Å; R1080-H1084 PolarHBondContact O-N 3.42Å
1081	L	86.5	Confident	87.1	Confident	49 Å²	49	79.7 Å²	79.7	26%	0.257	38%	0.383	S	S	.	.	H	α-helix	trans	-62.6	-44.9	176.8	177.8	60	0	0	0	112.1	L102 S105 Q1077 I1078 L1083 H1084 I1085	L102-L1081 HydrophobicContact CD1-CD2 3.82Å; S105-L1081 WeakPolarHBondContact OG-CD1 3.49Å; Q1077-L1081 WeakPolarHBondContact O-CB 3.14Å; Q1077-L1081 PolarHBondContact O-N 3.12Å; I1078-L1081 PolarHBondContact O-N 3.04Å; L1081-L1083 VanDerWaalsContact C-N 3.32Å; L1081-L1083 PolarHBondContact O-N 3.39Å; L1081-H1084 WeakPolarHBondContact O-CB 3.16Å; L1081-H1084 PolarHBondContact O-N 3.24Å; L1081-I1085 HydrophobicContact CD1-CD1 3.91Å; L1081-I1085 HydrophobicContact CD1-CG1 4.1Å; L1081-I1085 HydrophobicContact CG-CD1 3.94Å; L1081-I1085 WeakPolarHBondContact O-CG1 3.21Å; L1081-I1085 PolarHBondContact O-N 3.27Å
1082	Y	87.9	Confident	86.7	Confident	70 Å²	70	80 Å²	80	28%	0.275	39%	0.389	S	S	.	.	H	α-helix	trans	-58.5	-44.9	176.3	176.5	-92.9	0	0	0	111.8	L93 L98 I1078 R1079 K1086	L93-Y1082 HydrophobicContact CB-CE2 3.91Å; L93-Y1082 PolarHBondContact N-OH 3.29Å; L98-Y1082 HydrophobicContact CD1-CD2 4.17Å; I1078-Y1082 WeakPolarHBondContact O-CB 3.29Å; I1078-Y1082 PolarHBondContact O-N 2.86Å; R1079-Y1082 PolarHBondContact O-N 3.4Å; Y1082-K1086 WeakPolarHBondContact O-CB 3.3Å; Y1082-K1086 PolarHBondContact O-N 2.82Å
1083	L	86.7	Confident	86.3	Confident	60 Å²	60	76.9 Å²	76.9	31%	0.314	38%	0.376	S	S	.	.	H	α-helix	trans	-64.7	-40.2	176.6	-72.4	171.7	0	0	0	111.8	R1079 R1080 L1081 K1086 D1087	R1079-L1083 HydrophobicContact CG-CD1 4.38Å; R1079-L1083 WeakPolarHBondContact O-CG 3.31Å; R1079-L1083 PolarHBondContact O-N 3.41Å; R1080-L1083 PolarHBondContact O-N 3.41Å; L1081-L1083 VanDerWaalsContact C-N 3.32Å; L1081-L1083 PolarHBondContact O-N 3.39Å; L1083-K1086 PolarHBondContact O-N 2.91Å; L1083-D1087 WeakPolarHBondContact O-CB 3.3Å; L1083-D1087 PolarHBondContact O-N 2.85Å
1084	H	86	Confident	86.2	Confident	93 Å²	93	78.4 Å²	78.4	43%	0.431	38%	0.378	S	S	.	.	H	α-helix	trans	-61.8	-48.4	176.6	-176.4	-77.8	0	0	0	112.5	R1080 L1081 K1086 D1087 E1088	R1080-H1084 WeakPolarHBondContact O-CB 3.26Å; R1080-H1084 PolarHBondContact O-N 3.42Å; L1081-H1084 WeakPolarHBondContact O-CB 3.16Å; L1081-H1084 PolarHBondContact O-N 3.24Å; H1084-K1086 VanDerWaalsContact C-N 3.27Å; H1084-K1086 PolarHBondContact O-N 2.83Å; H1084-D1087 PolarHBondContact O-N 3.2Å; H1084-E1088 IonicContact CE1-OE1 3.36Å; H1084-E1088 PolarHBondContact CE1-OE1 2.92Å; H1084-E1088 IonicContact CE1-OE2 3.61Å; H1084-E1088 IonicContact ND1-OE2 3.41Å; H1084-E1088 PolarHBondContact O-N 3.47Å
1085	I	87.1	Confident	86	Confident	9 Å²	9	79.4 Å²	79.4	5%	0.046	38%	0.377	C	S	.	.	H	α-helix	trans	-63.2	-37.8	178.3	-62.8	166.8	0	0	0	110.5	L93 L98 L1081 K1089	L93-I1085 HydrophobicContact CD2-CB 4.36Å; L93-I1085 HydrophobicContact CD2-CG2 3.7Å; L98-I1085 HydrophobicContact CD1-CD1 4.17Å; L1081-I1085 HydrophobicContact CD1-CD1 3.91Å; L1081-I1085 HydrophobicContact CD1-CG1 4.1Å; L1081-I1085 HydrophobicContact CG-CD1 3.94Å; L1081-I1085 WeakPolarHBondContact O-CG1 3.21Å; L1081-I1085 PolarHBondContact O-N 3.27Å; I1085-K1089 PolarHBondContact O-N 3.41Å
1086	K	87.2	Confident	85.8	Confident	36 Å²	36	74.7 Å²	74.7	16%	0.157	35%	0.352	C	S	.	.	H	α-helix	trans	-65.7	-42.9	175.7	-174.9	178.4	178.6	178.4	0	111.7	Y85 L93 Y1082 L1083 H1084 Y1090	Y85-K1086 HydrophobicContact CD1-CG 4.43Å; Y85-K1086 HydrophobicContact CE1-CD 4.09Å; Y85-K1086 HydrophobicContact CE1-CG 3.86Å; L93-K1086 HydrophobicContact CD1-CB 3.94Å; L93-K1086 HydrophobicContact CD1-CD 4.35Å; L93-K1086 HydrophobicContact CD1-CG 3.83Å; Y1082-K1086 WeakPolarHBondContact O-CB 3.3Å; Y1082-K1086 PolarHBondContact O-N 2.82Å; L1083-K1086 PolarHBondContact O-N 2.91Å; H1084-K1086 VanDerWaalsContact C-N 3.27Å; H1084-K1086 PolarHBondContact O-N 2.83Å; K1086-Y1090 HydrophobicContact CG-CD2 4.38Å; K1086-Y1090 WeakPolarHBondContact O-CB 3.3Å; K1086-Y1090 PolarHBondContact O-N 3.45Å
1087	D	85.8	Confident	85.6	Confident	28 Å²	28	76.5 Å²	76.5	15%	0.15	36%	0.362	C	S	.	.	H	α-helix	trans	-65.4	-49.3	178.6	-66.6	-18.5	0	0	0	110.6	R83 Y85 L1083 H1084 K1089 Y1090 L1091	R83-D1087 WeakPolarHBondContact CD-OD1 3.41Å; R83-D1087 IonicContact CZ-OD1 3.71Å; R83-D1087 IonicContact CZ-OD2 2.96Å; R83-D1087 IonicContact NE-OD1 3.76Å; R83-D1087 IonicContact NE-OD2 3.39Å; R83-D1087 PolarHBondContact NE-OD2 2.75Å; R83-D1087 VanDerWaalsContact NH1-CG 3.29Å; R83-D1087 IonicContact NH1-OD1 3.07Å; R83-D1087 PolarHBondContact NH1-OD1 3.12Å; R83-D1087 IonicContact NH1-OD2 2.69Å; R83-D1087 PolarHBondContact NH1-OD2 3.47Å; R83-D1087 IonicContact NH2-OD2 3.53Å; Y85-D1087 PolarHBondContact OH-OD1 3.04Å; L1083-D1087 WeakPolarHBondContact O-CB 3.3Å; L1083-D1087 PolarHBondContact O-N 2.85Å; H1084-D1087 PolarHBondContact O-N 3.2Å; D1087-K1089 PolarHBondContact O-N 3Å; D1087-K1089 VanDerWaalsContact O-N 3.14Å; D1087-Y1090 PolarHBondContact O-N 3.16Å; D1087-L1091 HydrophobicContact CB-CB 4.41Å; D1087-L1091 HydrophobicContact CB-CD2 4.46Å; D1087-L1091 WeakPolarHBondContact O-CB 3.32Å; D1087-L1091 PolarHBondContact O-N 2.89Å
1088	E	85.7	Confident	85.7	Confident	115 Å²	115	74.6 Å²	74.6	54%	0.537	36%	0.355	S	S	.	.	H	α-helix	trans	-53.6	-37	179.2	-94.4	-175	158	0	0	112.9	R108 H1084	R108-E1088 IonicContact NH1-OE1 2.75Å; R108-E1088 IonicContact NH2-OE1 3.25Å; R108-E1088 PolarHBondContact NH2-OE1 3.05Å; R108-E1088 IonicContact NH2-OE2 3.69Å; H1084-E1088 IonicContact CE1-OE1 3.36Å; H1084-E1088 PolarHBondContact CE1-OE1 2.92Å; H1084-E1088 IonicContact CE1-OE2 3.61Å; H1084-E1088 IonicContact ND1-OE2 3.41Å; H1084-E1088 PolarHBondContact O-N 3.47Å
1089	K	85.3	Confident	85.2	Confident	129 Å²	129	72.3 Å²	72.3	56%	0.561	34%	0.341	S	S	*	.	H	α-helix	trans	-96.5	-26.8	-173.6	-170.3	147.8	-177.3	164.4	0	115.1	V97 I1085 D1087	V97-K1089 HydrophobicContact CG1-CD 3.68Å; V97-K1089 HydrophobicContact CG2-CD 4.49Å; I1085-K1089 PolarHBondContact O-N 3.41Å; D1087-K1089 PolarHBondContact O-N 3Å; D1087-K1089 VanDerWaalsContact O-N 3.14Å
1090	Y	87.4	Confident	84.1	Confident	43 Å²	43	75 Å²	75	17%	0.169	35%	0.352	C	S	.	.	H	α-helix	trans	-128.8	-6.6	-167.7	-61.8	-73.4	0	0	0	114.8	Y85 A86 T89 L93 K1086 D1087 V1092	Y85-Y1090 VanDerWaalsContact CA-O 3.29Å; Y85-Y1090 WeakPolarHBondContact CA-O 3.24Å; A86-Y1090 PolarHBondContact N-O 3.35Å; A86-Y1090 VanDerWaalsContact N-O 3.13Å; T89-Y1090 HydrophobicContact CG2-CD1 3.38Å; T89-Y1090 HydrophobicContact CG2-CD2 4.13Å; T89-Y1090 HydrophobicContact CG2-CE1 4.15Å; T89-Y1090 HydrophobicContact CG2-CG 3.35Å; L93-Y1090 HydrophobicContact CD1-CD2 4.04Å; L93-Y1090 HydrophobicContact CD1-CE2 3.67Å; L93-Y1090 HydrophobicContact CG-CE2 4.21Å; K1086-Y1090 HydrophobicContact CG-CD2 4.38Å; K1086-Y1090 WeakPolarHBondContact O-CB 3.3Å; K1086-Y1090 PolarHBondContact O-N 3.45Å; D1087-Y1090 PolarHBondContact O-N 3.16Å; Y1090-V1092 PolarHBondContact O-N 3.34Å
1091	L	86.8	Confident	82.4	Confident	58 Å²	58	73.6 Å²	73.6	30%	0.304	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	114.9	176.1	-172	70.2	0	0	0	109.1	R83 D1087 G1093	R83-L1091 HydrophobicContact CB-CD1 3.51Å; R83-L1091 HydrophobicContact CG-CD1 3.86Å; D1087-L1091 HydrophobicContact CB-CB 4.41Å; D1087-L1091 HydrophobicContact CB-CD2 4.46Å; D1087-L1091 WeakPolarHBondContact O-CB 3.32Å; D1087-L1091 PolarHBondContact O-N 2.89Å; L1091-G1093 WeakPolarHBondContact CD1-O 3.4Å
1092	V	85	Confident	80.2	Confident	111 Å²	111	76.8 Å²	76.8	67%	0.673	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.1	-30.2	175.2	177.8	0	0	0	0	110.4	I84 A86 Y1090	I84-V1092 PolarHBondContact O-N 3.15Å; A86-V1092 HydrophobicContact CB-CG2 3.64Å; Y1090-V1092 PolarHBondContact O-N 3.34Å
1093	G	82.7	Confident	77.6	Confident	28 Å²	28	78.3 Å²	78.3	29%	0.289	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	178.3	-177.1	179	0	0	0	0	0	112.2	I84 L1091	I84-G1093 PolarHBondContact N-O 2.84Å; L1091-G1093 WeakPolarHBondContact CD1-O 3.4Å
1094	K	85.2	Confident	75.1	Confident	127 Å²	127	81 Å²	81	55%	0.552	43%	0.426	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115	130.5	175.8	-66.8	173.8	-173.1	164.1	0	108.7	Q57 F81 T82	Q57-K1094 PolarHBondContact NE2-O 3.03Å; F81-K1094 HydrophobicContact CB-CB 4.23Å; F81-K1094 HydrophobicContact CD1-CB 4.31Å; T82-K1094 CarbonylContact O-C 3.52Å; T82-K1094 WeakPolarHBondContact O-CA 3.48Å
1095	Q	83.6	Confident	72.6	Confident	84 Å²	84	81.5 Å²	81.5	39%	0.393	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	139.2	172.2	-148.3	172.6	-7.1	0	0	110.3	F43 Q57 F81 T82 I84	F43-Q1095 HydrophobicContact CZ-CG 4.48Å; Q57-Q1095 VanDerWaalsContact OE1-CG 3.29Å; F81-Q1095 CarbonylContact C-O 3.57Å; F81-Q1095 WeakPolarHBondContact CA-O 3.34Å; T82-Q1095 PolarHBondContact N-O 3.47Å; T82-Q1095 PolarHBondContact O-N 3.24Å; T82-Q1095 PolarHBondContact OG1-O 3.2Å; I84-Q1095 HydrophobicContact CD1-CB 3.49Å; I84-Q1095 VanDerWaalsContact CD1-CB 3.49Å; I84-Q1095 HydrophobicContact CD1-CG 3.96Å; I84-Q1095 HydrophobicContact CG1-CB 3.79Å
1096	L	85.1	Confident	70	Confident	3 Å²	3	90.1 Å²	90.1	2%	0.016	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	129.8	172.1	-176.9	61.7	0	0	0	110.2	F43 P45 I55 Q57 L60 F79 F81	F43-L1096 HydrophobicContact CB-CD2 3.69Å; F43-L1096 HydrophobicContact CB-CG 4.31Å; F43-L1096 HydrophobicContact CD1-CB 4.33Å; F43-L1096 VanDerWaalsContact CD1-O 3.3Å; F43-L1096 WeakPolarHBondContact CD1-O 3.31Å; F43-L1096 WeakPolarHBondContact CE1-O 3.4Å; F43-L1096 HydrophobicContact CG-CB 4.42Å; F43-L1096 HydrophobicContact CG-CD2 4.08Å; F43-L1096 HydrophobicContact CG-CG 4.44Å; P45-L1096 HydrophobicContact CB-CD1 3.63Å; P45-L1096 HydrophobicContact CB-CD2 3.84Å; P45-L1096 HydrophobicContact CB-CG 3.82Å; P45-L1096 HydrophobicContact CG-CD1 4.42Å; P45-L1096 HydrophobicContact CG-CD2 3.92Å; P45-L1096 HydrophobicContact CG-CG 4.45Å; I55-L1096 HydrophobicContact CG2-CD2 4.3Å; Q57-L1096 HydrophobicContact CB-CB 4.44Å; Q57-L1096 HydrophobicContact CG-CB 4.09Å; L60-L1096 HydrophobicContact CB-CD2 4.42Å; L60-L1096 HydrophobicContact CD2-CD1 3.51Å; L60-L1096 HydrophobicContact CD2-CD2 3.45Å; L60-L1096 VanDerWaalsContact CD2-CD2 3.45Å; L60-L1096 HydrophobicContact CD2-CG 4.11Å; F79-L1096 HydrophobicContact CB-CD1 4.5Å; F81-L1096 HydrophobicContact CD1-CB 4.36Å; F81-L1096 HydrophobicContact CD1-CD1 4.21Å; F81-L1096 HydrophobicContact CE1-CB 4.15Å; F81-L1096 HydrophobicContact CE1-CD1 3.78Å; F81-L1096 HydrophobicContact CE2-CD1 4.41Å; F81-L1096 HydrophobicContact CZ-CD1 3.89Å
1097	L	80.8	Confident	67.4	Low	78 Å²	78	93.2 Å²	93.2	41%	0.408	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-86.8	138.5	171.5	-76.9	172.6	0	0	0	110.7	A80 T82	A80-L1097 HydrophobicContact CB-CB 4.22Å; A80-L1097 HydrophobicContact CB-CD1 4.12Å; A80-L1097 WeakPolarHBondContact O-CB 3.3Å; A80-L1097 PolarHBondContact O-N 3.2Å; T82-L1097 HydrophobicContact CG2-CD1 3.4Å; T82-L1097 HydrophobicContact CG2-CD2 3.83Å; T82-L1097 HydrophobicContact CG2-CG 3.62Å
1098	N	84.8	Confident	64.8	Low	67 Å²	67	100 Å²	100	36%	0.358	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-69.5	138.3	166.1	-77.1	-16	0	0	0	110.7	F43 H44 R1100	F43-N1098 WeakPolarHBondContact CA-OD1 3.11Å; F43-N1098 VanDerWaalsContact CB-OD1 3.26Å; F43-N1098 WeakPolarHBondContact CB-OD1 3.13Å; F43-N1098 VanDerWaalsContact CD1-OD1 3.3Å; F43-N1098 WeakPolarHBondContact CD1-OD1 3.49Å; H44-N1098 VanDerWaalsContact CD2-CG 3.42Å; H44-N1098 PolarHBondContact CD2-ND2 3.47Å; H44-N1098 PolarHBondContact N-OD1 3.16Å; H44-N1098 WeakPolarHBondContact NE2-CB 3.41Å; H44-N1098 PolarHBondContact NE2-ND2 3.25Å; N1098-R1100 PolarHBondContact O-N 3.11Å
1099	F	75.8	Confident	62.4	Low	57 Å²	57	100.6 Å²	100.6	25%	0.25	55%	0.553	C	S	.	*			trans	-64.5	105.2	168.6	176.6	-95.5	0	0	0	108.8	H44 L47 H77 P1101	H44-F1099 PolarHBondContact CE1-O 2.93Å; H44-F1099 PolarHBondContact ND1-O 3.35Å; H44-F1099 WeakPolarHBondContact O-CB 3.44Å; H44-F1099 PolarHBondContact O-N 3.41Å; L47-F1099 HydrophobicContact CD2-CD1 4Å; L47-F1099 HydrophobicContact CD2-CD2 4.31Å; L47-F1099 HydrophobicContact CD2-CE1 3.35Å; L47-F1099 HydrophobicContact CD2-CE2 3.7Å; L47-F1099 HydrophobicContact CD2-CG 4.46Å; L47-F1099 HydrophobicContact CD2-CZ 3.19Å; L47-F1099 HydrophobicContact CG-CD2 4.48Å; L47-F1099 HydrophobicContact CG-CE1 4.4Å; L47-F1099 HydrophobicContact CG-CE2 4.15Å; L47-F1099 HydrophobicContact CG-CZ 4.13Å; H77-F1099 AromaticContact CE1-CD2 3.88Å; H77-F1099 AromaticContact NE2-CD2 3.4Å; H77-F1099 WeakPolarHBondContact NE2-CD2 3.47Å; H77-F1099 AromaticContact NE2-CE2 3.63Å; F1099-P1101 HydrophobicContact CE1-CB 4Å; F1099-P1101 WeakPolarHBondContact O-CD 3.24Å
1100	R	65.2	Low	59.9	Low	212 Å²	212	99.4 Å²	99.4	80%	0.8	56%	0.558	S	S	*	*			trans	-87.1	113.3	169.5	-146.2	174.3	-156.9	155.2	4.6	106.7	N1098 S1102	N1098-R1100 PolarHBondContact O-N 3.11Å; R1100-S1102 PolarHBondContact O-N 3.3Å; R1100-S1102 VanDerWaalsContact O-N 3.13Å
1101	P	50.6	Low	57.2	Low	88 Å²	88	104.3 Å²	104.3	57%	0.571	59%	0.593	S	S	*	*			trans	-55.3	127.6	164.3	22	-27.9	0	0	0	106.1	F1099 S1103	F1099-P1101 HydrophobicContact CE1-CB 4Å; F1099-P1101 WeakPolarHBondContact O-CD 3.24Å; P1101-S1103 VanDerWaalsContact C-N 3.33Å; P1101-S1103 PolarHBondContact O-N 3.08Å
1102	S	39.7	Very low	54.6	Low	116 Å²	116	106.4 Å²	106.4	81%	0.811	61%	0.612	S	S	*	*			trans	-55.7	103.4	174.6	-50.9	0	0	0	0	106.6	R1100 P1104	R1100-S1102 PolarHBondContact O-N 3.3Å; R1100-S1102 VanDerWaalsContact O-N 3.13Å; S1102-P1104 VanDerWaalsContact O-CD 3.31Å; S1102-P1104 WeakPolarHBondContact O-CD 3.37Å
1103	S	33.3	Very low	52.3	Low	103 Å²	103	110.3 Å²	110.3	72%	0.72	65%	0.645	S	S	*	*			trans	-54	119.5	171	51.3	0	0	0	0	105.7	P1101 S1105	P1101-S1103 VanDerWaalsContact C-N 3.33Å; P1101-S1103 PolarHBondContact O-N 3.08Å; S1103-S1105 PolarHBondContact O-N 3.06Å; S1103-S1105 VanDerWaalsContact O-N 3.12Å
1104	P	33.1	Very low	50.8	Low	115 Å²	115	114.5 Å²	114.5	75%	0.747	66%	0.663	S	S	*	*			trans	-53.6	126.6	173.9	-18	28.6	0	0	0	106.7	S1102	S1102-P1104 VanDerWaalsContact O-CD 3.31Å; S1102-P1104 WeakPolarHBondContact O-CD 3.37Å
1105	S	35.3	Very low	49	Very low	104 Å²	104	113.8 Å²	113.8	73%	0.727	67%	0.668	S	S	*	*	S	Bend	trans	11.9	113.3	160.2	51.5	0	0	0	0	115.1	S1103 S1107	S1103-S1105 PolarHBondContact O-N 3.06Å; S1103-S1105 VanDerWaalsContact O-N 3.12Å; S1105-S1107 PolarHBondContact O-N 3.15Å
1106	Q	32.3	Very low	47	Very low	191 Å²	191	115.4 Å²	115.4	89%	0.893	68%	0.684	S	S	*	*			trans	-16.4	100.5	155.3	-71.3	170.5	-15.4	0	0	110.8	L1108	Q1106-L1108 PolarHBondContact O-N 3.02Å
1107	S	31.5	Very low	44.8	Very low	100 Å²	100	122.1 Å²	122.1	70%	0.699	72%	0.723	S	S	*	*			trans	-60.1	114.7	172.5	48	0	0	0	0	106.4	S1105 V1109	S1105-S1107 PolarHBondContact O-N 3.15Å; S1107-V1109 PolarHBondContact O-N 3.44Å
1108	L	31.1	Very low	42.6	Very low	170 Å²	170	124.8 Å²	124.8	89%	0.89	74%	0.743	S	S	*	*			trans	-43	104.1	164.5	-69.9	120.7	0	0	0	108.9	Q1106	Q1106-L1108 PolarHBondContact O-N 3.02Å
1109	V	36.1	Very low	39.7	Very low	128 Å²	128	128.7 Å²	128.7	78%	0.776	77%	0.768	S	S	*	*			trans	-101.2	106.6	156.9	-178.7	0	0	0	0	104.9	S1107	S1107-V1109 PolarHBondContact O-N 3.44Å
1110	P	33.2	Very low	37.2	Very low	104 Å²	104	133.8 Å²	133.8	68%	0.675	81%	0.805	S	S	*	*			trans	-68	135.8	-177.7	26.9	-31	0	0	0	109.6	S1112	P1110-S1112 PolarHBondContact O-N 2.94Å
1111	T	29.6	Very low	35	Very low	146 Å²	146	127.8 Å²	127.8	90%	0.896	81%	0.806	S	S	*	*			trans	-56.1	114.6	165.8	45.4	0	0	0	0	109.7
1112	S	33.2	Very low	33.7	Very low	102 Å²	102	131.1 Å²	131.1	71%	0.713	83%	0.825	S	S	*	*			trans	-133.1	115.3	159.9	59.5	0	0	0	0	108.6	P1110	P1110-S1112 PolarHBondContact O-N 2.94Å
1113	S	36.1	Very low	33.2	Very low	194 Å²	194	132.5 Å²	132.5	100%	1.357	83%	0.827	S	S	*	*			trans	47.2	0	158.8	62.4	0	0	0	0	118.3

Retrieved 1,113 of 1,113 residues in 177.1 ms (Link to these results)

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