A0A087YFM2_POEFO Loading...

Zinc transporter ZIP12

AlphaFold DB , UniProt , Accession A0A087YFM2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 677 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.7	Very low	34	Very low	244 Å²	244	150.8 Å²	150.8	100%	1.202	79%	0.791	S	S	*	*				0	148.7	0	-74	160.1	173	0	0	108.2
2	R	25.9	Very low	34.4	Very low	241 Å²	241	148.8 Å²	148.8	91%	0.909	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-81.2	127.4	-170.7	-67.3	177.3	175.4	174	-3.1	111
3	F	25.7	Very low	34.6	Very low	208 Å²	208	146.6 Å²	146.6	91%	0.912	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-75.9	135.9	160.2	-94.6	-99.5	0	0	0	109.2
4	W	31.6	Very low	34.8	Very low	242 Å²	242	144.6 Å²	144.6	92%	0.917	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-93.5	130.2	168.6	-99.9	26.5	0	0	0	109.7
5	S	32.1	Very low	34.9	Very low	110 Å²	110	143.9 Å²	143.9	77%	0.769	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-79.7	122.9	176.2	177.4	0	0	0	0	110	A7	S5-A7 VanDerWaalsContact C-N 3.33Å; S5-A7 PolarHBondContact O-N 2.96Å; S5-A7 VanDerWaalsContact O-N 3.12Å
6	S	33.8	Very low	35	Very low	116 Å²	116	142.3 Å²	142.3	81%	0.811	74%	0.741	S	S	*	*			trans	-80.9	79	169.4	51.7	0	0	0	0	110.3	P8	S6-P8 VanDerWaalsContact C-CD 3.45Å
7	A	37.6	Very low	34.9	Very low	75 Å²	75	139.2 Å²	139.2	62%	0.62	73%	0.733	S	S	*	*			trans	-115.1	85.2	174	0	0	0	0	0	112.6	S5	S5-A7 VanDerWaalsContact C-N 3.33Å; S5-A7 PolarHBondContact O-N 2.96Å; S5-A7 VanDerWaalsContact O-N 3.12Å
8	P	37	Very low	34.7	Very low	96 Å²	96	138.7 Å²	138.7	62%	0.623	73%	0.726	S	S	*	*			trans	-118.9	-11.7	163	36.7	-27.8	0	0	0	114.9	S6	S6-P8 VanDerWaalsContact C-CD 3.45Å
9	C	36.4	Very low	34.5	Very low	101 Å²	101	139 Å²	139	68%	0.682	73%	0.728	S	S	*	*	H	α-helix	trans	-78.5	-31	-178.5	-76.8	0	0	0	0	114.8	V11	C9-V11 PolarHBondContact O-N 3.29Å
10	L	37	Very low	34.3	Very low	135 Å²	135	135.1 Å²	135.1	71%	0.707	72%	0.723	S	S	*	*	H	α-helix	trans	-73.8	-28.3	-174.1	-126.7	85.9	0	0	0	113.7	L14	L10-L14 PolarHBondContact O-N 3.41Å
11	V	42.2	Very low	34.1	Very low	91 Å²	91	138.4 Å²	138.4	55%	0.552	73%	0.725	S	S	*	*	H	α-helix	trans	-76.8	-29.3	-177.4	-178.6	0	0	0	0	111.7	C9 L14 H15	C9-V11 PolarHBondContact O-N 3.29Å; V11-L14 PolarHBondContact O-N 2.97Å; V11-H15 PolarHBondContact O-N 3.37Å
12	L	38.5	Very low	34	Very low	127 Å²	127	132.8 Å²	132.8	67%	0.665	70%	0.704	S	S	*	*	H	α-helix	trans	-68.5	-36.3	176.2	-136.5	81.5	0	0	0	112.1	L16	L12-L16 PolarHBondContact O-N 3.1Å
13	L	37.4	Very low	34.3	Very low	120 Å²	120	127.8 Å²	127.8	63%	0.628	70%	0.701	S	S	*	*	H	α-helix	trans	-69	-35.9	177.1	-87.6	156.1	0	0	0	112.8	L16 C17	L13-L16 PolarHBondContact O-N 3.33Å; L13-C17 WeakPolarHBondContact O-CB 3.45Å; L13-C17 PolarHBondContact O-N 3.22Å; L13-C17 VanDerWaalsContact O-N 3.09Å
14	L	37.3	Very low	34.3	Very low	118 Å²	118	121 Å²	121	62%	0.618	69%	0.69	S	S	*	*	H	α-helix	trans	-68.6	-39.2	175.7	-81.8	161	0	0	0	112.5	L10 V11 C17 E18	L10-L14 PolarHBondContact O-N 3.41Å; V11-L14 PolarHBondContact O-N 2.97Å; L14-C17 PolarHBondContact O-N 3.21Å; L14-E18 PolarHBondContact O-N 3.08Å; L14-E18 VanDerWaalsContact O-N 3.08Å
15	H	37	Very low	34.1	Very low	134 Å²	134	113 Å²	113	62%	0.62	68%	0.683	S	S	*	*	H	α-helix	trans	-71.1	-28.7	175.7	-87.8	-58.4	0	0	0	114	V11 L19	V11-H15 PolarHBondContact O-N 3.37Å; H15-L19 PolarHBondContact O-N 3.41Å
16	L	36.4	Very low	33.9	Very low	118 Å²	118	116.8 Å²	116.8	62%	0.618	69%	0.685	S	S	*	*	H	α-helix	trans	-73.4	-27.5	170.8	-75.6	165	0	0	0	112.6	L12 L13 G20	L12-L16 PolarHBondContact O-N 3.1Å; L13-L16 PolarHBondContact O-N 3.33Å; L16-G20 PolarHBondContact O-N 3.16Å
17	C	31.9	Very low	33.9	Very low	91 Å²	91	115 Å²	115	62%	0.615	68%	0.678	S	S	*	*	H	α-helix	trans	-76.5	-34.4	175.8	-154.4	0	0	0	0	112.7	L13 L14	L13-C17 WeakPolarHBondContact O-CB 3.45Å; L13-C17 PolarHBondContact O-N 3.22Å; L13-C17 VanDerWaalsContact O-N 3.09Å; L14-C17 PolarHBondContact O-N 3.21Å
18	E	31.7	Very low	33.9	Very low	130 Å²	130	120 Å²	120	61%	0.607	68%	0.681	S	S	*	*	H	α-helix	trans	-70.8	-34.7	171.9	-80.1	-81.8	119.7	0	0	112.7	L14 G20 R21	L14-E18 PolarHBondContact O-N 3.08Å; L14-E18 VanDerWaalsContact O-N 3.08Å; E18-G20 VanDerWaalsContact C-N 3.27Å; E18-G20 PolarHBondContact O-N 3.28Å; E18-R21 PolarHBondContact O-N 2.97Å
19	L	30.5	Very low	34.2	Very low	144 Å²	144	122 Å²	122	75%	0.754	69%	0.686	S	S	*	*	H	α-helix	trans	-69	-24.7	176.2	-130	77.9	0	0	0	113.3	H15 R21	H15-L19 PolarHBondContact O-N 3.41Å; L19-R21 VanDerWaalsContact C-N 3.28Å; L19-R21 PolarHBondContact O-N 3.49Å
20	G	31.7	Very low	35.1	Very low	61 Å²	61	122.6 Å²	122.6	63%	0.629	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-2.3	174.5	0	0	0	0	0	114.9	L16 E18	L16-G20 PolarHBondContact O-N 3.16Å; E18-G20 VanDerWaalsContact C-N 3.27Å; E18-G20 PolarHBondContact O-N 3.28Å
21	R	28.8	Very low	36.6	Very low	204 Å²	204	120.8 Å²	120.8	77%	0.77	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.6	8.2	-171.5	-146	171.6	-176.5	150.5	3.5	114.9	E18 L19	E18-R21 PolarHBondContact O-N 2.97Å; L19-R21 VanDerWaalsContact C-N 3.28Å; L19-R21 PolarHBondContact O-N 3.49Å
22	V	33.8	Very low	38.1	Very low	126 Å²	126	117.1 Å²	117.1	76%	0.764	64%	0.638	S	S	*	*	S	Bend	trans	-101.4	-3.5	-176.6	-179.2	0	0	0	0	113.4
23	T	31.2	Very low	39.9	Very low	136 Å²	136	111.1 Å²	111.1	83%	0.834	61%	0.607	S	S	*	*			trans	-101.3	46.9	165.1	57.3	0	0	0	0	111.9	G25	T23-G25 VanDerWaalsContact C-N 3.25Å; T23-G25 PolarHBondContact O-N 3.25Å
24	G	26.9	Very low	41.8	Very low	67 Å²	67	106.5 Å²	106.5	69%	0.691	58%	0.584	S	S	*	*			trans	-64.8	92.1	156.8	0	0	0	0	0	108.3	K26	G24-K26 PolarHBondContact O-N 3.4Å; G24-K26 VanDerWaalsContact O-N 3.14Å
25	G	26.6	Very low	43.5	Very low	74 Å²	74	103.1 Å²	103.1	76%	0.763	57%	0.565	S	S	*	*			trans	-58.5	116.3	178.5	0	0	0	0	0	109.8	T23 A27	T23-G25 VanDerWaalsContact C-N 3.25Å; T23-G25 PolarHBondContact O-N 3.25Å; G25-A27 PolarHBondContact O-N 2.95Å
26	K	27.7	Very low	45.4	Very low	188 Å²	188	96.8 Å²	96.8	82%	0.817	54%	0.535	S	S	*	.			trans	-57	137.5	161.1	-70.2	177.1	175.8	179.3	0	107.5	G24 R28	G24-K26 PolarHBondContact O-N 3.4Å; G24-K26 VanDerWaalsContact O-N 3.14Å; K26-R28 PolarHBondContact O-N 3Å
27	A	34	Very low	47.3	Very low	79 Å²	79	91.3 Å²	91.3	65%	0.653	51%	0.507	S	S	*	.			trans	-42.4	118.6	168.8	0	0	0	0	0	109.4	G25	G25-A27 PolarHBondContact O-N 2.95Å
28	R	38.8	Very low	49.5	Very low	181 Å²	181	93.9 Å²	93.9	68%	0.683	50%	0.504	S	S	*	.			trans	-90.8	110.8	171.2	-84.7	-176.3	169.8	174	-1.1	106.4	K26 W30	K26-R28 PolarHBondContact O-N 3Å; R28-W30 HydrophobicContact CB-CG 4.26Å; R28-W30 VanDerWaalsContact NH1-CZ2 3.32Å; R28-W30 PolarHBondContact O-N 3.34Å
29	D	43.2	Very low	51.5	Low	137 Å²	137	90 Å²	90	73%	0.733	49%	0.489	S	S	*	.			trans	-63.2	88.6	160.5	-66.4	-46.4	0	0	0	107.7	H31	D29-H31 PolarHBondContact O-N 3.37Å
30	W	55	Low	53.6	Low	113 Å²	113	84.8 Å²	84.8	43%	0.428	46%	0.462	S	S	.	.			trans	-75.4	93.7	-179.7	-84.1	113.3	0	0	0	109.9	R28 Y32 E197	R28-W30 HydrophobicContact CB-CG 4.26Å; R28-W30 VanDerWaalsContact NH1-CZ2 3.32Å; R28-W30 PolarHBondContact O-N 3.34Å; W30-Y32 HydrophobicContact CB-CE1 4.15Å; W30-Y32 HydrophobicContact CB-CE2 4.35Å; W30-Y32 VanDerWaalsContact O-CD2 3.27Å; W30-Y32 WeakPolarHBondContact O-CD2 3.47Å; W30-Y32 VanDerWaalsContact O-CE2 3.31Å; W30-Y32 WeakPolarHBondContact O-CE2 3.44Å; W30-Y32 PolarHBondContact O-N 3.47Å; W30-E197 HydrophobicContact CG-CG 4.44Å
31	H	68.4	Low	55.4	Low	97 Å²	97	85.1 Å²	85.1	45%	0.449	47%	0.465	S	S	.	.			trans	-73.1	98.6	175.1	-62.2	-60.1	0	0	0	111.3	D29 L33 P34 E103	D29-H31 PolarHBondContact O-N 3.37Å; H31-L33 PolarHBondContact O-N 3.07Å; H31-P34 HydrophobicContact CB-CG 3.45Å; H31-P34 VanDerWaalsContact CB-CG 3.45Å; H31-P34 WeakPolarHBondContact O-CD 3.5Å; H31-P34 VanDerWaalsContact O-CG 3.23Å; H31-P34 WeakPolarHBondContact O-CG 3.3Å; H31-E103 VanDerWaalsContact CA-OE1 3.27Å; H31-E103 WeakPolarHBondContact CA-OE1 3.39Å; H31-E103 IonicContact CE1-OE1 3.15Å; H31-E103 IonicContact CE1-OE2 3.74Å; H31-E103 PolarHBondContact CE1-OE2 3.31Å; H31-E103 IonicContact CG-OE1 3.38Å; H31-E103 IonicContact ND1-OE1 2.75Å; H31-E103 PolarHBondContact ND1-OE1 3.01Å; H31-E103 IonicContact ND1-OE2 2.7Å; H31-E103 PolarHBondContact ND1-OE2 3.15Å
32	Y	74.1	Confident	57.5	Low	15 Å²	15	76.6 Å²	76.6	6%	0.059	43%	0.434	C	S	.	.	H	α-helix	trans	-70.2	-29.4	-177.6	-59.2	-71.5	0	0	0	113.7	W30 T36 H107 E197 A216 A217	W30-Y32 HydrophobicContact CB-CE1 4.15Å; W30-Y32 HydrophobicContact CB-CE2 4.35Å; W30-Y32 VanDerWaalsContact O-CD2 3.27Å; W30-Y32 WeakPolarHBondContact O-CD2 3.47Å; W30-Y32 VanDerWaalsContact O-CE2 3.31Å; W30-Y32 WeakPolarHBondContact O-CE2 3.44Å; W30-Y32 PolarHBondContact O-N 3.47Å; Y32-T36 WeakPolarHBondContact O-CB 3.36Å; Y32-T36 PolarHBondContact O-N 3.22Å; Y32-T36 VanDerWaalsContact O-N 3.09Å; Y32-T36 PolarHBondContact O-OG1 3.33Å; Y32-H107 AromaticContact CD2-NE2 3.74Å; Y32-E197 PolarHBondContact OH-O 2.84Å; Y32-A216 HydrophobicContact CD2-CB 4.14Å; Y32-A216 HydrophobicContact CG-CB 4.3Å; Y32-A217 HydrophobicContact CD1-CB 4.28Å; Y32-A217 HydrophobicContact CE1-CB 3.6Å; Y32-A217 HydrophobicContact CE2-CB 4.43Å
33	L	76.6	Confident	59	Low	1 Å²	1	75.2 Å²	75.2	1%	0.005	43%	0.428	C	S	.	.	H	α-helix	trans	-63.8	-49.9	179.7	-179.2	56.9	0	0	0	113.9	H31 E35 T36 L37 P50 L52 E103 Y106	H31-L33 PolarHBondContact O-N 3.07Å; L33-E35 VanDerWaalsContact C-N 3.31Å; L33-E35 PolarHBondContact O-N 2.95Å; L33-T36 WeakPolarHBondContact O-CB 3.46Å; L33-T36 PolarHBondContact O-N 3.38Å; L33-L37 HydrophobicContact CD1-CD1 4.4Å; L33-L37 HydrophobicContact CD1-CG 4.33Å; L33-L37 HydrophobicContact CG-CD1 4.28Å; L33-L37 WeakPolarHBondContact O-CG 3.33Å; L33-L37 PolarHBondContact O-N 2.96Å; L33-P50 VanDerWaalsContact CD2-O 3.3Å; L33-P50 WeakPolarHBondContact CD2-O 3.37Å; L33-L52 HydrophobicContact CD1-CB 4.01Å; L33-E103 HydrophobicContact CD2-CB 4.4Å; L33-Y106 HydrophobicContact CB-CD1 4.27Å; L33-Y106 HydrophobicContact CB-CG 4.35Å; L33-Y106 HydrophobicContact CD1-CD2 3.96Å; L33-Y106 HydrophobicContact CD1-CG 3.93Å
34	P	75.8	Confident	60.4	Low	23 Å²	23	73 Å²	73	15%	0.149	41%	0.411	C	S	.	.	H	α-helix	trans	-62.4	-32.6	175.9	17.2	-27.5	0	0	0	114.2	H31 L37 R38 L44 P50	H31-P34 HydrophobicContact CB-CG 3.45Å; H31-P34 VanDerWaalsContact CB-CG 3.45Å; H31-P34 WeakPolarHBondContact O-CD 3.5Å; H31-P34 VanDerWaalsContact O-CG 3.23Å; H31-P34 WeakPolarHBondContact O-CG 3.3Å; P34-L37 PolarHBondContact O-N 2.89Å; P34-R38 PolarHBondContact O-N 3.42Å; P34-L44 HydrophobicContact CB-CD2 3.6Å; P34-P50 HydrophobicContact CB-CB 4.11Å; P34-P50 HydrophobicContact CB-CG 3.74Å; P34-P50 HydrophobicContact CG-CG 3.73Å
35	E	74.1	Confident	61.7	Low	46 Å²	46	72 Å²	72	22%	0.215	40%	0.4	C	S	.	.	H	α-helix	trans	-68.2	-43	175.9	-156.9	58.8	-127.4	0	0	110.7	L33 L37 R38 T39	L33-E35 VanDerWaalsContact C-N 3.31Å; L33-E35 PolarHBondContact O-N 2.95Å; E35-L37 VanDerWaalsContact C-N 3.35Å; E35-L37 PolarHBondContact O-N 3.04Å; E35-R38 WeakPolarHBondContact O-CB 3.37Å; E35-R38 PolarHBondContact O-N 3.46Å; E35-R38 IonicContact OE1-CZ 2.72Å; E35-R38 IonicContact OE1-NE 3.52Å; E35-R38 IonicContact OE1-NH1 3.46Å; E35-R38 PolarHBondContact OE1-NH1 3.24Å; E35-R38 IonicContact OE2-CZ 3.81Å; E35-R38 VanDerWaalsContact OE2-CZ 3.31Å; E35-R38 IonicContact OE2-NH1 3.31Å; E35-R38 PolarHBondContact OE2-NH1 3.39Å; E35-R38 IonicContact OE2-NH2 2.65Å; E35-T39 PolarHBondContact O-N 3.44Å; E35-T39 PolarHBondContact O-OG1 3.29Å
36	T	75.4	Confident	62.8	Low	1 Å²	1	74.1 Å²	74.1	1%	0.006	40%	0.403	C	S	.	.	H	α-helix	trans	-59.6	-42.9	172.9	-60	0	0	0	0	112	Y32 L33 R38 T39 L40 L60 Y106 L223	Y32-T36 WeakPolarHBondContact O-CB 3.36Å; Y32-T36 PolarHBondContact O-N 3.22Å; Y32-T36 VanDerWaalsContact O-N 3.09Å; Y32-T36 PolarHBondContact O-OG1 3.33Å; L33-T36 WeakPolarHBondContact O-CB 3.46Å; L33-T36 PolarHBondContact O-N 3.38Å; T36-R38 PolarHBondContact O-N 3.44Å; T36-T39 PolarHBondContact O-N 3.42Å; T36-L40 HydrophobicContact CG2-CD1 4.08Å; T36-L40 WeakPolarHBondContact O-CG 3.32Å; T36-L40 PolarHBondContact O-N 3.36Å; T36-L60 HydrophobicContact CG2-CD1 3.66Å; T36-Y106 HydrophobicContact CG2-CE2 4.02Å; T36-Y106 PolarHBondContact OG1-OH 3.13Å; T36-L223 HydrophobicContact CG2-CD1 3.92Å
37	L	77.5	Confident	63.7	Low	4 Å²	4	71.5 Å²	71.5	2%	0.021	40%	0.398	C	S	.	.	H	α-helix	trans	-63.4	-39	175.8	-71.4	169.7	0	0	0	112.3	L33 P34 E35 L40 G41 L42 L44 P50 L52	L33-L37 HydrophobicContact CD1-CD1 4.4Å; L33-L37 HydrophobicContact CD1-CG 4.33Å; L33-L37 HydrophobicContact CG-CD1 4.28Å; L33-L37 WeakPolarHBondContact O-CG 3.33Å; L33-L37 PolarHBondContact O-N 2.96Å; P34-L37 PolarHBondContact O-N 2.89Å; E35-L37 VanDerWaalsContact C-N 3.35Å; E35-L37 PolarHBondContact O-N 3.04Å; L37-L40 PolarHBondContact O-N 3.34Å; L37-G41 PolarHBondContact O-N 3.17Å; L37-L42 HydrophobicContact CD2-CB 3.98Å; L37-L42 HydrophobicContact CD2-CD1 3.84Å; L37-L42 PolarHBondContact O-N 2.81Å; L37-L44 HydrophobicContact CB-CD2 4.4Å; L37-L44 HydrophobicContact CD1-CD2 4.35Å; L37-P50 HydrophobicContact CD1-CB 3.85Å; L37-L52 HydrophobicContact CD2-CB 4.25Å; L37-L52 HydrophobicContact CD2-CD1 3.83Å
38	R	77.4	Confident	64.6	Low	144 Å²	144	77.6 Å²	77.6	54%	0.543	41%	0.413	S	S	.	.	H	α-helix	trans	-62.3	-46.6	175.1	-171.1	-174.8	-60.2	143.9	10.1	111.3	P34 E35 T36 L40 G41	P34-R38 PolarHBondContact O-N 3.42Å; E35-R38 WeakPolarHBondContact O-CB 3.37Å; E35-R38 PolarHBondContact O-N 3.46Å; E35-R38 IonicContact OE1-CZ 2.72Å; E35-R38 IonicContact OE1-NE 3.52Å; E35-R38 IonicContact OE1-NH1 3.46Å; E35-R38 PolarHBondContact OE1-NH1 3.24Å; E35-R38 IonicContact OE2-CZ 3.81Å; E35-R38 VanDerWaalsContact OE2-CZ 3.31Å; E35-R38 IonicContact OE2-NH1 3.31Å; E35-R38 PolarHBondContact OE2-NH1 3.39Å; E35-R38 IonicContact OE2-NH2 2.65Å; T36-R38 PolarHBondContact O-N 3.44Å; R38-L40 VanDerWaalsContact C-N 3.32Å; R38-L40 PolarHBondContact O-N 3.09Å; R38-G41 PolarHBondContact O-N 2.89Å
39	T	74.8	Confident	65.5	Low	50 Å²	50	77.1 Å²	77.1	31%	0.307	42%	0.416	S	S	.	.	H	α-helix	trans	-63.5	-35.2	177.5	-60.7	0	0	0	0	112.7	E35 T36 G41 L223	E35-T39 PolarHBondContact O-N 3.44Å; E35-T39 PolarHBondContact O-OG1 3.29Å; T36-T39 PolarHBondContact O-N 3.42Å; T39-G41 PolarHBondContact O-N 2.96Å; T39-L223 HydrophobicContact CG2-CB 4.14Å; T39-L223 WeakPolarHBondContact CG2-O 3.49Å
40	L	73.8	Confident	66.5	Low	34 Å²	34	72.3 Å²	72.3	18%	0.178	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-0.4	174	-66.3	173.7	0	0	0	113.9	T36 L37 R38 L42 L60 K63	T36-L40 HydrophobicContact CG2-CD1 4.08Å; T36-L40 WeakPolarHBondContact O-CG 3.32Å; T36-L40 PolarHBondContact O-N 3.36Å; L37-L40 PolarHBondContact O-N 3.34Å; R38-L40 VanDerWaalsContact C-N 3.32Å; R38-L40 PolarHBondContact O-N 3.09Å; L40-L42 HydrophobicContact CB-CD1 4.07Å; L40-L42 HydrophobicContact CB-CG 3.92Å; L40-L42 HydrophobicContact CD1-CD1 4.31Å; L40-L42 PolarHBondContact O-N 3.1Å; L40-L60 HydrophobicContact CD1-CB 4.06Å; L40-L60 HydrophobicContact CD1-CD1 4.18Å; L40-K63 HydrophobicContact CD2-CB 3.93Å; L40-K63 HydrophobicContact CD2-CG 4.05Å
41	G	69.1	Low	67.3	Low	67 Å²	67	69 Å²	69	69%	0.691	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.4	23.2	-178.5	0	0	0	0	0	114	L37 R38 T39	L37-G41 PolarHBondContact O-N 3.17Å; R38-G41 PolarHBondContact O-N 2.89Å; T39-G41 PolarHBondContact O-N 2.96Å
42	L	73.6	Confident	67.6	Low	25 Å²	25	64.4 Å²	64.4	13%	0.131	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-91	143.1	-177.7	-61.5	-178.8	0	0	0	110.9	L37 L40 L44 L52 R56	L37-L42 HydrophobicContact CD2-CB 3.98Å; L37-L42 HydrophobicContact CD2-CD1 3.84Å; L37-L42 PolarHBondContact O-N 2.81Å; L40-L42 HydrophobicContact CB-CD1 4.07Å; L40-L42 HydrophobicContact CB-CG 3.92Å; L40-L42 HydrophobicContact CD1-CD1 4.31Å; L40-L42 PolarHBondContact O-N 3.1Å; L42-L44 PolarHBondContact O-N 2.9Å; L42-L52 HydrophobicContact CD1-CD1 3.98Å; L42-R56 HydrophobicContact CD1-CB 4.44Å
43	P	64.3	Low	67.9	Low	98 Å²	98	67.5 Å²	67.5	64%	0.636	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-66.3	131	178.2	27.6	-34.2	0	0	0	110.7
44	L	61.2	Low	67.9	Low	90 Å²	90	70 Å²	70	47%	0.471	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-67.1	128.4	166.2	-66.2	155.3	0	0	0	107.9	P34 L37 L42 P50	P34-L44 HydrophobicContact CB-CD2 3.6Å; L37-L44 HydrophobicContact CB-CD2 4.4Å; L37-L44 HydrophobicContact CD1-CD2 4.35Å; L42-L44 PolarHBondContact O-N 2.9Å; L44-P50 HydrophobicContact CD2-CB 3.87Å
45	G	54.3	Low	68	Low	45 Å²	45	75 Å²	75	46%	0.464	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-58.5	152.7	-178.5	0	0	0	0	0	113	D47	G45-D47 VanDerWaalsContact C-N 3.32Å; G45-D47 PolarHBondContact O-N 3.3Å
46	S	49	Very low	68.2	Low	118 Å²	118	77 Å²	77	83%	0.825	42%	0.42	S	S	*	.	S	Bend	trans	-78.9	-0.7	-166.5	53.9	0	0	0	0	116.6
47	D	47	Very low	68.5	Low	134 Å²	134	77 Å²	77	72%	0.717	42%	0.42	S	S	*	.	S	Bend	trans	-136.9	110.1	-178.6	-71.3	-70.2	0	0	0	110.7	G45 K49	G45-D47 VanDerWaalsContact C-N 3.32Å; G45-D47 PolarHBondContact O-N 3.3Å; D47-K49 PolarHBondContact O-N 3Å
48	E	52.6	Low	68.6	Low	206 Å²	206	78 Å²	78	96%	0.963	43%	0.431	S	S	*	.	S	Bend	trans	33.4	-15.5	168.2	-68.9	-169.9	152	0	0	123.1
49	K	58.8	Low	68.8	Low	171 Å²	171	75.8 Å²	75.8	74%	0.743	43%	0.43	S	S	*	.	S	Bend	trans	-137.3	120.5	176.7	-68.9	-170.8	177.3	-174.1	0	111.5	D47	D47-K49 PolarHBondContact O-N 3Å
50	P	63.9	Low	69.3	Low	36 Å²	36	73.4 Å²	73.4	23%	0.234	42%	0.415	C	S	.	.			trans	-73.6	130.7	178.6	31	-35.3	0	0	0	111.3	L33 P34 L37 L44	L33-P50 VanDerWaalsContact CD2-O 3.3Å; L33-P50 WeakPolarHBondContact CD2-O 3.37Å; P34-P50 HydrophobicContact CB-CB 4.11Å; P34-P50 HydrophobicContact CB-CG 3.74Å; P34-P50 HydrophobicContact CG-CG 3.73Å; L37-P50 HydrophobicContact CD1-CB 3.85Å; L44-P50 HydrophobicContact CD2-CB 3.87Å
51	T	71.8	Confident	69.8	Low	43 Å²	43	72 Å²	72	26%	0.264	41%	0.408	S	S	.	.			trans	-122	145.5	178.4	56.5	0	0	0	0	112	E100 L101	T51-E100 HydrophobicContact CG2-CB 4.39Å; T51-E100 PolarHBondContact OG1-OE2 3.03Å; T51-L101 WeakPolarHBondContact CA-O 3.48Å
52	L	75	Confident	70.5	Confident	2 Å²	2	70.9 Å²	70.9	1%	0.01	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	125.7	173	174.5	66.5	0	0	0	109.9	L33 L37 L42 R56 L60 L101	L33-L52 HydrophobicContact CD1-CB 4.01Å; L37-L52 HydrophobicContact CD2-CB 4.25Å; L37-L52 HydrophobicContact CD2-CD1 3.83Å; L42-L52 HydrophobicContact CD1-CD1 3.98Å; L52-R56 HydrophobicContact CD1-CB 3.95Å; L52-L60 HydrophobicContact CD2-CD2 4.45Å; L52-L101 HydrophobicContact CB-CB 4.27Å; L52-L101 HydrophobicContact CB-CD1 4.4Å; L52-L101 HydrophobicContact CD2-CD1 4.07Å; L52-L101 HydrophobicContact CG-CD1 4.18Å; L52-L101 PolarHBondContact N-O 3.44Å; L52-L101 VanDerWaalsContact N-O 3.15Å; L52-L101 VanDerWaalsContact O-CB 3.28Å; L52-L101 WeakPolarHBondContact O-CB 3.31Å; L52-L101 WeakPolarHBondContact O-CG 3.47Å; L52-L101 PolarHBondContact O-N 2.86Å
53	Q	79.3	Confident	70.9	Confident	80 Å²	80	72.8 Å²	72.8	37%	0.374	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	133.3	174.5	-63.4	-173.8	-36.6	0	0	110.8	N55 R56	Q53-N55 WeakPolarHBondContact CB-OD1 3.49Å; Q53-N55 PolarHBondContact O-N 3.48Å; Q53-N55 VanDerWaalsContact O-N 3.11Å; Q53-R56 WeakPolarHBondContact O-CB 3.48Å; Q53-R56 PolarHBondContact O-N 3.18Å
54	K	77.8	Confident	71.9	Confident	53 Å²	53	68.2 Å²	68.2	23%	0.23	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-54.6	-32.1	-179.1	-80.2	-177	173.5	164.2	0	114.3	R56 T57 L91 D96 R98 T99 L101	K54-R56 PolarHBondContact O-N 2.87Å; K54-T57 PolarHBondContact O-N 2.88Å; K54-T57 PolarHBondContact O-OG1 2.91Å; K54-L91 HydrophobicContact CB-CD1 4.4Å; K54-L91 HydrophobicContact CG-CD1 4.39Å; K54-L91 HydrophobicContact CG-CD2 4.24Å; K54-D96 PolarHBondContact NZ-O 3.24Å; K54-R98 VanDerWaalsContact CD-O 3.24Å; K54-R98 WeakPolarHBondContact CD-O 3.43Å; K54-R98 WeakPolarHBondContact CE-O 3.33Å; K54-R98 PolarHBondContact NZ-O 3.04Å; K54-T99 PolarHBondContact N-O 2.86Å; K54-L101 HydrophobicContact CG-CD1 4.2Å; K54-L101 HydrophobicContact CG-CD2 3.81Å; K54-L101 HydrophobicContact CG-CG 3.88Å
55	N	77.3	Confident	73	Confident	129 Å²	129	64.1 Å²	64.1	69%	0.69	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-69.4	-14.6	176.6	65	-5.6	0	0	0	113.7	Q53	Q53-N55 WeakPolarHBondContact CB-OD1 3.49Å; Q53-N55 PolarHBondContact O-N 3.48Å; Q53-N55 VanDerWaalsContact O-N 3.11Å
56	R	79	Confident	74.3	Confident	88 Å²	88	66.8 Å²	66.8	33%	0.332	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-97.9	-5.7	177.3	-69.1	-179.8	-179.9	-179	-1.4	113.6	L42 L52 Q53 K54 G58 L59	L42-R56 HydrophobicContact CD1-CB 4.44Å; L52-R56 HydrophobicContact CD1-CB 3.95Å; Q53-R56 WeakPolarHBondContact O-CB 3.48Å; Q53-R56 PolarHBondContact O-N 3.18Å; K54-R56 PolarHBondContact O-N 2.87Å; R56-G58 PolarHBondContact O-N 2.89Å; R56-G58 VanDerWaalsContact O-N 3.11Å; R56-L59 HydrophobicContact CB-CD1 4.31Å; R56-L59 HydrophobicContact CG-CD1 4.29Å; R56-L59 WeakPolarHBondContact O-CB 3.22Å; R56-L59 PolarHBondContact O-N 3.37Å
57	T	80.3	Confident	75.8	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-57.9	-25.4	176	-52.4	0	0	0	0	112.7	K54 L59 L60 I61 L91	K54-T57 PolarHBondContact O-N 2.88Å; K54-T57 PolarHBondContact O-OG1 2.91Å; T57-L59 PolarHBondContact O-N 3.28Å; T57-L60 WeakPolarHBondContact O-CB 3.17Å; T57-L60 PolarHBondContact O-N 3.04Å; T57-I61 HydrophobicContact CG2-CD1 4.3Å; T57-I61 WeakPolarHBondContact O-CG1 3.26Å; T57-I61 PolarHBondContact O-N 3.07Å; T57-L91 HydrophobicContact CG2-CD2 4.46Å; T57-L91 HydrophobicContact CG2-CG 4.49Å
58	G	80.3	Confident	77.4	Confident	24 Å²	24	56 Å²	56	25%	0.247	28%	0.277	C	S	.	.	H	α-helix	trans	-61.1	-37.8	170.8	0	0	0	0	0	114	R56 L60 I61 T62	R56-G58 PolarHBondContact O-N 2.89Å; R56-G58 VanDerWaalsContact O-N 3.11Å; G58-L60 VanDerWaalsContact C-N 3.35Å; G58-L60 PolarHBondContact O-N 3.22Å; G58-I61 PolarHBondContact O-N 3.27Å; G58-T62 PolarHBondContact O-N 2.8Å; G58-T62 PolarHBondContact O-OG1 3.27Å
59	L	82.3	Confident	78.6	Confident	98 Å²	98	48.9 Å²	48.9	51%	0.513	24%	0.244	S	C	.	.	H	α-helix	trans	-65.5	-39.3	178.7	-65	169	0	0	0	111.7	R56 T57 K63	R56-L59 HydrophobicContact CB-CD1 4.31Å; R56-L59 HydrophobicContact CG-CD1 4.29Å; R56-L59 WeakPolarHBondContact O-CB 3.22Å; R56-L59 PolarHBondContact O-N 3.37Å; T57-L59 PolarHBondContact O-N 3.28Å; L59-K63 VanDerWaalsContact O-CB 3.29Å; L59-K63 WeakPolarHBondContact O-CB 3.43Å; L59-K63 PolarHBondContact O-N 2.92Å
60	L	83.7	Confident	79.4	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-58.9	-49.6	173.7	173.9	65.4	0	0	0	110.9	T36 L40 L52 T57 G58 L64 Y106 L113 L223	T36-L60 HydrophobicContact CG2-CD1 3.66Å; L40-L60 HydrophobicContact CD1-CB 4.06Å; L40-L60 HydrophobicContact CD1-CD1 4.18Å; L52-L60 HydrophobicContact CD2-CD2 4.45Å; T57-L60 WeakPolarHBondContact O-CB 3.17Å; T57-L60 PolarHBondContact O-N 3.04Å; G58-L60 VanDerWaalsContact C-N 3.35Å; G58-L60 PolarHBondContact O-N 3.22Å; L60-L64 VanDerWaalsContact O-CB 3.22Å; L60-L64 WeakPolarHBondContact O-CB 3.48Å; L60-L64 PolarHBondContact O-N 3.28Å; L60-Y106 HydrophobicContact CD2-CE2 3.88Å; L60-L113 HydrophobicContact CD2-CD1 3.92Å; L60-L113 HydrophobicContact CG-CD1 4.31Å; L60-L223 HydrophobicContact CD1-CD1 3.52Å
61	I	84.4	Confident	79.6	Confident	5 Å²	5	40.1 Å²	40.1	3%	0.026	21%	0.206	C	C	.	.	H	α-helix	trans	-65.5	-47.4	-178.8	-65.8	167.2	0	0	0	111.3	T57 G58 K63 L64 L65 L85 P87 A90 L113	T57-I61 HydrophobicContact CG2-CD1 4.3Å; T57-I61 WeakPolarHBondContact O-CG1 3.26Å; T57-I61 PolarHBondContact O-N 3.07Å; G58-I61 PolarHBondContact O-N 3.27Å; I61-K63 PolarHBondContact O-N 2.77Å; I61-L64 PolarHBondContact O-N 3.5Å; I61-L65 HydrophobicContact CG2-CD1 3.8Å; I61-L65 HydrophobicContact CG2-CG 4.27Å; I61-L65 WeakPolarHBondContact O-CB 3.27Å; I61-L65 WeakPolarHBondContact O-CG 3.45Å; I61-L65 PolarHBondContact O-N 3.36Å; I61-L85 HydrophobicContact CG2-CB 4.37Å; I61-L85 HydrophobicContact CG2-CD2 4.15Å; I61-L85 HydrophobicContact CG2-CG 3.99Å; I61-L85 WeakPolarHBondContact CG2-O 3.32Å; I61-P87 HydrophobicContact CD1-CB 4.35Å; I61-P87 HydrophobicContact CD1-CG 4.15Å; I61-A90 HydrophobicContact CD1-CB 3.84Å; I61-L113 HydrophobicContact CG1-CD2 3.94Å
62	T	83.8	Confident	79.4	Confident	44 Å²	44	45.5 Å²	45.5	27%	0.27	23%	0.228	S	C	.	.	H	α-helix	trans	-60	-44.2	178.4	-64.4	0	0	0	0	111.7	G58 L65 Q66 E82	G58-T62 PolarHBondContact O-N 2.8Å; G58-T62 PolarHBondContact O-OG1 3.27Å; T62-L65 PolarHBondContact O-N 3.28Å; T62-Q66 WeakPolarHBondContact O-CG 3.43Å; T62-Q66 PolarHBondContact O-N 3.25Å; T62-Q66 VanDerWaalsContact O-N 3.12Å; T62-E82 WeakPolarHBondContact CG2-OE1 3.45Å
63	K	83.3	Confident	79	Confident	64 Å²	64	52.1 Å²	52.1	28%	0.278	25%	0.253	S	S	.	.	H	α-helix	trans	-63.6	-45.9	177.3	177.4	54.6	174.5	135.2	0	111.6	L40 L59 I61 L65 Q66 D67 L223	L40-K63 HydrophobicContact CD2-CB 3.93Å; L40-K63 HydrophobicContact CD2-CG 4.05Å; L59-K63 VanDerWaalsContact O-CB 3.29Å; L59-K63 WeakPolarHBondContact O-CB 3.43Å; L59-K63 PolarHBondContact O-N 2.92Å; I61-K63 PolarHBondContact O-N 2.77Å; K63-L65 PolarHBondContact O-N 2.95Å; K63-Q66 WeakPolarHBondContact O-CB 3.47Å; K63-Q66 PolarHBondContact O-N 3.4Å; K63-D67 WeakPolarHBondContact CD-OD2 3.44Å; K63-D67 WeakPolarHBondContact CE-OD2 3.48Å; K63-D67 IonicContact NZ-OD1 3.88Å; K63-D67 PolarHBondContact NZ-OD1 3.24Å; K63-D67 IonicContact NZ-OD2 2.67Å; K63-D67 PolarHBondContact NZ-OD2 2.98Å; K63-D67 PolarHBondContact O-N 3.24Å; K63-L223 HydrophobicContact CB-CD2 4.4Å; K63-L223 HydrophobicContact CG-CD2 3.8Å
64	L	85.2	Confident	78.1	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-60.7	-44	178.1	-173.6	61.9	0	0	0	112.5	L60 I61 Q66 D67 V68 L113 I117 I219 I222 L223	L60-L64 VanDerWaalsContact O-CB 3.22Å; L60-L64 WeakPolarHBondContact O-CB 3.48Å; L60-L64 PolarHBondContact O-N 3.28Å; I61-L64 PolarHBondContact O-N 3.5Å; L64-Q66 VanDerWaalsContact C-N 3.29Å; L64-Q66 PolarHBondContact O-N 3.03Å; L64-D67 PolarHBondContact O-N 3.31Å; L64-V68 WeakPolarHBondContact O-CG2 3.36Å; L64-V68 PolarHBondContact O-N 3.49Å; L64-V68 VanDerWaalsContact O-N 3.09Å; L64-L113 HydrophobicContact CD2-CB 3.95Å; L64-L113 HydrophobicContact CD2-CD1 3.94Å; L64-L113 HydrophobicContact CD2-CD2 4.38Å; L64-L113 HydrophobicContact CD2-CG 4.3Å; L64-I117 HydrophobicContact CD1-CD1 3.89Å; L64-I117 HydrophobicContact CD2-CD1 3.96Å; L64-I117 HydrophobicContact CG-CD1 3.93Å; L64-I219 HydrophobicContact CD1-CD1 4.28Å; L64-I219 HydrophobicContact CD1-CG2 4.27Å; L64-I219 HydrophobicContact CD2-CD1 4.1Å; L64-I219 HydrophobicContact CD2-CG2 4.28Å; L64-I222 HydrophobicContact CD1-CB 4.31Å; L64-I222 HydrophobicContact CD1-CG2 3.69Å; L64-L223 HydrophobicContact CB-CD2 4.11Å; L64-L223 HydrophobicContact CD1-CD2 4.08Å; L64-L223 HydrophobicContact CD1-CG 4.23Å
65	L	83.3	Confident	77.1	Confident	5 Å²	5	50.5 Å²	50.5	3%	0.026	27%	0.268	C	S	.	.	H	α-helix	trans	-65.9	-28.7	176.9	-72.2	174.5	0	0	0	113.3	I61 T62 K63 C70 L120	I61-L65 HydrophobicContact CG2-CD1 3.8Å; I61-L65 HydrophobicContact CG2-CG 4.27Å; I61-L65 WeakPolarHBondContact O-CB 3.27Å; I61-L65 WeakPolarHBondContact O-CG 3.45Å; I61-L65 PolarHBondContact O-N 3.36Å; T62-L65 PolarHBondContact O-N 3.28Å; K63-L65 PolarHBondContact O-N 2.95Å; L65-C70 HydrophobicContact CD2-CB 4.34Å; L65-C70 WeakPolarHBondContact O-CB 3.33Å; L65-C70 PolarHBondContact O-N 3.03Å; L65-C70 VanDerWaalsContact O-N 3.16Å; L65-L120 HydrophobicContact CD2-CD1 4.38Å
66	Q	81.8	Confident	76.5	Confident	101 Å²	101	47.5 Å²	47.5	47%	0.472	25%	0.249	S	C	.	.	H	α-helix	trans	-71.3	-45.7	171.2	-72.8	172	-3.8	0	0	111.4	T62 K63 L64 V68 H69	T62-Q66 WeakPolarHBondContact O-CG 3.43Å; T62-Q66 PolarHBondContact O-N 3.25Å; T62-Q66 VanDerWaalsContact O-N 3.12Å; K63-Q66 WeakPolarHBondContact O-CB 3.47Å; K63-Q66 PolarHBondContact O-N 3.4Å; L64-Q66 VanDerWaalsContact C-N 3.29Å; L64-Q66 PolarHBondContact O-N 3.03Å; Q66-V68 VanDerWaalsContact C-N 3.33Å; Q66-V68 PolarHBondContact O-N 3.12Å; Q66-H69 WeakPolarHBondContact O-CA 3.46Å; Q66-H69 PolarHBondContact O-N 3.06Å
67	D	80.6	Confident	75.8	Confident	25 Å²	25	47.6 Å²	47.6	13%	0.134	26%	0.259	C	S	.	.	H	α-helix	trans	-66.6	-33.3	-177.8	-67.1	-34.3	0	0	0	112.5	K63 L64 H69 Y176 I222	K63-D67 WeakPolarHBondContact CD-OD2 3.44Å; K63-D67 WeakPolarHBondContact CE-OD2 3.48Å; K63-D67 IonicContact NZ-OD1 3.88Å; K63-D67 PolarHBondContact NZ-OD1 3.24Å; K63-D67 IonicContact NZ-OD2 2.67Å; K63-D67 PolarHBondContact NZ-OD2 2.98Å; K63-D67 PolarHBondContact O-N 3.24Å; L64-D67 PolarHBondContact O-N 3.31Å; D67-H69 PolarHBondContact O-N 3.41Å; D67-H69 PolarHBondContact O-ND1 3.18Å; D67-Y176 WeakPolarHBondContact O-CD2 3.19Å; D67-I222 HydrophobicContact CB-CG2 4.24Å
68	V	80.5	Confident	75.1	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	12.9	170.5	-51.9	0	0	0	0	114.2	L64 Q66 C70 I117 H175 Y176 I222	L64-V68 WeakPolarHBondContact O-CG2 3.36Å; L64-V68 PolarHBondContact O-N 3.49Å; L64-V68 VanDerWaalsContact O-N 3.09Å; Q66-V68 VanDerWaalsContact C-N 3.33Å; Q66-V68 PolarHBondContact O-N 3.12Å; V68-C70 HydrophobicContact CG2-CB 4.49Å; V68-C70 PolarHBondContact O-N 3.16Å; V68-C70 VanDerWaalsContact O-N 3.11Å; V68-I117 HydrophobicContact CG1-CD1 4.26Å; V68-I117 HydrophobicContact CG1-CG1 4.4Å; V68-I117 HydrophobicContact CG1-CG2 4.26Å; V68-H175 VanDerWaalsContact O-O 3.1Å; V68-Y176 HydrophobicContact CG1-CD2 4.36Å; V68-I222 HydrophobicContact CG1-CG2 4.15Å
69	H	77.3	Confident	74.4	Confident	56 Å²	56	54.2 Å²	54.2	26%	0.259	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.8	41.3	173.9	-63.3	69	0	0	0	113.8	Q66 D67 A71 E72 R73 N177	Q66-H69 WeakPolarHBondContact O-CA 3.46Å; Q66-H69 PolarHBondContact O-N 3.06Å; D67-H69 PolarHBondContact O-N 3.41Å; D67-H69 PolarHBondContact O-ND1 3.18Å; H69-A71 VanDerWaalsContact C-N 3.34Å; H69-A71 PolarHBondContact O-N 3.34Å; H69-E72 IonicContact CD2-OE2 3.86Å; H69-E72 PolarHBondContact O-N 3.13Å; H69-E72 VanDerWaalsContact O-N 3.16Å; H69-R73 PolarHBondContact O-N 2.82Å; H69-R73 VanDerWaalsContact O-N 3.13Å; H69-N177 PolarHBondContact CE1-O 3.35Å
70	C	76.4	Confident	73.7	Confident	1 Å²	1	53 Å²	53	1%	0.007	28%	0.28	C	S	.	.	H	α-helix	trans	-54	-45.9	-167.5	176.2	0	0	0	0	113.2	L65 V68 T74 C81 L120	L65-C70 HydrophobicContact CD2-CB 4.34Å; L65-C70 WeakPolarHBondContact O-CB 3.33Å; L65-C70 PolarHBondContact O-N 3.03Å; L65-C70 VanDerWaalsContact O-N 3.16Å; V68-C70 HydrophobicContact CG2-CB 4.49Å; V68-C70 PolarHBondContact O-N 3.16Å; V68-C70 VanDerWaalsContact O-N 3.11Å; C70-T74 WeakPolarHBondContact O-CB 3.35Å; C70-T74 WeakPolarHBondContact O-CG2 3.48Å; C70-T74 PolarHBondContact O-N 2.87Å; C70-T74 PolarHBondContact O-OG1 2.84Å; C70-C81 HydrophobicContact CB-CB 3.83Å; C70-C81 WeakPolarHBondContact CB-SG 3.46Å; C70-C81 WeakPolarHBondContact SG-CB 3.43Å; C70-C81 CovalentContact SG-SG 2.04Å; C70-C81 PolarHBondContact SG-SG 2.96Å; C70-L120 HydrophobicContact CB-CD2 4.23Å
71	A	69.3	Low	73	Confident	22 Å²	22	53.1 Å²	53.1	18%	0.182	28%	0.28	C	S	.	.	H	α-helix	trans	-61.1	-46.4	-179.1	0	0	0	0	0	112.8	H69 G75 F76 C81	H69-A71 VanDerWaalsContact C-N 3.34Å; H69-A71 PolarHBondContact O-N 3.34Å; A71-G75 PolarHBondContact O-N 3Å; A71-F76 WeakPolarHBondContact CA-O 3.33Å; A71-F76 WeakPolarHBondContact CB-O 3.16Å; A71-F76 PolarHBondContact O-N 3.44Å; A71-C81 PolarHBondContact N-SG 3.38Å
72	E	67.1	Low	72.4	Confident	157 Å²	157	56.6 Å²	56.6	73%	0.734	30%	0.296	S	S	*	.	H	α-helix	trans	-69.2	-38.1	-177.4	-61.7	-173.7	167.4	0	0	112.6	H69	H69-E72 IonicContact CD2-OE2 3.86Å; H69-E72 PolarHBondContact O-N 3.13Å; H69-E72 VanDerWaalsContact O-N 3.16Å
73	R	65.6	Low	71.8	Confident	141 Å²	141	61.5 Å²	61.5	53%	0.532	31%	0.314	S	S	.	.	H	α-helix	trans	-81.1	-27.3	-177.1	-72.1	-63.4	-157.5	168.8	8.3	114.1	H69 Q174	H69-R73 PolarHBondContact O-N 2.82Å; H69-R73 VanDerWaalsContact O-N 3.13Å; R73-Q174 PolarHBondContact NH2-O 3.29Å
74	T	60.6	Low	71.4	Confident	27 Å²	27	59.7 Å²	59.7	17%	0.166	31%	0.309	C	S	.	.	H	α-helix	trans	-96.9	-16.8	179.2	62	0	0	0	0	113.5	C70 F76 L120	C70-T74 WeakPolarHBondContact O-CB 3.35Å; C70-T74 WeakPolarHBondContact O-CG2 3.48Å; C70-T74 PolarHBondContact O-N 2.87Å; C70-T74 PolarHBondContact O-OG1 2.84Å; T74-F76 VanDerWaalsContact C-N 3.33Å; T74-F76 WeakPolarHBondContact OG1-CD2 3.37Å; T74-L120 HydrophobicContact CG2-CD2 4.21Å; T74-L120 HydrophobicContact CG2-CG 4.4Å
75	G	58.1	Low	71.2	Confident	72 Å²	72	59.9 Å²	59.9	74%	0.742	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.7	12.8	-177	0	0	0	0	0	114.2	A71	A71-G75 PolarHBondContact O-N 3Å
76	F	63.6	Low	71.1	Confident	66 Å²	66	61.9 Å²	61.9	29%	0.289	32%	0.322	S	S	.	.			trans	-100.4	165.9	179.7	-65.6	-58	0	0	0	112.8	A71 T74 M80 V125	A71-F76 WeakPolarHBondContact CA-O 3.33Å; A71-F76 WeakPolarHBondContact CB-O 3.16Å; A71-F76 PolarHBondContact O-N 3.44Å; T74-F76 VanDerWaalsContact C-N 3.33Å; T74-F76 WeakPolarHBondContact OG1-CD2 3.37Å; F76-M80 HydrophobicContact CB-CB 4.03Å; F76-M80 HydrophobicContact CD1-SD 4.11Å; F76-M80 HydrophobicContact CG-CB 4.39Å; F76-V125 HydrophobicContact CE2-CG2 3.92Å; F76-V125 HydrophobicContact CZ-CG2 4.35Å
77	T	65.3	Low	71.1	Confident	89 Å²	89	59.3 Å²	59.3	55%	0.546	32%	0.315	S	S	.	.			trans	-74.5	155.1	166.7	58.6	0	0	0	0	111.1	D79 M80 C81	T77-D79 PolarHBondContact O-N 3.22Å; T77-D79 VanDerWaalsContact O-N 3.17Å; T77-M80 PolarHBondContact O-N 3.19Å; T77-C81 PolarHBondContact O-N 2.82Å
78	Q	65.4	Low	71	Confident	58 Å²	58	64.4 Å²	64.4	27%	0.271	34%	0.341	S	S	.	.	H	α-helix	trans	-50.1	-41.9	178.2	-170.1	68.8	11.9	0	0	112.2	M80 C81 E82	Q78-M80 PolarHBondContact O-N 3.36Å; Q78-M80 VanDerWaalsContact O-N 3.1Å; Q78-C81 WeakPolarHBondContact O-CB 3.4Å; Q78-C81 PolarHBondContact O-N 2.9Å; Q78-C81 VanDerWaalsContact O-N 3.08Å; Q78-E82 PolarHBondContact O-N 3.06Å
79	D	65.5	Low	71	Confident	105 Å²	105	66 Å²	66	56%	0.561	35%	0.352	S	S	*	.	H	α-helix	trans	-59.9	-18.1	178	-53.9	-11.5	0	0	0	115.1	T77 K83	T77-D79 PolarHBondContact O-N 3.22Å; T77-D79 VanDerWaalsContact O-N 3.17Å; D79-K83 VanDerWaalsContact O-CD 3.28Å; D79-K83 WeakPolarHBondContact O-CD 3.26Å; D79-K83 VanDerWaalsContact O-CE 3.31Å; D79-K83 WeakPolarHBondContact O-CE 3.36Å; D79-K83 WeakPolarHBondContact O-CG 3.22Å
80	M	66.4	Low	71.2	Confident	74 Å²	74	63.4 Å²	63.4	37%	0.365	34%	0.339	S	S	.	.	H	α-helix	trans	-92.8	-34.7	174.8	-59.7	-151.8	73.7	0	0	111.6	F76 T77 Q78 E82 K83 C84	F76-M80 HydrophobicContact CB-CB 4.03Å; F76-M80 HydrophobicContact CD1-SD 4.11Å; F76-M80 HydrophobicContact CG-CB 4.39Å; T77-M80 PolarHBondContact O-N 3.19Å; Q78-M80 PolarHBondContact O-N 3.36Å; Q78-M80 VanDerWaalsContact O-N 3.1Å; M80-E82 VanDerWaalsContact C-N 3.34Å; M80-K83 PolarHBondContact O-N 3.46Å; M80-C84 PolarHBondContact O-N 3.17Å
81	C	70.3	Confident	71.5	Confident	2 Å²	2	64.8 Å²	64.8	1%	0.014	35%	0.347	C	S	.	.	H	α-helix	trans	-60.1	-43.6	169.8	-78.3	0	0	0	0	111.7	C70 A71 T77 Q78 K83 C84	C70-C81 HydrophobicContact CB-CB 3.83Å; C70-C81 WeakPolarHBondContact CB-SG 3.46Å; C70-C81 WeakPolarHBondContact SG-CB 3.43Å; C70-C81 CovalentContact SG-SG 2.04Å; C70-C81 PolarHBondContact SG-SG 2.96Å; A71-C81 PolarHBondContact N-SG 3.38Å; T77-C81 PolarHBondContact O-N 2.82Å; Q78-C81 WeakPolarHBondContact O-CB 3.4Å; Q78-C81 PolarHBondContact O-N 2.9Å; Q78-C81 VanDerWaalsContact O-N 3.08Å; C81-K83 PolarHBondContact O-N 3.02Å; C81-C84 WeakPolarHBondContact O-CB 3.33Å; C81-C84 PolarHBondContact O-N 3.07Å
82	E	70.1	Confident	72	Confident	77 Å²	77	66.3 Å²	66.3	36%	0.36	36%	0.356	S	S	.	.	H	α-helix	trans	-66.3	-16.4	177	-66.9	-173.4	175.2	0	0	114	T62 Q78 M80	T62-E82 WeakPolarHBondContact CG2-OE1 3.45Å; Q78-E82 PolarHBondContact O-N 3.06Å; M80-E82 VanDerWaalsContact C-N 3.34Å
83	K	72.5	Confident	72.6	Confident	148 Å²	148	59.5 Å²	59.5	64%	0.643	33%	0.325	S	S	*	.	H	α-helix	trans	-87.4	-20.3	172.7	-70.8	169.3	-171.7	163.9	0	113.4	D79 M80 C81	D79-K83 VanDerWaalsContact O-CD 3.28Å; D79-K83 WeakPolarHBondContact O-CD 3.26Å; D79-K83 VanDerWaalsContact O-CE 3.31Å; D79-K83 WeakPolarHBondContact O-CE 3.36Å; D79-K83 WeakPolarHBondContact O-CG 3.22Å; M80-K83 PolarHBondContact O-N 3.46Å; C81-K83 PolarHBondContact O-N 3.02Å
84	C	75.4	Confident	73.3	Confident	25 Å²	25	54 Å²	54	17%	0.169	31%	0.306	C	S	.	.	H	α-helix	trans	-71	-40.6	-179.6	-175.1	0	0	0	0	112.1	M80 C81 Y116 C124	M80-C84 PolarHBondContact O-N 3.17Å; C81-C84 WeakPolarHBondContact O-CB 3.33Å; C81-C84 PolarHBondContact O-N 3.07Å; C84-Y116 WeakPolarHBondContact O-CE1 3.29Å; C84-C124 HydrophobicContact CB-CB 3.74Å; C84-C124 WeakPolarHBondContact CB-SG 3.41Å; C84-C124 WeakPolarHBondContact SG-CA 3.48Å; C84-C124 WeakPolarHBondContact SG-CB 3.45Å; C84-C124 CovalentContact SG-SG 2.03Å; C84-C124 PolarHBondContact SG-SG 2.92Å
85	L	80.5	Confident	73.6	Confident	6 Å²	6	60.9 Å²	60.9	3%	0.031	34%	0.342	C	S	.	.	S	Bend	trans	-125.8	105.5	179.4	178.9	56.5	0	0	0	109.6	I61 V89 L113 Y116	I61-L85 HydrophobicContact CG2-CB 4.37Å; I61-L85 HydrophobicContact CG2-CD2 4.15Å; I61-L85 HydrophobicContact CG2-CG 3.99Å; I61-L85 WeakPolarHBondContact CG2-O 3.32Å; L85-V89 HydrophobicContact CD1-CG1 4.43Å; L85-L113 HydrophobicContact CD2-CD2 3.8Å; L85-L113 HydrophobicContact CG-CD2 4.49Å; L85-Y116 HydrophobicContact CB-CD1 4.19Å; L85-Y116 HydrophobicContact CD1-CD1 4.13Å; L85-Y116 HydrophobicContact CD1-CD2 3.92Å; L85-Y116 HydrophobicContact CD1-CE1 4.44Å; L85-Y116 HydrophobicContact CD1-CE2 4.25Å; L85-Y116 HydrophobicContact CD1-CG 3.87Å; L85-Y116 HydrophobicContact CD2-CG 4.38Å; L85-Y116 HydrophobicContact CG-CG 4.49Å
86	T	81.3	Confident	74.1	Confident	48 Å²	48	60.4 Å²	60.4	29%	0.294	32%	0.322	S	S	.	.			trans	-100.5	154.4	179.7	66.2	0	0	0	0	111.6	N88 V89 A90	T86-N88 PolarHBondContact O-N 2.97Å; T86-N88 VanDerWaalsContact O-N 3.14Å; T86-V89 PolarHBondContact O-N 3.28Å; T86-A90 PolarHBondContact O-N 3.47Å; T86-A90 VanDerWaalsContact O-N 3.16Å
87	P	80.9	Confident	74.1	Confident	47 Å²	47	65 Å²	65	31%	0.305	35%	0.35	S	S	.	.	H	α-helix	trans	-54.2	-33.5	175.9	-27.2	34.9	0	0	0	113.6	I61 V89 A90 L91	I61-P87 HydrophobicContact CD1-CB 4.35Å; I61-P87 HydrophobicContact CD1-CG 4.15Å; P87-V89 VanDerWaalsContact C-N 3.32Å; P87-V89 PolarHBondContact O-N 3.39Å; P87-A90 PolarHBondContact O-N 3.5Å; P87-L91 VanDerWaalsContact O-CB 3.3Å; P87-L91 WeakPolarHBondContact O-CB 3.17Å; P87-L91 WeakPolarHBondContact O-CG 3.29Å; P87-L91 PolarHBondContact O-N 2.89Å
88	N	79.1	Confident	74.6	Confident	131 Å²	131	66.5 Å²	66.5	70%	0.701	35%	0.345	S	S	*	.	H	α-helix	trans	-65.3	-34.1	178.8	-63.8	-13.2	0	0	0	112.7	T86 S92	T86-N88 PolarHBondContact O-N 2.97Å; T86-N88 VanDerWaalsContact O-N 3.14Å; N88-S92 WeakPolarHBondContact O-CB 3.37Å; N88-S92 PolarHBondContact O-N 2.91Å
89	V	80.1	Confident	75.1	Confident	35 Å²	35	68.9 Å²	68.9	21%	0.212	36%	0.364	C	S	.	.	H	α-helix	trans	-75.7	-42.8	175.8	173.7	0	0	0	0	110.5	L85 T86 P87 L91 S92 V112 Y116	L85-V89 HydrophobicContact CD1-CG1 4.43Å; T86-V89 PolarHBondContact O-N 3.28Å; P87-V89 VanDerWaalsContact C-N 3.32Å; P87-V89 PolarHBondContact O-N 3.39Å; V89-L91 PolarHBondContact O-N 3.22Å; V89-S92 PolarHBondContact O-N 2.65Å; V89-S92 PolarHBondContact O-OG 2.88Å; V89-V112 HydrophobicContact CG1-CG1 4.42Å; V89-Y116 HydrophobicContact CG1-CE2 3.83Å
90	A	81	Confident	75.6	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-61.6	-33.6	175.9	0	0	0	0	0	112.6	I61 T86 P87 I109 L113	I61-A90 HydrophobicContact CD1-CB 3.84Å; T86-A90 PolarHBondContact O-N 3.47Å; T86-A90 VanDerWaalsContact O-N 3.16Å; P87-A90 PolarHBondContact O-N 3.5Å; A90-I109 HydrophobicContact CB-CG2 4.24Å; A90-L113 HydrophobicContact CB-CD2 4.12Å
91	L	83.2	Confident	76.3	Confident	31 Å²	31	64.9 Å²	64.9	16%	0.162	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-6.9	179.1	-66.1	171.1	0	0	0	114.2	K54 T57 P87 V89 V93 L94 L101 I109	K54-L91 HydrophobicContact CB-CD1 4.4Å; K54-L91 HydrophobicContact CG-CD1 4.39Å; K54-L91 HydrophobicContact CG-CD2 4.24Å; T57-L91 HydrophobicContact CG2-CD2 4.46Å; T57-L91 HydrophobicContact CG2-CG 4.49Å; P87-L91 VanDerWaalsContact O-CB 3.3Å; P87-L91 WeakPolarHBondContact O-CB 3.17Å; P87-L91 WeakPolarHBondContact O-CG 3.29Å; P87-L91 PolarHBondContact O-N 2.89Å; V89-L91 PolarHBondContact O-N 3.22Å; L91-V93 PolarHBondContact O-N 3.1Å; L91-L94 HydrophobicContact CD2-CD1 3.94Å; L91-L94 PolarHBondContact O-N 2.89Å; L91-L101 HydrophobicContact CD2-CD1 4.12Å; L91-L101 HydrophobicContact CD2-CD2 4.07Å; L91-I109 HydrophobicContact CD2-CD1 3.87Å; L91-I109 HydrophobicContact CD2-CG1 4.42Å
92	S	80.2	Confident	76.9	Confident	54 Å²	54	67 Å²	67	38%	0.378	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-2	-173.6	73.7	0	0	0	0	115.1	N88 V89	N88-S92 WeakPolarHBondContact O-CB 3.37Å; N88-S92 PolarHBondContact O-N 2.91Å; V89-S92 PolarHBondContact O-N 2.65Å; V89-S92 PolarHBondContact O-OG 2.88Å
93	V	78.7	Confident	77.4	Confident	14 Å²	14	66.1 Å²	66.1	9%	0.085	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	8.4	179	-174.1	0	0	0	0	111.2	L91 K108 V112 L141 Y144	L91-V93 PolarHBondContact O-N 3.1Å; V93-K108 HydrophobicContact CG1-CB 4.46Å; V93-V112 HydrophobicContact CB-CG2 4.28Å; V93-V112 HydrophobicContact CG2-CG2 3.53Å; V93-L141 HydrophobicContact CG1-CB 3.7Å; V93-L141 HydrophobicContact CG1-CD1 3.68Å; V93-L141 HydrophobicContact CG1-CG 4.23Å; V93-Y144 HydrophobicContact CG2-CD2 4.32Å; V93-Y144 HydrophobicContact CG2-CE2 3.79Å
94	L	81.1	Confident	77.9	Confident	26 Å²	26	64.7 Å²	64.7	14%	0.136	35%	0.346	C	S	.	.			trans	-113.3	119.9	176.5	-55.5	179.5	0	0	0	110.3	L91 D96 L101 D105 K108 I109	L91-L94 HydrophobicContact CD2-CD1 3.94Å; L91-L94 PolarHBondContact O-N 2.89Å; L94-D96 PolarHBondContact O-N 2.84Å; L94-L101 HydrophobicContact CD1-CD2 3.37Å; L94-D105 HydrophobicContact CD1-CB 4.06Å; L94-D105 HydrophobicContact CD2-CB 3.87Å; L94-K108 HydrophobicContact CD2-CB 4.05Å; L94-K108 HydrophobicContact CD2-CD 3.94Å; L94-I109 HydrophobicContact CD1-CD1 3.99Å; L94-I109 HydrophobicContact CD1-CG1 4.17Å
95	D	67.9	Low	78.3	Confident	170 Å²	170	64.1 Å²	64.1	91%	0.909	34%	0.341	S	S	*	.			trans	-82.4	12.3	-179.6	-61.5	-51.7	0	0	0	114.1
96	D	66.6	Low	78.6	Confident	63 Å²	63	63.9 Å²	63.9	34%	0.337	34%	0.34	S	S	.	.			trans	-123.3	132.7	-163.3	-163.1	-44.2	0	0	0	112.6	K54 L94 R98	K54-D96 PolarHBondContact NZ-O 3.24Å; L94-D96 PolarHBondContact O-N 2.84Å; D96-R98 VanDerWaalsContact C-N 3.31Å; D96-R98 VanDerWaalsContact CG-NE 3.29Å; D96-R98 PolarHBondContact O-N 3.48Å; D96-R98 VanDerWaalsContact OD1-CB 3.31Å; D96-R98 WeakPolarHBondContact OD1-CB 3.17Å; D96-R98 VanDerWaalsContact OD1-CG 3.25Å; D96-R98 WeakPolarHBondContact OD1-CG 3.46Å; D96-R98 PolarHBondContact OD1-N 3.24Å; D96-R98 IonicContact OD1-NE 2.88Å; D96-R98 PolarHBondContact OD1-NE 3.04Å; D96-R98 IonicContact OD2-CZ 2.76Å; D96-R98 IonicContact OD2-NE 3.94Å; D96-R98 PolarHBondContact OD2-NE 3.01Å; D96-R98 IonicContact OD2-NH2 3.5Å; D96-R98 PolarHBondContact OD2-NH2 3.27Å
97	D	65.3	Low	78.9	Confident	163 Å²	163	62.8 Å²	62.8	87%	0.872	33%	0.331	S	S	*	.			trans	-76.1	-8.3	178.6	-80	-36.6	0	0	0	114.5	T99	D97-T99 PolarHBondContact O-N 3.31Å
98	R	75.9	Confident	79.2	Confident	119 Å²	119	62.9 Å²	62.9	45%	0.449	33%	0.327	S	S	.	.			trans	-46	135.2	178.2	-86.4	-177.7	-74.3	150.6	3.1	112.7	K54 D96 E100	K54-R98 VanDerWaalsContact CD-O 3.24Å; K54-R98 WeakPolarHBondContact CD-O 3.43Å; K54-R98 WeakPolarHBondContact CE-O 3.33Å; K54-R98 PolarHBondContact NZ-O 3.04Å; D96-R98 VanDerWaalsContact C-N 3.31Å; D96-R98 VanDerWaalsContact CG-NE 3.29Å; D96-R98 PolarHBondContact O-N 3.48Å; D96-R98 VanDerWaalsContact OD1-CB 3.31Å; D96-R98 WeakPolarHBondContact OD1-CB 3.17Å; D96-R98 VanDerWaalsContact OD1-CG 3.25Å; D96-R98 WeakPolarHBondContact OD1-CG 3.46Å; D96-R98 PolarHBondContact OD1-N 3.24Å; D96-R98 IonicContact OD1-NE 2.88Å; D96-R98 PolarHBondContact OD1-NE 3.04Å; D96-R98 IonicContact OD2-CZ 2.76Å; D96-R98 IonicContact OD2-NE 3.94Å; D96-R98 PolarHBondContact OD2-NE 3.01Å; D96-R98 IonicContact OD2-NH2 3.5Å; D96-R98 PolarHBondContact OD2-NH2 3.27Å; R98-E100 VanDerWaalsContact C-N 3.28Å; R98-E100 PolarHBondContact O-N 3.42Å
99	T	74.3	Confident	79.6	Confident	108 Å²	108	56.7 Å²	56.7	66%	0.663	29%	0.294	S	S	*	.	S	Bend	trans	-75.5	-17.5	179.4	45.4	0	0	0	0	113.7	K54 D97	K54-T99 PolarHBondContact N-O 2.86Å; D97-T99 PolarHBondContact O-N 3.31Å
100	E	77.8	Confident	80	Confident	94 Å²	94	55 Å²	55	44%	0.439	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	134	-176.3	-68.5	179.7	-173.4	0	0	110.4	T51 R98	T51-E100 HydrophobicContact CG2-CB 4.39Å; T51-E100 PolarHBondContact OG1-OE2 3.03Å; R98-E100 VanDerWaalsContact C-N 3.28Å; R98-E100 PolarHBondContact O-N 3.42Å
101	L	80.6	Confident	80.4	Confident	2 Å²	2	55 Å²	55	1%	0.01	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	128.1	178.3	-59.5	168.5	0	0	0	109.1	T51 L52 K54 L91 L94 D105 I109	T51-L101 WeakPolarHBondContact CA-O 3.48Å; L52-L101 HydrophobicContact CB-CB 4.27Å; L52-L101 HydrophobicContact CB-CD1 4.4Å; L52-L101 HydrophobicContact CD2-CD1 4.07Å; L52-L101 HydrophobicContact CG-CD1 4.18Å; L52-L101 PolarHBondContact N-O 3.44Å; L52-L101 VanDerWaalsContact N-O 3.15Å; L52-L101 VanDerWaalsContact O-CB 3.28Å; L52-L101 WeakPolarHBondContact O-CB 3.31Å; L52-L101 WeakPolarHBondContact O-CG 3.47Å; L52-L101 PolarHBondContact O-N 2.86Å; K54-L101 HydrophobicContact CG-CD1 4.2Å; K54-L101 HydrophobicContact CG-CD2 3.81Å; K54-L101 HydrophobicContact CG-CG 3.88Å; L91-L101 HydrophobicContact CD2-CD1 4.12Å; L91-L101 HydrophobicContact CD2-CD2 4.07Å; L94-L101 HydrophobicContact CD1-CD2 3.37Å; L101-D105 HydrophobicContact CB-CB 4.24Å; L101-D105 HydrophobicContact CD2-CB 4.04Å; L101-I109 HydrophobicContact CD1-CD1 3.66Å; L101-I109 HydrophobicContact CD2-CD1 4.04Å; L101-I109 HydrophobicContact CG-CD1 4.39Å
102	T	83.4	Confident	80.6	Confident	47 Å²	47	53.6 Å²	53.6	29%	0.288	28%	0.276	S	S	.	.			trans	-82.6	173.9	171	69.8	0	0	0	0	111	E104 D105 Y106	T102-E104 VanDerWaalsContact C-N 3.33Å; T102-E104 PolarHBondContact O-N 3.47Å; T102-D105 WeakPolarHBondContact CB-OD2 3.08Å; T102-D105 PolarHBondContact N-OD2 3.48Å; T102-D105 WeakPolarHBondContact O-CB 3.31Å; T102-D105 PolarHBondContact O-N 3.5Å; T102-D105 VanDerWaalsContact OG1-CG 3.26Å; T102-D105 PolarHBondContact OG1-N 3.44Å; T102-D105 PolarHBondContact OG1-OD2 3.02Å; T102-Y106 PolarHBondContact O-N 3.33Å
103	E	80.6	Confident	81	Confident	57 Å²	57	51 Å²	51	27%	0.266	26%	0.258	S	S	.	.	H	α-helix	trans	-60	-38.8	174.5	-178.1	176.3	-162.6	0	0	113.2	H31 L33 D105 Y106 H107	H31-E103 VanDerWaalsContact CA-OE1 3.27Å; H31-E103 WeakPolarHBondContact CA-OE1 3.39Å; H31-E103 IonicContact CE1-OE1 3.15Å; H31-E103 IonicContact CE1-OE2 3.74Å; H31-E103 PolarHBondContact CE1-OE2 3.31Å; H31-E103 IonicContact CG-OE1 3.38Å; H31-E103 IonicContact ND1-OE1 2.75Å; H31-E103 PolarHBondContact ND1-OE1 3.01Å; H31-E103 IonicContact ND1-OE2 2.7Å; H31-E103 PolarHBondContact ND1-OE2 3.15Å; L33-E103 HydrophobicContact CD2-CB 4.4Å; E103-D105 VanDerWaalsContact C-N 3.33Å; E103-D105 PolarHBondContact O-N 3.47Å; E103-Y106 WeakPolarHBondContact O-CB 3.19Å; E103-Y106 PolarHBondContact O-N 3.3Å; E103-H107 PolarHBondContact O-CD2 3.19Å; E103-H107 VanDerWaalsContact O-CD2 3.3Å; E103-H107 VanDerWaalsContact O-CG 3.31Å; E103-H107 PolarHBondContact O-N 3.35Å
104	E	81.4	Confident	81.5	Confident	119 Å²	119	50.5 Å²	50.5	56%	0.556	26%	0.255	S	S	*	.	H	α-helix	trans	-65.8	-37.7	175.6	-164	-164.6	135.8	0	0	111.5	T102 Y106 H107 K108	T102-E104 VanDerWaalsContact C-N 3.33Å; T102-E104 PolarHBondContact O-N 3.47Å; E104-Y106 VanDerWaalsContact C-N 3.32Å; E104-H107 PolarHBondContact O-N 3.19Å; E104-K108 WeakPolarHBondContact O-CG 3.5Å; E104-K108 PolarHBondContact O-N 3.47Å; E104-K108 VanDerWaalsContact O-N 3.15Å; E104-K108 WeakPolarHBondContact OE1-CE 3.46Å; E104-K108 IonicContact OE1-NZ 3.93Å; E104-K108 PolarHBondContact OE1-NZ 3.47Å
105	D	85	Confident	81.9	Confident	12 Å²	12	50.7 Å²	50.7	6%	0.064	25%	0.254	C	S	.	.	H	α-helix	trans	-66.3	-37.8	174.4	-53	-50.5	0	0	0	110.7	L94 L101 T102 E103 K108 I109	L94-D105 HydrophobicContact CD1-CB 4.06Å; L94-D105 HydrophobicContact CD2-CB 3.87Å; L101-D105 HydrophobicContact CB-CB 4.24Å; L101-D105 HydrophobicContact CD2-CB 4.04Å; T102-D105 WeakPolarHBondContact CB-OD2 3.08Å; T102-D105 PolarHBondContact N-OD2 3.48Å; T102-D105 WeakPolarHBondContact O-CB 3.31Å; T102-D105 PolarHBondContact O-N 3.5Å; T102-D105 VanDerWaalsContact OG1-CG 3.26Å; T102-D105 PolarHBondContact OG1-N 3.44Å; T102-D105 PolarHBondContact OG1-OD2 3.02Å; E103-D105 VanDerWaalsContact C-N 3.33Å; E103-D105 PolarHBondContact O-N 3.47Å; D105-K108 PolarHBondContact O-N 3.02Å; D105-I109 WeakPolarHBondContact O-CD1 3.29Å; D105-I109 VanDerWaalsContact O-CG1 3.25Å; D105-I109 WeakPolarHBondContact O-CG1 3.4Å; D105-I109 PolarHBondContact O-N 2.98Å
106	Y	85.9	Confident	82.7	Confident	1 Å²	1	44 Å²	44	0%	0.004	22%	0.216	C	C	.	.	H	α-helix	trans	-63.4	-37.7	173.4	-178.3	-105.4	0	0	0	112.6	L33 T36 L60 T102 E103 E104 S110 A216	L33-Y106 HydrophobicContact CB-CD1 4.27Å; L33-Y106 HydrophobicContact CB-CG 4.35Å; L33-Y106 HydrophobicContact CD1-CD2 3.96Å; L33-Y106 HydrophobicContact CD1-CG 3.93Å; T36-Y106 HydrophobicContact CG2-CE2 4.02Å; T36-Y106 PolarHBondContact OG1-OH 3.13Å; L60-Y106 HydrophobicContact CD2-CE2 3.88Å; T102-Y106 PolarHBondContact O-N 3.33Å; E103-Y106 WeakPolarHBondContact O-CB 3.19Å; E103-Y106 PolarHBondContact O-N 3.3Å; E104-Y106 VanDerWaalsContact C-N 3.32Å; Y106-S110 VanDerWaalsContact O-CB 3.27Å; Y106-S110 WeakPolarHBondContact O-CB 3.46Å; Y106-S110 PolarHBondContact O-N 3.04Å; Y106-S110 PolarHBondContact O-OG 3.38Å; Y106-A216 HydrophobicContact CD1-CB 4.23Å; Y106-A216 HydrophobicContact CE1-CB 4.03Å
107	H	87.9	Confident	83.6	Confident	25 Å²	25	41.2 Å²	41.2	12%	0.116	20%	0.201	C	C	.	.	H	α-helix	trans	-62.8	-44.5	173.5	-62.5	168.2	0	0	0	112	Y32 E103 E104 S110 T111 P212 A216	Y32-H107 AromaticContact CD2-NE2 3.74Å; E103-H107 PolarHBondContact O-CD2 3.19Å; E103-H107 VanDerWaalsContact O-CD2 3.3Å; E103-H107 VanDerWaalsContact O-CG 3.31Å; E103-H107 PolarHBondContact O-N 3.35Å; E104-H107 PolarHBondContact O-N 3.19Å; H107-S110 PolarHBondContact O-N 3.22Å; H107-T111 PolarHBondContact O-N 3.45Å; H107-T111 VanDerWaalsContact O-N 3.12Å; H107-T111 PolarHBondContact O-OG1 3.21Å; H107-P212 HydrophobicContact CB-CB 3.81Å; H107-A216 WeakPolarHBondContact CD2-CB 3.24Å
108	K	86.6	Confident	84.6	Confident	50 Å²	50	33.9 Å²	33.9	22%	0.217	16%	0.162	C	C	.	.	H	α-helix	trans	-63.4	-45.8	177	-66.7	170.3	-170.7	163.2	0	111.8	V93 L94 E104 D105 T111 L141	V93-K108 HydrophobicContact CG1-CB 4.46Å; L94-K108 HydrophobicContact CD2-CB 4.05Å; L94-K108 HydrophobicContact CD2-CD 3.94Å; E104-K108 WeakPolarHBondContact O-CG 3.5Å; E104-K108 PolarHBondContact O-N 3.47Å; E104-K108 VanDerWaalsContact O-N 3.15Å; E104-K108 WeakPolarHBondContact OE1-CE 3.46Å; E104-K108 IonicContact OE1-NZ 3.93Å; E104-K108 PolarHBondContact OE1-NZ 3.47Å; D105-K108 PolarHBondContact O-N 3.02Å; K108-T111 WeakPolarHBondContact O-CB 3Å; K108-T111 PolarHBondContact O-N 2.89Å; K108-L141 HydrophobicContact CB-CD1 4.4Å; K108-L141 HydrophobicContact CG-CD1 4.48Å; K108-L141 HydrophobicContact CG-CD2 4.06Å
109	I	87.7	Confident	84.9	Confident	1 Å²	1	29.6 Å²	29.6	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-59.5	-47.1	173.9	-67.8	162.8	0	0	0	110.5	A90 L91 L94 L101 D105 T111 V112 L113	A90-I109 HydrophobicContact CB-CG2 4.24Å; L91-I109 HydrophobicContact CD2-CD1 3.87Å; L91-I109 HydrophobicContact CD2-CG1 4.42Å; L94-I109 HydrophobicContact CD1-CD1 3.99Å; L94-I109 HydrophobicContact CD1-CG1 4.17Å; L101-I109 HydrophobicContact CD1-CD1 3.66Å; L101-I109 HydrophobicContact CD2-CD1 4.04Å; L101-I109 HydrophobicContact CG-CD1 4.39Å; D105-I109 WeakPolarHBondContact O-CD1 3.29Å; D105-I109 VanDerWaalsContact O-CG1 3.25Å; D105-I109 WeakPolarHBondContact O-CG1 3.4Å; D105-I109 PolarHBondContact O-N 2.98Å; I109-T111 PolarHBondContact O-N 2.93Å; I109-V112 WeakPolarHBondContact O-CA 3.37Å; I109-V112 WeakPolarHBondContact O-CB 3.26Å; I109-V112 PolarHBondContact O-N 3.18Å; I109-L113 HydrophobicContact CG2-CD1 3.92Å; I109-L113 HydrophobicContact CG2-CD2 4.44Å; I109-L113 HydrophobicContact CG2-CG 3.97Å; I109-L113 WeakPolarHBondContact O-CG 3.27Å; I109-L113 PolarHBondContact O-N 2.89Å
110	S	89.6	Confident	85	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-60.3	-32.1	-177.7	-63.1	0	0	0	0	113	Y106 H107 V112 L113 L114	Y106-S110 VanDerWaalsContact O-CB 3.27Å; Y106-S110 WeakPolarHBondContact O-CB 3.46Å; Y106-S110 PolarHBondContact O-N 3.04Å; Y106-S110 PolarHBondContact O-OG 3.38Å; H107-S110 PolarHBondContact O-N 3.22Å; S110-V112 VanDerWaalsContact C-N 3.33Å; S110-V112 PolarHBondContact O-N 3.12Å; S110-L113 PolarHBondContact O-N 3.09Å; S110-L114 WeakPolarHBondContact O-CB 3.45Å; S110-L114 PolarHBondContact O-N 3.09Å
111	T	88.8	Confident	84.8	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-58.8	-43.4	171.9	-50.3	0	0	0	0	111.6	H107 K108 I109 Y115 L141 L145 F148 P212	H107-T111 PolarHBondContact O-N 3.45Å; H107-T111 VanDerWaalsContact O-N 3.12Å; H107-T111 PolarHBondContact O-OG1 3.21Å; K108-T111 WeakPolarHBondContact O-CB 3Å; K108-T111 PolarHBondContact O-N 2.89Å; I109-T111 PolarHBondContact O-N 2.93Å; T111-Y115 PolarHBondContact O-N 2.98Å; T111-L141 HydrophobicContact CG2-CD1 3.96Å; T111-L145 HydrophobicContact CG2-CD2 3.97Å; T111-F148 HydrophobicContact CG2-CD2 4.41Å; T111-F148 HydrophobicContact CG2-CE2 3.8Å; T111-P212 WeakPolarHBondContact OG1-CA 3.31Å
112	V	87.7	Confident	84.4	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-70.1	-44.7	176.4	-173.4	0	0	0	0	110.9	V89 V93 I109 S110 L114 Y115 Y116 Y144	V89-V112 HydrophobicContact CG1-CG1 4.42Å; V93-V112 HydrophobicContact CB-CG2 4.28Å; V93-V112 HydrophobicContact CG2-CG2 3.53Å; I109-V112 WeakPolarHBondContact O-CA 3.37Å; I109-V112 WeakPolarHBondContact O-CB 3.26Å; I109-V112 PolarHBondContact O-N 3.18Å; S110-V112 VanDerWaalsContact C-N 3.33Å; S110-V112 PolarHBondContact O-N 3.12Å; V112-L114 VanDerWaalsContact C-N 3.33Å; V112-L114 PolarHBondContact O-N 3.44Å; V112-Y115 PolarHBondContact O-N 3.23Å; V112-Y116 HydrophobicContact CG1-CD2 4.07Å; V112-Y116 HydrophobicContact CG1-CE2 4.11Å; V112-Y116 WeakPolarHBondContact O-CD2 3.41Å; V112-Y116 PolarHBondContact O-N 2.96Å; V112-Y116 VanDerWaalsContact O-N 3.16Å; V112-Y144 HydrophobicContact CG1-CE1 4.43Å; V112-Y144 HydrophobicContact CG2-CD2 4.13Å; V112-Y144 HydrophobicContact CG2-CE2 3.92Å
113	L	88.3	Confident	84	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-58	-45.6	178.3	-61.3	-179.6	0	0	0	111.2	L60 I61 L64 L85 A90 I109 S110 Y115 Y116 I117 I219	L60-L113 HydrophobicContact CD2-CD1 3.92Å; L60-L113 HydrophobicContact CG-CD1 4.31Å; I61-L113 HydrophobicContact CG1-CD2 3.94Å; L64-L113 HydrophobicContact CD2-CB 3.95Å; L64-L113 HydrophobicContact CD2-CD1 3.94Å; L64-L113 HydrophobicContact CD2-CD2 4.38Å; L64-L113 HydrophobicContact CD2-CG 4.3Å; L85-L113 HydrophobicContact CD2-CD2 3.8Å; L85-L113 HydrophobicContact CG-CD2 4.49Å; A90-L113 HydrophobicContact CB-CD2 4.12Å; I109-L113 HydrophobicContact CG2-CD1 3.92Å; I109-L113 HydrophobicContact CG2-CD2 4.44Å; I109-L113 HydrophobicContact CG2-CG 3.97Å; I109-L113 WeakPolarHBondContact O-CG 3.27Å; I109-L113 PolarHBondContact O-N 2.89Å; S110-L113 PolarHBondContact O-N 3.09Å; L113-Y115 PolarHBondContact O-N 3.39Å; L113-Y116 PolarHBondContact O-N 2.63Å; L113-I117 WeakPolarHBondContact O-CG1 3.47Å; L113-I117 PolarHBondContact O-N 3.21Å; L113-I117 VanDerWaalsContact O-N 3.11Å; L113-I219 HydrophobicContact CB-CD1 3.99Å; L113-I219 HydrophobicContact CB-CG1 4.25Å; L113-I219 HydrophobicContact CD1-CG2 4.3Å
114	L	89.8	Confident	83.5	Confident	4 Å²	4	30.7 Å²	30.7	2%	0.021	15%	0.148	C	C	.	.	H	α-helix	trans	-62	-43	177.8	178.2	60	0	0	0	112	S110 V112 Y116 I117 I118 F148 I168 I172 A215 I218 I219	S110-L114 WeakPolarHBondContact O-CB 3.45Å; S110-L114 PolarHBondContact O-N 3.09Å; V112-L114 VanDerWaalsContact C-N 3.33Å; V112-L114 PolarHBondContact O-N 3.44Å; L114-Y116 VanDerWaalsContact C-N 3.28Å; L114-Y116 PolarHBondContact O-N 3.02Å; L114-I117 PolarHBondContact O-N 2.98Å; L114-I117 VanDerWaalsContact O-N 3.1Å; L114-I118 HydrophobicContact CD1-CG2 4.16Å; L114-I118 WeakPolarHBondContact O-CG1 3.47Å; L114-I118 PolarHBondContact O-N 3.44Å; L114-F148 HydrophobicContact CB-CZ 3.98Å; L114-F148 HydrophobicContact CD2-CE1 3.88Å; L114-F148 HydrophobicContact CD2-CE2 4.37Å; L114-F148 HydrophobicContact CD2-CZ 3.76Å; L114-F148 HydrophobicContact CG-CE1 3.8Å; L114-F148 HydrophobicContact CG-CZ 3.66Å; L114-I168 HydrophobicContact CD1-CG2 4.17Å; L114-I168 HydrophobicContact CD2-CG2 4.32Å; L114-I172 HydrophobicContact CD1-CD1 3.89Å; L114-I172 HydrophobicContact CD1-CG1 4.3Å; L114-A215 HydrophobicContact CB-CB 4.28Å; L114-A215 HydrophobicContact CD2-CB 3.77Å; L114-I218 HydrophobicContact CD1-CD1 4.47Å; L114-I218 HydrophobicContact CD1-CG2 3.92Å; L114-I218 HydrophobicContact CD2-CD1 3.96Å; L114-I219 HydrophobicContact CB-CD1 4.34Å
115	Y	88.4	Confident	82.7	Confident	30 Å²	30	28.5 Å²	28.5	12%	0.118	14%	0.142	C	C	.	.	H	α-helix	trans	-59.5	-39.5	178.8	174.7	-97.2	0	0	0	112.2	T111 V112 L113 I118 N119 L123 Y144 H147	T111-Y115 PolarHBondContact O-N 2.98Å; V112-Y115 PolarHBondContact O-N 3.23Å; L113-Y115 PolarHBondContact O-N 3.39Å; Y115-I118 WeakPolarHBondContact O-CG1 3.41Å; Y115-N119 VanDerWaalsContact CE2-ND2 3.26Å; Y115-N119 WeakPolarHBondContact CE2-ND2 3.48Å; Y115-N119 WeakPolarHBondContact O-CB 3.4Å; Y115-N119 PolarHBondContact O-N 3.06Å; Y115-N119 PolarHBondContact O-ND2 3.26Å; Y115-N119 VanDerWaalsContact O-ND2 3.11Å; Y115-L123 HydrophobicContact CD1-CD1 4.14Å; Y115-L123 HydrophobicContact CE1-CD1 3.7Å; Y115-Y144 AromaticContact CD1-CD1 3.72Å; Y115-Y144 HydrophobicContact CD1-CD1 3.72Å; Y115-Y144 AromaticContact CD1-CE1 3.63Å; Y115-Y144 HydrophobicContact CD1-CE1 3.63Å; Y115-Y144 HydrophobicContact CD2-CD1 4.03Å; Y115-Y144 HydrophobicContact CE1-CD1 4.3Å; Y115-Y144 HydrophobicContact CE1-CE1 4.04Å; Y115-Y144 AromaticContact CG-CD1 3.57Å; Y115-Y144 HydrophobicContact CG-CD1 3.57Å; Y115-Y144 AromaticContact CG-CE1 3.99Å; Y115-Y144 HydrophobicContact CG-CE1 3.99Å; Y115-H147 HydrophobicContact CD2-CB 4.42Å; Y115-H147 AromaticContact CD2-ND1 3.96Å; Y115-H147 HydrophobicContact CE2-CB 4.25Å; Y115-H147 AromaticContact CE2-CD2 3.59Å; Y115-H147 AromaticContact CE2-CE1 3.97Å; Y115-H147 AromaticContact CE2-CG 3.66Å; Y115-H147 AromaticContact CE2-ND1 3.89Å; Y115-H147 AromaticContact CE2-NE2 3.76Å
116	Y	84.9	Confident	81.2	Confident	29 Å²	29	32 Å²	32	11%	0.114	17%	0.167	C	C	.	.	H	α-helix	trans	-72.3	-29.5	175.8	-88.2	-97.1	0	0	0	113.3	C84 L85 V89 V112 L113 L114 L120 L123	C84-Y116 WeakPolarHBondContact O-CE1 3.29Å; L85-Y116 HydrophobicContact CB-CD1 4.19Å; L85-Y116 HydrophobicContact CD1-CD1 4.13Å; L85-Y116 HydrophobicContact CD1-CD2 3.92Å; L85-Y116 HydrophobicContact CD1-CE1 4.44Å; L85-Y116 HydrophobicContact CD1-CE2 4.25Å; L85-Y116 HydrophobicContact CD1-CG 3.87Å; L85-Y116 HydrophobicContact CD2-CG 4.38Å; L85-Y116 HydrophobicContact CG-CG 4.49Å; V89-Y116 HydrophobicContact CG1-CE2 3.83Å; V112-Y116 HydrophobicContact CG1-CD2 4.07Å; V112-Y116 HydrophobicContact CG1-CE2 4.11Å; V112-Y116 WeakPolarHBondContact O-CD2 3.41Å; V112-Y116 PolarHBondContact O-N 2.96Å; V112-Y116 VanDerWaalsContact O-N 3.16Å; L113-Y116 PolarHBondContact O-N 2.63Å; L114-Y116 VanDerWaalsContact C-N 3.28Å; L114-Y116 PolarHBondContact O-N 3.02Å; Y116-L120 VanDerWaalsContact O-CA 3.24Å; Y116-L120 WeakPolarHBondContact O-CA 3.21Å; Y116-L120 PolarHBondContact O-N 3.33Å; Y116-L120 VanDerWaalsContact O-N 3.11Å; Y116-L123 HydrophobicContact CD1-CD1 3.8Å; Y116-L123 HydrophobicContact CD2-CD1 4.49Å; Y116-L123 HydrophobicContact CE1-CB 4.45Å; Y116-L123 HydrophobicContact CE1-CD1 3.95Å; Y116-L123 HydrophobicContact CG-CD1 4.09Å
117	I	85.3	Confident	79.4	Confident	4 Å²	4	38.2 Å²	38.2	2%	0.021	20%	0.201	C	C	.	.	H	α-helix	trans	-70.4	-47.3	174.8	-69.6	168.8	0	0	0	111.2	L64 V68 L113 L114 N119 L120 I172 I219 I222	L64-I117 HydrophobicContact CD1-CD1 3.89Å; L64-I117 HydrophobicContact CD2-CD1 3.96Å; L64-I117 HydrophobicContact CG-CD1 3.93Å; V68-I117 HydrophobicContact CG1-CD1 4.26Å; V68-I117 HydrophobicContact CG1-CG1 4.4Å; V68-I117 HydrophobicContact CG1-CG2 4.26Å; L113-I117 WeakPolarHBondContact O-CG1 3.47Å; L113-I117 PolarHBondContact O-N 3.21Å; L113-I117 VanDerWaalsContact O-N 3.11Å; L114-I117 PolarHBondContact O-N 2.98Å; L114-I117 VanDerWaalsContact O-N 3.1Å; I117-N119 VanDerWaalsContact C-N 3.28Å; I117-N119 PolarHBondContact O-N 3.26Å; I117-L120 WeakPolarHBondContact O-CB 3.38Å; I117-L120 PolarHBondContact O-N 3.48Å; I117-I172 HydrophobicContact CG2-CG1 4.26Å; I117-I219 HydrophobicContact CD1-CD1 3.57Å; I117-I222 HydrophobicContact CD1-CD1 4.11Å
118	I	86.6	Confident	77	Confident	9 Å²	9	43.3 Å²	43.3	5%	0.046	23%	0.234	C	C	.	.	H	α-helix	trans	-69.5	-26.2	-177.7	60.5	154.7	0	0	0	113.1	L114 Y115 F148 I168 L171 I172	L114-I118 HydrophobicContact CD1-CG2 4.16Å; L114-I118 WeakPolarHBondContact O-CG1 3.47Å; L114-I118 PolarHBondContact O-N 3.44Å; Y115-I118 WeakPolarHBondContact O-CG1 3.41Å; I118-F148 HydrophobicContact CD1-CD1 4.1Å; I118-F148 HydrophobicContact CD1-CE1 3.63Å; I118-F148 HydrophobicContact CG1-CE1 4.25Å; I118-I168 HydrophobicContact CG2-CG2 4.26Å; I118-L171 HydrophobicContact CB-CB 4.14Å; I118-L171 HydrophobicContact CB-CD1 4.28Å; I118-L171 HydrophobicContact CG2-CB 4.04Å; I118-I172 HydrophobicContact CG2-CG1 4.08Å
119	N	81.6	Confident	74.9	Confident	29 Å²	29	44 Å²	44	16%	0.155	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	21.3	179.5	-63.9	-64.6	0	0	0	113	Y115 I117 K121 D122 L123	Y115-N119 VanDerWaalsContact CE2-ND2 3.26Å; Y115-N119 WeakPolarHBondContact CE2-ND2 3.48Å; Y115-N119 WeakPolarHBondContact O-CB 3.4Å; Y115-N119 PolarHBondContact O-N 3.06Å; Y115-N119 PolarHBondContact O-ND2 3.26Å; Y115-N119 VanDerWaalsContact O-ND2 3.11Å; I117-N119 VanDerWaalsContact C-N 3.28Å; I117-N119 PolarHBondContact O-N 3.26Å; N119-K121 PolarHBondContact O-N 2.93Å; N119-K121 VanDerWaalsContact O-N 3.12Å; N119-D122 PolarHBondContact O-N 3.15Å; N119-D122 VanDerWaalsContact O-N 3.09Å; N119-L123 HydrophobicContact CB-CD1 3.67Å; N119-L123 HydrophobicContact CB-CG 3.9Å; N119-L123 PolarHBondContact O-N 2.85Å
120	L	77.8	Confident	72.5	Confident	3 Å²	3	49.3 Å²	49.3	2%	0.016	29%	0.289	C	S	.	.	H	α-helix	trans	-54	-39	-171	-168.8	76.2	0	0	0	112.6	L65 C70 T74 Y116 I117 C124 H175	L65-L120 HydrophobicContact CD2-CD1 4.38Å; C70-L120 HydrophobicContact CB-CD2 4.23Å; T74-L120 HydrophobicContact CG2-CD2 4.21Å; T74-L120 HydrophobicContact CG2-CG 4.4Å; Y116-L120 VanDerWaalsContact O-CA 3.24Å; Y116-L120 WeakPolarHBondContact O-CA 3.21Å; Y116-L120 PolarHBondContact O-N 3.33Å; Y116-L120 VanDerWaalsContact O-N 3.11Å; I117-L120 WeakPolarHBondContact O-CB 3.38Å; I117-L120 PolarHBondContact O-N 3.48Å; L120-C124 WeakPolarHBondContact O-CB 3.28Å; L120-C124 PolarHBondContact O-N 2.87Å; L120-C124 VanDerWaalsContact O-N 3.1Å; L120-C124 PolarHBondContact O-SG 3.33Å; L120-H175 HydrophobicContact CD2-CB 4.48Å
121	K	72.7	Confident	70.3	Confident	135 Å²	135	52.9 Å²	52.9	59%	0.587	31%	0.313	S	S	*	.	H	α-helix	trans	-66.6	-46.6	179.3	-168.1	179.8	179.3	-174.1	0	112.4	N119 V125	N119-K121 PolarHBondContact O-N 2.93Å; N119-K121 VanDerWaalsContact O-N 3.12Å; K121-V125 HydrophobicContact CG-CG2 4.32Å; K121-V125 WeakPolarHBondContact O-CB 3.14Å; K121-V125 WeakPolarHBondContact O-CG2 3.43Å; K121-V125 PolarHBondContact O-N 3.21Å
122	D	73.4	Confident	67.9	Low	110 Å²	110	58.5 Å²	58.5	59%	0.588	35%	0.349	S	S	*	.	H	α-helix	trans	-79.1	-36	-172.2	-59.7	-37.7	0	0	0	112.1	N119 S126	N119-D122 PolarHBondContact O-N 3.15Å; N119-D122 VanDerWaalsContact O-N 3.09Å; D122-S126 PolarHBondContact O-OG 3.04Å
123	L	74.3	Confident	65.5	Low	63 Å²	63	63 Å²	63	33%	0.33	39%	0.387	S	S	.	.	H	α-helix	trans	-76.5	-36.7	178.4	-63.3	174.8	0	0	0	112.9	Y115 Y116 N119	Y115-L123 HydrophobicContact CD1-CD1 4.14Å; Y115-L123 HydrophobicContact CE1-CD1 3.7Å; Y116-L123 HydrophobicContact CD1-CD1 3.8Å; Y116-L123 HydrophobicContact CD2-CD1 4.49Å; Y116-L123 HydrophobicContact CE1-CB 4.45Å; Y116-L123 HydrophobicContact CE1-CD1 3.95Å; Y116-L123 HydrophobicContact CG-CD1 4.09Å; N119-L123 HydrophobicContact CB-CD1 3.67Å; N119-L123 HydrophobicContact CB-CG 3.9Å; N119-L123 PolarHBondContact O-N 2.85Å
124	C	70.8	Confident	63.3	Low	21 Å²	21	67.3 Å²	67.3	14%	0.142	41%	0.409	C	S	.	.	H	α-helix	trans	-93.2	-19.8	-175.5	-50.2	0	0	0	0	114.7	C84 L120	C84-C124 HydrophobicContact CB-CB 3.74Å; C84-C124 WeakPolarHBondContact CB-SG 3.41Å; C84-C124 WeakPolarHBondContact SG-CA 3.48Å; C84-C124 WeakPolarHBondContact SG-CB 3.45Å; C84-C124 CovalentContact SG-SG 2.03Å; C84-C124 PolarHBondContact SG-SG 2.92Å; L120-C124 WeakPolarHBondContact O-CB 3.28Å; L120-C124 PolarHBondContact O-N 2.87Å; L120-C124 VanDerWaalsContact O-N 3.1Å; L120-C124 PolarHBondContact O-SG 3.33Å
125	V	63.6	Low	60.7	Low	73 Å²	73	72.5 Å²	72.5	44%	0.442	44%	0.443	S	S	.	.	H	α-helix	trans	-83.6	-23.8	178.9	175.4	0	0	0	0	112.5	F76 K121 N127	F76-V125 HydrophobicContact CE2-CG2 3.92Å; F76-V125 HydrophobicContact CZ-CG2 4.35Å; K121-V125 HydrophobicContact CG-CG2 4.32Å; K121-V125 WeakPolarHBondContact O-CB 3.14Å; K121-V125 WeakPolarHBondContact O-CG2 3.43Å; K121-V125 PolarHBondContact O-N 3.21Å; V125-N127 VanDerWaalsContact C-N 3.3Å; V125-N127 PolarHBondContact O-N 2.8Å
126	S	53	Low	58.1	Low	84 Å²	84	75.9 Å²	75.9	59%	0.587	47%	0.471	S	S	*	.			trans	-77	67.8	-173.7	-61	0	0	0	0	113.5	D122 T128	D122-S126 PolarHBondContact O-OG 3.04Å; S126-T128 PolarHBondContact O-N 3.31Å
127	N	49	Very low	56	Low	133 Å²	133	80.1 Å²	80.1	71%	0.711	51%	0.505	S	S	*	.			trans	-76.6	59.7	-176.6	-166.8	19.7	0	0	0	113.9	V125	V125-N127 VanDerWaalsContact C-N 3.3Å; V125-N127 PolarHBondContact O-N 2.8Å
128	T	37.8	Very low	53.9	Low	131 Å²	131	83.4 Å²	83.4	80%	0.804	53%	0.528	S	S	*	.	S	Bend	trans	-139.4	93.8	170.2	53.7	0	0	0	0	112.4	S126	S126-T128 PolarHBondContact O-N 3.31Å
129	G	41.6	Very low	52.3	Low	65 Å²	65	84.7 Å²	84.7	67%	0.67	54%	0.536	S	S	*	.	S	Bend	trans	100	175.8	168.9	0	0	0	0	0	115
130	P	38.6	Very low	51.5	Low	112 Å²	112	88.2 Å²	88.2	73%	0.727	56%	0.555	S	S	*	*	S	Bend	trans	-59.6	159.9	163.9	-4.4	19	0	0	0	109.3
131	P	43	Very low	51.5	Low	76 Å²	76	89.9 Å²	89.9	49%	0.494	56%	0.564	S	S	.	*	S	Bend	trans	-49.5	136	169.4	23.9	-34.6	0	0	0	109.1	A133 L134	P131-A133 WeakPolarHBondContact O-CA 3.25Å; P131-A133 PolarHBondContact O-N 2.85Å; P131-L134 HydrophobicContact CB-CD1 3.95Å; P131-L134 HydrophobicContact CG-CD1 4.35Å
132	P	38.7	Very low	51.9	Low	118 Å²	118	88.5 Å²	88.5	77%	0.766	56%	0.56	S	S	*	*	S	Bend	trans	-51.2	115.6	-165.5	20.3	-33.7	0	0	0	109.2	L134	P132-L134 PolarHBondContact O-N 3.49Å
133	A	37	Very low	52.5	Low	95 Å²	95	88.9 Å²	88.9	79%	0.785	56%	0.556	S	S	*	*			trans	-40	96	-155	0	0	0	0	0	112.6	P131 P135	P131-A133 WeakPolarHBondContact O-CA 3.25Å; P131-A133 PolarHBondContact O-N 2.85Å; A133-P135 WeakPolarHBondContact O-CD 3.31Å
134	L	42.5	Very low	52.9	Low	90 Å²	90	86.2 Å²	86.2	47%	0.471	54%	0.542	S	S	.	.			trans	-63.3	124	-175.8	-78.2	91.6	0	0	0	107.2	P131 P132 S136 V139	P131-L134 HydrophobicContact CB-CD1 3.95Å; P131-L134 HydrophobicContact CG-CD1 4.35Å; P132-L134 PolarHBondContact O-N 3.49Å; L134-S136 PolarHBondContact O-N 3.03Å; L134-V139 HydrophobicContact CB-CG2 4.4Å; L134-V139 HydrophobicContact CD2-CG1 4.09Å; L134-V139 HydrophobicContact CD2-CG2 3.62Å
135	P	35	Very low	53.6	Low	112 Å²	112	85.7 Å²	85.7	73%	0.727	54%	0.538	S	S	*	.			trans	-55.9	135.1	-179.1	-27.1	35.5	0	0	0	110.9	A133	A133-P135 WeakPolarHBondContact O-CD 3.31Å
136	S	33.5	Very low	54.6	Low	101 Å²	101	86.1 Å²	86.1	71%	0.706	54%	0.537	S	S	*	.	S	Bend	trans	-27.8	129.9	170.9	49	0	0	0	0	115.3	L134 S138	L134-S136 PolarHBondContact O-N 3.03Å; S136-S138 PolarHBondContact O-N 3.44Å
137	S	40	Very low	56.1	Low	119 Å²	119	84.5 Å²	84.5	83%	0.832	52%	0.52	S	S	*	.	S	Bend	trans	53.6	49	152.1	62.9	0	0	0	0	116.8
138	S	42.1	Very low	57.9	Low	73 Å²	73	78.2 Å²	78.2	51%	0.51	49%	0.486	S	S	.	.			trans	174	87.3	137.5	42.8	0	0	0	0	108.9	S136 N140	S136-S138 PolarHBondContact O-N 3.44Å; S138-N140 PolarHBondContact O-N 3.03Å
139	V	53	Low	60.1	Low	35 Å²	35	72 Å²	72	21%	0.212	45%	0.448	C	S	.	.			trans	-73.4	81	163.3	-173.4	0	0	0	0	106.3	L134 L141 Y144	L134-V139 HydrophobicContact CB-CG2 4.4Å; L134-V139 HydrophobicContact CD2-CG1 4.09Å; L134-V139 HydrophobicContact CD2-CG2 3.62Å; V139-L141 PolarHBondContact O-N 3.42Å; V139-Y144 HydrophobicContact CG1-CE2 3.7Å
140	N	65.1	Low	62	Low	103 Å²	103	71.3 Å²	71.3	55%	0.551	43%	0.433	S	S	*	.			trans	-54	127.1	-178.2	-83.2	-55.2	0	0	0	108.7	S138 Q142 F143	S138-N140 PolarHBondContact O-N 3.03Å; N140-Q142 HydrophobicContact CB-CB 3.92Å; N140-Q142 PolarHBondContact O-N 3.24Å; N140-F143 WeakPolarHBondContact O-CB 3.48Å; N140-F143 PolarHBondContact O-N 3.2Å
141	L	77.8	Confident	64	Low	38 Å²	38	68.2 Å²	68.2	20%	0.199	41%	0.41	C	S	.	.	H	α-helix	trans	-41.9	-36.4	169.2	-179.3	67.4	0	0	0	111.2	V93 K108 T111 V139 F143 Y144 L145 P212	V93-L141 HydrophobicContact CG1-CB 3.7Å; V93-L141 HydrophobicContact CG1-CD1 3.68Å; V93-L141 HydrophobicContact CG1-CG 4.23Å; K108-L141 HydrophobicContact CB-CD1 4.4Å; K108-L141 HydrophobicContact CG-CD1 4.48Å; K108-L141 HydrophobicContact CG-CD2 4.06Å; T111-L141 HydrophobicContact CG2-CD1 3.96Å; V139-L141 PolarHBondContact O-N 3.42Å; L141-F143 PolarHBondContact O-N 3.48Å; L141-F143 VanDerWaalsContact O-N 3.1Å; L141-Y144 PolarHBondContact O-N 3.05Å; L141-L145 HydrophobicContact CD2-CD1 4.1Å; L141-L145 HydrophobicContact CG-CD1 3.78Å; L141-L145 HydrophobicContact CG-CG 4.01Å; L141-L145 WeakPolarHBondContact O-CG 3.34Å; L141-L145 PolarHBondContact O-N 3.13Å; L141-P212 HydrophobicContact CD2-CG 4.36Å
142	Q	81.1	Confident	65.6	Low	107 Å²	107	66.8 Å²	66.8	50%	0.5	40%	0.398	S	S	.	.	H	α-helix	trans	-43.8	-35.3	171.3	-161.1	62.9	38.7	0	0	116.1	N140 L146	N140-Q142 HydrophobicContact CB-CB 3.92Å; N140-Q142 PolarHBondContact O-N 3.24Å; Q142-L146 VanDerWaalsContact O-CB 3.25Å; Q142-L146 WeakPolarHBondContact O-CB 3.33Å; Q142-L146 PolarHBondContact O-N 2.9Å
143	F	84.3	Confident	67.2	Low	117 Å²	117	66.5 Å²	66.5	51%	0.513	40%	0.397	S	S	.	.	H	α-helix	trans	-64.9	-49.7	177.4	173.5	-96.5	0	0	0	111.3	N140 L141 L146 H147	N140-F143 WeakPolarHBondContact O-CB 3.48Å; N140-F143 PolarHBondContact O-N 3.2Å; L141-F143 PolarHBondContact O-N 3.48Å; L141-F143 VanDerWaalsContact O-N 3.1Å; F143-L146 PolarHBondContact O-N 3.48Å; F143-H147 PolarHBondContact O-N 3.06Å
144	Y	84.1	Confident	68.6	Low	8 Å²	8	69.7 Å²	69.7	3%	0.031	40%	0.401	C	S	.	.	H	α-helix	trans	-66.5	-39.5	177.5	-57.7	-71	0	0	0	111.3	V93 V112 Y115 V139 L141 H147 F148	V93-Y144 HydrophobicContact CG2-CD2 4.32Å; V93-Y144 HydrophobicContact CG2-CE2 3.79Å; V112-Y144 HydrophobicContact CG1-CE1 4.43Å; V112-Y144 HydrophobicContact CG2-CD2 4.13Å; V112-Y144 HydrophobicContact CG2-CE2 3.92Å; Y115-Y144 AromaticContact CD1-CD1 3.72Å; Y115-Y144 HydrophobicContact CD1-CD1 3.72Å; Y115-Y144 AromaticContact CD1-CE1 3.63Å; Y115-Y144 HydrophobicContact CD1-CE1 3.63Å; Y115-Y144 HydrophobicContact CD2-CD1 4.03Å; Y115-Y144 HydrophobicContact CE1-CD1 4.3Å; Y115-Y144 HydrophobicContact CE1-CE1 4.04Å; Y115-Y144 AromaticContact CG-CD1 3.57Å; Y115-Y144 HydrophobicContact CG-CD1 3.57Å; Y115-Y144 AromaticContact CG-CE1 3.99Å; Y115-Y144 HydrophobicContact CG-CE1 3.99Å; V139-Y144 HydrophobicContact CG1-CE2 3.7Å; L141-Y144 PolarHBondContact O-N 3.05Å; Y144-H147 PolarHBondContact O-N 2.98Å; Y144-F148 WeakPolarHBondContact O-CD2 3.34Å; Y144-F148 PolarHBondContact O-N 3.31Å
145	L	85.3	Confident	70	Confident	9 Å²	9	68.1 Å²	68.1	5%	0.047	39%	0.391	C	S	.	.	H	α-helix	trans	-61.4	-48.3	176.5	-64.6	176.8	0	0	0	112.1	T111 L141 H147 F148 T149 V208 V211 P212	T111-L145 HydrophobicContact CG2-CD2 3.97Å; L141-L145 HydrophobicContact CD2-CD1 4.1Å; L141-L145 HydrophobicContact CG-CD1 3.78Å; L141-L145 HydrophobicContact CG-CG 4.01Å; L141-L145 WeakPolarHBondContact O-CG 3.34Å; L141-L145 PolarHBondContact O-N 3.13Å; L145-H147 VanDerWaalsContact C-N 3.27Å; L145-H147 PolarHBondContact O-N 3.35Å; L145-F148 PolarHBondContact O-N 3.08Å; L145-F148 VanDerWaalsContact O-N 3.16Å; L145-T149 PolarHBondContact O-N 3.45Å; L145-T149 PolarHBondContact O-OG1 3.04Å; L145-V208 HydrophobicContact CB-CG1 4.01Å; L145-V208 HydrophobicContact CD1-CG1 3.92Å; L145-V208 HydrophobicContact CG-CG1 4.5Å; L145-V211 HydrophobicContact CD2-CB 3.76Å; L145-V211 HydrophobicContact CD2-CG1 3.68Å; L145-P212 HydrophobicContact CD2-CG 3.93Å
146	L	83.3	Confident	71.8	Confident	83 Å²	83	67 Å²	67	44%	0.435	38%	0.379	S	S	.	.	H	α-helix	trans	-60.8	-37.6	-179.9	-177.5	64.1	0	0	0	111.8	Q142 F143 F148 T149 S150 H157	Q142-L146 VanDerWaalsContact O-CB 3.25Å; Q142-L146 WeakPolarHBondContact O-CB 3.33Å; Q142-L146 PolarHBondContact O-N 2.9Å; F143-L146 PolarHBondContact O-N 3.48Å; L146-F148 VanDerWaalsContact C-N 3.3Å; L146-F148 PolarHBondContact O-N 3.1Å; L146-T149 CarbonylContact O-C 3.53Å; L146-T149 PolarHBondContact O-N 3.01Å; L146-T149 PolarHBondContact O-OG1 3.22Å; L146-S150 VanDerWaalsContact O-CB 3.26Å; L146-S150 WeakPolarHBondContact O-CB 3.23Å; L146-S150 PolarHBondContact O-N 2.83Å; L146-S150 VanDerWaalsContact O-N 3.11Å; L146-S150 PolarHBondContact O-OG 2.71Å; L146-S150 VanDerWaalsContact O-OG 3.12Å; L146-H157 HydrophobicContact CD1-CB 4.37Å
147	H	85.5	Confident	73.9	Confident	49 Å²	49	66.6 Å²	66.6	23%	0.227	37%	0.365	C	S	.	.	H	α-helix	trans	-62.2	-35	177.6	-176	-76.7	0	0	0	113.1	Y115 F143 Y144 L145	Y115-H147 HydrophobicContact CD2-CB 4.42Å; Y115-H147 AromaticContact CD2-ND1 3.96Å; Y115-H147 HydrophobicContact CE2-CB 4.25Å; Y115-H147 AromaticContact CE2-CD2 3.59Å; Y115-H147 AromaticContact CE2-CE1 3.97Å; Y115-H147 AromaticContact CE2-CG 3.66Å; Y115-H147 AromaticContact CE2-ND1 3.89Å; Y115-H147 AromaticContact CE2-NE2 3.76Å; F143-H147 PolarHBondContact O-N 3.06Å; Y144-H147 PolarHBondContact O-N 2.98Å; L145-H147 VanDerWaalsContact C-N 3.27Å; L145-H147 PolarHBondContact O-N 3.35Å
148	F	86	Confident	75.8	Confident	1 Å²	1	66.9 Å²	66.9	0%	0.004	35%	0.354	C	S	.	.	H	α-helix	trans	-74.2	-35.5	177.1	-64.4	-56.2	0	0	0	112.3	T111 L114 I118 Y144 L145 L146 S150 L160 I168 V211	T111-F148 HydrophobicContact CG2-CD2 4.41Å; T111-F148 HydrophobicContact CG2-CE2 3.8Å; L114-F148 HydrophobicContact CB-CZ 3.98Å; L114-F148 HydrophobicContact CD2-CE1 3.88Å; L114-F148 HydrophobicContact CD2-CE2 4.37Å; L114-F148 HydrophobicContact CD2-CZ 3.76Å; L114-F148 HydrophobicContact CG-CE1 3.8Å; L114-F148 HydrophobicContact CG-CZ 3.66Å; I118-F148 HydrophobicContact CD1-CD1 4.1Å; I118-F148 HydrophobicContact CD1-CE1 3.63Å; I118-F148 HydrophobicContact CG1-CE1 4.25Å; Y144-F148 WeakPolarHBondContact O-CD2 3.34Å; Y144-F148 PolarHBondContact O-N 3.31Å; L145-F148 PolarHBondContact O-N 3.08Å; L145-F148 VanDerWaalsContact O-N 3.16Å; L146-F148 VanDerWaalsContact C-N 3.3Å; L146-F148 PolarHBondContact O-N 3.1Å; F148-S150 VanDerWaalsContact C-N 3.31Å; F148-S150 PolarHBondContact O-N 2.91Å; F148-L160 HydrophobicContact CB-CD1 4.16Å; F148-L160 VanDerWaalsContact O-CD1 3.28Å; F148-L160 WeakPolarHBondContact O-CD1 3.22Å; F148-I168 HydrophobicContact CB-CD1 4.13Å; F148-I168 HydrophobicContact CD1-CD1 3.68Å; F148-I168 HydrophobicContact CD1-CG1 4.23Å; F148-I168 HydrophobicContact CE1-CD1 4.49Å; F148-I168 HydrophobicContact CG-CD1 4.21Å; F148-V211 HydrophobicContact CB-CG1 4.34Å; F148-V211 HydrophobicContact CD2-CG1 3.9Å; F148-V211 HydrophobicContact CG-CG1 4.46Å
149	T	83.7	Confident	77.7	Confident	1 Å²	1	65.7 Å²	65.7	1%	0.006	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	22.1	178	65.8	0	0	0	0	113.3	L145 L146 H157 L160 E164 V208 V211	L145-T149 PolarHBondContact O-N 3.45Å; L145-T149 PolarHBondContact O-OG1 3.04Å; L146-T149 CarbonylContact O-C 3.53Å; L146-T149 PolarHBondContact O-N 3.01Å; L146-T149 PolarHBondContact O-OG1 3.22Å; T149-H157 VanDerWaalsContact O-CA 3.24Å; T149-H157 WeakPolarHBondContact O-CA 3.26Å; T149-H157 WeakPolarHBondContact O-CB 3.47Å; T149-H157 PolarHBondContact O-CD2 3.39Å; T149-H157 PolarHBondContact OG1-O 3.08Å; T149-L160 HydrophobicContact CG2-CB 4.03Å; T149-E164 WeakPolarHBondContact CA-OE1 3.24Å; T149-V208 HydrophobicContact CG2-CG2 4.42Å; T149-V211 HydrophobicContact CG2-CG2 4.37Å
150	S	82.7	Confident	79.2	Confident	51 Å²	51	64.1 Å²	64.1	36%	0.357	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.3	27.9	176	83.6	0	0	0	0	111.6	L146 F148 N152 E164	L146-S150 VanDerWaalsContact O-CB 3.26Å; L146-S150 WeakPolarHBondContact O-CB 3.23Å; L146-S150 PolarHBondContact O-N 2.83Å; L146-S150 VanDerWaalsContact O-N 3.11Å; L146-S150 PolarHBondContact O-OG 2.71Å; L146-S150 VanDerWaalsContact O-OG 3.12Å; F148-S150 VanDerWaalsContact C-N 3.31Å; F148-S150 PolarHBondContact O-N 2.91Å; S150-N152 VanDerWaalsContact C-N 3.34Å; S150-E164 PolarHBondContact N-OE1 2.54Å; S150-E164 VanDerWaalsContact N-OE1 3.14Å
151	L	81.3	Confident	80.1	Confident	46 Å²	46	59.8 Å²	59.8	24%	0.241	31%	0.308	C	S	.	.	S	Bend	trans	-73.8	-32.5	178.2	-69.9	174.7	0	0	0	110.7	E164 I168	L151-E164 HydrophobicContact CB-CG 4.38Å; L151-E164 PolarHBondContact N-OE1 2.79Å; L151-E164 VanDerWaalsContact N-OE1 3.15Å; L151-I168 HydrophobicContact CD1-CD1 4.14Å; L151-I168 HydrophobicContact CD1-CG1 3.52Å
152	N	76.1	Confident	80.2	Confident	46 Å²	46	61.2 Å²	61.2	25%	0.246	31%	0.313	C	S	.	.	S	Bend	trans	-111.5	115.1	175.8	-72.6	-32.2	0	0	0	110.6	S150 N154 E155 E164	S150-N152 VanDerWaalsContact C-N 3.34Å; N152-N154 PolarHBondContact O-N 2.58Å; N152-E155 HydrophobicContact CB-CB 4.32Å; N152-E155 HydrophobicContact CB-CG 3.86Å; N152-E155 PolarHBondContact ND2-OE1 2.68Å; N152-E155 PolarHBondContact O-N 3.24Å; N152-E164 HydrophobicContact CB-CG 4.46Å
153	P	71.3	Confident	80	Confident	113 Å²	113	58.4 Å²	58.4	73%	0.734	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-3.8	-174.6	29.5	-37.1	0	0	0	114.7
154	N	66.4	Low	80	Confident	162 Å²	162	52.9 Å²	52.9	87%	0.866	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	0.1	-179.9	-62.6	-28.2	0	0	0	112.9	N152	N152-N154 PolarHBondContact O-N 2.58Å
155	E	72	Confident	80	Confident	56 Å²	56	52.5 Å²	52.5	26%	0.262	28%	0.28	S	S	.	.	S	Bend	trans	-110.7	165.4	-173.1	-61.9	-170.8	-150.5	0	0	112.4	N152 H157 S161 S163	N152-E155 HydrophobicContact CB-CB 4.32Å; N152-E155 HydrophobicContact CB-CG 3.86Å; N152-E155 PolarHBondContact ND2-OE1 2.68Å; N152-E155 PolarHBondContact O-N 3.24Å; E155-H157 PolarHBondContact O-N 2.9Å; E155-S161 WeakPolarHBondContact OE2-CB 3.39Å; E155-S161 PolarHBondContact OE2-OG 2.87Å; E155-S163 VanDerWaalsContact CD-OG 3.24Å; E155-S163 WeakPolarHBondContact OE1-CB 3.31Å; E155-S163 PolarHBondContact OE1-OG 3.4Å; E155-S163 PolarHBondContact OE2-OG 3.38Å; E155-S163 VanDerWaalsContact OE2-OG 3.05Å
156	N	73.9	Confident	79.9	Confident	89 Å²	89	53.5 Å²	53.5	48%	0.476	28%	0.284	S	S	.	.			trans	-88.6	109.9	-174.4	178.8	11.5	0	0	0	111.4	Q158 F159	N156-Q158 PolarHBondContact ND2-OE1 3.28Å; N156-Q158 VanDerWaalsContact ND2-OE1 3.16Å; N156-Q158 PolarHBondContact O-N 2.85Å; N156-Q158 WeakPolarHBondContact OD1-CG 3.36Å; N156-Q158 PolarHBondContact OD1-N 2.99Å; N156-F159 PolarHBondContact O-N 3.03Å
157	H	77.4	Confident	80	Confident	92 Å²	92	51 Å²	51	43%	0.426	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	7.3	-179.2	-42.1	148	0	0	0	116.6	L146 T149 E155	L146-H157 HydrophobicContact CD1-CB 4.37Å; T149-H157 VanDerWaalsContact O-CA 3.24Å; T149-H157 WeakPolarHBondContact O-CA 3.26Å; T149-H157 WeakPolarHBondContact O-CB 3.47Å; T149-H157 PolarHBondContact O-CD2 3.39Å; T149-H157 PolarHBondContact OG1-O 3.08Å; E155-H157 PolarHBondContact O-N 2.9Å
158	Q	78.6	Confident	80.1	Confident	125 Å²	125	48.9 Å²	48.9	58%	0.584	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-12.7	173	-68.1	176.7	-18	0	0	113.4	N156 V208	N156-Q158 PolarHBondContact ND2-OE1 3.28Å; N156-Q158 VanDerWaalsContact ND2-OE1 3.16Å; N156-Q158 PolarHBondContact O-N 2.85Å; N156-Q158 WeakPolarHBondContact OD1-CG 3.36Å; N156-Q158 PolarHBondContact OD1-N 2.99Å; Q158-V208 WeakPolarHBondContact O-CG2 3.34Å
159	F	82.9	Confident	80.1	Confident	48 Å²	48	48.8 Å²	48.8	21%	0.211	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	145.1	-178.8	-54.7	-93.8	0	0	0	109.2	N156 S161 P204 A206 R207	N156-F159 PolarHBondContact O-N 3.03Å; F159-S161 PolarHBondContact O-N 2.95Å; F159-P204 HydrophobicContact CB-CG 4.27Å; F159-P204 HydrophobicContact CD1-CG 3.67Å; F159-P204 HydrophobicContact CD2-CB 4.48Å; F159-P204 HydrophobicContact CD2-CG 3.7Å; F159-P204 HydrophobicContact CE1-CG 3.84Å; F159-P204 HydrophobicContact CE2-CG 3.89Å; F159-P204 HydrophobicContact CG-CB 4.41Å; F159-P204 HydrophobicContact CG-CG 3.6Å; F159-P204 HydrophobicContact CZ-CG 3.96Å; F159-A206 CarbonylContact C-O 3.6Å; F159-A206 VanDerWaalsContact CA-O 3.22Å; F159-A206 WeakPolarHBondContact CA-O 3.23Å; F159-R207 HydrophobicContact CD1-CG 3.97Å; F159-R207 HydrophobicContact CE1-CG 3.83Å
160	L	85	Confident	80.1	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.01	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	108.4	162.2	178.5	69.7	0	0	0	107.4	F148 T149 E164 I168 G205 A206 V211 V214	F148-L160 HydrophobicContact CB-CD1 4.16Å; F148-L160 VanDerWaalsContact O-CD1 3.28Å; F148-L160 WeakPolarHBondContact O-CD1 3.22Å; T149-L160 HydrophobicContact CG2-CB 4.03Å; L160-E164 HydrophobicContact CD1-CB 3.64Å; L160-I168 HydrophobicContact CD1-CD1 3.81Å; L160-I168 HydrophobicContact CD2-CD1 4.33Å; L160-G205 CarbonylContact O-C 3.42Å; L160-G205 WeakPolarHBondContact O-CA 3.09Å; L160-A206 HydrophobicContact CB-CB 4.36Å; L160-A206 PolarHBondContact N-O 3.24Å; L160-A206 PolarHBondContact O-N 3.15Å; L160-V211 HydrophobicContact CB-CG2 3.72Å; L160-V211 HydrophobicContact CD2-CG2 4.11Å; L160-V214 HydrophobicContact CD2-CG1 4.27Å
161	S	83.6	Confident	80.2	Confident	13 Å²	13	52.4 Å²	52.4	9%	0.091	28%	0.278	C	S	.	.			trans	-75.8	172	-174.9	80.3	0	0	0	0	113.1	E155 F159 S163 E164 T165	E155-S161 WeakPolarHBondContact OE2-CB 3.39Å; E155-S161 PolarHBondContact OE2-OG 2.87Å; F159-S161 PolarHBondContact O-N 2.95Å; S161-S163 VanDerWaalsContact C-N 3.31Å; S161-S163 PolarHBondContact O-N 3.26Å; S161-S163 PolarHBondContact OG-N 3Å; S161-S163 PolarHBondContact OG-OG 2.8Å; S161-E164 PolarHBondContact N-OE2 2.92Å; S161-E164 WeakPolarHBondContact OG-CG 3.31Å; S161-E164 PolarHBondContact OG-N 3.42Å; S161-T165 VanDerWaalsContact O-CB 3.32Å; S161-T165 WeakPolarHBondContact O-CB 3.44Å; S161-T165 PolarHBondContact O-N 2.97Å; S161-T165 PolarHBondContact O-OG1 3.42Å
162	H	79.9	Confident	80.4	Confident	68 Å²	68	50.2 Å²	50.2	32%	0.315	27%	0.267	S	S	.	.	H	α-helix	trans	-61.2	-38.8	169.2	-75.1	-79.9	0	0	0	112.3	T165 E166 L195	H162-T165 PolarHBondContact O-N 3.31Å; H162-E166 WeakPolarHBondContact O-CG 3.42Å; H162-E166 PolarHBondContact O-N 3.28Å; H162-L195 WeakPolarHBondContact ND1-CD1 3.25Å
163	S	77.2	Confident	80.7	Confident	48 Å²	48	50.5 Å²	50.5	34%	0.336	27%	0.268	S	S	.	.	H	α-helix	trans	-72.2	-37.2	179.7	29.4	0	0	0	0	112.7	E155 S161 E166 S167	E155-S163 VanDerWaalsContact CD-OG 3.24Å; E155-S163 WeakPolarHBondContact OE1-CB 3.31Å; E155-S163 PolarHBondContact OE1-OG 3.4Å; E155-S163 PolarHBondContact OE2-OG 3.38Å; E155-S163 VanDerWaalsContact OE2-OG 3.05Å; S161-S163 VanDerWaalsContact C-N 3.31Å; S161-S163 PolarHBondContact O-N 3.26Å; S161-S163 PolarHBondContact OG-N 3Å; S161-S163 PolarHBondContact OG-OG 2.8Å; S163-E166 PolarHBondContact O-N 3.26Å; S163-S167 WeakPolarHBondContact O-CB 3.33Å; S163-S167 PolarHBondContact O-N 3.46Å; S163-S167 PolarHBondContact O-OG 3.17Å
164	E	83.9	Confident	81	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-67.9	-40.8	171.2	-68.1	-175.5	127	0	0	111.4	T149 S150 L151 N152 L160 S161 E166 S167 I168	T149-E164 WeakPolarHBondContact CA-OE1 3.24Å; S150-E164 PolarHBondContact N-OE1 2.54Å; S150-E164 VanDerWaalsContact N-OE1 3.14Å; L151-E164 HydrophobicContact CB-CG 4.38Å; L151-E164 PolarHBondContact N-OE1 2.79Å; L151-E164 VanDerWaalsContact N-OE1 3.15Å; N152-E164 HydrophobicContact CB-CG 4.46Å; L160-E164 HydrophobicContact CD1-CB 3.64Å; S161-E164 PolarHBondContact N-OE2 2.92Å; S161-E164 WeakPolarHBondContact OG-CG 3.31Å; S161-E164 PolarHBondContact OG-N 3.42Å; E164-E166 VanDerWaalsContact C-N 3.33Å; E164-E166 PolarHBondContact O-N 3.01Å; E164-S167 WeakPolarHBondContact O-CB 3Å; E164-S167 PolarHBondContact O-N 3.01Å; E164-S167 VanDerWaalsContact O-N 3.12Å; E164-I168 WeakPolarHBondContact O-CG1 3.01Å; E164-I168 PolarHBondContact O-N 3.06Å
165	T	84.9	Confident	81.4	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.006	22%	0.222	C	C	.	.	H	α-helix	trans	-59.8	-43.1	172.9	-56.8	0	0	0	0	111.2	S161 H162 S167 I168 L169 L194 L195	S161-T165 VanDerWaalsContact O-CB 3.32Å; S161-T165 WeakPolarHBondContact O-CB 3.44Å; S161-T165 PolarHBondContact O-N 2.97Å; S161-T165 PolarHBondContact O-OG1 3.42Å; H162-T165 PolarHBondContact O-N 3.31Å; T165-S167 VanDerWaalsContact C-N 3.33Å; T165-S167 PolarHBondContact O-N 3.11Å; T165-I168 PolarHBondContact O-N 3.02Å; T165-L169 WeakPolarHBondContact O-CG 3.23Å; T165-L169 PolarHBondContact O-N 2.91Å; T165-L194 HydrophobicContact CG2-CD2 4.11Å; T165-L195 HydrophobicContact CG2-CD1 4.33Å; T165-L195 HydrophobicContact CG2-CG 4.47Å
166	E	82.2	Confident	81.8	Confident	30 Å²	30	41.4 Å²	41.4	14%	0.14	21%	0.21	C	C	.	.	H	α-helix	trans	-64.2	-36	173.5	-75.5	-178.2	174.8	0	0	112.9	H162 S163 E164 L169 L170 S191 R231	H162-E166 WeakPolarHBondContact O-CG 3.42Å; H162-E166 PolarHBondContact O-N 3.28Å; S163-E166 PolarHBondContact O-N 3.26Å; E164-E166 VanDerWaalsContact C-N 3.33Å; E164-E166 PolarHBondContact O-N 3.01Å; E166-L169 PolarHBondContact O-N 3.23Å; E166-L170 WeakPolarHBondContact O-CB 3.32Å; E166-L170 WeakPolarHBondContact O-CG 3.46Å; E166-L170 PolarHBondContact O-N 3.43Å; E166-S191 WeakPolarHBondContact CG-OG 3.41Å; E166-S191 PolarHBondContact OE1-OG 3.26Å; E166-R231 WeakPolarHBondContact OE1-CD 3.29Å; E166-R231 WeakPolarHBondContact OE1-CG 3.46Å
167	S	85.1	Confident	81.7	Confident	31 Å²	31	41.8 Å²	41.8	22%	0.217	21%	0.212	C	C	.	.	H	α-helix	trans	-64.9	-40.7	174.9	-56.8	0	0	0	0	111.7	S163 E164 T165 L170 L171	S163-S167 WeakPolarHBondContact O-CB 3.33Å; S163-S167 PolarHBondContact O-N 3.46Å; S163-S167 PolarHBondContact O-OG 3.17Å; E164-S167 WeakPolarHBondContact O-CB 3Å; E164-S167 PolarHBondContact O-N 3.01Å; E164-S167 VanDerWaalsContact O-N 3.12Å; T165-S167 VanDerWaalsContact C-N 3.33Å; T165-S167 PolarHBondContact O-N 3.11Å; S167-L170 PolarHBondContact O-N 2.95Å; S167-L171 WeakPolarHBondContact O-CG 3.44Å; S167-L171 PolarHBondContact O-N 2.89Å
168	I	87.4	Confident	81.4	Confident	3 Å²	3	39.4 Å²	39.4	2%	0.015	21%	0.205	C	C	.	.	H	α-helix	trans	-61.4	-47.4	172.4	-68.4	168.8	0	0	0	110.6	L114 I118 F148 L151 L160 E164 T165 L170 L171 I172 I218	L114-I168 HydrophobicContact CD1-CG2 4.17Å; L114-I168 HydrophobicContact CD2-CG2 4.32Å; I118-I168 HydrophobicContact CG2-CG2 4.26Å; F148-I168 HydrophobicContact CB-CD1 4.13Å; F148-I168 HydrophobicContact CD1-CD1 3.68Å; F148-I168 HydrophobicContact CD1-CG1 4.23Å; F148-I168 HydrophobicContact CE1-CD1 4.49Å; F148-I168 HydrophobicContact CG-CD1 4.21Å; L151-I168 HydrophobicContact CD1-CD1 4.14Å; L151-I168 HydrophobicContact CD1-CG1 3.52Å; L160-I168 HydrophobicContact CD1-CD1 3.81Å; L160-I168 HydrophobicContact CD2-CD1 4.33Å; E164-I168 WeakPolarHBondContact O-CG1 3.01Å; E164-I168 PolarHBondContact O-N 3.06Å; T165-I168 PolarHBondContact O-N 3.02Å; I168-L170 VanDerWaalsContact C-N 3.33Å; I168-L170 PolarHBondContact O-N 3.32Å; I168-L171 PolarHBondContact O-N 2.7Å; I168-I172 HydrophobicContact CG2-CD1 3.8Å; I168-I172 WeakPolarHBondContact O-CD1 3.26Å; I168-I172 VanDerWaalsContact O-CG1 3.3Å; I168-I172 WeakPolarHBondContact O-CG1 3.3Å; I168-I172 PolarHBondContact O-N 3.04Å; I168-I218 HydrophobicContact CG2-CD1 4.04Å
169	L	86.9	Confident	80.4	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.7	-36.5	177.9	-65.6	-176.8	0	0	0	112.6	T165 E166 I172 N173 L194 F228	T165-L169 WeakPolarHBondContact O-CG 3.23Å; T165-L169 PolarHBondContact O-N 2.91Å; E166-L169 PolarHBondContact O-N 3.23Å; L169-I172 HydrophobicContact CD2-CD1 4.2Å; L169-N173 WeakPolarHBondContact O-CB 3.45Å; L169-N173 PolarHBondContact O-N 2.83Å; L169-N173 VanDerWaalsContact O-N 3.1Å; L169-L194 HydrophobicContact CD2-CD2 4.28Å; L169-F228 HydrophobicContact CD2-CB 4.11Å; L169-F228 HydrophobicContact CD2-CD1 3.55Å; L169-F228 HydrophobicContact CD2-CE1 4.09Å; L169-F228 HydrophobicContact CD2-CG 3.82Å
170	L	83.6	Confident	78.9	Confident	78 Å²	78	42.6 Å²	42.6	41%	0.408	24%	0.235	S	C	.	.	H	α-helix	trans	-62.7	-45.1	172.7	-80.6	163.6	0	0	0	111.9	E166 S167 I168 N173 Q174 P230	E166-L170 WeakPolarHBondContact O-CB 3.32Å; E166-L170 WeakPolarHBondContact O-CG 3.46Å; E166-L170 PolarHBondContact O-N 3.43Å; S167-L170 PolarHBondContact O-N 2.95Å; I168-L170 VanDerWaalsContact C-N 3.33Å; I168-L170 PolarHBondContact O-N 3.32Å; L170-N173 PolarHBondContact O-N 3.38Å; L170-Q174 WeakPolarHBondContact O-CG 3.42Å; L170-Q174 PolarHBondContact O-N 2.96Å; L170-P230 HydrophobicContact CD1-CB 4.42Å; L170-P230 HydrophobicContact CD2-CB 3.78Å; L170-P230 HydrophobicContact CD2-CG 3.5Å; L170-P230 HydrophobicContact CG-CB 3.65Å; L170-P230 HydrophobicContact CG-CG 3.9Å
171	L	84.7	Confident	77.1	Confident	50 Å²	50	51.2 Å²	51.2	26%	0.262	27%	0.273	S	S	.	.	H	α-helix	trans	-64	-43.5	177.6	-72	168	0	0	0	111.8	I118 S167 I168 N173 Q174	I118-L171 HydrophobicContact CB-CB 4.14Å; I118-L171 HydrophobicContact CB-CD1 4.28Å; I118-L171 HydrophobicContact CG2-CB 4.04Å; S167-L171 WeakPolarHBondContact O-CG 3.44Å; S167-L171 PolarHBondContact O-N 2.89Å; I168-L171 PolarHBondContact O-N 2.7Å; L171-N173 PolarHBondContact O-N 3.33Å; L171-Q174 WeakPolarHBondContact O-CB 3.32Å; L171-Q174 PolarHBondContact O-N 3.03Å
172	I	85.1	Confident	75.2	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-57.4	-48.8	175.3	-67.9	160.3	0	0	0	110.6	L114 I117 I118 I168 L169 Q174 H175 Y176 I218 I222 F228	L114-I172 HydrophobicContact CD1-CD1 3.89Å; L114-I172 HydrophobicContact CD1-CG1 4.3Å; I117-I172 HydrophobicContact CG2-CG1 4.26Å; I118-I172 HydrophobicContact CG2-CG1 4.08Å; I168-I172 HydrophobicContact CG2-CD1 3.8Å; I168-I172 WeakPolarHBondContact O-CD1 3.26Å; I168-I172 VanDerWaalsContact O-CG1 3.3Å; I168-I172 WeakPolarHBondContact O-CG1 3.3Å; I168-I172 PolarHBondContact O-N 3.04Å; L169-I172 HydrophobicContact CD2-CD1 4.2Å; I172-Q174 PolarHBondContact O-N 3.42Å; I172-Q174 VanDerWaalsContact O-N 3.08Å; I172-H175 PolarHBondContact O-N 3Å; I172-Y176 HydrophobicContact CG2-CD1 4.17Å; I172-Y176 HydrophobicContact CG2-CG 4.26Å; I172-Y176 WeakPolarHBondContact O-CB 3.31Å; I172-Y176 PolarHBondContact O-N 3.27Å; I172-I218 HydrophobicContact CD1-CG2 3.53Å; I172-I222 HydrophobicContact CG2-CD1 4.13Å; I172-F228 HydrophobicContact CG2-CD2 4.24Å; I172-F228 HydrophobicContact CG2-CE2 4.35Å
173	N	82.3	Confident	73.5	Confident	51 Å²	51	62.2 Å²	62.2	27%	0.273	33%	0.329	S	S	.	.	H	α-helix	trans	-64.7	-10.5	-179	-82	-4.9	0	0	0	114.6	L169 L170 L171 H175 F228 P230	L169-N173 WeakPolarHBondContact O-CB 3.45Å; L169-N173 PolarHBondContact O-N 2.83Å; L169-N173 VanDerWaalsContact O-N 3.1Å; L170-N173 PolarHBondContact O-N 3.38Å; L171-N173 PolarHBondContact O-N 3.33Å; N173-H175 VanDerWaalsContact C-N 3.3Å; N173-F228 PolarHBondContact ND2-O 2.86Å; N173-P230 WeakPolarHBondContact ND2-CD 3.43Å
174	Q	78.1	Confident	71.7	Confident	111 Å²	111	71.7 Å²	71.7	52%	0.519	36%	0.357	S	S	.	.	H	α-helix	trans	-70.5	-29.3	169.9	-59.1	-171.1	11.9	0	0	112.3	R73 L170 L171 I172	R73-Q174 PolarHBondContact NH2-O 3.29Å; L170-Q174 WeakPolarHBondContact O-CG 3.42Å; L170-Q174 PolarHBondContact O-N 2.96Å; L171-Q174 WeakPolarHBondContact O-CB 3.32Å; L171-Q174 PolarHBondContact O-N 3.03Å; I172-Q174 PolarHBondContact O-N 3.42Å; I172-Q174 VanDerWaalsContact O-N 3.08Å
175	H	74.8	Confident	70	Confident	22 Å²	22	75.1 Å²	75.1	10%	0.102	39%	0.393	C	S	.	.	H	α-helix	trans	-115.4	-39.5	-172.4	-60.6	-45.3	0	0	0	112.4	V68 L120 I172 N173	V68-H175 VanDerWaalsContact O-O 3.1Å; L120-H175 HydrophobicContact CD2-CB 4.48Å; I172-H175 PolarHBondContact O-N 3Å; N173-H175 VanDerWaalsContact C-N 3.3Å
176	Y	81.1	Confident	68.5	Low	7 Å²	7	82.9 Å²	82.9	3%	0.027	43%	0.427	C	S	.	.			trans	-79.6	135.8	176.5	177.5	-117.2	0	0	0	112.3	D67 V68 I172 I222 G225 H226 F228	D67-Y176 WeakPolarHBondContact O-CD2 3.19Å; V68-Y176 HydrophobicContact CG1-CD2 4.36Å; I172-Y176 HydrophobicContact CG2-CD1 4.17Å; I172-Y176 HydrophobicContact CG2-CG 4.26Å; I172-Y176 WeakPolarHBondContact O-CB 3.31Å; I172-Y176 PolarHBondContact O-N 3.27Å; Y176-I222 HydrophobicContact CD2-CG2 4.01Å; Y176-I222 HydrophobicContact CE2-CB 4.48Å; Y176-I222 HydrophobicContact CE2-CG2 3.86Å; Y176-G225 VanDerWaalsContact OH-CA 3.3Å; Y176-G225 WeakPolarHBondContact OH-CA 3.27Å; Y176-G225 PolarHBondContact OH-O 3.39Å; Y176-H226 WeakPolarHBondContact CE1-O 3.5Å; Y176-H226 PolarHBondContact OH-N 2.84Å; Y176-H226 PolarHBondContact OH-O 3.06Å; Y176-F228 HydrophobicContact CD1-CD2 4.06Å; Y176-F228 HydrophobicContact CD1-CE2 4.22Å; Y176-F228 AromaticContact CE1-CD2 3.95Å; Y176-F228 HydrophobicContact CE1-CD2 3.95Å; Y176-F228 AromaticContact CE1-CE2 3.93Å; Y176-F228 HydrophobicContact CE1-CE2 3.93Å
177	N	71.7	Confident	67.6	Low	97 Å²	97	89.6 Å²	89.6	52%	0.519	46%	0.458	S	S	.	.			trans	-136.6	116.9	171.4	-173.2	25	0	0	0	108.4	H69	H69-N177 PolarHBondContact CE1-O 3.35Å
178	P	70.6	Confident	67.1	Low	42 Å²	42	90.2 Å²	90.2	27%	0.273	46%	0.462	S	S	.	.			trans	-61.8	138.7	-177.9	26.9	-36.7	0	0	0	111	N180 C227	P178-N180 PolarHBondContact O-N 3.07Å; P178-C227 HydrophobicContact CB-CB 4.3Å; P178-C227 HydrophobicContact CG-CB 3.89Å
179	S	57.3	Low	66.8	Low	86 Å²	86	90.9 Å²	90.9	60%	0.601	47%	0.466	S	S	*	.			trans	-60.7	134.9	-179.9	-86.4	0	0	0	0	111.5	K181	S179-K181 PolarHBondContact O-N 2.9Å
180	N	51.2	Low	66.5	Low	155 Å²	155	94.3 Å²	94.3	83%	0.829	48%	0.481	S	S	*	.	S	Bend	trans	-73.7	33.8	-166.1	-152.8	10.3	0	0	0	115.2	P178	P178-N180 PolarHBondContact O-N 3.07Å
181	K	47.1	Very low	66.2	Low	182 Å²	182	90.7 Å²	90.7	79%	0.791	46%	0.463	S	S	*	.	S	Bend	trans	-98	116.3	176	-74.8	-177.9	176.1	176.3	0	109.7	S179	S179-K181 PolarHBondContact O-N 2.9Å
182	D	44.3	Very low	65.7	Low	130 Å²	130	90.4 Å²	90.4	70%	0.695	47%	0.468	S	S	*	.			trans	65.2	57.4	166.8	-55.3	-46.7	0	0	0	116.8	R184	D182-R184 PolarHBondContact O-N 3.42Å
183	M	44.3	Very low	65.3	Low	182 Å²	182	95.3 Å²	95.3	90%	0.897	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	37.2	163	-156.3	-170.4	-172.5	0	0	113.6
184	R	39.8	Very low	65.3	Low	247 Å²	247	92.9 Å²	92.9	93%	0.932	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.6	65.4	174.9	-76.2	-162.6	-75.8	-149.9	-4.5	110.6	D182	D182-R184 PolarHBondContact O-N 3.42Å
185	G	47.8	Very low	65.3	Low	72 Å²	72	87.7 Å²	87.7	74%	0.742	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	167.5	-31	169.2	0	0	0	0	0	115.9
186	F	53.1	Low	65.4	Low	164 Å²	164	92.9 Å²	92.9	72%	0.719	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-93.6	126	-173.3	-66.3	-79.7	0	0	0	112.9
187	Q	63.4	Low	65	Low	172 Å²	172	94.1 Å²	94.1	80%	0.804	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-82	129.6	170.4	-175.2	170.6	-7.9	0	0	108.6
188	C	75.4	Confident	65.1	Low	44 Å²	44	90 Å²	90	30%	0.297	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-68.5	147.6	-179.4	-62.1	0	0	0	0	111.9	H190 C227 A229	C188-H190 PolarHBondContact O-N 2.98Å; C188-C227 CarbonylContact C-O 3.45Å; C188-C227 WeakPolarHBondContact CA-O 3.43Å; C188-C227 WeakPolarHBondContact CA-SG 3.45Å; C188-C227 HydrophobicContact CB-CB 3.97Å; C188-C227 WeakPolarHBondContact CB-O 3.21Å; C188-C227 WeakPolarHBondContact CB-SG 3.47Å; C188-C227 WeakPolarHBondContact SG-CB 3.41Å; C188-C227 CovalentContact SG-SG 2.04Å; C188-C227 PolarHBondContact SG-SG 2.72Å; C188-A229 HydrophobicContact CB-CB 3.59Å
189	I	79.9	Confident	64.9	Low	17 Å²	17	94.2 Å²	94.2	9%	0.087	48%	0.482	C	S	.	.	B	Isolated β-bridge	trans	-75.4	126.2	-177	-57.6	173.9	0	0	0	109.1	L194 N221 H226 C227 F228 A229	I189-L194 HydrophobicContact CG2-CB 4.17Å; I189-N221 HydrophobicContact CD1-CB 4Å; I189-N221 VanDerWaalsContact CD1-CG 3.41Å; I189-N221 WeakPolarHBondContact CD1-OD1 3.49Å; I189-H226 HydrophobicContact CD1-CB 3.83Å; I189-C227 PolarHBondContact N-O 2.95Å; I189-F228 HydrophobicContact CB-CD1 4.09Å; I189-F228 HydrophobicContact CB-CE1 4.44Å; I189-F228 HydrophobicContact CD1-CE1 4.49Å; I189-F228 HydrophobicContact CG2-CD1 4.39Å; I189-F228 WeakPolarHBondContact O-CA 3.37Å; I189-A229 PolarHBondContact O-N 3.49Å
190	H	80.3	Confident	65.4	Low	72 Å²	72	91.1 Å²	91.1	33%	0.333	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-98.7	157.5	174.7	-65.1	-69.5	0	0	0	110.8	C188 A192 H193 L194 A229	C188-H190 PolarHBondContact O-N 2.98Å; H190-A192 PolarHBondContact O-N 3.17Å; H190-H193 PolarHBondContact O-N 2.95Å; H190-H193 VanDerWaalsContact O-N 3.12Å; H190-L194 PolarHBondContact O-N 2.76Å; H190-A229 VanDerWaalsContact CE1-CB 3.43Å; H190-A229 WeakPolarHBondContact CE1-CB 3.23Å; H190-A229 PolarHBondContact ND1-O 3.12Å
191	S	77.4	Confident	65.4	Low	2 Å²	2	90.3 Å²	90.3	1%	0.014	46%	0.455	C	S	.	.	H	α-helix	trans	-46.4	-42.4	173.3	51.5	0	0	0	0	113.8	E166 L195	E166-S191 WeakPolarHBondContact CG-OG 3.41Å; E166-S191 PolarHBondContact OE1-OG 3.26Å; S191-L195 WeakPolarHBondContact O-CG 3.24Å; S191-L195 PolarHBondContact O-N 2.79Å
192	A	74.8	Confident	65.9	Low	44 Å²	44	83.5 Å²	83.5	36%	0.364	44%	0.436	S	S	.	.	H	α-helix	trans	-64.6	-50.4	178	0	0	0	0	0	112.7	H190 L194 L195 E196	H190-A192 PolarHBondContact O-N 3.17Å; A192-L194 VanDerWaalsContact C-N 3.29Å; A192-L194 PolarHBondContact O-N 2.97Å; A192-L195 PolarHBondContact O-N 3.38Å; A192-E196 WeakPolarHBondContact O-CB 3.33Å; A192-E196 PolarHBondContact O-N 2.92Å
193	H	77.7	Confident	66.5	Low	102 Å²	102	84.6 Å²	84.6	47%	0.472	44%	0.442	S	S	.	.	H	α-helix	trans	-63.5	-36.4	179.3	-175.7	-72.9	0	0	0	111.7	H190 L195 E197	H190-H193 PolarHBondContact O-N 2.95Å; H190-H193 VanDerWaalsContact O-N 3.12Å; H193-L195 VanDerWaalsContact C-N 3.31Å; H193-L195 PolarHBondContact O-N 3.36Å; H193-E197 IonicContact CE1-OE2 2.65Å; H193-E197 IonicContact ND1-OE2 3.13Å; H193-E197 VanDerWaalsContact O-CB 3.28Å; H193-E197 WeakPolarHBondContact O-CB 3.43Å; H193-E197 PolarHBondContact O-N 2.93Å
194	L	81	Confident	67.4	Low	0 Å²	0	79 Å²	79	0%	0	42%	0.419	C	S	.	.	H	α-helix	trans	-64.9	-33.4	176.9	-177.9	69.5	0	0	0	112.7	T165 L169 I189 H190 A192 V198 V214 A217 I218	T165-L194 HydrophobicContact CG2-CD2 4.11Å; L169-L194 HydrophobicContact CD2-CD2 4.28Å; I189-L194 HydrophobicContact CG2-CB 4.17Å; H190-L194 PolarHBondContact O-N 2.76Å; A192-L194 VanDerWaalsContact C-N 3.29Å; A192-L194 PolarHBondContact O-N 2.97Å; L194-V198 VanDerWaalsContact O-CG2 3.31Å; L194-V198 WeakPolarHBondContact O-CG2 3.36Å; L194-V214 HydrophobicContact CD2-CG1 4.23Å; L194-V214 HydrophobicContact CG-CG1 4.49Å; L194-A217 HydrophobicContact CD1-CB 3.81Å; L194-I218 HydrophobicContact CD1-CG1 4.18Å; L194-I218 HydrophobicContact CD2-CD1 3.96Å; L194-I218 HydrophobicContact CD2-CG1 3.63Å
195	L	79.1	Confident	69.1	Low	2 Å²	2	67.5 Å²	67.5	1%	0.01	38%	0.378	C	S	.	.	H	α-helix	trans	-82.8	-35.9	178.3	-70.7	165.5	0	0	0	111.8	H162 T165 S191 A192 H193 E197 V198 V200 A206 V214	H162-L195 WeakPolarHBondContact ND1-CD1 3.25Å; T165-L195 HydrophobicContact CG2-CD1 4.33Å; T165-L195 HydrophobicContact CG2-CG 4.47Å; S191-L195 WeakPolarHBondContact O-CG 3.24Å; S191-L195 PolarHBondContact O-N 2.79Å; A192-L195 PolarHBondContact O-N 3.38Å; H193-L195 VanDerWaalsContact C-N 3.31Å; H193-L195 PolarHBondContact O-N 3.36Å; L195-E197 VanDerWaalsContact C-N 3.35Å; L195-V198 PolarHBondContact O-N 2.97Å; L195-V200 HydrophobicContact CB-CB 4.49Å; L195-V200 WeakPolarHBondContact O-CB 3.42Å; L195-V200 PolarHBondContact O-N 3.2Å; L195-V200 VanDerWaalsContact O-N 3.09Å; L195-A206 HydrophobicContact CD2-CB 3.91Å; L195-V214 HydrophobicContact CD2-CG2 4.13Å
196	E	76.2	Confident	70.7	Confident	132 Å²	132	64.1 Å²	64.1	62%	0.617	34%	0.342	S	S	*	.	H	α-helix	trans	-60.8	-41	170.2	-172.1	178.2	-179.6	0	0	111.4	A192 V198 D199	A192-E196 WeakPolarHBondContact O-CB 3.33Å; A192-E196 PolarHBondContact O-N 2.92Å; E196-V198 PolarHBondContact O-N 3.47Å; E196-D199 PolarHBondContact O-N 3.39Å
197	E	73	Confident	72.1	Confident	33 Å²	33	64.3 Å²	64.3	15%	0.154	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-23	175.9	-169.7	179.2	153.4	0	0	113.5	W30 Y32 H193 L195	W30-E197 HydrophobicContact CG-CG 4.44Å; Y32-E197 PolarHBondContact OH-O 2.84Å; H193-E197 IonicContact CE1-OE2 2.65Å; H193-E197 IonicContact ND1-OE2 3.13Å; H193-E197 VanDerWaalsContact O-CB 3.28Å; H193-E197 WeakPolarHBondContact O-CB 3.43Å; H193-E197 PolarHBondContact O-N 2.93Å; L195-E197 VanDerWaalsContact C-N 3.35Å
198	V	74.3	Confident	73.1	Confident	11 Å²	11	57.5 Å²	57.5	7%	0.067	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	9.7	-177	-178.8	0	0	0	0	112.4	L194 L195 E196 V200 K213 V214 A217	L194-V198 VanDerWaalsContact O-CG2 3.31Å; L194-V198 WeakPolarHBondContact O-CG2 3.36Å; L195-V198 PolarHBondContact O-N 2.97Å; E196-V198 PolarHBondContact O-N 3.47Å; V198-V200 VanDerWaalsContact C-N 3.32Å; V198-V200 HydrophobicContact CB-CG2 4.17Å; V198-V200 HydrophobicContact CG1-CG2 3.98Å; V198-K213 HydrophobicContact CG1-CB 3.55Å; V198-K213 HydrophobicContact CG1-CD 3.94Å; V198-K213 HydrophobicContact CG1-CG 4.45Å; V198-V214 HydrophobicContact CB-CG2 4.46Å; V198-V214 HydrophobicContact CG1-CG2 4Å; V198-V214 HydrophobicContact CG2-CG2 4.35Å; V198-A217 HydrophobicContact CG2-CB 4.09Å
199	D	65.1	Low	73.4	Confident	129 Å²	129	59.3 Å²	59.3	69%	0.69	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.4	35.2	-177.1	-163.3	45.3	0	0	0	112.9	E196	E196-D199 PolarHBondContact O-N 3.39Å
200	V	67.6	Low	73.6	Confident	21 Å²	21	60.1 Å²	60.1	13%	0.127	33%	0.331	C	S	.	.			trans	-104.4	62.8	178.5	-169.7	0	0	0	0	110.6	L195 V198 G202 A206	L195-V200 HydrophobicContact CB-CB 4.49Å; L195-V200 WeakPolarHBondContact O-CB 3.42Å; L195-V200 PolarHBondContact O-N 3.2Å; L195-V200 VanDerWaalsContact O-N 3.09Å; V198-V200 VanDerWaalsContact C-N 3.32Å; V198-V200 HydrophobicContact CB-CG2 4.17Å; V198-V200 HydrophobicContact CG1-CG2 3.98Å; V200-G202 PolarHBondContact O-N 3.1Å; V200-A206 VanDerWaalsContact CG1-CA 3.5Å; V200-A206 HydrophobicContact CG1-CB 3.99Å; V200-A206 HydrophobicContact CG2-CB 4.14Å
201	D	52.3	Low	74	Confident	139 Å²	139	56.9 Å²	56.9	74%	0.743	32%	0.316	S	S	*	.			trans	-76.5	81.3	173.8	-89.2	-9.8	0	0	0	111.4
202	G	56	Low	74.5	Confident	38 Å²	38	57.3 Å²	57.3	39%	0.392	32%	0.319	S	S	.	.	S	Bend	trans	167.8	134.3	166.3	0	0	0	0	0	117.4	V200 G205	V200-G202 PolarHBondContact O-N 3.1Å; G202-G205 PolarHBondContact O-N 3.02Å
203	N	57.6	Low	75.1	Confident	154 Å²	154	58.9 Å²	58.9	82%	0.824	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	119.8	157.5	-161.2	19	0	0	0	107.6
204	P	63.5	Low	75.6	Confident	64 Å²	64	54.2 Å²	54.2	42%	0.416	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	cis	-102.1	2.4	33.3	38.7	-37.7	0	0	0	117.8	F159	F159-P204 HydrophobicContact CB-CG 4.27Å; F159-P204 HydrophobicContact CD1-CG 3.67Å; F159-P204 HydrophobicContact CD2-CB 4.48Å; F159-P204 HydrophobicContact CD2-CG 3.7Å; F159-P204 HydrophobicContact CE1-CG 3.84Å; F159-P204 HydrophobicContact CE2-CG 3.89Å; F159-P204 HydrophobicContact CG-CB 4.41Å; F159-P204 HydrophobicContact CG-CG 3.6Å; F159-P204 HydrophobicContact CZ-CG 3.96Å
205	G	75.8	Confident	76	Confident	6 Å²	6	54.2 Å²	54.2	6%	0.062	30%	0.297	C	S	.	.			trans	123.6	-166	-177.9	0	0	0	0	0	114.1	L160 G202	L160-G205 CarbonylContact O-C 3.42Å; L160-G205 WeakPolarHBondContact O-CA 3.09Å; G202-G205 PolarHBondContact O-N 3.02Å
206	A	82	Confident	76.5	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	135.4	-174.3	0	0	0	0	0	111.6	F159 L160 L195 V200 D210 V214	F159-A206 CarbonylContact C-O 3.6Å; F159-A206 VanDerWaalsContact CA-O 3.22Å; F159-A206 WeakPolarHBondContact CA-O 3.23Å; L160-A206 HydrophobicContact CB-CB 4.36Å; L160-A206 PolarHBondContact N-O 3.24Å; L160-A206 PolarHBondContact O-N 3.15Å; L195-A206 HydrophobicContact CD2-CB 3.91Å; V200-A206 VanDerWaalsContact CG1-CA 3.5Å; V200-A206 HydrophobicContact CG1-CB 3.99Å; V200-A206 HydrophobicContact CG2-CB 4.14Å; A206-D210 HydrophobicContact CB-CB 4.48Å; A206-V214 HydrophobicContact CB-CG2 4.08Å
207	R	82.6	Confident	77	Confident	168 Å²	168	47.9 Å²	47.9	63%	0.634	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.5	155.8	175.3	-61.9	174.9	-179	-177.3	2.2	109.8	F159 A209 D210 V211	F159-R207 HydrophobicContact CD1-CG 3.97Å; F159-R207 HydrophobicContact CE1-CG 3.83Å; R207-A209 PolarHBondContact O-N 3.19Å; R207-D210 PolarHBondContact O-N 3.21Å; R207-V211 PolarHBondContact O-N 3.5Å
208	V	82.8	Confident	77.7	Confident	29 Å²	29	46.3 Å²	46.3	18%	0.176	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.6	-33.1	174.7	-177.9	0	0	0	0	113	L145 T149 Q158	L145-V208 HydrophobicContact CB-CG1 4.01Å; L145-V208 HydrophobicContact CD1-CG1 3.92Å; L145-V208 HydrophobicContact CG-CG1 4.5Å; T149-V208 HydrophobicContact CG2-CG2 4.42Å; Q158-V208 WeakPolarHBondContact O-CG2 3.34Å
209	A	81.6	Confident	78.4	Confident	82 Å²	82	45.8 Å²	45.8	68%	0.678	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-22.7	177.5	0	0	0	0	0	114.8	R207 P212	R207-A209 PolarHBondContact O-N 3.19Å; A209-P212 WeakPolarHBondContact O-CD 3.39Å
210	D	85.6	Confident	79.5	Confident	35 Å²	35	39.8 Å²	39.8	19%	0.187	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-15.8	-177.5	-62	-65.6	0	0	0	112.7	A206 R207 P212 K213 V214	A206-D210 HydrophobicContact CB-CB 4.48Å; R207-D210 PolarHBondContact O-N 3.21Å; D210-P212 VanDerWaalsContact C-CD 3.41Å; D210-P212 VanDerWaalsContact C-N 3.3Å; D210-K213 HydrophobicContact CB-CD 4.45Å; D210-K213 WeakPolarHBondContact O-CA 3.39Å; D210-K213 VanDerWaalsContact O-CB 3.28Å; D210-K213 WeakPolarHBondContact O-CB 3.48Å; D210-K213 PolarHBondContact O-N 2.92Å; D210-K213 WeakPolarHBondContact OD1-CE 3.49Å; D210-K213 IonicContact OD1-NZ 2.72Å; D210-K213 PolarHBondContact OD1-NZ 2.94Å; D210-V214 PolarHBondContact O-N 3.38Å
211	V	87.4	Confident	80.3	Confident	3 Å²	3	39.1 Å²	39.1	2%	0.018	22%	0.22	C	C	.	.	H	α-helix	trans	-50.4	-38.6	174	173.8	0	0	0	0	113.6	L145 F148 T149 L160 R207 K213 V214 A215	L145-V211 HydrophobicContact CD2-CB 3.76Å; L145-V211 HydrophobicContact CD2-CG1 3.68Å; F148-V211 HydrophobicContact CB-CG1 4.34Å; F148-V211 HydrophobicContact CD2-CG1 3.9Å; F148-V211 HydrophobicContact CG-CG1 4.46Å; T149-V211 HydrophobicContact CG2-CG2 4.37Å; L160-V211 HydrophobicContact CB-CG2 3.72Å; L160-V211 HydrophobicContact CD2-CG2 4.11Å; R207-V211 PolarHBondContact O-N 3.5Å; V211-K213 VanDerWaalsContact C-N 3.27Å; V211-K213 PolarHBondContact O-N 3.48Å; V211-V214 PolarHBondContact O-N 3.06Å; V211-A215 WeakPolarHBondContact O-CB 3.46Å; V211-A215 PolarHBondContact O-N 2.92Å
212	P	88.8	Confident	81.9	Confident	12 Å²	12	32.5 Å²	32.5	8%	0.078	19%	0.185	C	C	.	.	H	α-helix	trans	-59.7	-32.2	172.7	-26.3	36.1	0	0	0	114.8	H107 T111 L141 L145 A209 D210 A216	H107-P212 HydrophobicContact CB-CB 3.81Å; T111-P212 WeakPolarHBondContact OG1-CA 3.31Å; L141-P212 HydrophobicContact CD2-CG 4.36Å; L145-P212 HydrophobicContact CD2-CG 3.93Å; A209-P212 WeakPolarHBondContact O-CD 3.39Å; D210-P212 VanDerWaalsContact C-CD 3.41Å; D210-P212 VanDerWaalsContact C-N 3.3Å; P212-A216 WeakPolarHBondContact O-CB 3.28Å; P212-A216 PolarHBondContact O-N 2.81Å
213	K	87.3	Confident	83.2	Confident	77 Å²	77	31 Å²	31	34%	0.335	17%	0.168	S	C	.	.	H	α-helix	trans	-71.9	-44.8	174.7	-55.8	170.4	-179.9	166.8	0	110.4	V198 D210 V211 A215 A216 A217	V198-K213 HydrophobicContact CG1-CB 3.55Å; V198-K213 HydrophobicContact CG1-CD 3.94Å; V198-K213 HydrophobicContact CG1-CG 4.45Å; D210-K213 HydrophobicContact CB-CD 4.45Å; D210-K213 WeakPolarHBondContact O-CA 3.39Å; D210-K213 VanDerWaalsContact O-CB 3.28Å; D210-K213 WeakPolarHBondContact O-CB 3.48Å; D210-K213 PolarHBondContact O-N 2.92Å; D210-K213 WeakPolarHBondContact OD1-CE 3.49Å; D210-K213 IonicContact OD1-NZ 2.72Å; D210-K213 PolarHBondContact OD1-NZ 2.94Å; V211-K213 VanDerWaalsContact C-N 3.27Å; V211-K213 PolarHBondContact O-N 3.48Å; K213-A215 VanDerWaalsContact C-N 3.28Å; K213-A215 PolarHBondContact O-N 3.38Å; K213-A216 PolarHBondContact O-N 2.95Å; K213-A216 VanDerWaalsContact O-N 3.13Å; K213-A217 PolarHBondContact O-N 3.02Å
214	V	88.3	Confident	84.4	Confident	3 Å²	3	27.1 Å²	27.1	2%	0.018	15%	0.145	C	C	.	.	H	α-helix	trans	-58.4	-42.4	174.9	-177.6	0	0	0	0	110.5	L160 L194 L195 V198 A206 D210 V211 A217 I218	L160-V214 HydrophobicContact CD2-CG1 4.27Å; L194-V214 HydrophobicContact CD2-CG1 4.23Å; L194-V214 HydrophobicContact CG-CG1 4.49Å; L195-V214 HydrophobicContact CD2-CG2 4.13Å; V198-V214 HydrophobicContact CB-CG2 4.46Å; V198-V214 HydrophobicContact CG1-CG2 4Å; V198-V214 HydrophobicContact CG2-CG2 4.35Å; A206-V214 HydrophobicContact CB-CG2 4.08Å; D210-V214 PolarHBondContact O-N 3.38Å; V211-V214 PolarHBondContact O-N 3.06Å; V214-A217 PolarHBondContact O-N 3.07Å; V214-I218 HydrophobicContact CG1-CD1 4.17Å; V214-I218 WeakPolarHBondContact O-CG1 3.34Å; V214-I218 PolarHBondContact O-N 3.4Å
215	A	89.9	Confident	84.9	Confident	1 Å²	1	25.7 Å²	25.7	1%	0.008	14%	0.142	C	C	.	.	H	α-helix	trans	-62.3	-44.6	174.6	0	0	0	0	0	112.2	L114 V211 K213 A217 I218 I219	L114-A215 HydrophobicContact CB-CB 4.28Å; L114-A215 HydrophobicContact CD2-CB 3.77Å; V211-A215 WeakPolarHBondContact O-CB 3.46Å; V211-A215 PolarHBondContact O-N 2.92Å; K213-A215 VanDerWaalsContact C-N 3.28Å; K213-A215 PolarHBondContact O-N 3.38Å; A215-A217 PolarHBondContact O-N 3.14Å; A215-I218 PolarHBondContact O-N 3.24Å; A215-I219 WeakPolarHBondContact O-CG1 3.27Å; A215-I219 PolarHBondContact O-N 3.27Å
216	A	88.3	Confident	85.3	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-62.9	-39	176	0	0	0	0	0	113.3	Y32 Y106 H107 P212 K213 I219 S220	Y32-A216 HydrophobicContact CD2-CB 4.14Å; Y32-A216 HydrophobicContact CG-CB 4.3Å; Y106-A216 HydrophobicContact CD1-CB 4.23Å; Y106-A216 HydrophobicContact CE1-CB 4.03Å; H107-A216 WeakPolarHBondContact CD2-CB 3.24Å; P212-A216 WeakPolarHBondContact O-CB 3.28Å; P212-A216 PolarHBondContact O-N 2.81Å; K213-A216 PolarHBondContact O-N 2.95Å; K213-A216 VanDerWaalsContact O-N 3.13Å; A216-I219 PolarHBondContact O-N 3.12Å; A216-S220 VanDerWaalsContact O-CB 3.27Å; A216-S220 WeakPolarHBondContact O-CB 3.43Å; A216-S220 PolarHBondContact O-N 3.02Å
217	A	87.5	Confident	85.2	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-61.7	-45.8	173.9	0	0	0	0	0	111.3	Y32 L194 V198 K213 V214 A215 S220 N221	Y32-A217 HydrophobicContact CD1-CB 4.28Å; Y32-A217 HydrophobicContact CE1-CB 3.6Å; Y32-A217 HydrophobicContact CE2-CB 4.43Å; L194-A217 HydrophobicContact CD1-CB 3.81Å; V198-A217 HydrophobicContact CG2-CB 4.09Å; K213-A217 PolarHBondContact O-N 3.02Å; V214-A217 PolarHBondContact O-N 3.07Å; A215-A217 PolarHBondContact O-N 3.14Å; A217-S220 PolarHBondContact O-N 3.48Å; A217-N221 WeakPolarHBondContact O-CB 3.33Å; A217-N221 PolarHBondContact O-N 3.24Å; A217-N221 PolarHBondContact O-ND2 2.96Å
218	I	88.5	Confident	85.2	Confident	1 Å²	1	21.9 Å²	21.9	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-60.5	-51.5	175.5	-68.7	167.7	0	0	0	111.1	L114 I168 I172 L194 V214 A215 S220 N221 I222 F228	L114-I218 HydrophobicContact CD1-CD1 4.47Å; L114-I218 HydrophobicContact CD1-CG2 3.92Å; L114-I218 HydrophobicContact CD2-CD1 3.96Å; I168-I218 HydrophobicContact CG2-CD1 4.04Å; I172-I218 HydrophobicContact CD1-CG2 3.53Å; L194-I218 HydrophobicContact CD1-CG1 4.18Å; L194-I218 HydrophobicContact CD2-CD1 3.96Å; L194-I218 HydrophobicContact CD2-CG1 3.63Å; V214-I218 HydrophobicContact CG1-CD1 4.17Å; V214-I218 WeakPolarHBondContact O-CG1 3.34Å; V214-I218 PolarHBondContact O-N 3.4Å; A215-I218 PolarHBondContact O-N 3.24Å; I218-S220 VanDerWaalsContact C-N 3.34Å; I218-S220 PolarHBondContact O-N 3.46Å; I218-N221 PolarHBondContact O-N 3.33Å; I218-I222 HydrophobicContact CG2-CD1 3.85Å; I218-I222 HydrophobicContact CG2-CG1 4.46Å; I218-I222 WeakPolarHBondContact O-CG1 3.31Å; I218-I222 PolarHBondContact O-N 2.93Å; I218-F228 HydrophobicContact CG2-CZ 4.32Å
219	I	89.1	Confident	84.7	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61.1	-43	-179.1	-64.5	-55.9	0	0	0	111.1	L64 L113 L114 I117 A215 A216 N221 I222 L223	L64-I219 HydrophobicContact CD1-CD1 4.28Å; L64-I219 HydrophobicContact CD1-CG2 4.27Å; L64-I219 HydrophobicContact CD2-CD1 4.1Å; L64-I219 HydrophobicContact CD2-CG2 4.28Å; L113-I219 HydrophobicContact CB-CD1 3.99Å; L113-I219 HydrophobicContact CB-CG1 4.25Å; L113-I219 HydrophobicContact CD1-CG2 4.3Å; L114-I219 HydrophobicContact CB-CD1 4.34Å; I117-I219 HydrophobicContact CD1-CD1 3.57Å; A215-I219 WeakPolarHBondContact O-CG1 3.27Å; A215-I219 PolarHBondContact O-N 3.27Å; A216-I219 PolarHBondContact O-N 3.12Å; I219-N221 PolarHBondContact O-N 3.36Å; I219-I222 HydrophobicContact CD1-CD1 4.44Å; I219-I222 PolarHBondContact O-N 2.87Å; I219-L223 HydrophobicContact CG2-CD1 3.91Å; I219-L223 VanDerWaalsContact O-CG 3.29Å; I219-L223 WeakPolarHBondContact O-CG 3.26Å; I219-L223 PolarHBondContact O-N 2.86Å; I219-L223 VanDerWaalsContact O-N 3.07Å
220	S	86.6	Confident	83.8	Confident	2 Å²	2	19.1 Å²	19.1	1%	0.014	11%	0.11	C	C	.	.	H	α-helix	trans	-60.7	-43.4	176.3	-171.8	0	0	0	0	111.9	A216 A217 I218 L223 Q224	A216-S220 VanDerWaalsContact O-CB 3.27Å; A216-S220 WeakPolarHBondContact O-CB 3.43Å; A216-S220 PolarHBondContact O-N 3.02Å; A217-S220 PolarHBondContact O-N 3.48Å; I218-S220 VanDerWaalsContact C-N 3.34Å; I218-S220 PolarHBondContact O-N 3.46Å; S220-L223 PolarHBondContact O-N 2.97Å; S220-Q224 VanDerWaalsContact O-CG 3.3Å; S220-Q224 WeakPolarHBondContact O-CG 3.43Å; S220-Q224 PolarHBondContact O-N 3.17Å; S220-Q224 PolarHBondContact O-NE2 2.83Å; S220-Q224 PolarHBondContact OG-NE2 3.43Å
221	N	85.9	Confident	82.6	Confident	7 Å²	7	25.4 Å²	25.4	4%	0.037	13%	0.131	C	C	.	.	H	α-helix	trans	-69.1	-34	178.8	-81.7	-67.1	0	0	0	113.3	I189 A217 I218 I219 G225 H226 F228	I189-N221 HydrophobicContact CD1-CB 4Å; I189-N221 VanDerWaalsContact CD1-CG 3.41Å; I189-N221 WeakPolarHBondContact CD1-OD1 3.49Å; A217-N221 WeakPolarHBondContact O-CB 3.33Å; A217-N221 PolarHBondContact O-N 3.24Å; A217-N221 PolarHBondContact O-ND2 2.96Å; I218-N221 PolarHBondContact O-N 3.33Å; I219-N221 PolarHBondContact O-N 3.36Å; N221-G225 PolarHBondContact O-N 2.91Å; N221-H226 HydrophobicContact CB-CB 4.4Å; N221-H226 PolarHBondContact O-N 3.02Å; N221-H226 PolarHBondContact OD1-ND1 3.24Å; N221-F228 HydrophobicContact CB-CE1 4.06Å; N221-F228 HydrophobicContact CB-CZ 3.76Å
222	I	85.4	Confident	80.8	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-61.5	-48.4	170.6	-69.8	167.8	0	0	0	110.4	L64 D67 V68 I117 I172 Y176 I218 I219 Q224 G225 F228	L64-I222 HydrophobicContact CD1-CB 4.31Å; L64-I222 HydrophobicContact CD1-CG2 3.69Å; D67-I222 HydrophobicContact CB-CG2 4.24Å; V68-I222 HydrophobicContact CG1-CG2 4.15Å; I117-I222 HydrophobicContact CD1-CD1 4.11Å; I172-I222 HydrophobicContact CG2-CD1 4.13Å; Y176-I222 HydrophobicContact CD2-CG2 4.01Å; Y176-I222 HydrophobicContact CE2-CB 4.48Å; Y176-I222 HydrophobicContact CE2-CG2 3.86Å; I218-I222 HydrophobicContact CG2-CD1 3.85Å; I218-I222 HydrophobicContact CG2-CG1 4.46Å; I218-I222 WeakPolarHBondContact O-CG1 3.31Å; I218-I222 PolarHBondContact O-N 2.93Å; I219-I222 HydrophobicContact CD1-CD1 4.44Å; I219-I222 PolarHBondContact O-N 2.87Å; I222-Q224 VanDerWaalsContact C-N 3.3Å; I222-Q224 PolarHBondContact O-N 2.81Å; I222-G225 PolarHBondContact O-N 3.43Å; I222-F228 HydrophobicContact CD1-CE2 4.48Å; I222-F228 HydrophobicContact CG1-CE2 3.66Å; I222-F228 HydrophobicContact CG1-CZ 4.05Å
223	L	84	Confident	79.3	Confident	7 Å²	7	36.8 Å²	36.8	4%	0.037	20%	0.199	C	C	.	.	H	α-helix	trans	-66.1	-32.4	-178.5	-67.4	167.2	0	0	0	112.6	T36 T39 L60 K63 L64 I219 S220 G225	T36-L223 HydrophobicContact CG2-CD1 3.92Å; T39-L223 HydrophobicContact CG2-CB 4.14Å; T39-L223 WeakPolarHBondContact CG2-O 3.49Å; L60-L223 HydrophobicContact CD1-CD1 3.52Å; K63-L223 HydrophobicContact CB-CD2 4.4Å; K63-L223 HydrophobicContact CG-CD2 3.8Å; L64-L223 HydrophobicContact CB-CD2 4.11Å; L64-L223 HydrophobicContact CD1-CD2 4.08Å; L64-L223 HydrophobicContact CD1-CG 4.23Å; I219-L223 HydrophobicContact CG2-CD1 3.91Å; I219-L223 VanDerWaalsContact O-CG 3.29Å; I219-L223 WeakPolarHBondContact O-CG 3.26Å; I219-L223 PolarHBondContact O-N 2.86Å; I219-L223 VanDerWaalsContact O-N 3.07Å; S220-L223 PolarHBondContact O-N 2.97Å; L223-G225 VanDerWaalsContact C-N 3.26Å; L223-G225 PolarHBondContact O-N 3.11Å
224	Q	81.3	Confident	78	Confident	72 Å²	72	36 Å²	36	34%	0.336	20%	0.201	S	C	.	.	H	α-helix	trans	-72.4	-16.1	172.5	-72.1	173.2	64.4	0	0	113.3	S220 I222 H226	S220-Q224 VanDerWaalsContact O-CG 3.3Å; S220-Q224 WeakPolarHBondContact O-CG 3.43Å; S220-Q224 PolarHBondContact O-N 3.17Å; S220-Q224 PolarHBondContact O-NE2 2.83Å; S220-Q224 PolarHBondContact OG-NE2 3.43Å; I222-Q224 VanDerWaalsContact C-N 3.3Å; I222-Q224 PolarHBondContact O-N 2.81Å; Q224-H226 PolarHBondContact OE1-CE1 3.2Å
225	G	75.6	Confident	76.7	Confident	34 Å²	34	39 Å²	39	35%	0.351	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.8	16.3	-178.9	0	0	0	0	0	114.8	Y176 N221 I222 L223	Y176-G225 VanDerWaalsContact OH-CA 3.3Å; Y176-G225 WeakPolarHBondContact OH-CA 3.27Å; Y176-G225 PolarHBondContact OH-O 3.39Å; N221-G225 PolarHBondContact O-N 2.91Å; I222-G225 PolarHBondContact O-N 3.43Å; L223-G225 VanDerWaalsContact C-N 3.26Å; L223-G225 PolarHBondContact O-N 3.11Å
226	H	82.3	Confident	75.7	Confident	56 Å²	56	43.9 Å²	43.9	26%	0.259	25%	0.254	S	S	.	.			trans	-70.3	148.8	177.5	-66.1	155.8	0	0	0	111.9	Y176 I189 N221 Q224	Y176-H226 WeakPolarHBondContact CE1-O 3.5Å; Y176-H226 PolarHBondContact OH-N 2.84Å; Y176-H226 PolarHBondContact OH-O 3.06Å; I189-H226 HydrophobicContact CD1-CB 3.83Å; N221-H226 HydrophobicContact CB-CB 4.4Å; N221-H226 PolarHBondContact O-N 3.02Å; N221-H226 PolarHBondContact OD1-ND1 3.24Å; Q224-H226 PolarHBondContact OE1-CE1 3.2Å
227	C	81.4	Confident	74.9	Confident	29 Å²	29	49.2 Å²	49.2	20%	0.196	28%	0.283	C	S	.	.			trans	-90.6	143.8	177.7	54.9	0	0	0	0	112.1	P178 C188 I189	P178-C227 HydrophobicContact CB-CB 4.3Å; P178-C227 HydrophobicContact CG-CB 3.89Å; C188-C227 CarbonylContact C-O 3.45Å; C188-C227 WeakPolarHBondContact CA-O 3.43Å; C188-C227 WeakPolarHBondContact CA-SG 3.45Å; C188-C227 HydrophobicContact CB-CB 3.97Å; C188-C227 WeakPolarHBondContact CB-O 3.21Å; C188-C227 WeakPolarHBondContact CB-SG 3.47Å; C188-C227 WeakPolarHBondContact SG-CB 3.41Å; C188-C227 CovalentContact SG-SG 2.04Å; C188-C227 PolarHBondContact SG-SG 2.72Å; I189-C227 PolarHBondContact N-O 2.95Å
228	F	82.6	Confident	74.5	Confident	9 Å²	9	54.5 Å²	54.5	4%	0.039	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-104	135.5	172.6	-57.5	-76.3	0	0	0	110.8	L169 I172 N173 Y176 I189 I218 N221 I222	L169-F228 HydrophobicContact CD2-CB 4.11Å; L169-F228 HydrophobicContact CD2-CD1 3.55Å; L169-F228 HydrophobicContact CD2-CE1 4.09Å; L169-F228 HydrophobicContact CD2-CG 3.82Å; I172-F228 HydrophobicContact CG2-CD2 4.24Å; I172-F228 HydrophobicContact CG2-CE2 4.35Å; N173-F228 PolarHBondContact ND2-O 2.86Å; Y176-F228 HydrophobicContact CD1-CD2 4.06Å; Y176-F228 HydrophobicContact CD1-CE2 4.22Å; Y176-F228 AromaticContact CE1-CD2 3.95Å; Y176-F228 HydrophobicContact CE1-CD2 3.95Å; Y176-F228 AromaticContact CE1-CE2 3.93Å; Y176-F228 HydrophobicContact CE1-CE2 3.93Å; I189-F228 HydrophobicContact CB-CD1 4.09Å; I189-F228 HydrophobicContact CB-CE1 4.44Å; I189-F228 HydrophobicContact CD1-CE1 4.49Å; I189-F228 HydrophobicContact CG2-CD1 4.39Å; I189-F228 WeakPolarHBondContact O-CA 3.37Å; I218-F228 HydrophobicContact CG2-CZ 4.32Å; N221-F228 HydrophobicContact CB-CE1 4.06Å; N221-F228 HydrophobicContact CB-CZ 3.76Å; I222-F228 HydrophobicContact CD1-CE2 4.48Å; I222-F228 HydrophobicContact CG1-CE2 3.66Å; I222-F228 HydrophobicContact CG1-CZ 4.05Å
229	A	72	Confident	74.2	Confident	24 Å²	24	59.9 Å²	59.9	20%	0.198	33%	0.329	C	S	.	.			trans	-120.2	97.1	179.6	0	0	0	0	0	110.9	C188 I189 H190	C188-A229 HydrophobicContact CB-CB 3.59Å; I189-A229 PolarHBondContact O-N 3.49Å; H190-A229 VanDerWaalsContact CE1-CB 3.43Å; H190-A229 WeakPolarHBondContact CE1-CB 3.23Å; H190-A229 PolarHBondContact ND1-O 3.12Å
230	P	62.7	Low	73.9	Confident	30 Å²	30	61.4 Å²	61.4	20%	0.195	34%	0.337	C	S	.	.			trans	-71.4	150.6	173.6	29.6	-33.6	0	0	0	111	L170 N173 S232	L170-P230 HydrophobicContact CD1-CB 4.42Å; L170-P230 HydrophobicContact CD2-CB 3.78Å; L170-P230 HydrophobicContact CD2-CG 3.5Å; L170-P230 HydrophobicContact CG-CB 3.65Å; L170-P230 HydrophobicContact CG-CG 3.9Å; N173-P230 WeakPolarHBondContact ND2-CD 3.43Å; P230-S232 PolarHBondContact O-N 3.12Å
231	R	59.8	Low	73.7	Confident	167 Å²	167	64 Å²	64	63%	0.63	35%	0.351	S	S	*	.			trans	-74	93.3	166.7	-68.7	-178.6	173.6	-178.1	0.2	108.6	E166 L233	E166-R231 WeakPolarHBondContact OE1-CD 3.29Å; E166-R231 WeakPolarHBondContact OE1-CG 3.46Å; R231-L233 VanDerWaalsContact C-N 3.27Å; R231-L233 PolarHBondContact O-N 3.16Å
232	S	50.6	Low	73.4	Confident	105 Å²	105	65.7 Å²	65.7	73%	0.734	36%	0.363	S	S	*	.			trans	-72.7	78	179.7	61.9	0	0	0	0	111.8	P230	P230-S232 PolarHBondContact O-N 3.12Å
233	L	55.9	Low	73.3	Confident	149 Å²	149	68.2 Å²	68.2	78%	0.78	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-88.9	135.3	168.5	-64.8	175.7	0	0	0	109.6	R231	R231-L233 VanDerWaalsContact C-N 3.27Å; R231-L233 PolarHBondContact O-N 3.16Å
234	P	59.8	Low	73.4	Confident	59 Å²	59	68 Å²	68	38%	0.383	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-74.7	159.4	177.6	32.3	-35.9	0	0	0	111.9	F238 F239	P234-F238 HydrophobicContact CB-CB 3.94Å; P234-F238 HydrophobicContact CB-CD1 3.53Å; P234-F238 HydrophobicContact CB-CD2 4.49Å; P234-F238 HydrophobicContact CB-CE1 4.16Å; P234-F238 HydrophobicContact CB-CG 3.73Å; P234-F238 HydrophobicContact CG-CD1 3.81Å; P234-F238 HydrophobicContact CG-CE1 4.26Å; P234-F238 HydrophobicContact CG-CG 4.49Å; P234-F239 HydrophobicContact CG-CE1 4.25Å; P234-F239 HydrophobicContact CG-CE2 3.93Å; P234-F239 HydrophobicContact CG-CZ 3.57Å
235	S	61.8	Low	73.4	Confident	66 Å²	66	71.3 Å²	71.3	46%	0.462	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-65.7	157.3	174.9	60.5	0	0	0	0	112	D237 F238	S235-D237 VanDerWaalsContact C-N 3.26Å; S235-D237 PolarHBondContact O-N 3.29Å; S235-F238 VanDerWaalsContact O-CB 3.26Å; S235-F238 WeakPolarHBondContact O-CB 3.43Å; S235-F238 PolarHBondContact O-N 3.45Å; S235-F238 VanDerWaalsContact O-N 3.16Å
236	P	68.7	Low	73.5	Confident	104 Å²	104	73 Å²	73	68%	0.675	40%	0.397	S	S	*	.	H	α-helix	trans	-55.7	-37.6	177.9	-27.9	36.6	0	0	0	114	F238 F239	P236-F238 VanDerWaalsContact C-N 3.27Å; P236-F238 PolarHBondContact O-N 3Å; P236-F239 PolarHBondContact O-N 3.41Å
237	D	71.8	Confident	73.2	Confident	113 Å²	113	71.4 Å²	71.4	60%	0.604	39%	0.39	S	S	*	.	H	α-helix	trans	-64.3	-31.3	-178.9	-51.8	-51.9	0	0	0	112.9	S235 F239 I240 D241	S235-D237 VanDerWaalsContact C-N 3.26Å; S235-D237 PolarHBondContact O-N 3.29Å; D237-F239 PolarHBondContact O-N 3.13Å; D237-I240 PolarHBondContact O-N 2.85Å; D237-I240 VanDerWaalsContact O-N 3.16Å; D237-D241 PolarHBondContact O-N 2.88Å
238	F	77.9	Confident	73.1	Confident	110 Å²	110	77.3 Å²	77.3	48%	0.482	42%	0.42	S	S	.	.	H	α-helix	trans	-55.3	-35.9	179.3	173	-95.4	0	0	0	112.4	P234 S235 P236 S242	P234-F238 HydrophobicContact CB-CB 3.94Å; P234-F238 HydrophobicContact CB-CD1 3.53Å; P234-F238 HydrophobicContact CB-CD2 4.49Å; P234-F238 HydrophobicContact CB-CE1 4.16Å; P234-F238 HydrophobicContact CB-CG 3.73Å; P234-F238 HydrophobicContact CG-CD1 3.81Å; P234-F238 HydrophobicContact CG-CE1 4.26Å; P234-F238 HydrophobicContact CG-CG 4.49Å; S235-F238 VanDerWaalsContact O-CB 3.26Å; S235-F238 WeakPolarHBondContact O-CB 3.43Å; S235-F238 PolarHBondContact O-N 3.45Å; S235-F238 VanDerWaalsContact O-N 3.16Å; P236-F238 VanDerWaalsContact C-N 3.27Å; P236-F238 PolarHBondContact O-N 3Å; F238-S242 WeakPolarHBondContact O-CB 3.28Å; F238-S242 PolarHBondContact O-N 3.48Å; F238-S242 PolarHBondContact O-OG 2.97Å
239	F	82.2	Confident	72.6	Confident	114 Å²	114	77.7 Å²	77.7	50%	0.5	42%	0.423	S	S	.	.	H	α-helix	trans	-69.7	-43.3	-179.2	-62.5	-79.1	0	0	0	111.8	P234 P236 D237 I243	P234-F239 HydrophobicContact CG-CE1 4.25Å; P234-F239 HydrophobicContact CG-CE2 3.93Å; P234-F239 HydrophobicContact CG-CZ 3.57Å; P236-F239 PolarHBondContact O-N 3.41Å; D237-F239 PolarHBondContact O-N 3.13Å; F239-I243 VanDerWaalsContact O-CG1 3.32Å; F239-I243 WeakPolarHBondContact O-CG1 3.42Å; F239-I243 PolarHBondContact O-N 2.85Å; F239-I243 VanDerWaalsContact O-N 3.15Å
240	I	83.6	Confident	72.3	Confident	32 Å²	32	81.7 Å²	81.7	16%	0.164	45%	0.45	C	S	.	.	H	α-helix	trans	-68.7	-45.1	178	-54.7	-58.2	0	0	0	110.2	D237 S242 I243 F244 K323 F326	D237-I240 PolarHBondContact O-N 2.85Å; D237-I240 VanDerWaalsContact O-N 3.16Å; I240-S242 VanDerWaalsContact C-N 3.33Å; I240-S242 PolarHBondContact O-N 3.48Å; I240-I243 PolarHBondContact O-N 3.19Å; I240-F244 HydrophobicContact CG2-CD2 4.07Å; I240-F244 HydrophobicContact CG2-CE2 3.96Å; I240-F244 VanDerWaalsContact O-CD2 3.31Å; I240-F244 WeakPolarHBondContact O-CD2 3.37Å; I240-F244 PolarHBondContact O-N 3.14Å; I240-K323 HydrophobicContact CG2-CB 4.06Å; I240-K323 HydrophobicContact CG2-CD 4.42Å; I240-K323 HydrophobicContact CG2-CG 4.15Å; I240-F326 HydrophobicContact CD1-CD1 4.19Å; I240-F326 HydrophobicContact CD1-CE1 4.27Å; I240-F326 HydrophobicContact CG2-CD1 4.35Å
241	D	82	Confident	72.6	Confident	57 Å²	57	85.1 Å²	85.1	31%	0.305	47%	0.467	S	S	.	.	H	α-helix	trans	-61.2	-40.6	176.6	-80.4	-9.7	0	0	0	112.2	D237 I243 F244 Q245 K323	D237-D241 PolarHBondContact O-N 2.88Å; D241-I243 PolarHBondContact O-N 3.38Å; D241-F244 PolarHBondContact O-N 3.31Å; D241-Q245 WeakPolarHBondContact O-CB 3.49Å; D241-Q245 VanDerWaalsContact O-CG 3.23Å; D241-Q245 WeakPolarHBondContact O-CG 3.35Å; D241-Q245 PolarHBondContact O-N 3.45Å; D241-K323 WeakPolarHBondContact OD1-CE 3.44Å; D241-K323 IonicContact OD1-NZ 2.65Å; D241-K323 PolarHBondContact OD1-NZ 3.07Å
242	S	80.2	Confident	73.5	Confident	43 Å²	43	81.2 Å²	81.2	30%	0.301	46%	0.458	S	S	.	.	H	α-helix	trans	-63.4	-39.7	176.3	-65.6	0	0	0	0	112.4	F238 I240 S246	F238-S242 WeakPolarHBondContact O-CB 3.28Å; F238-S242 PolarHBondContact O-N 3.48Å; F238-S242 PolarHBondContact O-OG 2.97Å; I240-S242 VanDerWaalsContact C-N 3.33Å; I240-S242 PolarHBondContact O-N 3.48Å; S242-S246 WeakPolarHBondContact O-CB 3.47Å; S242-S246 PolarHBondContact O-N 2.82Å
243	I	83.8	Confident	74.9	Confident	52 Å²	52	76.2 Å²	76.2	27%	0.267	42%	0.423	S	S	.	.	H	α-helix	trans	-64.4	-48.8	176.2	-68.9	164.4	0	0	0	110.1	F239 I240 D241 Q245 S246 L247 L261 F326	F239-I243 VanDerWaalsContact O-CG1 3.32Å; F239-I243 WeakPolarHBondContact O-CG1 3.42Å; F239-I243 PolarHBondContact O-N 2.85Å; F239-I243 VanDerWaalsContact O-N 3.15Å; I240-I243 PolarHBondContact O-N 3.19Å; D241-I243 PolarHBondContact O-N 3.38Å; I243-Q245 PolarHBondContact O-N 3.18Å; I243-S246 PolarHBondContact O-N 3.04Å; I243-S246 VanDerWaalsContact O-N 3.12Å; I243-S246 PolarHBondContact O-OG 3.39Å; I243-L247 HydrophobicContact CG2-CD1 4.18Å; I243-L247 PolarHBondContact O-N 3.22Å; I243-L261 HydrophobicContact CG2-CD1 4.28Å; I243-L261 HydrophobicContact CG2-CD2 4.01Å; I243-F326 HydrophobicContact CD1-CE1 4.12Å; I243-F326 HydrophobicContact CD1-CZ 4.45Å; I243-F326 HydrophobicContact CG2-CE1 4.16Å; I243-F326 HydrophobicContact CG2-CZ 3.99Å
244	F	84.5	Confident	76.2	Confident	2 Å²	2	75.8 Å²	75.8	1%	0.009	42%	0.415	C	S	.	.	H	α-helix	trans	-61.7	-43.1	179.5	-84.6	-122.4	0	0	0	111.4	I240 D241 S246 L247 N248 C249 N251 L253 K323 F326	I240-F244 HydrophobicContact CG2-CD2 4.07Å; I240-F244 HydrophobicContact CG2-CE2 3.96Å; I240-F244 VanDerWaalsContact O-CD2 3.31Å; I240-F244 WeakPolarHBondContact O-CD2 3.37Å; I240-F244 PolarHBondContact O-N 3.14Å; D241-F244 PolarHBondContact O-N 3.31Å; F244-S246 PolarHBondContact O-N 3.22Å; F244-L247 PolarHBondContact O-N 2.97Å; F244-N248 PolarHBondContact O-N 3.01Å; F244-C249 CarbonylContact C-O 3.45Å; F244-C249 HydrophobicContact CD1-CB 4.27Å; F244-C249 PolarHBondContact O-N 2.64Å; F244-N251 WeakPolarHBondContact CE1-O 3.47Å; F244-L253 HydrophobicContact CD1-CD1 4.04Å; F244-L253 HydrophobicContact CD2-CD1 3.93Å; F244-L253 HydrophobicContact CE1-CB 4.48Å; F244-L253 HydrophobicContact CE1-CD1 3.78Å; F244-L253 HydrophobicContact CE2-CD1 3.67Å; F244-L253 HydrophobicContact CG-CD1 4.11Å; F244-L253 HydrophobicContact CZ-CB 4.42Å; F244-L253 HydrophobicContact CZ-CD1 3.59Å; F244-K323 HydrophobicContact CD1-CG 4.29Å; F244-K323 HydrophobicContact CE1-CG 3.88Å; F244-K323 HydrophobicContact CE2-CG 4.36Å; F244-K323 HydrophobicContact CZ-CG 3.93Å; F244-F326 HydrophobicContact CE2-CB 4.05Å; F244-F326 AromaticContact CE2-CD1 3.76Å; F244-F326 HydrophobicContact CE2-CD1 3.76Å; F244-F326 HydrophobicContact CE2-CE1 4.37Å; F244-F326 AromaticContact CE2-CG 3.85Å; F244-F326 HydrophobicContact CE2-CG 3.85Å; F244-F326 HydrophobicContact CZ-CB 4.06Å; F244-F326 HydrophobicContact CZ-CG 4.31Å
245	Q	82.2	Confident	77	Confident	143 Å²	143	74.3 Å²	74.3	67%	0.668	40%	0.404	S	S	*	.	H	α-helix	trans	-61.3	-40	173	-72.2	175.3	28	0	0	112.6	D241 I243 L247 N248	D241-Q245 WeakPolarHBondContact O-CB 3.49Å; D241-Q245 VanDerWaalsContact O-CG 3.23Å; D241-Q245 WeakPolarHBondContact O-CG 3.35Å; D241-Q245 PolarHBondContact O-N 3.45Å; I243-Q245 PolarHBondContact O-N 3.18Å; Q245-L247 PolarHBondContact O-N 3.29Å; Q245-N248 PolarHBondContact O-N 3.09Å
246	S	78.6	Confident	77.7	Confident	68 Å²	68	74.2 Å²	74.2	48%	0.476	41%	0.407	S	S	.	.	H	α-helix	trans	-67	-21.4	179.5	81	0	0	0	0	114.5	S242 I243 F244 R264	S242-S246 WeakPolarHBondContact O-CB 3.47Å; S242-S246 PolarHBondContact O-N 2.82Å; I243-S246 PolarHBondContact O-N 3.04Å; I243-S246 VanDerWaalsContact O-N 3.12Å; I243-S246 PolarHBondContact O-OG 3.39Å; F244-S246 PolarHBondContact O-N 3.22Å; S246-R264 PolarHBondContact O-NH1 3.49Å
247	L	76.1	Confident	78.3	Confident	23 Å²	23	71.5 Å²	71.5	12%	0.12	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-0.7	173.7	-63.3	167.6	0	0	0	112.3	I243 F244 Q245 C249 L253 E260 L261	I243-L247 HydrophobicContact CG2-CD1 4.18Å; I243-L247 PolarHBondContact O-N 3.22Å; F244-L247 PolarHBondContact O-N 2.97Å; Q245-L247 PolarHBondContact O-N 3.29Å; L247-C249 VanDerWaalsContact C-N 3.28Å; L247-C249 PolarHBondContact O-N 3.38Å; L247-L253 HydrophobicContact CD1-CD1 3.98Å; L247-L253 HydrophobicContact CD1-CD2 4.38Å; L247-E260 HydrophobicContact CD2-CG 4.17Å; L247-L261 HydrophobicContact CD1-CB 4.1Å; L247-L261 HydrophobicContact CD1-CD1 4.38Å; L247-L261 HydrophobicContact CD1-CD2 4.34Å; L247-L261 HydrophobicContact CD1-CG 4.5Å; L247-L261 HydrophobicContact CD2-CB 4.33Å
248	N	77.6	Confident	78.8	Confident	153 Å²	153	66.1 Å²	66.1	82%	0.818	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	32.5	-175.3	-165.6	49.7	0	0	0	113.5	F244 Q245	F244-N248 PolarHBondContact O-N 3.01Å; Q245-N248 PolarHBondContact O-N 3.09Å
249	C	71.8	Confident	78.8	Confident	17 Å²	17	66.2 Å²	66.2	12%	0.115	36%	0.36	C	S	.	.			trans	-102.7	135.2	176.7	-58	0	0	0	0	110.1	F244 L247	F244-C249 CarbonylContact C-O 3.45Å; F244-C249 HydrophobicContact CD1-CB 4.27Å; F244-C249 PolarHBondContact O-N 2.64Å; L247-C249 VanDerWaalsContact C-N 3.28Å; L247-C249 PolarHBondContact O-N 3.38Å
250	S	66.8	Low	78.7	Confident	108 Å²	108	64.9 Å²	64.9	76%	0.755	36%	0.355	S	S	*	.	S	Bend	trans	-83.8	-53.6	-176.8	-49.4	0	0	0	0	113.6
251	N	69.5	Low	78.6	Confident	103 Å²	103	64.1 Å²	64.1	55%	0.551	35%	0.351	S	S	*	.	S	Bend	trans	-136.6	-25.7	-177	-84.5	-16.3	0	0	0	114.4	F244	F244-N251 WeakPolarHBondContact CE1-O 3.47Å
252	N	78.1	Confident	78.4	Confident	85 Å²	85	62.9 Å²	62.9	46%	0.455	35%	0.345	S	S	.	.			trans	-130.6	144.7	-176.9	-46.6	-4.8	0	0	0	110.2	S320 I321	N252-S320 WeakPolarHBondContact CB-OG 3.27Å; N252-S320 PolarHBondContact ND2-OG 3.37Å; N252-I321 CarbonylContact C-O 3.57Å; N252-I321 VanDerWaalsContact CA-O 3.26Å; N252-I321 WeakPolarHBondContact CA-O 3.24Å
253	L	79.6	Confident	78.2	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	36%	0.358	C	S	.	.	B	Isolated β-bridge	trans	-100.6	149.4	176.5	-126.1	104.1	0	0	0	110.7	F244 L247 D257 L258 S320 I321	F244-L253 HydrophobicContact CD1-CD1 4.04Å; F244-L253 HydrophobicContact CD2-CD1 3.93Å; F244-L253 HydrophobicContact CE1-CB 4.48Å; F244-L253 HydrophobicContact CE1-CD1 3.78Å; F244-L253 HydrophobicContact CE2-CD1 3.67Å; F244-L253 HydrophobicContact CG-CD1 4.11Å; F244-L253 HydrophobicContact CZ-CB 4.42Å; F244-L253 HydrophobicContact CZ-CD1 3.59Å; L247-L253 HydrophobicContact CD1-CD1 3.98Å; L247-L253 HydrophobicContact CD1-CD2 4.38Å; L253-D257 HydrophobicContact CD2-CB 3.87Å; L253-D257 HydrophobicContact CG-CB 3.86Å; L253-L258 HydrophobicContact CD2-CB 3.78Å; L253-L258 HydrophobicContact CD2-CD1 4.49Å; L253-S320 CarbonylContact O-C 3.58Å; L253-S320 WeakPolarHBondContact O-CA 3.34Å; L253-I321 HydrophobicContact CB-CB 4.07Å; L253-I321 PolarHBondContact N-O 2.88Å; L253-I321 PolarHBondContact O-N 2.71Å
254	K	83.1	Confident	77.7	Confident	140 Å²	140	70.8 Å²	70.8	61%	0.609	37%	0.37	S	S	*	.			trans	-101.2	163.4	164.1	-60.2	178.7	-178.8	177	0	110.4	A256 D257 L258	K254-A256 PolarHBondContact O-N 2.98Å; K254-D257 VanDerWaalsContact CB-OD2 3.3Å; K254-D257 WeakPolarHBondContact CB-OD2 3.35Å; K254-D257 PolarHBondContact N-OD2 3.44Å; K254-D257 WeakPolarHBondContact O-CA 3.48Å; K254-D257 WeakPolarHBondContact O-CB 3.06Å; K254-D257 PolarHBondContact O-N 2.89Å; K254-L258 PolarHBondContact O-N 3.3Å
255	I	78.1	Confident	77	Confident	27 Å²	27	74 Å²	74	14%	0.138	39%	0.387	C	S	.	.	H	α-helix	trans	-53.8	-41	175.3	-60.2	-178.5	0	0	0	111.7	D257 L258 E259 A306 N307 V310 P317	I255-D257 VanDerWaalsContact C-N 3.29Å; I255-D257 PolarHBondContact O-N 2.88Å; I255-L258 WeakPolarHBondContact O-CB 3.46Å; I255-L258 PolarHBondContact O-N 3.18Å; I255-L258 VanDerWaalsContact O-N 3.16Å; I255-E259 WeakPolarHBondContact O-CB 3.44Å; I255-E259 PolarHBondContact O-N 3.32Å; I255-A306 HydrophobicContact CG2-CB 3.81Å; I255-N307 WeakPolarHBondContact CG2-OD1 3.39Å; I255-V310 HydrophobicContact CD1-CG1 4.44Å; I255-V310 HydrophobicContact CG1-CG2 4.34Å; I255-P317 HydrophobicContact CD1-CB 3.7Å; I255-P317 WeakPolarHBondContact CD1-O 3.16Å
256	A	76.1	Confident	76.1	Confident	65 Å²	65	69.1 Å²	69.1	54%	0.537	38%	0.375	S	S	.	.	H	α-helix	trans	-63.3	-32.4	176.8	0	0	0	0	0	113.4	K254 E260	K254-A256 PolarHBondContact O-N 2.98Å; A256-E260 PolarHBondContact O-N 2.95Å
257	D	80.4	Confident	74.6	Confident	47 Å²	47	69.5 Å²	69.5	25%	0.251	37%	0.371	S	S	.	.	H	α-helix	trans	-75.7	-31.8	176.8	-48.3	-42.2	0	0	0	110.6	L253 K254 I255 L261	L253-D257 HydrophobicContact CD2-CB 3.87Å; L253-D257 HydrophobicContact CG-CB 3.86Å; K254-D257 VanDerWaalsContact CB-OD2 3.3Å; K254-D257 WeakPolarHBondContact CB-OD2 3.35Å; K254-D257 PolarHBondContact N-OD2 3.44Å; K254-D257 WeakPolarHBondContact O-CA 3.48Å; K254-D257 WeakPolarHBondContact O-CB 3.06Å; K254-D257 PolarHBondContact O-N 2.89Å; I255-D257 VanDerWaalsContact C-N 3.29Å; I255-D257 PolarHBondContact O-N 2.88Å; D257-L261 PolarHBondContact O-N 2.97Å
258	L	81.6	Confident	72.9	Confident	0 Å²	0	79.2 Å²	79.2	0%	0	41%	0.406	C	S	.	.	H	α-helix	trans	-70.4	-39.8	172.5	-178.8	60.8	0	0	0	111.1	L253 K254 I255 L261 L262 A306 V310 I321 F326 I329 I333	L253-L258 HydrophobicContact CD2-CB 3.78Å; L253-L258 HydrophobicContact CD2-CD1 4.49Å; K254-L258 PolarHBondContact O-N 3.3Å; I255-L258 WeakPolarHBondContact O-CB 3.46Å; I255-L258 PolarHBondContact O-N 3.18Å; I255-L258 VanDerWaalsContact O-N 3.16Å; L258-L261 HydrophobicContact CD1-CD2 4.48Å; L258-L261 WeakPolarHBondContact O-CB 3.44Å; L258-L261 PolarHBondContact O-N 2.99Å; L258-L262 HydrophobicContact CG-CD1 4.5Å; L258-L262 VanDerWaalsContact O-CG 3.3Å; L258-L262 WeakPolarHBondContact O-CG 3.18Å; L258-L262 PolarHBondContact O-N 3.04Å; L258-A306 HydrophobicContact CB-CB 4.24Å; L258-A306 HydrophobicContact CD2-CB 4.04Å; L258-A306 HydrophobicContact CG-CB 4Å; L258-V310 HydrophobicContact CD2-CG2 4.35Å; L258-I321 HydrophobicContact CD2-CD1 3.89Å; L258-F326 HydrophobicContact CD1-CE2 4.11Å; L258-I329 HydrophobicContact CD2-CD1 4.46Å; L258-I333 HydrophobicContact CD1-CD1 4.07Å
259	E	78.4	Confident	70.6	Confident	111 Å²	111	79.2 Å²	79.2	52%	0.519	40%	0.399	S	S	.	.	H	α-helix	trans	-65.2	-41.9	176.2	-167.6	168.6	-158.3	0	0	111.7	I255 L261 L262 H263 A306	I255-E259 WeakPolarHBondContact O-CB 3.44Å; I255-E259 PolarHBondContact O-N 3.32Å; E259-L261 PolarHBondContact O-N 3.5Å; E259-L262 PolarHBondContact O-N 3.38Å; E259-H263 WeakPolarHBondContact O-CB 3.43Å; E259-H263 PolarHBondContact O-N 2.83Å; E259-A306 HydrophobicContact CB-CB 4.01Å
260	E	80.4	Confident	68.5	Low	87 Å²	87	84.4 Å²	84.4	41%	0.407	43%	0.433	S	S	.	.	H	α-helix	trans	-59.6	-42.5	169.4	172.3	71.6	-171.4	0	0	111.9	L247 A256 H263 R264	L247-E260 HydrophobicContact CD2-CG 4.17Å; A256-E260 PolarHBondContact O-N 2.95Å; E260-H263 PolarHBondContact O-N 3.32Å; E260-R264 WeakPolarHBondContact O-CG 3.17Å; E260-R264 PolarHBondContact O-N 3.38Å; E260-R264 IonicContact OE1-CZ 2.77Å; E260-R264 IonicContact OE1-NE 3.57Å; E260-R264 PolarHBondContact OE1-NE 3.49Å; E260-R264 IonicContact OE1-NH2 2.65Å; E260-R264 PolarHBondContact OE1-NH2 3.17Å
261	L	81.8	Confident	66.4	Low	15 Å²	15	88 Å²	88	8%	0.079	44%	0.439	C	S	.	.	H	α-helix	trans	-63.1	-46.1	176.6	-179.7	63.9	0	0	0	111.8	I243 L247 D257 L258 E259 H263 R264 L265 F326	I243-L261 HydrophobicContact CG2-CD1 4.28Å; I243-L261 HydrophobicContact CG2-CD2 4.01Å; L247-L261 HydrophobicContact CD1-CB 4.1Å; L247-L261 HydrophobicContact CD1-CD1 4.38Å; L247-L261 HydrophobicContact CD1-CD2 4.34Å; L247-L261 HydrophobicContact CD1-CG 4.5Å; L247-L261 HydrophobicContact CD2-CB 4.33Å; D257-L261 PolarHBondContact O-N 2.97Å; L258-L261 HydrophobicContact CD1-CD2 4.48Å; L258-L261 WeakPolarHBondContact O-CB 3.44Å; L258-L261 PolarHBondContact O-N 2.99Å; E259-L261 PolarHBondContact O-N 3.5Å; L261-H263 VanDerWaalsContact C-N 3.33Å; L261-H263 PolarHBondContact O-N 3Å; L261-R264 PolarHBondContact O-N 3Å; L261-L265 HydrophobicContact CD1-CD1 4.03Å; L261-L265 HydrophobicContact CD1-CG 4.3Å; L261-L265 HydrophobicContact CG-CD1 3.9Å; L261-L265 VanDerWaalsContact O-CG 3.3Å; L261-L265 WeakPolarHBondContact O-CG 3.35Å; L261-L265 PolarHBondContact O-N 3.36Å; L261-F326 HydrophobicContact CD2-CE2 3.66Å; L261-F326 HydrophobicContact CD2-CZ 3.6Å
262	L	78	Confident	64.3	Low	31 Å²	31	92 Å²	92	16%	0.162	46%	0.455	C	S	.	.	H	α-helix	trans	-61.1	-42	176.7	-69.7	176.5	0	0	0	111.4	L258 E259 R264 L265 G266 A306 L309 I333	L258-L262 HydrophobicContact CG-CD1 4.5Å; L258-L262 VanDerWaalsContact O-CG 3.3Å; L258-L262 WeakPolarHBondContact O-CG 3.18Å; L258-L262 PolarHBondContact O-N 3.04Å; E259-L262 PolarHBondContact O-N 3.38Å; L262-R264 PolarHBondContact O-N 3.29Å; L262-L265 PolarHBondContact O-N 2.98Å; L262-G266 PolarHBondContact O-N 3.09Å; L262-A306 HydrophobicContact CD1-CB 4.16Å; L262-L309 HydrophobicContact CD1-CD1 3.99Å; L262-L309 HydrophobicContact CD2-CD1 4.48Å; L262-I333 HydrophobicContact CD2-CD1 4.41Å; L262-I333 HydrophobicContact CD2-CG1 4.09Å; L262-I333 HydrophobicContact CD2-CG2 4.13Å
263	H	75.4	Confident	61.8	Low	128 Å²	128	92.6 Å²	92.6	59%	0.593	47%	0.465	S	S	*	.	H	α-helix	trans	-63.1	-41.1	175.5	-168.6	-42.8	0	0	0	112.1	E259 E260 L261 L265 G266 D267	E259-H263 WeakPolarHBondContact O-CB 3.43Å; E259-H263 PolarHBondContact O-N 2.83Å; E260-H263 PolarHBondContact O-N 3.32Å; L261-H263 VanDerWaalsContact C-N 3.33Å; L261-H263 PolarHBondContact O-N 3Å; H263-L265 VanDerWaalsContact C-N 3.33Å; H263-L265 PolarHBondContact O-N 3.41Å; H263-G266 PolarHBondContact O-N 3.17Å; H263-D267 PolarHBondContact O-N 2.92Å
264	R	73.9	Confident	59.4	Low	133 Å²	133	102.7 Å²	102.7	50%	0.502	51%	0.505	S	S	.	.	H	α-helix	trans	-67.1	-31.8	176.1	-73.8	-177.5	-171.5	-180	9.7	113.4	S246 E260 L261 L262	S246-R264 PolarHBondContact O-NH1 3.49Å; E260-R264 WeakPolarHBondContact O-CG 3.17Å; E260-R264 PolarHBondContact O-N 3.38Å; E260-R264 IonicContact OE1-CZ 2.77Å; E260-R264 IonicContact OE1-NE 3.57Å; E260-R264 PolarHBondContact OE1-NE 3.49Å; E260-R264 IonicContact OE1-NH2 2.65Å; E260-R264 PolarHBondContact OE1-NH2 3.17Å; L261-R264 PolarHBondContact O-N 3Å; L262-R264 PolarHBondContact O-N 3.29Å
265	L	69.8	Low	56.8	Low	70 Å²	70	105.9 Å²	105.9	37%	0.366	52%	0.519	S	S	.	.	H	α-helix	trans	-79.8	-26.8	178.3	-68.5	170	0	0	0	112.5	L261 L262 H263 I333 L337	L261-L265 HydrophobicContact CD1-CD1 4.03Å; L261-L265 HydrophobicContact CD1-CG 4.3Å; L261-L265 HydrophobicContact CG-CD1 3.9Å; L261-L265 VanDerWaalsContact O-CG 3.3Å; L261-L265 WeakPolarHBondContact O-CG 3.35Å; L261-L265 PolarHBondContact O-N 3.36Å; L262-L265 PolarHBondContact O-N 2.98Å; H263-L265 VanDerWaalsContact C-N 3.33Å; H263-L265 PolarHBondContact O-N 3.41Å; L265-I333 HydrophobicContact CD1-CG2 3.96Å; L265-L337 HydrophobicContact CB-CD1 4.31Å; L265-L337 HydrophobicContact CB-CD2 4.17Å; L265-L337 HydrophobicContact CD1-CD1 4.33Å
266	G	62.2	Low	54.6	Low	40 Å²	40	112.9 Å²	112.9	41%	0.412	55%	0.551	S	S	.	*	H	α-helix	trans	-79.4	-36.7	175.8	0	0	0	0	0	115.2	L262 H263 R268	L262-G266 PolarHBondContact O-N 3.09Å; H263-G266 PolarHBondContact O-N 3.17Å; G266-R268 PolarHBondContact O-N 3.45Å
267	D	48.8	Very low	52.3	Low	76 Å²	76	119.6 Å²	119.6	41%	0.406	57%	0.568	S	S	.	*			trans	-89.5	79.1	-174.5	-166.4	17.4	0	0	0	112.5	H263 K269	H263-D267 PolarHBondContact O-N 2.92Å; D267-K269 PolarHBondContact O-N 3.43Å
268	R	39.8	Very low	50.1	Low	228 Å²	228	126.4 Å²	126.4	86%	0.86	60%	0.595	S	S	*	*			trans	-74.4	85.9	177.1	-81.5	-166.9	175.6	-167.3	2.3	112.5	G266	G266-R268 PolarHBondContact O-N 3.45Å
269	K	29.1	Very low	47.5	Very low	153 Å²	153	138 Å²	138	67%	0.665	64%	0.639	S	S	*	*			trans	-121.1	145.2	156.1	-76.9	176.6	-176.9	159.1	0	111.5	D267 M271	D267-K269 PolarHBondContact O-N 3.43Å; K269-M271 PolarHBondContact O-N 2.78Å
270	P	26.9	Very low	45.3	Very low	126 Å²	126	136.6 Å²	136.6	82%	0.818	65%	0.654	S	S	*	*			trans	-63.7	132.9	-173.9	24.7	-33.6	0	0	0	111.9	H272	P270-H272 PolarHBondContact O-N 2.9Å
271	M	22.3	Very low	42.9	Very low	182 Å²	182	140.7 Å²	140.7	90%	0.897	68%	0.677	S	S	*	*			trans	-69.2	109.2	-170.7	179.8	161.8	60.9	0	0	112.5	K269	K269-M271 PolarHBondContact O-N 2.78Å
272	H	27.3	Very low	40.3	Very low	189 Å²	189	149.3 Å²	149.3	88%	0.875	71%	0.714	S	S	*	*			trans	-118.5	133.6	160.4	-90.9	-57.4	0	0	0	112.4	P270	P270-H272 PolarHBondContact O-N 2.9Å
273	S	25.5	Very low	38	Very low	96 Å²	96	157.3 Å²	157.3	67%	0.671	75%	0.75	S	S	*	*			trans	-82.9	130.6	-160.3	-179.2	0	0	0	0	114.1
274	Y	27.8	Very low	35.6	Very low	212 Å²	212	155.9 Å²	155.9	83%	0.831	76%	0.755	S	S	*	*			trans	59.4	114.1	152.3	-77.1	-124.6	0	0	0	119.7
275	K	28.4	Very low	33.4	Very low	208 Å²	208	154.5 Å²	154.5	90%	0.904	77%	0.766	S	S	*	*				-159.8	133.3	97.1	-109.5	170.9	-173.8	172.4	0	115
276	Q	32	Very low	31.4	Very low	174 Å²	174	159.1 Å²	159.1	81%	0.813	79%	0.785	S	S	*	*			trans	-64.7	133	-177.7	-166.9	178.5	43.3	0	0	113
277	K	27.7	Very low	29.8	Very low	205 Å²	205	164.1 Å²	164.1	89%	0.891	80%	0.801	S	S	*	*			trans	-145.6	95.9	160	-145.8	171.1	-168.5	174.1	0	112	R279	K277-R279 PolarHBondContact O-N 3.35Å
278	K	34.2	Very low	28.9	Very low	191 Å²	191	166.4 Å²	166.4	83%	0.83	82%	0.82	S	S	*	*			trans	-54.8	126.3	170.7	-73.4	178.6	172.9	179	0	110.6
279	R	26.7	Very low	28.5	Very low	244 Å²	244	163.4 Å²	163.4	92%	0.921	82%	0.816	S	S	*	*			trans	-148.3	117.4	148.9	-103.7	174.7	-177.3	-175.3	-2.1	107.8	K277	K277-R279 PolarHBondContact O-N 3.35Å
280	G	34.3	Very low	28.3	Very low	81 Å²	81	163.6 Å²	163.6	84%	0.835	83%	0.825	S	S	*	*			trans	-76.5	149.1	-173.2	0	0	0	0	0	112.5
281	I	29.5	Very low	28.4	Very low	173 Å²	173	166.6 Å²	166.6	89%	0.887	83%	0.825	S	S	*	*			trans	-126.4	151.1	167.3	-65.3	-177.6	0	0	0	108
282	K	26.1	Very low	28.5	Very low	195 Å²	195	163.2 Å²	163.2	85%	0.848	82%	0.819	S	S	*	*			trans	-69.8	145.5	-162.9	-66.5	167.5	176.6	175	0	113.1	S284	K282-S284 PolarHBondContact O-N 3.01Å
283	Q	30.6	Very low	28.8	Very low	199 Å²	199	162.6 Å²	162.6	93%	0.93	82%	0.817	S	S	*	*			trans	-45.8	120.7	156	-165.3	172.5	22.6	0	0	110.4
284	S	24.7	Very low	28.9	Very low	98 Å²	98	165.2 Å²	165.2	69%	0.685	82%	0.823	S	S	*	*			trans	-136.3	107.2	167.5	-172.5	0	0	0	0	108.5	K282	K282-S284 PolarHBondContact O-N 3.01Å
285	S	28.6	Very low	29.4	Very low	105 Å²	105	161.3 Å²	161.3	73%	0.734	82%	0.822	S	S	*	*			trans	-86.7	103	179.5	50.5	0	0	0	0	110.1
286	H	25.9	Very low	30	Very low	167 Å²	167	155.5 Å²	155.5	77%	0.773	82%	0.82	S	S	*	*			trans	-138.1	104.5	165.3	-82.2	-71.3	0	0	0	110.8
287	L	29.8	Very low	30.4	Very low	144 Å²	144	149.7 Å²	149.7	75%	0.754	81%	0.808	S	S	*	*			trans	-65.1	147.5	158.3	-81.1	73.6	0	0	0	109.2	Q289	L287-Q289 HydrophobicContact CD2-CG 4.23Å
288	P	30	Very low	31.4	Very low	124 Å²	124	145.3 Å²	145.3	81%	0.805	79%	0.794	S	S	*	*			trans	-108.2	107.5	138.6	3.5	16.8	0	0	0	108.8	N290	P288-N290 PolarHBondContact O-N 3.26Å
289	Q	30.8	Very low	32.7	Very low	166 Å²	166	145.1 Å²	145.1	78%	0.776	79%	0.788	S	S	*	*			trans	-69.8	123.5	156	-76.2	178.8	-34.3	0	0	107.8	L287	L287-Q289 HydrophobicContact CD2-CG 4.23Å
290	N	24.8	Very low	34.2	Very low	157 Å²	157	136 Å²	136	84%	0.84	76%	0.76	S	S	*	*			trans	-160.4	84.6	155	-101.7	-18.2	0	0	0	109.4	P288 S292	P288-N290 PolarHBondContact O-N 3.26Å; N290-S292 PolarHBondContact O-N 3.43Å
291	F	28.4	Very low	35.4	Very low	188 Å²	188	139.6 Å²	139.6	83%	0.825	75%	0.754	S	S	*	*			trans	-78.5	96.2	164.6	-95.3	-89.7	0	0	0	108.9	H293	F291-H293 PolarHBondContact O-N 3.18Å
292	S	25.7	Very low	37.1	Very low	111 Å²	111	133.9 Å²	133.9	78%	0.776	73%	0.728	S	S	*	*			trans	-74.1	99.3	161.4	46.6	0	0	0	0	108.9	N290 N294	N290-S292 PolarHBondContact O-N 3.43Å; S292-N294 PolarHBondContact O-N 3.22Å; S292-N294 VanDerWaalsContact O-N 3.1Å
293	H	32.8	Very low	39.4	Very low	177 Å²	177	127.3 Å²	127.3	82%	0.819	71%	0.705	S	S	*	*			trans	-55	113.6	164.3	-99.6	-85.3	0	0	0	109.1	F291	F291-H293 PolarHBondContact O-N 3.18Å
294	N	27.6	Very low	41.8	Very low	150 Å²	150	119.6 Å²	119.6	80%	0.802	67%	0.669	S	S	*	*			trans	-129.1	119.1	158.4	-152.8	12.3	0	0	0	108.9	S292	S292-N294 PolarHBondContact O-N 3.22Å; S292-N294 VanDerWaalsContact O-N 3.1Å
295	T	38.4	Very low	44.4	Very low	131 Å²	131	117.2 Å²	117.2	80%	0.804	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	120	-172.8	43.8	0	0	0	0	110.8
296	G	42.1	Very low	46.9	Very low	85 Å²	85	112.3 Å²	112.3	88%	0.876	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	108.5	21.3	173	0	0	0	0	0	116.2
297	G	38.6	Very low	49.3	Very low	53 Å²	53	107.8 Å²	107.8	55%	0.546	60%	0.6	S	S	.	*			trans	-78.1	144.8	174.7	0	0	0	0	0	113.5
298	D	50.7	Low	51.6	Low	112 Å²	112	104.3 Å²	104.3	60%	0.599	58%	0.58	S	S	*	*			trans	-70.4	127.9	175.5	-172.8	10.1	0	0	0	111.2	T300	D298-T300 PolarHBondContact O-N 2.87Å; D298-T300 WeakPolarHBondContact OD1-CG2 3.46Å; D298-T300 PolarHBondContact OD1-N 3.43Å; D298-T300 PolarHBondContact OD1-OG1 3.47Å; D298-T300 PolarHBondContact OD2-OG1 3.03Å
299	W	60.2	Low	54.1	Low	187 Å²	187	98.5 Å²	98.5	71%	0.708	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-79.3	-6	-175.5	-60.6	99.3	0	0	0	113.3	Q301 V302 F304	W299-Q301 VanDerWaalsContact C-N 3.28Å; W299-Q301 PolarHBondContact O-N 3.09Å; W299-V302 HydrophobicContact CE3-CG2 4.29Å; W299-F304 HydrophobicContact CE3-CZ 4.39Å
300	T	59.5	Low	56.5	Low	54 Å²	54	90.7 Å²	90.7	33%	0.331	51%	0.505	S	S	.	.	G	3₁₀ helix	trans	-63.4	-28.9	177.8	58.6	0	0	0	0	113.6	D298	D298-T300 PolarHBondContact O-N 2.87Å; D298-T300 WeakPolarHBondContact OD1-CG2 3.46Å; D298-T300 PolarHBondContact OD1-N 3.43Å; D298-T300 PolarHBondContact OD1-OG1 3.47Å; D298-T300 PolarHBondContact OD2-OG1 3.03Å
301	Q	57.5	Low	59.1	Low	155 Å²	155	87.8 Å²	87.8	72%	0.724	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-101.5	3.2	-173.2	-62.6	-168.4	-12.1	0	0	114.8	W299	W299-Q301 VanDerWaalsContact C-N 3.28Å; W299-Q301 PolarHBondContact O-N 3.09Å
302	V	66.9	Low	61.6	Low	54 Å²	54	83.4 Å²	83.4	33%	0.327	47%	0.474	S	S	.	.			trans	-88.2	118.3	-177.5	-175.9	0	0	0	0	110.7	W299 F304	W299-V302 HydrophobicContact CE3-CG2 4.29Å; V302-F304 HydrophobicContact CB-CE1 4.44Å; V302-F304 HydrophobicContact CB-CE2 3.91Å; V302-F304 HydrophobicContact CB-CZ 3.81Å; V302-F304 HydrophobicContact CG1-CD1 4.2Å; V302-F304 HydrophobicContact CG1-CD2 4.42Å; V302-F304 HydrophobicContact CG1-CE1 3.72Å; V302-F304 HydrophobicContact CG1-CE2 3.96Å; V302-F304 HydrophobicContact CG1-CZ 3.59Å; V302-F304 VanDerWaalsContact O-CD2 3.29Å; V302-F304 WeakPolarHBondContact O-CD2 3.38Å; V302-F304 VanDerWaalsContact O-CE2 3.31Å; V302-F304 WeakPolarHBondContact O-CE2 3.23Å
303	C	73.5	Confident	64.3	Low	56 Å²	56	81.3 Å²	81.3	38%	0.378	45%	0.451	S	S	.	.			trans	-81.3	126.4	169.7	-177.9	0	0	0	0	110.1	A341 C342	C303-A341 HydrophobicContact CB-CB 4.43Å; C303-C342 HydrophobicContact CB-CB 4Å; C303-C342 WeakPolarHBondContact CB-SG 3.38Å; C303-C342 VanDerWaalsContact SG-CA 3.52Å; C303-C342 WeakPolarHBondContact SG-CB 3.33Å; C303-C342 CovalentContact SG-SG 2.04Å; C303-C342 PolarHBondContact SG-SG 3.26Å
304	F	80.7	Confident	65.7	Low	38 Å²	38	77.3 Å²	77.3	17%	0.167	45%	0.449	C	S	.	.			trans	-105	130.2	-178.2	-63.5	-83	0	0	0	111.4	W299 V302 Q308 L309 I312 Q336	W299-F304 HydrophobicContact CE3-CZ 4.39Å; V302-F304 HydrophobicContact CB-CE1 4.44Å; V302-F304 HydrophobicContact CB-CE2 3.91Å; V302-F304 HydrophobicContact CB-CZ 3.81Å; V302-F304 HydrophobicContact CG1-CD1 4.2Å; V302-F304 HydrophobicContact CG1-CD2 4.42Å; V302-F304 HydrophobicContact CG1-CE1 3.72Å; V302-F304 HydrophobicContact CG1-CE2 3.96Å; V302-F304 HydrophobicContact CG1-CZ 3.59Å; V302-F304 VanDerWaalsContact O-CD2 3.29Å; V302-F304 WeakPolarHBondContact O-CD2 3.38Å; V302-F304 VanDerWaalsContact O-CE2 3.31Å; V302-F304 WeakPolarHBondContact O-CE2 3.23Å; F304-Q308 HydrophobicContact CB-CB 4.36Å; F304-Q308 HydrophobicContact CD1-CB 4.23Å; F304-L309 HydrophobicContact CB-CD2 3.76Å; F304-L309 HydrophobicContact CB-CG 3.9Å; F304-L309 HydrophobicContact CG-CD2 4.4Å; F304-I312 HydrophobicContact CD1-CD1 3.59Å; F304-I312 HydrophobicContact CE1-CD1 3.68Å; F304-I312 HydrophobicContact CG-CD1 4.14Å; F304-I312 HydrophobicContact CZ-CD1 4.31Å; F304-Q336 PolarHBondContact O-OE1 2.78Å
305	S	80.1	Confident	67.8	Low	48 Å²	48	71.3 Å²	71.3	34%	0.336	42%	0.416	S	S	.	.			trans	-69.4	161.2	171.7	64.7	0	0	0	0	112	N307 Q308 L309	S305-N307 PolarHBondContact O-N 3.38Å; S305-Q308 PolarHBondContact O-N 3.02Å; S305-Q308 WeakPolarHBondContact OG-CG 3.37Å; S305-Q308 PolarHBondContact OG-N 3.48Å; S305-Q308 PolarHBondContact OG-OE1 3Å; S305-L309 PolarHBondContact O-N 2.75Å
306	A	79.8	Confident	69.1	Low	1 Å²	1	69.1 Å²	69.1	1%	0.008	40%	0.4	C	S	.	.	H	α-helix	trans	-54.3	-38	177.6	0	0	0	0	0	113	I255 L258 E259 L262 V310	I255-A306 HydrophobicContact CG2-CB 3.81Å; L258-A306 HydrophobicContact CB-CB 4.24Å; L258-A306 HydrophobicContact CD2-CB 4.04Å; L258-A306 HydrophobicContact CG-CB 4Å; E259-A306 HydrophobicContact CB-CB 4.01Å; L262-A306 HydrophobicContact CD1-CB 4.16Å; A306-V310 WeakPolarHBondContact O-CG2 3.45Å; A306-V310 PolarHBondContact O-N 3.27Å; A306-V310 VanDerWaalsContact O-N 3.14Å
307	N	77.5	Confident	70	Confident	73 Å²	73	67.7 Å²	67.7	39%	0.39	38%	0.375	S	S	.	.	H	α-helix	trans	-63.7	-48.4	174.4	-63.4	-62	0	0	0	111.7	I255 S305 L309 V310 D311	I255-N307 WeakPolarHBondContact CG2-OD1 3.39Å; S305-N307 PolarHBondContact O-N 3.38Å; N307-L309 VanDerWaalsContact C-N 3.32Å; N307-L309 PolarHBondContact O-N 3.03Å; N307-V310 WeakPolarHBondContact O-CB 3.19Å; N307-V310 PolarHBondContact O-N 3.34Å; N307-V310 VanDerWaalsContact O-N 3.16Å; N307-D311 VanDerWaalsContact O-CG 3.27Å; N307-D311 PolarHBondContact O-N 3.43Å
308	Q	78.6	Confident	70.9	Confident	71 Å²	71	73.7 Å²	73.7	33%	0.332	39%	0.388	S	S	.	.	H	α-helix	trans	-65.1	-35	-179.2	-71	163.3	-53.6	0	0	112.4	F304 S305 D311 I312	F304-Q308 HydrophobicContact CB-CB 4.36Å; F304-Q308 HydrophobicContact CD1-CB 4.23Å; S305-Q308 PolarHBondContact O-N 3.02Å; S305-Q308 WeakPolarHBondContact OG-CG 3.37Å; S305-Q308 PolarHBondContact OG-N 3.48Å; S305-Q308 PolarHBondContact OG-OE1 3Å; Q308-D311 PolarHBondContact O-N 2.99Å; Q308-I312 WeakPolarHBondContact O-CB 3.48Å; Q308-I312 WeakPolarHBondContact O-CD1 3.5Å; Q308-I312 WeakPolarHBondContact O-CG1 3.5Å; Q308-I312 PolarHBondContact O-N 3.45Å
309	L	81.1	Confident	71.6	Confident	1 Å²	1	73.9 Å²	73.9	1%	0.005	39%	0.389	C	S	.	.	H	α-helix	trans	-63.7	-45.9	172.6	-69.6	174.5	0	0	0	111	L262 F304 S305 N307 D311 I312 F313 I329 A332 I333	L262-L309 HydrophobicContact CD1-CD1 3.99Å; L262-L309 HydrophobicContact CD2-CD1 4.48Å; F304-L309 HydrophobicContact CB-CD2 3.76Å; F304-L309 HydrophobicContact CB-CG 3.9Å; F304-L309 HydrophobicContact CG-CD2 4.4Å; S305-L309 PolarHBondContact O-N 2.75Å; N307-L309 VanDerWaalsContact C-N 3.32Å; N307-L309 PolarHBondContact O-N 3.03Å; L309-D311 VanDerWaalsContact C-N 3.33Å; L309-D311 PolarHBondContact O-N 2.98Å; L309-I312 PolarHBondContact O-N 3.25Å; L309-F313 VanDerWaalsContact O-CD2 3.24Å; L309-F313 WeakPolarHBondContact O-CD2 3.27Å; L309-F313 PolarHBondContact O-N 3.05Å; L309-F313 VanDerWaalsContact O-N 3.13Å; L309-I329 HydrophobicContact CB-CG2 4.29Å; L309-I329 HydrophobicContact CD1-CG2 4.26Å; L309-A332 HydrophobicContact CD2-CB 3.82Å; L309-I333 HydrophobicContact CD1-CG1 4.33Å
310	V	82.4	Confident	72.3	Confident	2 Å²	2	67.3 Å²	67.3	1%	0.012	37%	0.371	C	S	.	.	H	α-helix	trans	-58.5	-44.2	174.9	163.2	0	0	0	0	111.2	I255 L258 A306 N307 F313 A314 L315 P317 I321	I255-V310 HydrophobicContact CD1-CG1 4.44Å; I255-V310 HydrophobicContact CG1-CG2 4.34Å; L258-V310 HydrophobicContact CD2-CG2 4.35Å; A306-V310 WeakPolarHBondContact O-CG2 3.45Å; A306-V310 PolarHBondContact O-N 3.27Å; A306-V310 VanDerWaalsContact O-N 3.14Å; N307-V310 WeakPolarHBondContact O-CB 3.19Å; N307-V310 PolarHBondContact O-N 3.34Å; N307-V310 VanDerWaalsContact O-N 3.16Å; V310-F313 PolarHBondContact O-N 3.47Å; V310-A314 PolarHBondContact O-N 3.46Å; V310-L315 HydrophobicContact CG1-CB 3.9Å; V310-L315 VanDerWaalsContact CG1-O 3.3Å; V310-L315 WeakPolarHBondContact CG1-O 3.26Å; V310-L315 PolarHBondContact O-N 2.83Å; V310-P317 HydrophobicContact CG1-CB 4.12Å; V310-I321 HydrophobicContact CG2-CD1 3.87Å
311	D	79.7	Confident	73.3	Confident	97 Å²	97	65 Å²	65	52%	0.519	36%	0.357	S	S	.	.	H	α-helix	trans	-63.9	-42.7	176.1	-66	-31.3	0	0	0	112.7	N307 Q308 L309 F313 A314	N307-D311 VanDerWaalsContact O-CG 3.27Å; N307-D311 PolarHBondContact O-N 3.43Å; Q308-D311 PolarHBondContact O-N 2.99Å; L309-D311 VanDerWaalsContact C-N 3.33Å; L309-D311 PolarHBondContact O-N 2.98Å; D311-F313 VanDerWaalsContact C-N 3.33Å; D311-F313 PolarHBondContact O-N 3.14Å; D311-A314 WeakPolarHBondContact O-CA 3.47Å; D311-A314 PolarHBondContact O-N 3.05Å
312	I	81.1	Confident	74.6	Confident	96 Å²	96	58.9 Å²	58.9	49%	0.492	33%	0.331	S	S	.	.	H	α-helix	trans	-61.8	-39.9	179.3	-76	162.6	0	0	0	111.5	F304 Q308 L309 A314	F304-I312 HydrophobicContact CD1-CD1 3.59Å; F304-I312 HydrophobicContact CE1-CD1 3.68Å; F304-I312 HydrophobicContact CG-CD1 4.14Å; F304-I312 HydrophobicContact CZ-CD1 4.31Å; Q308-I312 WeakPolarHBondContact O-CB 3.48Å; Q308-I312 WeakPolarHBondContact O-CD1 3.5Å; Q308-I312 WeakPolarHBondContact O-CG1 3.5Å; Q308-I312 PolarHBondContact O-N 3.45Å; L309-I312 PolarHBondContact O-N 3.25Å; I312-A314 PolarHBondContact O-N 2.99Å
313	F	81	Confident	75.3	Confident	67 Å²	67	58.7 Å²	58.7	29%	0.294	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	11.3	175.8	-68.4	-75	0	0	0	113.3	L309 V310 D311 L315 Q328 I329 A332	L309-F313 VanDerWaalsContact O-CD2 3.24Å; L309-F313 WeakPolarHBondContact O-CD2 3.27Å; L309-F313 PolarHBondContact O-N 3.05Å; L309-F313 VanDerWaalsContact O-N 3.13Å; V310-F313 PolarHBondContact O-N 3.47Å; D311-F313 VanDerWaalsContact C-N 3.33Å; D311-F313 PolarHBondContact O-N 3.14Å; F313-L315 HydrophobicContact CB-CD1 4.2Å; F313-L315 HydrophobicContact CB-CG 4.08Å; F313-L315 PolarHBondContact O-N 3Å; F313-Q328 HydrophobicContact CD1-CB 4.42Å; F313-Q328 VanDerWaalsContact CE1-O 3.26Å; F313-Q328 WeakPolarHBondContact CE1-O 3.13Å; F313-Q328 WeakPolarHBondContact CZ-O 3.4Å; F313-I329 HydrophobicContact CD2-CB 4.37Å; F313-I329 HydrophobicContact CD2-CG1 3.78Å; F313-I329 HydrophobicContact CE2-CB 4.37Å; F313-I329 HydrophobicContact CE2-CG1 4.27Å; F313-I329 HydrophobicContact CE2-CG2 4.46Å; F313-I329 HydrophobicContact CG-CG1 4.31Å; F313-A332 HydrophobicContact CE2-CB 3.73Å; F313-A332 HydrophobicContact CZ-CB 3.91Å
314	A	62.7	Low	75.7	Confident	93 Å²	93	61.6 Å²	61.6	77%	0.769	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	34.9	178.8	0	0	0	0	0	113.9	V310 D311 I312	V310-A314 PolarHBondContact O-N 3.46Å; D311-A314 WeakPolarHBondContact O-CA 3.47Å; D311-A314 PolarHBondContact O-N 3.05Å; I312-A314 PolarHBondContact O-N 2.99Å
315	L	70.8	Confident	75.7	Confident	23 Å²	23	62.9 Å²	62.9	12%	0.12	34%	0.341	C	S	.	.			trans	-87.9	138.7	177	-60	177.5	0	0	0	109.4	V310 F313 P317 Q325 I329	V310-L315 HydrophobicContact CG1-CB 3.9Å; V310-L315 VanDerWaalsContact CG1-O 3.3Å; V310-L315 WeakPolarHBondContact CG1-O 3.26Å; V310-L315 PolarHBondContact O-N 2.83Å; F313-L315 HydrophobicContact CB-CD1 4.2Å; F313-L315 HydrophobicContact CB-CG 4.08Å; F313-L315 PolarHBondContact O-N 3Å; L315-P317 WeakPolarHBondContact O-CD 3.37Å; L315-Q325 HydrophobicContact CD1-CB 4.14Å; L315-Q325 HydrophobicContact CD2-CB 4.33Å; L315-Q325 HydrophobicContact CD2-CG 3.89Å; L315-I329 HydrophobicContact CD1-CD1 3.84Å; L315-I329 HydrophobicContact CD1-CG1 4.33Å
316	D	67.1	Low	75.9	Confident	85 Å²	85	60.7 Å²	60.7	46%	0.455	33%	0.325	S	S	.	.			trans	-69.5	119.9	177.3	-176.4	-28.4	0	0	0	109.8	H318 L319	D316-H318 PolarHBondContact O-N 3.35Å; D316-H318 VanDerWaalsContact O-N 3.07Å; D316-H318 WeakPolarHBondContact OD1-CB 3.3Å; D316-H318 IonicContact OD1-CD2 3.86Å; D316-H318 IonicContact OD1-CG 2.85Å; D316-H318 PolarHBondContact OD1-N 3.33Å; D316-L319 HydrophobicContact CB-CB 4.37Å; D316-L319 HydrophobicContact CB-CD1 3.66Å; D316-L319 PolarHBondContact O-N 2.9Å; D316-L319 WeakPolarHBondContact OD2-CD1 3.18Å
317	P	59.7	Low	76.1	Confident	56 Å²	56	66.9 Å²	66.9	36%	0.364	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-8	-176.7	28	-35.7	0	0	0	114.4	I255 V310 L315	I255-P317 HydrophobicContact CD1-CB 3.7Å; I255-P317 WeakPolarHBondContact CD1-O 3.16Å; V310-P317 HydrophobicContact CG1-CB 4.12Å; L315-P317 WeakPolarHBondContact O-CD 3.37Å
318	H	59.1	Low	76.4	Confident	178 Å²	178	68.6 Å²	68.6	82%	0.824	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-10.2	171.8	-62.6	-52.3	0	0	0	114	D316	D316-H318 PolarHBondContact O-N 3.35Å; D316-H318 VanDerWaalsContact O-N 3.07Å; D316-H318 WeakPolarHBondContact OD1-CB 3.3Å; D316-H318 IonicContact OD1-CD2 3.86Å; D316-H318 IonicContact OD1-CG 2.85Å; D316-H318 PolarHBondContact OD1-N 3.33Å
319	L	65.4	Low	76.8	Confident	116 Å²	116	65.2 Å²	65.2	61%	0.607	34%	0.344	S	S	*	.	S	Bend	trans	-93.8	156.5	172.9	-84.4	96.1	0	0	0	112.5	D316	D316-L319 HydrophobicContact CB-CB 4.37Å; D316-L319 HydrophobicContact CB-CD1 3.66Å; D316-L319 PolarHBondContact O-N 2.9Å; D316-L319 WeakPolarHBondContact OD2-CD1 3.18Å
320	S	74.1	Confident	77	Confident	49 Å²	49	66.6 Å²	66.6	34%	0.343	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-86.3	130.3	177.6	62.3	0	0	0	0	111	N252 L253 S322	N252-S320 WeakPolarHBondContact CB-OG 3.27Å; N252-S320 PolarHBondContact ND2-OG 3.37Å; L253-S320 CarbonylContact O-C 3.58Å; L253-S320 WeakPolarHBondContact O-CA 3.34Å; S320-S322 PolarHBondContact O-N 3.46Å
321	I	81.1	Confident	77.2	Confident	5 Å²	5	70.7 Å²	70.7	3%	0.026	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-68.3	121.8	-176.4	-52.8	171.4	0	0	0	109.7	N252 L253 L258 V310 Q325 F326 I329	N252-I321 CarbonylContact C-O 3.57Å; N252-I321 VanDerWaalsContact CA-O 3.26Å; N252-I321 WeakPolarHBondContact CA-O 3.24Å; L253-I321 HydrophobicContact CB-CB 4.07Å; L253-I321 PolarHBondContact N-O 2.88Å; L253-I321 PolarHBondContact O-N 2.71Å; L258-I321 HydrophobicContact CD2-CD1 3.89Å; V310-I321 HydrophobicContact CG2-CD1 3.87Å; I321-Q325 HydrophobicContact CG2-CB 3.79Å; I321-F326 HydrophobicContact CG2-CB 4.16Å; I321-I329 HydrophobicContact CD1-CD1 4.25Å; I321-I329 HydrophobicContact CG2-CD1 4Å
322	S	84.4	Confident	77.3	Confident	27 Å²	27	67.2 Å²	67.2	19%	0.189	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-78.4	171.6	175.2	82.6	0	0	0	0	112.5	S320 E324 Q325 F326	S320-S322 PolarHBondContact O-N 3.46Å; S322-E324 VanDerWaalsContact C-N 3.29Å; S322-E324 WeakPolarHBondContact CB-OE2 3.13Å; S322-E324 PolarHBondContact O-N 3.35Å; S322-E324 PolarHBondContact OG-N 3.45Å; S322-E324 PolarHBondContact OG-OE2 2.81Å; S322-Q325 PolarHBondContact O-N 3.27Å; S322-Q325 WeakPolarHBondContact OG-CG 3.37Å; S322-Q325 PolarHBondContact OG-N 3.15Å; S322-F326 WeakPolarHBondContact O-CB 3.4Å; S322-F326 PolarHBondContact O-N 3.33Å
323	K	81.9	Confident	77.4	Confident	50 Å²	50	63 Å²	63	22%	0.217	34%	0.343	C	S	.	.	H	α-helix	trans	-61.3	-38.5	176.8	-65.9	-176.6	-174.4	180	0	112.1	I240 D241 F244 F326 Q327	I240-K323 HydrophobicContact CG2-CB 4.06Å; I240-K323 HydrophobicContact CG2-CD 4.42Å; I240-K323 HydrophobicContact CG2-CG 4.15Å; D241-K323 WeakPolarHBondContact OD1-CE 3.44Å; D241-K323 IonicContact OD1-NZ 2.65Å; D241-K323 PolarHBondContact OD1-NZ 3.07Å; F244-K323 HydrophobicContact CD1-CG 4.29Å; F244-K323 HydrophobicContact CE1-CG 3.88Å; F244-K323 HydrophobicContact CE2-CG 4.36Å; F244-K323 HydrophobicContact CZ-CG 3.93Å; K323-F326 PolarHBondContact O-N 3.25Å; K323-Q327 PolarHBondContact O-N 3.47Å
324	E	80.6	Confident	77.4	Confident	118 Å²	118	63.6 Å²	63.6	55%	0.551	35%	0.352	S	S	*	.	H	α-helix	trans	-69.6	-40.2	179.1	-51.5	72.3	-156.2	0	0	111.1	S322 Q327 Q328	S322-E324 VanDerWaalsContact C-N 3.29Å; S322-E324 WeakPolarHBondContact CB-OE2 3.13Å; S322-E324 PolarHBondContact O-N 3.35Å; S322-E324 PolarHBondContact OG-N 3.45Å; S322-E324 PolarHBondContact OG-OE2 2.81Å; E324-Q327 WeakPolarHBondContact O-CB 3.26Å; E324-Q327 PolarHBondContact O-N 3.15Å; E324-Q328 PolarHBondContact O-N 2.88Å
325	Q	80.8	Confident	78.2	Confident	64 Å²	64	63.4 Å²	63.4	30%	0.299	34%	0.335	S	S	.	.	H	α-helix	trans	-67.9	-40	174	-68.2	172.3	-28.8	0	0	111.2	L315 I321 S322 Q327 Q328 I329	L315-Q325 HydrophobicContact CD1-CB 4.14Å; L315-Q325 HydrophobicContact CD2-CB 4.33Å; L315-Q325 HydrophobicContact CD2-CG 3.89Å; I321-Q325 HydrophobicContact CG2-CB 3.79Å; S322-Q325 PolarHBondContact O-N 3.27Å; S322-Q325 WeakPolarHBondContact OG-CG 3.37Å; S322-Q325 PolarHBondContact OG-N 3.15Å; Q325-Q327 VanDerWaalsContact C-N 3.31Å; Q325-Q327 PolarHBondContact O-N 2.87Å; Q325-Q328 WeakPolarHBondContact O-CB 3.37Å; Q325-Q328 PolarHBondContact O-N 2.63Å; Q325-Q328 VanDerWaalsContact O-N 3.13Å; Q325-I329 WeakPolarHBondContact O-CG1 3.45Å; Q325-I329 PolarHBondContact O-N 3.34Å; Q325-I329 VanDerWaalsContact O-N 3.15Å
326	F	84.9	Confident	78.4	Confident	3 Å²	3	62.6 Å²	62.6	1%	0.013	33%	0.331	C	S	.	.	H	α-helix	trans	-62.9	-37.7	174.3	-178.1	-102	0	0	0	112.2	I240 I243 F244 L258 L261 I321 S322 K323 Q328 I329 C330 I333	I240-F326 HydrophobicContact CD1-CD1 4.19Å; I240-F326 HydrophobicContact CD1-CE1 4.27Å; I240-F326 HydrophobicContact CG2-CD1 4.35Å; I243-F326 HydrophobicContact CD1-CE1 4.12Å; I243-F326 HydrophobicContact CD1-CZ 4.45Å; I243-F326 HydrophobicContact CG2-CE1 4.16Å; I243-F326 HydrophobicContact CG2-CZ 3.99Å; F244-F326 HydrophobicContact CE2-CB 4.05Å; F244-F326 AromaticContact CE2-CD1 3.76Å; F244-F326 HydrophobicContact CE2-CD1 3.76Å; F244-F326 HydrophobicContact CE2-CE1 4.37Å; F244-F326 AromaticContact CE2-CG 3.85Å; F244-F326 HydrophobicContact CE2-CG 3.85Å; F244-F326 HydrophobicContact CZ-CB 4.06Å; F244-F326 HydrophobicContact CZ-CG 4.31Å; L258-F326 HydrophobicContact CD1-CE2 4.11Å; L261-F326 HydrophobicContact CD2-CE2 3.66Å; L261-F326 HydrophobicContact CD2-CZ 3.6Å; I321-F326 HydrophobicContact CG2-CB 4.16Å; S322-F326 WeakPolarHBondContact O-CB 3.4Å; S322-F326 PolarHBondContact O-N 3.33Å; K323-F326 PolarHBondContact O-N 3.25Å; F326-Q328 VanDerWaalsContact C-N 3.26Å; F326-Q328 PolarHBondContact O-N 3.49Å; F326-I329 PolarHBondContact O-N 3.19Å; F326-I329 VanDerWaalsContact O-N 3.12Å; F326-C330 WeakPolarHBondContact CE1-SG 3.43Å; F326-C330 PolarHBondContact O-N 2.99Å; F326-C330 PolarHBondContact O-SG 3.08Å; F326-I333 HydrophobicContact CE2-CD1 4.14Å
327	Q	83.9	Confident	78.6	Confident	130 Å²	130	62.2 Å²	62.2	61%	0.607	33%	0.328	S	S	*	.	H	α-helix	trans	-60.9	-32.9	173.5	-169.8	-179.2	9.9	0	0	112.5	K323 E324 Q325 P331	K323-Q327 PolarHBondContact O-N 3.47Å; E324-Q327 WeakPolarHBondContact O-CB 3.26Å; E324-Q327 PolarHBondContact O-N 3.15Å; Q325-Q327 VanDerWaalsContact C-N 3.31Å; Q325-Q327 PolarHBondContact O-N 2.87Å; Q327-P331 VanDerWaalsContact O-CD 3.26Å; Q327-P331 WeakPolarHBondContact O-CD 3.46Å
328	Q	84.3	Confident	78.9	Confident	109 Å²	109	66.5 Å²	66.5	51%	0.509	35%	0.347	S	S	.	.	H	α-helix	trans	-73.1	-32.6	173.7	-66	175	-3.3	0	0	112.9	F313 E324 Q325 F326 P331	F313-Q328 HydrophobicContact CD1-CB 4.42Å; F313-Q328 VanDerWaalsContact CE1-O 3.26Å; F313-Q328 WeakPolarHBondContact CE1-O 3.13Å; F313-Q328 WeakPolarHBondContact CZ-O 3.4Å; E324-Q328 PolarHBondContact O-N 2.88Å; Q325-Q328 WeakPolarHBondContact O-CB 3.37Å; Q325-Q328 PolarHBondContact O-N 2.63Å; Q325-Q328 VanDerWaalsContact O-N 3.13Å; F326-Q328 VanDerWaalsContact C-N 3.26Å; F326-Q328 PolarHBondContact O-N 3.49Å; Q328-P331 WeakPolarHBondContact O-CD 3.4Å
329	I	85.9	Confident	79	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-75.4	-29.7	176.6	-58.9	166.6	0	0	0	111.4	L258 L309 F313 L315 I321 Q325 F326 A332 I333	L258-I329 HydrophobicContact CD2-CD1 4.46Å; L309-I329 HydrophobicContact CB-CG2 4.29Å; L309-I329 HydrophobicContact CD1-CG2 4.26Å; F313-I329 HydrophobicContact CD2-CB 4.37Å; F313-I329 HydrophobicContact CD2-CG1 3.78Å; F313-I329 HydrophobicContact CE2-CB 4.37Å; F313-I329 HydrophobicContact CE2-CG1 4.27Å; F313-I329 HydrophobicContact CE2-CG2 4.46Å; F313-I329 HydrophobicContact CG-CG1 4.31Å; L315-I329 HydrophobicContact CD1-CD1 3.84Å; L315-I329 HydrophobicContact CD1-CG1 4.33Å; I321-I329 HydrophobicContact CD1-CD1 4.25Å; I321-I329 HydrophobicContact CG2-CD1 4Å; Q325-I329 WeakPolarHBondContact O-CG1 3.45Å; Q325-I329 PolarHBondContact O-N 3.34Å; Q325-I329 VanDerWaalsContact O-N 3.15Å; F326-I329 PolarHBondContact O-N 3.19Å; F326-I329 VanDerWaalsContact O-N 3.12Å; I329-A332 WeakPolarHBondContact O-CB 3.28Å; I329-A332 PolarHBondContact O-N 3.46Å; I329-I333 HydrophobicContact CG2-CD1 3.84Å; I329-I333 HydrophobicContact CG2-CG1 3.94Å; I329-I333 PolarHBondContact O-N 3.24Å; I329-I333 VanDerWaalsContact O-N 3.12Å
330	C	85.3	Confident	78.6	Confident	31 Å²	31	59.4 Å²	59.4	21%	0.209	33%	0.326	C	S	.	.	H	α-helix	trans	-51.2	-46.1	-176.4	-78.3	0	0	0	0	114.9	F326 A332 I333 V334	F326-C330 WeakPolarHBondContact CE1-SG 3.43Å; F326-C330 PolarHBondContact O-N 2.99Å; F326-C330 PolarHBondContact O-SG 3.08Å; C330-A332 VanDerWaalsContact C-N 3.29Å; C330-A332 PolarHBondContact O-N 3.2Å; C330-I333 PolarHBondContact O-N 3.25Å; C330-I333 VanDerWaalsContact O-N 3.15Å; C330-V334 WeakPolarHBondContact O-CG2 3.4Å; C330-V334 PolarHBondContact O-N 3.48Å
331	P	87.3	Confident	77.7	Confident	88 Å²	88	57.5 Å²	57.5	57%	0.571	31%	0.312	S	S	*	.	H	α-helix	trans	-55.2	-37.6	173.3	-29	35.4	0	0	0	114.5	Q327 Q328 V334 H335	Q327-P331 VanDerWaalsContact O-CD 3.26Å; Q327-P331 WeakPolarHBondContact O-CD 3.46Å; Q328-P331 WeakPolarHBondContact O-CD 3.4Å; P331-V334 PolarHBondContact O-N 3.41Å; P331-H335 VanDerWaalsContact O-CB 3.29Å; P331-H335 WeakPolarHBondContact O-CB 3.35Å; P331-H335 PolarHBondContact O-N 3.09Å
332	A	82.1	Confident	76.5	Confident	24 Å²	24	58.8 Å²	58.8	20%	0.198	32%	0.321	C	S	.	.	H	α-helix	trans	-71.9	-37.7	176.5	0	0	0	0	0	112	L309 F313 I329 C330 H335 Q336	L309-A332 HydrophobicContact CD2-CB 3.82Å; F313-A332 HydrophobicContact CE2-CB 3.73Å; F313-A332 HydrophobicContact CZ-CB 3.91Å; I329-A332 WeakPolarHBondContact O-CB 3.28Å; I329-A332 PolarHBondContact O-N 3.46Å; C330-A332 VanDerWaalsContact C-N 3.29Å; C330-A332 PolarHBondContact O-N 3.2Å; A332-H335 PolarHBondContact O-N 3.49Å; A332-Q336 WeakPolarHBondContact O-CG 3.33Å; A332-Q336 PolarHBondContact O-N 2.77Å
333	I	82.3	Confident	74.8	Confident	8 Å²	8	58.5 Å²	58.5	4%	0.041	32%	0.323	C	S	.	.	H	α-helix	trans	-62.6	-44.2	172.9	-61.2	173	0	0	0	110.4	L258 L262 L265 L309 F326 I329 C330 Q336 L337	L258-I333 HydrophobicContact CD1-CD1 4.07Å; L262-I333 HydrophobicContact CD2-CD1 4.41Å; L262-I333 HydrophobicContact CD2-CG1 4.09Å; L262-I333 HydrophobicContact CD2-CG2 4.13Å; L265-I333 HydrophobicContact CD1-CG2 3.96Å; L309-I333 HydrophobicContact CD1-CG1 4.33Å; F326-I333 HydrophobicContact CE2-CD1 4.14Å; I329-I333 HydrophobicContact CG2-CD1 3.84Å; I329-I333 HydrophobicContact CG2-CG1 3.94Å; I329-I333 PolarHBondContact O-N 3.24Å; I329-I333 VanDerWaalsContact O-N 3.12Å; C330-I333 PolarHBondContact O-N 3.25Å; C330-I333 VanDerWaalsContact O-N 3.15Å; I333-Q336 WeakPolarHBondContact O-CG 3.45Å; I333-L337 HydrophobicContact CG2-CD1 3.96Å; I333-L337 WeakPolarHBondContact O-CB 3.26Å; I333-L337 WeakPolarHBondContact O-CD1 3.35Å; I333-L337 WeakPolarHBondContact O-CG 3.3Å; I333-L337 PolarHBondContact O-N 2.91Å; I333-L337 VanDerWaalsContact O-N 3.14Å
334	V	81.1	Confident	72.7	Confident	79 Å²	79	59 Å²	59	48%	0.479	33%	0.333	S	S	.	.	H	α-helix	trans	-65.4	-42	176.6	172.5	0	0	0	0	110.8	C330 P331 L337 L338	C330-V334 WeakPolarHBondContact O-CG2 3.4Å; C330-V334 PolarHBondContact O-N 3.48Å; P331-V334 PolarHBondContact O-N 3.41Å; V334-L337 PolarHBondContact O-N 3.46Å; V334-L338 HydrophobicContact CG1-CD1 3.69Å; V334-L338 HydrophobicContact CG1-CG 4.15Å; V334-L338 WeakPolarHBondContact O-CB 3.45Å; V334-L338 VanDerWaalsContact O-CG 3.31Å; V334-L338 WeakPolarHBondContact O-CG 3.19Å; V334-L338 PolarHBondContact O-N 3.15Å
335	H	79.6	Confident	70.8	Confident	89 Å²	89	60 Å²	60	41%	0.412	34%	0.341	S	S	.	.	H	α-helix	trans	-58.8	-50.4	176.7	178.6	-92.2	0	0	0	112.5	P331 A332 L337 L338 G339	P331-H335 VanDerWaalsContact O-CB 3.29Å; P331-H335 WeakPolarHBondContact O-CB 3.35Å; P331-H335 PolarHBondContact O-N 3.09Å; A332-H335 PolarHBondContact O-N 3.49Å; H335-L337 VanDerWaalsContact C-N 3.28Å; H335-L337 PolarHBondContact O-N 3.22Å; H335-L338 PolarHBondContact O-N 3.49Å; H335-G339 PolarHBondContact O-N 2.93Å
336	Q	76.3	Confident	68.6	Low	6 Å²	6	60.9 Å²	60.9	3%	0.028	35%	0.345	C	S	.	.	H	α-helix	trans	-70.1	-22.5	179.8	70.2	-174	-3.1	0	0	113.8	F304 A332 I333 A341	F304-Q336 PolarHBondContact O-OE1 2.78Å; A332-Q336 WeakPolarHBondContact O-CG 3.33Å; A332-Q336 PolarHBondContact O-N 2.77Å; I333-Q336 WeakPolarHBondContact O-CG 3.45Å; Q336-A341 PolarHBondContact O-N 3.23Å
337	L	71.1	Confident	66	Low	77 Å²	77	68.2 Å²	68.2	40%	0.403	38%	0.38	S	S	.	.	H	α-helix	trans	-76.7	-39.4	170.3	-72	171.1	0	0	0	112.2	L265 I333 V334 H335 N340	L265-L337 HydrophobicContact CB-CD1 4.31Å; L265-L337 HydrophobicContact CB-CD2 4.17Å; L265-L337 HydrophobicContact CD1-CD1 4.33Å; I333-L337 HydrophobicContact CG2-CD1 3.96Å; I333-L337 WeakPolarHBondContact O-CB 3.26Å; I333-L337 WeakPolarHBondContact O-CD1 3.35Å; I333-L337 WeakPolarHBondContact O-CG 3.3Å; I333-L337 PolarHBondContact O-N 2.91Å; I333-L337 VanDerWaalsContact O-N 3.14Å; V334-L337 PolarHBondContact O-N 3.46Å; H335-L337 VanDerWaalsContact C-N 3.28Å; H335-L337 PolarHBondContact O-N 3.22Å; L337-N340 PolarHBondContact O-N 3.12Å
338	L	65.6	Low	63.6	Low	145 Å²	145	66.2 Å²	66.2	76%	0.759	37%	0.373	S	S	*	.	H	α-helix	trans	-71.9	-41.7	178	-73.5	173.5	0	0	0	112.4	V334 H335 N340	V334-L338 HydrophobicContact CG1-CD1 3.69Å; V334-L338 HydrophobicContact CG1-CG 4.15Å; V334-L338 WeakPolarHBondContact O-CB 3.45Å; V334-L338 VanDerWaalsContact O-CG 3.31Å; V334-L338 WeakPolarHBondContact O-CG 3.19Å; V334-L338 PolarHBondContact O-N 3.15Å; H335-L338 PolarHBondContact O-N 3.49Å; L338-N340 PolarHBondContact O-N 2.98Å
339	G	61.2	Low	61	Low	40 Å²	40	64.7 Å²	64.7	41%	0.412	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-0.2	174.8	0	0	0	0	0	114.2	H335 A341	H335-G339 PolarHBondContact O-N 2.93Å; G339-A341 PolarHBondContact O-N 2.9Å
340	N	56.7	Low	58.8	Low	106 Å²	106	69.9 Å²	69.9	57%	0.567	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	21.2	-175	-151.2	18.9	0	0	0	114.3	L337 L338 C342 G343	L337-N340 PolarHBondContact O-N 3.12Å; L338-N340 PolarHBondContact O-N 2.98Å; N340-C342 VanDerWaalsContact C-N 3.27Å; N340-C342 PolarHBondContact O-N 2.82Å; N340-G343 WeakPolarHBondContact O-CA 3.35Å; N340-G343 PolarHBondContact O-N 3.33Å; N340-G343 WeakPolarHBondContact OD1-CA 3.48Å
341	A	54.8	Low	56.8	Low	8 Å²	8	69 Å²	69	7%	0.066	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-37.7	-170.3	0	0	0	0	0	112.3	C303 Q336 G339 S344	C303-A341 HydrophobicContact CB-CB 4.43Å; Q336-A341 PolarHBondContact O-N 3.23Å; G339-A341 PolarHBondContact O-N 2.9Å; A341-S344 PolarHBondContact O-OG 2.62Å
342	C	57.1	Low	54.7	Low	32 Å²	32	69.5 Å²	69.5	22%	0.216	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-11.8	174.9	-57.2	0	0	0	0	113.9	C303 N340 S344	C303-C342 HydrophobicContact CB-CB 4Å; C303-C342 WeakPolarHBondContact CB-SG 3.38Å; C303-C342 VanDerWaalsContact SG-CA 3.52Å; C303-C342 WeakPolarHBondContact SG-CB 3.33Å; C303-C342 CovalentContact SG-SG 2.04Å; C303-C342 PolarHBondContact SG-SG 3.26Å; N340-C342 VanDerWaalsContact C-N 3.27Å; N340-C342 PolarHBondContact O-N 2.82Å; C342-S344 PolarHBondContact O-N 2.94Å
343	G	47.6	Very low	53.4	Low	21 Å²	21	72.2 Å²	72.2	22%	0.216	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-12	174.5	0	0	0	0	0	113.9	N340 L345 Q346 Q347	N340-G343 WeakPolarHBondContact O-CA 3.35Å; N340-G343 PolarHBondContact O-N 3.33Å; N340-G343 WeakPolarHBondContact OD1-CA 3.48Å; G343-L345 PolarHBondContact O-N 3.42Å; G343-L345 VanDerWaalsContact O-N 3.14Å; G343-Q346 PolarHBondContact O-N 3.14Å; G343-Q347 PolarHBondContact O-N 3.34Å
344	S	38.4	Very low	52.4	Low	61 Å²	61	72.3 Å²	72.3	43%	0.427	41%	0.411	S	S	.	.	H	α-helix	trans	-57	-21.3	169.7	59	0	0	0	0	113.6	A341 C342 Q346 N348	A341-S344 PolarHBondContact O-OG 2.62Å; C342-S344 PolarHBondContact O-N 2.94Å; S344-Q346 PolarHBondContact O-N 3.36Å; S344-N348 PolarHBondContact O-N 3.03Å; S344-N348 PolarHBondContact O-ND2 3.02Å
345	L	41.3	Very low	52	Low	138 Å²	138	72.4 Å²	72.4	72%	0.723	41%	0.411	S	S	*	.	H	α-helix	trans	-71.7	-12.1	170.2	-79.9	166.3	0	0	0	114.1	G343	G343-L345 PolarHBondContact O-N 3.42Å; G343-L345 VanDerWaalsContact O-N 3.14Å
346	Q	34.7	Very low	51.7	Low	83 Å²	83	71.5 Å²	71.5	39%	0.388	42%	0.42	S	S	.	.	H	α-helix	trans	-120.4	-10.7	179.7	-157.3	152.3	65.1	0	0	114.8	G343 S344 S349	G343-Q346 PolarHBondContact O-N 3.14Å; S344-Q346 PolarHBondContact O-N 3.36Å; Q346-S349 WeakPolarHBondContact O-CB 3.39Å; Q346-S349 PolarHBondContact O-N 3.38Å; Q346-S349 VanDerWaalsContact O-N 3.16Å
347	Q	30.5	Very low	51.7	Low	158 Å²	158	78.1 Å²	78.1	74%	0.738	45%	0.454	S	S	*	.	H	α-helix	trans	-65.4	-27.9	149.2	-94.5	-175.2	-13.2	0	0	111	G343 S349	G343-Q347 PolarHBondContact O-N 3.34Å; Q347-S349 PolarHBondContact O-N 2.99Å
348	N	32	Very low	51.8	Low	88 Å²	88	77.8 Å²	77.8	47%	0.471	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	31.9	162.5	-76.6	-65.6	0	0	0	113.8	S344 V353	S344-N348 PolarHBondContact O-N 3.03Å; S344-N348 PolarHBondContact O-ND2 3.02Å; N348-V353 WeakPolarHBondContact OD1-CG2 3.43Å
349	S	30.6	Very low	52.6	Low	77 Å²	77	72.8 Å²	72.8	54%	0.538	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.8	21.3	169.7	-68.9	0	0	0	0	113.7	Q346 Q347 G351	Q346-S349 WeakPolarHBondContact O-CB 3.39Å; Q346-S349 PolarHBondContact O-N 3.38Å; Q346-S349 VanDerWaalsContact O-N 3.16Å; Q347-S349 PolarHBondContact O-N 2.99Å; S349-G351 VanDerWaalsContact C-N 3.35Å; S349-G351 PolarHBondContact O-N 3.29Å
350	R	38.7	Very low	53.9	Low	109 Å²	109	75.9 Å²	75.9	41%	0.411	42%	0.422	S	S	.	.	S	Bend	trans	-87	81.3	147.3	-95.1	-171.5	165.4	138	-3.6	107.7	S552	R350-S552 WeakPolarHBondContact O-CB 3.3Å
351	G	44.1	Very low	55.5	Low	13 Å²	13	72.7 Å²	72.7	13%	0.134	41%	0.414	C	S	.	.	S	Bend	trans	63.9	165.8	-169.4	0	0	0	0	0	113.4	S349 E554	S349-G351 VanDerWaalsContact C-N 3.35Å; S349-G351 PolarHBondContact O-N 3.29Å; G351-E554 VanDerWaalsContact CA-OE1 3.26Å; G351-E554 WeakPolarHBondContact CA-OE1 3.4Å; G351-E554 VanDerWaalsContact CA-OE2 3.29Å; G351-E554 WeakPolarHBondContact CA-OE2 3.36Å; G351-E554 PolarHBondContact N-OE1 3.17Å; G351-E554 PolarHBondContact N-OE2 3.34Å
352	S	43.4	Very low	57.2	Low	97 Å²	97	78.3 Å²	78.3	68%	0.678	43%	0.434	S	S	*	.	S	Bend	trans	-67.5	134.3	154.9	48.8	0	0	0	0	108	P354	S352-P354 WeakPolarHBondContact O-CD 3.47Å
353	V	55.5	Low	58.9	Low	82 Å²	82	76.8 Å²	76.8	50%	0.497	42%	0.424	S	S	.	.			trans	-47.4	111.2	172.1	178.6	0	0	0	0	108.1	N348 T355	N348-V353 WeakPolarHBondContact OD1-CG2 3.43Å; V353-T355 PolarHBondContact O-N 3.31Å
354	P	60.2	Low	61.2	Low	9 Å²	9	77.5 Å²	77.5	6%	0.058	43%	0.425	C	S	.	.			trans	-64.6	144	-165.7	-12.7	17.9	0	0	0	110.1	S352 E358 K359	S352-P354 WeakPolarHBondContact O-CD 3.47Å; P354-E358 HydrophobicContact CB-CB 3.74Å; P354-K359 HydrophobicContact CB-CG 3.67Å; P354-K359 HydrophobicContact CG-CG 4.01Å; P354-K359 WeakPolarHBondContact O-CE 3.39Å; P354-K359 WeakPolarHBondContact O-CG 3.25Å
355	T	73.6	Confident	63.8	Low	81 Å²	81	76.8 Å²	76.8	50%	0.497	42%	0.422	S	S	.	.			trans	-59.4	157.8	175.2	59.1	0	0	0	0	110.1	V353 I357 E358 K359	V353-T355 PolarHBondContact O-N 3.31Å; T355-I357 PolarHBondContact O-N 3.05Å; T355-E358 WeakPolarHBondContact CB-OE2 3.39Å; T355-E358 WeakPolarHBondContact CG2-OE2 3.5Å; T355-E358 PolarHBondContact N-OE2 3.21Å; T355-E358 CarbonylContact O-C 3.51Å; T355-E358 WeakPolarHBondContact O-CA 3.31Å; T355-E358 PolarHBondContact O-N 3.33Å; T355-E358 WeakPolarHBondContact OG1-CG 3.35Å; T355-E358 PolarHBondContact OG1-OE2 3.49Å; T355-K359 PolarHBondContact O-N 3.01Å
356	A	72.8	Confident	66.3	Low	71 Å²	71	70.3 Å²	70.3	59%	0.587	39%	0.389	S	S	*	.	H	α-helix	trans	-55.2	-30	-179.1	0	0	0	0	0	113.1	Y360	A356-Y360 WeakPolarHBondContact O-CB 3.42Å; A356-Y360 WeakPolarHBondContact O-CD2 3.31Å; A356-Y360 PolarHBondContact O-N 3.06Å
357	I	75	Confident	69.2	Low	145 Å²	145	66.4 Å²	66.4	74%	0.744	37%	0.371	S	S	*	.	H	α-helix	trans	-73.3	-39.3	175.5	-60	175.7	0	0	0	111.1	T355 G361	T355-I357 PolarHBondContact O-N 3.05Å; I357-G361 VanDerWaalsContact O-CA 3.28Å; I357-G361 WeakPolarHBondContact O-CA 3.23Å; I357-G361 PolarHBondContact O-N 3.39Å
358	E	75.2	Confident	72.3	Confident	70 Å²	70	63.4 Å²	63.4	33%	0.327	36%	0.359	S	S	.	.	H	α-helix	trans	-69.4	-45.9	176.3	-70.2	161.9	147.4	0	0	111.7	P354 T355 Y362	P354-E358 HydrophobicContact CB-CB 3.74Å; T355-E358 WeakPolarHBondContact CB-OE2 3.39Å; T355-E358 WeakPolarHBondContact CG2-OE2 3.5Å; T355-E358 PolarHBondContact N-OE2 3.21Å; T355-E358 CarbonylContact O-C 3.51Å; T355-E358 WeakPolarHBondContact O-CA 3.31Å; T355-E358 PolarHBondContact O-N 3.33Å; T355-E358 WeakPolarHBondContact OG1-CG 3.35Å; T355-E358 PolarHBondContact OG1-OE2 3.49Å; E358-Y362 HydrophobicContact CB-CD2 3.86Å; E358-Y362 HydrophobicContact CB-CE2 3.67Å; E358-Y362 HydrophobicContact CG-CD2 4.43Å; E358-Y362 HydrophobicContact CG-CE2 3.75Å; E358-Y362 VanDerWaalsContact O-CB 3.28Å; E358-Y362 WeakPolarHBondContact O-CB 3.47Å; E358-Y362 WeakPolarHBondContact O-CD2 3.2Å; E358-Y362 PolarHBondContact O-N 2.95Å
359	K	82.1	Confident	75.2	Confident	40 Å²	40	64 Å²	64	17%	0.174	36%	0.361	C	S	.	.	H	α-helix	trans	-56.7	-59.9	177.7	-70.1	-169.2	168.5	-170.8	0	111.4	P354 T355 S363 S550 L607	P354-K359 HydrophobicContact CB-CG 3.67Å; P354-K359 HydrophobicContact CG-CG 4.01Å; P354-K359 WeakPolarHBondContact O-CE 3.39Å; P354-K359 WeakPolarHBondContact O-CG 3.25Å; T355-K359 PolarHBondContact O-N 3.01Å; K359-S363 WeakPolarHBondContact O-CB 3.42Å; K359-S363 PolarHBondContact O-N 3.13Å; K359-S363 VanDerWaalsContact O-N 3.15Å; K359-S363 PolarHBondContact O-OG 2.9Å; K359-S550 WeakPolarHBondContact CE-O 3.41Å; K359-S550 PolarHBondContact NZ-O 3.02Å; K359-L607 HydrophobicContact CB-CD2 4.48Å
360	Y	88.4	Confident	78.2	Confident	105 Å²	105	60.5 Å²	60.5	41%	0.412	34%	0.336	S	S	.	.	H	α-helix	trans	-70.9	-33.3	-176.6	-73.4	-107.9	0	0	0	111.7	A356 T364 Y604 L607	A356-Y360 WeakPolarHBondContact O-CB 3.42Å; A356-Y360 WeakPolarHBondContact O-CD2 3.31Å; A356-Y360 PolarHBondContact O-N 3.06Å; Y360-T364 WeakPolarHBondContact O-CB 3.5Å; Y360-T364 PolarHBondContact O-N 3.4Å; Y360-T364 PolarHBondContact O-OG1 3.3Å; Y360-Y604 HydrophobicContact CD1-CD1 4.27Å; Y360-Y604 HydrophobicContact CD1-CE1 4.19Å; Y360-Y604 HydrophobicContact CE1-CD1 4.38Å; Y360-L607 HydrophobicContact CD1-CD1 3.71Å; Y360-L607 HydrophobicContact CD2-CD1 4.47Å; Y360-L607 HydrophobicContact CE1-CB 4.37Å; Y360-L607 HydrophobicContact CE1-CD1 3.89Å; Y360-L607 HydrophobicContact CG-CD1 4.02Å
361	G	90.6	Very high	80.7	Confident	38 Å²	38	55.6 Å²	55.6	39%	0.392	32%	0.318	S	S	.	.	H	α-helix	trans	-69.9	-54.6	179.3	0	0	0	0	0	112.9	I357 T364 A365	I357-G361 VanDerWaalsContact O-CA 3.28Å; I357-G361 WeakPolarHBondContact O-CA 3.23Å; I357-G361 PolarHBondContact O-N 3.39Å; G361-T364 PolarHBondContact O-N 2.93Å; G361-A365 WeakPolarHBondContact O-CB 3.36Å; G361-A365 PolarHBondContact O-N 2.89Å
362	Y	90.2	Very high	83	Confident	126 Å²	126	59.3 Å²	59.3	49%	0.494	34%	0.338	S	S	.	.	H	α-helix	trans	-67.8	-39.8	-178.6	-63.6	-42.9	0	0	0	112.1	E358 A365 A366	E358-Y362 HydrophobicContact CB-CD2 3.86Å; E358-Y362 HydrophobicContact CB-CE2 3.67Å; E358-Y362 HydrophobicContact CG-CD2 4.43Å; E358-Y362 HydrophobicContact CG-CE2 3.75Å; E358-Y362 VanDerWaalsContact O-CB 3.28Å; E358-Y362 WeakPolarHBondContact O-CB 3.47Å; E358-Y362 WeakPolarHBondContact O-CD2 3.2Å; E358-Y362 PolarHBondContact O-N 2.95Å; Y362-A365 PolarHBondContact O-N 3.36Å; Y362-A366 WeakPolarHBondContact O-CB 3.42Å; Y362-A366 PolarHBondContact O-N 3.22Å
363	S	92.3	Very high	85.2	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-68.8	-36.5	178.9	80.4	0	0	0	0	112.5	K359 A366 V367 L603	K359-S363 WeakPolarHBondContact O-CB 3.42Å; K359-S363 PolarHBondContact O-N 3.13Å; K359-S363 VanDerWaalsContact O-N 3.15Å; K359-S363 PolarHBondContact O-OG 2.9Å; S363-A366 WeakPolarHBondContact O-CB 3.48Å; S363-A366 PolarHBondContact O-N 2.88Å; S363-V367 PolarHBondContact O-N 3.47Å; S363-L603 VanDerWaalsContact CB-CD1 3.46Å; S363-L603 WeakPolarHBondContact OG-CD1 3.26Å
364	T	94.8	Very high	86.6	Confident	37 Å²	37	51.5 Å²	51.5	23%	0.227	29%	0.29	C	S	.	.	H	α-helix	trans	-68.5	-38.7	174.4	-57	0	0	0	0	111.1	Y360 G361 L368 F600 Y604	Y360-T364 WeakPolarHBondContact O-CB 3.5Å; Y360-T364 PolarHBondContact O-N 3.4Å; Y360-T364 PolarHBondContact O-OG1 3.3Å; G361-T364 PolarHBondContact O-N 2.93Å; T364-L368 WeakPolarHBondContact O-CB 3.25Å; T364-L368 PolarHBondContact O-N 3.15Å; T364-F600 HydrophobicContact CG2-CD1 4.45Å; T364-F600 HydrophobicContact CG2-CE1 4.03Å; T364-Y604 PolarHBondContact OG1-OH 3.1Å
365	A	94.3	Very high	87.9	Confident	45 Å²	45	52 Å²	52	37%	0.372	29%	0.292	S	S	.	.	H	α-helix	trans	-65.4	-38.5	173.6	0	0	0	0	0	112.1	G361 Y362 L368 I369	G361-A365 WeakPolarHBondContact O-CB 3.36Å; G361-A365 PolarHBondContact O-N 2.89Å; Y362-A365 PolarHBondContact O-N 3.36Å; A365-L368 PolarHBondContact O-N 2.79Å; A365-I369 VanDerWaalsContact O-CG1 3.27Å; A365-I369 WeakPolarHBondContact O-CG1 3.43Å; A365-I369 PolarHBondContact O-N 2.65Å
366	A	94.2	Very high	88.3	Confident	3 Å²	3	54.2 Å²	54.2	3%	0.025	30%	0.295	C	S	.	.	H	α-helix	trans	-61.2	-51.5	175.2	0	0	0	0	0	112.3	Y362 S363 L368 I369 I370 V545 F549 T560	Y362-A366 WeakPolarHBondContact O-CB 3.42Å; Y362-A366 PolarHBondContact O-N 3.22Å; S363-A366 WeakPolarHBondContact O-CB 3.48Å; S363-A366 PolarHBondContact O-N 2.88Å; A366-L368 VanDerWaalsContact C-N 3.29Å; A366-L368 PolarHBondContact O-N 3.25Å; A366-I369 WeakPolarHBondContact O-CB 3.37Å; A366-I369 PolarHBondContact O-N 2.85Å; A366-I370 WeakPolarHBondContact O-CG1 3.38Å; A366-I370 PolarHBondContact O-N 3.04Å; A366-V545 HydrophobicContact CB-CG1 4.26Å; A366-F549 HydrophobicContact CB-CE2 3.65Å; A366-F549 HydrophobicContact CB-CZ 4.05Å; A366-T560 HydrophobicContact CB-CG2 3.59Å; A366-T560 WeakPolarHBondContact CB-OG1 3.37Å
367	V	95	Very high	88.5	Confident	1 Å²	1	50.9 Å²	50.9	1%	0.006	27%	0.267	C	S	.	.	H	α-helix	trans	-64.2	-34.1	176.8	176.8	0	0	0	0	111.6	S363 I370 T371 V545 A599 F600 L603	S363-V367 PolarHBondContact O-N 3.47Å; V367-I370 PolarHBondContact O-N 3.27Å; V367-T371 HydrophobicContact CG1-CG2 4.24Å; V367-T371 WeakPolarHBondContact O-CB 3.29Å; V367-T371 WeakPolarHBondContact O-CG2 3.2Å; V367-T371 PolarHBondContact O-N 3.46Å; V367-T371 PolarHBondContact O-OG1 2.93Å; V367-V545 HydrophobicContact CG2-CB 4.29Å; V367-V545 HydrophobicContact CG2-CG1 3.96Å; V367-A599 HydrophobicContact CG1-CB 3.73Å; V367-F600 HydrophobicContact CB-CD1 4.39Å; V367-F600 HydrophobicContact CB-CE1 4.12Å; V367-F600 HydrophobicContact CB-CZ 4.37Å; V367-F600 HydrophobicContact CG1-CD1 3.93Å; V367-F600 HydrophobicContact CG1-CD2 3.93Å; V367-F600 HydrophobicContact CG1-CE1 3.88Å; V367-F600 HydrophobicContact CG1-CE2 3.88Å; V367-F600 HydrophobicContact CG1-CG 3.97Å; V367-F600 HydrophobicContact CG1-CZ 3.86Å; V367-L603 HydrophobicContact CB-CD2 4.33Å; V367-L603 HydrophobicContact CG2-CB 4.16Å; V367-L603 HydrophobicContact CG2-CD1 4.04Å; V367-L603 HydrophobicContact CG2-CD2 3.94Å; V367-L603 HydrophobicContact CG2-CG 4.25Å
368	L	95	Very high	88.7	Confident	95 Å²	95	44 Å²	44	50%	0.497	23%	0.232	S	C	.	.	H	α-helix	trans	-63.8	-38.5	171.3	-176	65.1	0	0	0	112.5	T364 A365 A366 T371 V372 F600	T364-L368 WeakPolarHBondContact O-CB 3.25Å; T364-L368 PolarHBondContact O-N 3.15Å; A365-L368 PolarHBondContact O-N 2.79Å; A366-L368 VanDerWaalsContact C-N 3.29Å; A366-L368 PolarHBondContact O-N 3.25Å; L368-T371 WeakPolarHBondContact CA-OG1 3.33Å; L368-T371 PolarHBondContact O-OG1 3.13Å; L368-V372 HydrophobicContact CD1-CG2 4.02Å; L368-V372 HydrophobicContact CG-CG2 4.43Å; L368-V372 VanDerWaalsContact O-CB 3.3Å; L368-V372 WeakPolarHBondContact O-CB 3.29Å; L368-V372 VanDerWaalsContact O-CG2 3.24Å; L368-V372 WeakPolarHBondContact O-CG2 3.42Å; L368-V372 PolarHBondContact O-N 3.14Å; L368-F600 HydrophobicContact CB-CZ 4.17Å; L368-F600 HydrophobicContact CD1-CZ 4.33Å
369	I	94.3	Very high	88.5	Confident	100 Å²	100	42.7 Å²	42.7	51%	0.513	23%	0.23	S	C	.	.	H	α-helix	trans	-67.7	-41	175.6	-71.3	162.9	0	0	0	111.1	A365 A366 G373 L564	A365-I369 VanDerWaalsContact O-CG1 3.27Å; A365-I369 WeakPolarHBondContact O-CG1 3.43Å; A365-I369 PolarHBondContact O-N 2.65Å; A366-I369 WeakPolarHBondContact O-CB 3.37Å; A366-I369 PolarHBondContact O-N 2.85Å; I369-G373 WeakPolarHBondContact O-CA 3.26Å; I369-G373 PolarHBondContact O-N 2.9Å; I369-L564 HydrophobicContact CG2-CD2 4.46Å
370	I	92.8	Very high	87.8	Confident	4 Å²	4	45.1 Å²	45.1	2%	0.021	25%	0.245	C	C	.	.	H	α-helix	trans	-60.3	-57.2	175.7	-67.3	162	0	0	0	110.1	A366 V367 V372 G373 S374 V545 T560 I563 L564 E567	A366-I370 WeakPolarHBondContact O-CG1 3.38Å; A366-I370 PolarHBondContact O-N 3.04Å; V367-I370 PolarHBondContact O-N 3.27Å; I370-V372 PolarHBondContact O-N 3.38Å; I370-G373 WeakPolarHBondContact O-CA 3.39Å; I370-G373 PolarHBondContact O-N 3.23Å; I370-G373 VanDerWaalsContact O-N 3.08Å; I370-S374 PolarHBondContact O-N 3.43Å; I370-V545 HydrophobicContact CD1-CG2 4.14Å; I370-T560 HydrophobicContact CD1-CG2 4.09Å; I370-T560 HydrophobicContact CG1-CG2 4.24Å; I370-I563 HydrophobicContact CD1-CB 4.18Å; I370-I563 HydrophobicContact CD1-CG2 3.82Å; I370-I563 HydrophobicContact CG1-CG2 4.32Å; I370-I563 HydrophobicContact CG2-CG2 4.01Å; I370-L564 HydrophobicContact CG1-CB 4.39Å; I370-E567 HydrophobicContact CG2-CB 4.22Å; I370-E567 HydrophobicContact CG2-CG 3.93Å
371	T	91.9	Very high	86.9	Confident	5 Å²	5	41.1 Å²	41.1	3%	0.031	23%	0.23	C	C	.	.	H	α-helix	trans	-64.9	-33.9	-176.9	53.2	0	0	0	0	114.1	V367 L368 S374 M375 A596 F600	V367-T371 HydrophobicContact CG1-CG2 4.24Å; V367-T371 WeakPolarHBondContact O-CB 3.29Å; V367-T371 WeakPolarHBondContact O-CG2 3.2Å; V367-T371 PolarHBondContact O-N 3.46Å; V367-T371 PolarHBondContact O-OG1 2.93Å; L368-T371 WeakPolarHBondContact CA-OG1 3.33Å; L368-T371 PolarHBondContact O-OG1 3.13Å; T371-S374 PolarHBondContact O-OG 2.65Å; T371-M375 VanDerWaalsContact O-CG 3.26Å; T371-M375 WeakPolarHBondContact O-CG 3.42Å; T371-A596 HydrophobicContact CG2-CB 4.08Å; T371-A596 WeakPolarHBondContact CG2-O 3.28Å; T371-F600 HydrophobicContact CG2-CE2 4.08Å
372	V	91.2	Very high	85.8	Confident	91 Å²	91	44.8 Å²	44.8	55%	0.552	24%	0.236	S	C	*	.	H	α-helix	trans	-75.7	-34.1	172.5	173.7	0	0	0	0	111.2	L368 I370 F376	L368-V372 HydrophobicContact CD1-CG2 4.02Å; L368-V372 HydrophobicContact CG-CG2 4.43Å; L368-V372 VanDerWaalsContact O-CB 3.3Å; L368-V372 WeakPolarHBondContact O-CB 3.29Å; L368-V372 VanDerWaalsContact O-CG2 3.24Å; L368-V372 WeakPolarHBondContact O-CG2 3.42Å; L368-V372 PolarHBondContact O-N 3.14Å; I370-V372 PolarHBondContact O-N 3.38Å; V372-F376 PolarHBondContact O-N 3.43Å
373	G	89	Confident	84.4	Confident	16 Å²	16	47.3 Å²	47.3	17%	0.165	25%	0.249	C	C	.	.	H	α-helix	trans	-64	-47.1	177.1	0	0	0	0	0	112.9	I369 I370 F376 G377	I369-G373 WeakPolarHBondContact O-CA 3.26Å; I369-G373 PolarHBondContact O-N 2.9Å; I370-G373 WeakPolarHBondContact O-CA 3.39Å; I370-G373 PolarHBondContact O-N 3.23Å; I370-G373 VanDerWaalsContact O-N 3.08Å; G373-F376 WeakPolarHBondContact O-CB 3.33Å; G373-F376 PolarHBondContact O-N 3.2Å; G373-G377 PolarHBondContact O-N 3.06Å
374	S	86.8	Confident	82.9	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-61	-46.9	177.8	71.4	0	0	0	0	111.8	I370 T371 F376 G377 I378 E571	I370-S374 PolarHBondContact O-N 3.43Å; T371-S374 PolarHBondContact O-OG 2.65Å; S374-F376 VanDerWaalsContact C-N 3.28Å; S374-F376 PolarHBondContact O-N 2.81Å; S374-G377 WeakPolarHBondContact O-CA 3.03Å; S374-G377 PolarHBondContact O-N 3.12Å; S374-I378 PolarHBondContact O-N 3.27Å; S374-I378 VanDerWaalsContact O-N 3.15Å; S374-E571 VanDerWaalsContact CB-OE1 3.32Å; S374-E571 WeakPolarHBondContact CB-OE1 3.2Å; S374-E571 PolarHBondContact OG-OE1 3.3Å
375	M	85.8	Confident	81	Confident	19 Å²	19	54.3 Å²	54.3	9%	0.094	30%	0.295	C	S	.	.	H	α-helix	trans	-61.4	-33.4	175.3	-66.9	-61	106.9	0	0	113	T371 I378 C379 E571 N592 F593	T371-M375 VanDerWaalsContact O-CG 3.26Å; T371-M375 WeakPolarHBondContact O-CG 3.42Å; M375-I378 HydrophobicContact CE-CD1 3.62Å; M375-I378 PolarHBondContact O-N 3.1Å; M375-I378 HydrophobicContact SD-CD1 4.18Å; M375-C379 PolarHBondContact O-N 3.39Å; M375-C379 VanDerWaalsContact O-N 3.16Å; M375-C379 PolarHBondContact O-SG 3.47Å; M375-E571 VanDerWaalsContact CE-CD 3.5Å; M375-E571 WeakPolarHBondContact CE-OE1 3.37Å; M375-E571 WeakPolarHBondContact CE-OE2 3.46Å; M375-N592 HydrophobicContact CE-CB 4.11Å; M375-F593 HydrophobicContact CG-CD2 4.13Å; M375-F593 HydrophobicContact SD-CB 3.96Å; M375-F593 HydrophobicContact SD-CD2 4.28Å
376	F	83.8	Confident	79.8	Confident	127 Å²	127	55.4 Å²	55.4	56%	0.557	30%	0.3	S	S	*	.	H	α-helix	trans	-69.6	-35.1	172.2	-175.1	-100.4	0	0	0	112.2	V372 G373 S374 I378 C379 L380	V372-F376 PolarHBondContact O-N 3.43Å; G373-F376 WeakPolarHBondContact O-CB 3.33Å; G373-F376 PolarHBondContact O-N 3.2Å; S374-F376 VanDerWaalsContact C-N 3.28Å; S374-F376 PolarHBondContact O-N 2.81Å; F376-I378 VanDerWaalsContact C-N 3.35Å; F376-I378 PolarHBondContact O-N 3.46Å; F376-C379 WeakPolarHBondContact O-CA 3.18Å; F376-C379 WeakPolarHBondContact O-CB 3.28Å; F376-C379 PolarHBondContact O-N 3.44Å; F376-L380 HydrophobicContact CD1-CD1 4.29Å; F376-L380 HydrophobicContact CD1-CG 4.35Å; F376-L380 HydrophobicContact CE1-CD1 4.01Å; F376-L380 HydrophobicContact CE1-CD2 3.94Å; F376-L380 HydrophobicContact CE1-CG 4Å; F376-L380 HydrophobicContact CZ-CD2 4.02Å; F376-L380 HydrophobicContact CZ-CG 4.45Å; F376-L380 PolarHBondContact O-N 2.97Å; F376-L380 VanDerWaalsContact O-N 3.12Å
377	G	76.9	Confident	78.6	Confident	1 Å²	1	63.6 Å²	63.6	1%	0.01	34%	0.337	C	S	.	.	H	α-helix	trans	-54.3	-48.3	170	0	0	0	0	0	112.5	G373 S374 C379 L380	G373-G377 PolarHBondContact O-N 3.06Å; S374-G377 WeakPolarHBondContact O-CA 3.03Å; S374-G377 PolarHBondContact O-N 3.12Å; G377-C379 VanDerWaalsContact C-N 3.26Å; G377-C379 PolarHBondContact O-N 3.19Å; G377-L380 WeakPolarHBondContact O-CB 3.28Å; G377-L380 PolarHBondContact O-N 3.4Å
378	I	77.5	Confident	77.6	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-60.1	-36.8	173.7	-60.8	173.8	0	0	0	111.2	S374 M375 F376 L380 L381 F382 E571 F575 N592	S374-I378 PolarHBondContact O-N 3.27Å; S374-I378 VanDerWaalsContact O-N 3.15Å; M375-I378 HydrophobicContact CE-CD1 3.62Å; M375-I378 PolarHBondContact O-N 3.1Å; M375-I378 HydrophobicContact SD-CD1 4.18Å; F376-I378 VanDerWaalsContact C-N 3.35Å; F376-I378 PolarHBondContact O-N 3.46Å; I378-L380 VanDerWaalsContact C-N 3.33Å; I378-L380 PolarHBondContact O-N 2.97Å; I378-L381 WeakPolarHBondContact O-CB 3.18Å; I378-L381 PolarHBondContact O-N 3.16Å; I378-F382 HydrophobicContact CG2-CE2 4.43Å; I378-E571 HydrophobicContact CD1-CB 4.39Å; I378-F575 HydrophobicContact CD1-CB 4.09Å; I378-F575 HydrophobicContact CD1-CD2 4.48Å; I378-F575 HydrophobicContact CD1-CG 4.36Å; I378-F575 HydrophobicContact CG1-CB 4.23Å; I378-F575 HydrophobicContact CG1-CG 4.43Å; I378-F575 HydrophobicContact CG2-CB 4.44Å; I378-F575 HydrophobicContact CG2-CD1 3.7Å; I378-F575 HydrophobicContact CG2-CD2 3.89Å; I378-F575 HydrophobicContact CG2-CE1 3.79Å; I378-F575 HydrophobicContact CG2-CE2 3.99Å; I378-F575 HydrophobicContact CG2-CG 3.74Å; I378-F575 HydrophobicContact CG2-CZ 3.94Å; I378-N592 HydrophobicContact CD1-CB 4.44Å
379	C	71.8	Confident	76.6	Confident	44 Å²	44	66.4 Å²	66.4	30%	0.297	35%	0.352	S	S	.	.	H	α-helix	trans	-65.3	-33.1	178.1	-67	0	0	0	0	113.3	M375 F376 G377 L381 F382	M375-C379 PolarHBondContact O-N 3.39Å; M375-C379 VanDerWaalsContact O-N 3.16Å; M375-C379 PolarHBondContact O-SG 3.47Å; F376-C379 WeakPolarHBondContact O-CA 3.18Å; F376-C379 WeakPolarHBondContact O-CB 3.28Å; F376-C379 PolarHBondContact O-N 3.44Å; G377-C379 VanDerWaalsContact C-N 3.26Å; G377-C379 PolarHBondContact O-N 3.19Å; C379-L381 PolarHBondContact O-N 3.05Å; C379-F382 PolarHBondContact O-N 3.39Å
380	L	68.3	Low	75.7	Confident	91 Å²	91	64.1 Å²	64.1	48%	0.476	34%	0.337	S	S	.	.	H	α-helix	trans	-64.8	-25.2	177	-66.5	172.9	0	0	0	112.8	F376 G377 I378 F382 F383	F376-L380 HydrophobicContact CD1-CD1 4.29Å; F376-L380 HydrophobicContact CD1-CG 4.35Å; F376-L380 HydrophobicContact CE1-CD1 4.01Å; F376-L380 HydrophobicContact CE1-CD2 3.94Å; F376-L380 HydrophobicContact CE1-CG 4Å; F376-L380 HydrophobicContact CZ-CD2 4.02Å; F376-L380 HydrophobicContact CZ-CG 4.45Å; F376-L380 PolarHBondContact O-N 2.97Å; F376-L380 VanDerWaalsContact O-N 3.12Å; G377-L380 WeakPolarHBondContact O-CB 3.28Å; G377-L380 PolarHBondContact O-N 3.4Å; I378-L380 VanDerWaalsContact C-N 3.33Å; I378-L380 PolarHBondContact O-N 2.97Å; L380-F382 VanDerWaalsContact C-N 3.32Å; L380-F382 PolarHBondContact O-N 3.22Å; L380-F383 PolarHBondContact O-N 2.73Å
381	L	68.5	Low	75	Confident	20 Å²	20	66 Å²	66	11%	0.105	35%	0.35	C	S	.	.	H	α-helix	trans	-66.4	-30.4	178.8	-67.9	-177.6	0	0	0	113.5	I378 C379 F383 N384 Y390 M572 F575	I378-L381 WeakPolarHBondContact O-CB 3.18Å; I378-L381 PolarHBondContact O-N 3.16Å; C379-L381 PolarHBondContact O-N 3.05Å; L381-F383 PolarHBondContact O-N 3.42Å; L381-N384 PolarHBondContact O-N 2.96Å; L381-Y390 HydrophobicContact CB-CE2 4.01Å; L381-Y390 HydrophobicContact CD1-CE2 4.02Å; L381-Y390 HydrophobicContact CD2-CD2 3.99Å; L381-Y390 HydrophobicContact CD2-CE2 3.52Å; L381-Y390 HydrophobicContact CG-CE2 4.05Å; L381-M572 HydrophobicContact CD1-CB 4.16Å; L381-M572 HydrophobicContact CD1-CE 4.44Å; L381-M572 HydrophobicContact CD1-CG 4.13Å; L381-M572 HydrophobicContact CD2-CE 3.59Å; L381-M572 HydrophobicContact CG-CE 4.09Å; L381-M572 HydrophobicContact CG-CG 4.44Å; L381-F575 HydrophobicContact CD1-CD1 4.19Å
382	F	67.5	Low	74.5	Confident	116 Å²	116	67 Å²	67	51%	0.509	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-18.8	179.9	-69.8	-80.3	0	0	0	114	I378 C379 L380 N384 F575 V585	I378-F382 HydrophobicContact CG2-CE2 4.43Å; C379-F382 PolarHBondContact O-N 3.39Å; L380-F382 VanDerWaalsContact C-N 3.32Å; L380-F382 PolarHBondContact O-N 3.22Å; F382-N384 VanDerWaalsContact C-N 3.34Å; F382-F575 HydrophobicContact CZ-CE1 4.49Å; F382-F575 HydrophobicContact CZ-CZ 4.01Å; F382-V585 HydrophobicContact CE1-CG1 3.72Å; F382-V585 HydrophobicContact CZ-CG1 3.52Å
383	F	61.8	Low	74	Confident	178 Å²	178	65.4 Å²	65.4	78%	0.781	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-3.9	-176.1	-74	-81.1	0	0	0	114.3	L380 L381	L380-F383 PolarHBondContact O-N 2.73Å; L381-F383 PolarHBondContact O-N 3.42Å
384	N	59.8	Low	73.5	Confident	60 Å²	60	65.7 Å²	65.7	32%	0.321	34%	0.34	S	S	.	.			trans	-100	96	-173	-133.7	-32.6	0	0	0	112.5	L381 F382 C386 I393	L381-N384 PolarHBondContact O-N 2.96Å; F382-N384 VanDerWaalsContact C-N 3.34Å; N384-C386 PolarHBondContact O-N 3.47Å; N384-I393 WeakPolarHBondContact ND2-CD1 3.46Å
385	S	55.8	Low	73.4	Confident	124 Å²	124	66 Å²	66	87%	0.867	34%	0.341	S	S	*	.			trans	-70.7	14.8	-179.1	-52.1	0	0	0	0	115.4
386	C	67.4	Low	73.4	Confident	69 Å²	69	67.3 Å²	67.3	47%	0.466	35%	0.349	S	S	.	.			trans	-137.5	112.6	-175	-77.4	0	0	0	0	111.9	N384 E388 T389 Y390	N384-C386 PolarHBondContact O-N 3.47Å; C386-E388 PolarHBondContact O-N 3.14Å; C386-T389 WeakPolarHBondContact CB-OG1 3.47Å; C386-T389 PolarHBondContact O-N 3.04Å; C386-Y390 PolarHBondContact O-N 3.49Å
387	Q	70.8	Confident	73.5	Confident	174 Å²	174	64.2 Å²	64.2	81%	0.813	34%	0.335	S	S	*	.	H	α-helix	trans	-63.2	-36.5	-174.8	-170	171	-13	0	0	113.8	T391	Q387-T391 PolarHBondContact O-N 3.35Å
388	E	72.1	Confident	73.8	Confident	92 Å²	92	64.8 Å²	64.8	43%	0.43	34%	0.338	S	S	.	.	H	α-helix	trans	-69.4	-40.1	174.3	-76.1	-84.9	178.6	0	0	112.4	C386 Y390 T391 L392 N645	C386-E388 PolarHBondContact O-N 3.14Å; E388-Y390 VanDerWaalsContact C-N 3.32Å; E388-Y390 PolarHBondContact O-N 2.93Å; E388-T391 PolarHBondContact O-N 3.32Å; E388-T391 PolarHBondContact O-OG1 2.94Å; E388-L392 WeakPolarHBondContact O-CG 3.38Å; E388-L392 PolarHBondContact O-N 3.43Å; E388-N645 PolarHBondContact OE1-ND2 3.46Å
389	T	75.1	Confident	74.3	Confident	64 Å²	64	64.8 Å²	64.8	39%	0.393	34%	0.338	S	S	.	.	H	α-helix	trans	-66.6	-38.2	177.4	-47.4	0	0	0	0	111	C386 L392 I393	C386-T389 WeakPolarHBondContact CB-OG1 3.47Å; C386-T389 PolarHBondContact O-N 3.04Å; T389-L392 PolarHBondContact O-N 2.65Å; T389-I393 HydrophobicContact CG2-CD1 3.87Å; T389-I393 WeakPolarHBondContact O-CB 3.44Å; T389-I393 WeakPolarHBondContact O-CG1 3.23Å; T389-I393 PolarHBondContact O-N 3.37Å
390	Y	76.1	Confident	75.2	Confident	51 Å²	51	64.6 Å²	64.6	20%	0.2	33%	0.334	C	S	.	.	H	α-helix	trans	-57.7	-48.5	174.1	172.7	-85.2	0	0	0	112.1	L381 C386 E388 L392 I393 L394 A576	L381-Y390 HydrophobicContact CB-CE2 4.01Å; L381-Y390 HydrophobicContact CD1-CE2 4.02Å; L381-Y390 HydrophobicContact CD2-CD2 3.99Å; L381-Y390 HydrophobicContact CD2-CE2 3.52Å; L381-Y390 HydrophobicContact CG-CE2 4.05Å; C386-Y390 PolarHBondContact O-N 3.49Å; E388-Y390 VanDerWaalsContact C-N 3.32Å; E388-Y390 PolarHBondContact O-N 2.93Å; Y390-L392 PolarHBondContact O-N 2.67Å; Y390-I393 PolarHBondContact O-N 3.19Å; Y390-L394 HydrophobicContact CE1-CD1 3.86Å; Y390-L394 WeakPolarHBondContact O-CB 3.44Å; Y390-L394 PolarHBondContact O-N 3.19Å; Y390-A576 WeakPolarHBondContact OH-CB 3.41Å
391	T	77.6	Confident	76.1	Confident	45 Å²	45	60.3 Å²	60.3	28%	0.276	31%	0.311	S	S	.	.	H	α-helix	trans	-66	-37	-179	56.9	0	0	0	0	112.7	Q387 E388 Q395	Q387-T391 PolarHBondContact O-N 3.35Å; E388-T391 PolarHBondContact O-N 3.32Å; E388-T391 PolarHBondContact O-OG1 2.94Å; T391-Q395 WeakPolarHBondContact O-CB 3.42Å; T391-Q395 WeakPolarHBondContact O-CG 3.45Å; T391-Q395 PolarHBondContact O-N 2.99Å; T391-Q395 VanDerWaalsContact O-N 3.09Å
392	L	81.3	Confident	77.1	Confident	24 Å²	24	59.5 Å²	59.5	13%	0.126	31%	0.307	C	S	.	.	H	α-helix	trans	-66.7	-41.6	175.8	-68.1	173.5	0	0	0	112.4	E388 T389 Y390 Q395 L396 V649 M650 L653	E388-L392 WeakPolarHBondContact O-CG 3.38Å; E388-L392 PolarHBondContact O-N 3.43Å; T389-L392 PolarHBondContact O-N 2.65Å; Y390-L392 PolarHBondContact O-N 2.67Å; L392-Q395 PolarHBondContact O-N 3.41Å; L392-L396 PolarHBondContact O-N 3Å; L392-L396 VanDerWaalsContact O-N 3.17Å; L392-V649 HydrophobicContact CD2-CG1 4.4Å; L392-M650 HydrophobicContact CD2-CE 4.12Å; L392-M650 HydrophobicContact CD2-SD 4.28Å; L392-L653 HydrophobicContact CB-CD1 3.84Å; L392-L653 HydrophobicContact CD2-CD1 4.09Å; L392-L653 HydrophobicContact CG-CD1 4.46Å
393	I	80.3	Confident	78.3	Confident	59 Å²	59	54 Å²	54	30%	0.303	28%	0.283	S	S	.	.	H	α-helix	trans	-67.2	-45.1	176.7	-73.4	168.4	0	0	0	110.7	N384 T389 Y390 Q395 L396 F397	N384-I393 WeakPolarHBondContact ND2-CD1 3.46Å; T389-I393 HydrophobicContact CG2-CD1 3.87Å; T389-I393 WeakPolarHBondContact O-CB 3.44Å; T389-I393 WeakPolarHBondContact O-CG1 3.23Å; T389-I393 PolarHBondContact O-N 3.37Å; Y390-I393 PolarHBondContact O-N 3.19Å; I393-Q395 PolarHBondContact O-N 2.77Å; I393-L396 WeakPolarHBondContact O-CB 3.46Å; I393-L396 PolarHBondContact O-N 3.5Å; I393-F397 HydrophobicContact CG2-CD2 3.58Å; I393-F397 HydrophobicContact CG2-CE2 3.55Å; I393-F397 VanDerWaalsContact O-CD2 3.27Å; I393-F397 WeakPolarHBondContact O-CD2 3.29Å; I393-F397 PolarHBondContact O-N 3.21Å
394	L	79.1	Confident	79.7	Confident	22 Å²	22	45.5 Å²	45.5	12%	0.115	25%	0.246	C	C	.	.	H	α-helix	trans	-58.5	-35.9	176.8	-174.2	147.3	0	0	0	111.5	Y390 F397 V398 A576	Y390-L394 HydrophobicContact CE1-CD1 3.86Å; Y390-L394 WeakPolarHBondContact O-CB 3.44Å; Y390-L394 PolarHBondContact O-N 3.19Å; L394-F397 CarbonylContact O-C 3.59Å; L394-F397 WeakPolarHBondContact O-CB 3.06Å; L394-F397 PolarHBondContact O-N 3.4Å; L394-V398 HydrophobicContact CD2-CG2 3.85Å; L394-V398 WeakPolarHBondContact O-CG2 3.28Å; L394-V398 PolarHBondContact O-N 2.79Å; L394-A576 HydrophobicContact CD1-CB 3.79Å
395	Q	84.3	Confident	81.1	Confident	6 Å²	6	42.7 Å²	42.7	3%	0.028	23%	0.231	C	C	.	.	H	α-helix	trans	-78.1	-28.1	179.8	-72.4	-71.8	-54.4	0	0	114.3	T391 L392 I393 F397 G399 M639 V642 M650 Q654	T391-Q395 WeakPolarHBondContact O-CB 3.42Å; T391-Q395 WeakPolarHBondContact O-CG 3.45Å; T391-Q395 PolarHBondContact O-N 2.99Å; T391-Q395 VanDerWaalsContact O-N 3.09Å; L392-Q395 PolarHBondContact O-N 3.41Å; I393-Q395 PolarHBondContact O-N 2.77Å; Q395-F397 VanDerWaalsContact C-N 3.32Å; Q395-G399 PolarHBondContact O-N 2.65Å; Q395-G399 VanDerWaalsContact O-N 3.07Å; Q395-M639 PolarHBondContact OE1-O 3.13Å; Q395-V642 HydrophobicContact CG-CG1 4.44Å; Q395-M650 HydrophobicContact CB-CE 4.24Å; Q395-M650 HydrophobicContact CB-SD 3.33Å; Q395-M650 WeakPolarHBondContact CB-SD 3.41Å; Q395-M650 HydrophobicContact CG-CE 3.82Å; Q395-M650 HydrophobicContact CG-SD 3.5Å; Q395-M650 WeakPolarHBondContact CG-SD 3.43Å; Q395-Q654 HydrophobicContact CB-CG 4.35Å
396	L	86.8	Confident	82.9	Confident	47 Å²	47	37 Å²	37	25%	0.246	19%	0.191	C	C	.	.	H	α-helix	trans	-62.7	-42.5	164	176.1	65.2	0	0	0	110.6	L392 I393 G399 L400 L653 L656	L392-L396 PolarHBondContact O-N 3Å; L392-L396 VanDerWaalsContact O-N 3.17Å; I393-L396 WeakPolarHBondContact O-CB 3.46Å; I393-L396 PolarHBondContact O-N 3.5Å; L396-G399 PolarHBondContact O-N 2.81Å; L396-L400 WeakPolarHBondContact O-CB 3.44Å; L396-L400 PolarHBondContact O-N 3.01Å; L396-L653 HydrophobicContact CB-CB 4.33Å; L396-L653 HydrophobicContact CB-CD2 4.47Å; L396-L653 HydrophobicContact CD1-CD2 4.43Å; L396-L653 VanDerWaalsContact CD1-O 3.26Å; L396-L653 WeakPolarHBondContact CD1-O 3.35Å; L396-L653 HydrophobicContact CD2-CD2 4.48Å; L396-L656 HydrophobicContact CD1-CB 4.2Å; L396-L656 HydrophobicContact CD1-CD2 4.18Å; L396-L656 HydrophobicContact CD1-CG 4.1Å
397	F	84.6	Confident	84	Confident	62 Å²	62	33.7 Å²	33.7	27%	0.272	17%	0.169	S	C	.	.	H	α-helix	trans	-68.5	-44.9	179.6	-87	-56.6	0	0	0	113	I393 L394 Q395 G399 L400 A401 P569 M572	I393-F397 HydrophobicContact CG2-CD2 3.58Å; I393-F397 HydrophobicContact CG2-CE2 3.55Å; I393-F397 VanDerWaalsContact O-CD2 3.27Å; I393-F397 WeakPolarHBondContact O-CD2 3.29Å; I393-F397 PolarHBondContact O-N 3.21Å; L394-F397 CarbonylContact O-C 3.59Å; L394-F397 WeakPolarHBondContact O-CB 3.06Å; L394-F397 PolarHBondContact O-N 3.4Å; Q395-F397 VanDerWaalsContact C-N 3.32Å; F397-G399 VanDerWaalsContact C-N 3.34Å; F397-G399 PolarHBondContact O-N 3.49Å; F397-L400 HydrophobicContact CD1-CD2 4.32Å; F397-L400 WeakPolarHBondContact O-CA 3Å; F397-L400 WeakPolarHBondContact O-CB 3.35Å; F397-L400 PolarHBondContact O-N 2.04Å; F397-L400 VanDerWaalsContact O-N 3.1Å; F397-A401 PolarHBondContact O-N 3.16Å; F397-P569 HydrophobicContact CB-CB 3.87Å; F397-P569 HydrophobicContact CD1-CB 4.03Å; F397-P569 HydrophobicContact CD1-CG 4.02Å; F397-P569 HydrophobicContact CG-CB 4.37Å; F397-P569 WeakPolarHBondContact O-CB 3.36Å; F397-M572 HydrophobicContact CB-CE 4.49Å; F397-M572 HydrophobicContact CD2-CE 3.54Å; F397-M572 HydrophobicContact CE2-CE 3.84Å; F397-M572 HydrophobicContact CG-CE 4.01Å
398	V	83.4	Confident	84.8	Confident	13 Å²	13	25.4 Å²	25.4	8%	0.079	13%	0.13	C	C	.	.	H	α-helix	trans	-61.4	-42.9	173	170.4	0	0	0	0	110.9	L394 L400 A401 V402 M639	L394-V398 HydrophobicContact CD2-CG2 3.85Å; L394-V398 WeakPolarHBondContact O-CG2 3.28Å; L394-V398 PolarHBondContact O-N 2.79Å; V398-L400 VanDerWaalsContact C-N 3.28Å; V398-L400 PolarHBondContact O-N 3.05Å; V398-A401 PolarHBondContact O-N 3.43Å; V398-V402 WeakPolarHBondContact O-CG2 3.44Å; V398-V402 PolarHBondContact O-N 3.5Å; V398-M639 HydrophobicContact CG1-CB 3.97Å; V398-M639 HydrophobicContact CG1-CG 4.22Å
399	G	88.3	Confident	85.7	Confident	0 Å²	0	21 Å²	21	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-59.8	-38.7	172.9	0	0	0	0	0	112.6	Q395 L396 F397 G403 G657 L658	Q395-G399 PolarHBondContact O-N 2.65Å; Q395-G399 VanDerWaalsContact O-N 3.07Å; L396-G399 PolarHBondContact O-N 2.81Å; F397-G399 VanDerWaalsContact C-N 3.34Å; F397-G399 PolarHBondContact O-N 3.49Å; G399-G403 PolarHBondContact O-N 2.67Å; G399-G657 VanDerWaalsContact C-C 3.43Å; G399-G657 CarbonylContact O-C 3.35Å; G399-L658 WeakPolarHBondContact O-CA 3.3Å; G399-L658 WeakPolarHBondContact O-CD2 3.35Å; G399-L658 PolarHBondContact O-N 2.93Å
400	L	89.8	Confident	86.5	Confident	40 Å²	40	22.1 Å²	22.1	21%	0.209	11%	0.113	C	C	.	.	H	α-helix	trans	-62.4	-51.1	173.7	-176.8	66.6	0	0	0	111.3	L396 F397 V398 V402 G403 T404 P569 G657 L660	L396-L400 WeakPolarHBondContact O-CB 3.44Å; L396-L400 PolarHBondContact O-N 3.01Å; F397-L400 HydrophobicContact CD1-CD2 4.32Å; F397-L400 WeakPolarHBondContact O-CA 3Å; F397-L400 WeakPolarHBondContact O-CB 3.35Å; F397-L400 PolarHBondContact O-N 2.04Å; F397-L400 VanDerWaalsContact O-N 3.1Å; V398-L400 VanDerWaalsContact C-N 3.28Å; V398-L400 PolarHBondContact O-N 3.05Å; L400-V402 PolarHBondContact O-N 3.27Å; L400-G403 CarbonylContact O-C 3.39Å; L400-G403 WeakPolarHBondContact O-CA 3.36Å; L400-G403 PolarHBondContact O-N 3.18Å; L400-G403 VanDerWaalsContact O-N 3.09Å; L400-T404 HydrophobicContact CD1-CG2 4.05Å; L400-T404 HydrophobicContact CG-CG2 4.28Å; L400-T404 WeakPolarHBondContact O-CG2 3.42Å; L400-T404 PolarHBondContact O-N 3.38Å; L400-T404 PolarHBondContact O-OG1 3.43Å; L400-P569 HydrophobicContact CD2-CG 4.19Å; L400-P569 HydrophobicContact CG-CG 4.48Å; L400-G657 WeakPolarHBondContact CA-O 3.26Å; L400-L660 HydrophobicContact CD1-CB 3.94Å
401	A	87.5	Confident	87	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-57.2	-44.9	177.1	0	0	0	0	0	113	F397 V398 G403 T404 L405 P569 M635	F397-A401 PolarHBondContact O-N 3.16Å; V398-A401 PolarHBondContact O-N 3.43Å; A401-G403 VanDerWaalsContact C-N 3.28Å; A401-G403 PolarHBondContact O-N 3.17Å; A401-T404 VanDerWaalsContact CA-OG1 3.31Å; A401-T404 WeakPolarHBondContact CA-OG1 3.46Å; A401-T404 PolarHBondContact O-N 3.14Å; A401-T404 PolarHBondContact O-OG1 2.84Å; A401-L405 WeakPolarHBondContact O-CB 3.44Å; A401-L405 PolarHBondContact O-N 2.77Å; A401-P569 HydrophobicContact CB-CB 3.84Å; A401-P569 HydrophobicContact CB-CG 4.28Å; A401-M635 HydrophobicContact CB-CE 4.18Å; A401-M635 HydrophobicContact CB-SD 4Å
402	V	90.4	Very high	87.3	Confident	3 Å²	3	21.3 Å²	21.3	2%	0.018	11%	0.109	C	C	.	.	H	α-helix	trans	-60	-42.4	175.5	176.1	0	0	0	0	110.6	V398 L400 S406 M635 L636 L658	V398-V402 WeakPolarHBondContact O-CG2 3.44Å; V398-V402 PolarHBondContact O-N 3.5Å; L400-V402 PolarHBondContact O-N 3.27Å; V402-S406 VanDerWaalsContact O-CB 3.29Å; V402-S406 WeakPolarHBondContact O-CB 3.32Å; V402-S406 PolarHBondContact O-N 3.44Å; V402-S406 VanDerWaalsContact O-N 3.09Å; V402-S406 PolarHBondContact O-OG 2.93Å; V402-M635 HydrophobicContact CG2-CB 3.5Å; V402-M635 VanDerWaalsContact CG2-CB 3.5Å; V402-L636 HydrophobicContact CG1-CB 4.24Å; V402-L636 HydrophobicContact CG1-CD1 4.19Å; V402-L658 HydrophobicContact CB-CD2 3.7Å; V402-L658 HydrophobicContact CG1-CD2 3.48Å; V402-L658 VanDerWaalsContact CG1-CD2 3.48Å
403	G	91.9	Very high	87.5	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-67.6	-39.7	177.7	0	0	0	0	0	113.4	G399 L400 A401 G407	G399-G403 PolarHBondContact O-N 2.67Å; L400-G403 CarbonylContact O-C 3.39Å; L400-G403 WeakPolarHBondContact O-CA 3.36Å; L400-G403 PolarHBondContact O-N 3.18Å; L400-G403 VanDerWaalsContact O-N 3.09Å; A401-G403 VanDerWaalsContact C-N 3.28Å; A401-G403 PolarHBondContact O-N 3.17Å; G403-G407 WeakPolarHBondContact O-CA 3.15Å; G403-G407 PolarHBondContact O-N 2.85Å
404	T	91.3	Very high	87.9	Confident	1 Å²	1	18.9 Å²	18.9	1%	0.006	10%	0.097	C	C	.	.	H	α-helix	trans	-76.2	-42.3	-179.9	47	0	0	0	0	112.1	L400 A401 G407 D408 C565 H566 L665	L400-T404 HydrophobicContact CD1-CG2 4.05Å; L400-T404 HydrophobicContact CG-CG2 4.28Å; L400-T404 WeakPolarHBondContact O-CG2 3.42Å; L400-T404 PolarHBondContact O-N 3.38Å; L400-T404 PolarHBondContact O-OG1 3.43Å; A401-T404 VanDerWaalsContact CA-OG1 3.31Å; A401-T404 WeakPolarHBondContact CA-OG1 3.46Å; A401-T404 PolarHBondContact O-N 3.14Å; A401-T404 PolarHBondContact O-OG1 2.84Å; T404-G407 PolarHBondContact O-N 3.47Å; T404-D408 VanDerWaalsContact O-CB 3.31Å; T404-D408 WeakPolarHBondContact O-CB 3.33Å; T404-D408 PolarHBondContact O-N 2.82Å; T404-C565 HydrophobicContact CG2-CB 4.03Å; T404-C565 PolarHBondContact OG1-O 3.28Å; T404-H566 WeakPolarHBondContact OG1-CA 3.33Å; T404-H566 VanDerWaalsContact OG1-CB 3.25Å; T404-H566 WeakPolarHBondContact OG1-CB 3.46Å; T404-L665 HydrophobicContact CG2-CD2 3.69Å
405	L	89.4	Confident	88	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-63.8	-51	174	-81.8	159.4	0	0	0	112.8	A401 G407 D408 A409 H566 F627 M635	A401-L405 WeakPolarHBondContact O-CB 3.44Å; A401-L405 PolarHBondContact O-N 2.77Å; L405-G407 VanDerWaalsContact C-N 3.28Å; L405-G407 PolarHBondContact O-N 3.04Å; L405-D408 PolarHBondContact O-N 3.46Å; L405-A409 PolarHBondContact O-N 3.06Å; L405-H566 HydrophobicContact CD1-CB 4.31Å; L405-H566 HydrophobicContact CD2-CB 4.26Å; L405-H566 HydrophobicContact CG-CB 3.68Å; L405-F627 HydrophobicContact CD2-CB 4.24Å; L405-F627 HydrophobicContact CD2-CD1 3.94Å; L405-F627 HydrophobicContact CD2-CD2 4.49Å; L405-F627 HydrophobicContact CD2-CE1 4.38Å; L405-F627 HydrophobicContact CD2-CG 3.99Å; L405-M635 HydrophobicContact CD1-SD 3.87Å
406	S	92.8	Very high	87.6	Confident	4 Å²	4	20.8 Å²	20.8	3%	0.028	11%	0.107	C	C	.	.	H	α-helix	trans	-67.5	-32.6	178.4	63	0	0	0	0	111.7	V402 L410 W662	V402-S406 VanDerWaalsContact O-CB 3.29Å; V402-S406 WeakPolarHBondContact O-CB 3.32Å; V402-S406 PolarHBondContact O-N 3.44Å; V402-S406 VanDerWaalsContact O-N 3.09Å; V402-S406 PolarHBondContact O-OG 2.93Å; S406-L410 VanDerWaalsContact O-CB 3.25Å; S406-L410 WeakPolarHBondContact O-CB 3.2Å; S406-L410 WeakPolarHBondContact O-CD1 3.43Å; S406-L410 VanDerWaalsContact O-CG 3.24Å; S406-L410 WeakPolarHBondContact O-CG 3.49Å; S406-L410 PolarHBondContact O-N 3.4Å; S406-W662 PolarHBondContact OG-NE1 3.3Å
407	G	91	Very high	87.3	Confident	1 Å²	1	18.8 Å²	18.8	1%	0.01	10%	0.097	C	C	.	.	H	α-helix	trans	-65.1	-44	172.2	0	0	0	0	0	112.8	G403 T404 L405 L410 L411	G403-G407 WeakPolarHBondContact O-CA 3.15Å; G403-G407 PolarHBondContact O-N 2.85Å; T404-G407 PolarHBondContact O-N 3.47Å; L405-G407 VanDerWaalsContact C-N 3.28Å; L405-G407 PolarHBondContact O-N 3.04Å; G407-L410 PolarHBondContact O-N 3.43Å; G407-L411 WeakPolarHBondContact O-CA 3.24Å; G407-L411 VanDerWaalsContact O-CB 3.23Å; G407-L411 WeakPolarHBondContact O-CB 3.06Å; G407-L411 PolarHBondContact O-N 2.93Å
408	D	88.8	Confident	86.9	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.097	C	C	.	.	I	π-helix	trans	-64.7	-45.4	179	-166.7	32.3	0	0	0	110.9	T404 L405 H412 L413 H566 F627 L665	T404-D408 VanDerWaalsContact O-CB 3.31Å; T404-D408 WeakPolarHBondContact O-CB 3.33Å; T404-D408 PolarHBondContact O-N 2.82Å; L405-D408 PolarHBondContact O-N 3.46Å; D408-H412 WeakPolarHBondContact O-CB 3.49Å; D408-H412 PolarHBondContact O-N 3.27Å; D408-H412 WeakPolarHBondContact OD1-CB 3.48Å; D408-H412 IonicContact OD1-CE1 2.71Å; D408-H412 IonicContact OD1-CG 3.45Å; D408-H412 IonicContact OD1-ND1 2.66Å; D408-H412 PolarHBondContact OD1-ND1 3.19Å; D408-L413 PolarHBondContact O-N 3.38Å; D408-H566 IonicContact OD2-CE1 3.62Å; D408-F627 VanDerWaalsContact OD2-CE2 3.3Å; D408-F627 WeakPolarHBondContact OD2-CE2 3.04Å; D408-L665 HydrophobicContact CB-CD1 3.81Å; D408-L665 HydrophobicContact CB-CG 4.36Å
409	A	90.8	Very high	85.8	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.12	C	C	.	.	I	π-helix	trans	-60.5	-49.4	174	0	0	0	0	0	112.9	L405 I414 A624 F627 L628	L405-A409 PolarHBondContact O-N 3.06Å; A409-I414 VanDerWaalsContact O-CB 3.26Å; A409-I414 WeakPolarHBondContact O-CB 3.37Å; A409-I414 WeakPolarHBondContact O-CD1 3.47Å; A409-I414 WeakPolarHBondContact O-CG1 3.39Å; A409-I414 PolarHBondContact O-N 3.43Å; A409-A624 HydrophobicContact CB-CB 4.49Å; A409-F627 HydrophobicContact CB-CB 4Å; A409-L628 HydrophobicContact CB-CD2 4.16Å; A409-L628 HydrophobicContact CB-CG 3.78Å
410	L	91.3	Very high	84	Confident	87 Å²	87	26.4 Å²	26.4	46%	0.455	15%	0.149	S	C	.	.	I	π-helix	trans	-82.6	-34.8	-171.3	-68.7	168.9	0	0	0	115	S406 G407 I414 P415 L628	S406-L410 VanDerWaalsContact O-CB 3.25Å; S406-L410 WeakPolarHBondContact O-CB 3.2Å; S406-L410 WeakPolarHBondContact O-CD1 3.43Å; S406-L410 VanDerWaalsContact O-CG 3.24Å; S406-L410 WeakPolarHBondContact O-CG 3.49Å; S406-L410 PolarHBondContact O-N 3.4Å; G407-L410 PolarHBondContact O-N 3.43Å; L410-I414 HydrophobicContact CD2-CD1 3.91Å; L410-P415 WeakPolarHBondContact O-CD 3.39Å; L410-L628 HydrophobicContact CD1-CD2 4.43Å; L410-L628 HydrophobicContact CD2-CD2 4.17Å; L410-L628 HydrophobicContact CG-CD2 4.07Å
411	L	87	Confident	81.8	Confident	64 Å²	64	31.2 Å²	31.2	34%	0.335	17%	0.17	S	C	.	.	I	π-helix	trans	-106.6	-17.9	-170.9	-55.9	177.4	0	0	0	113.4	G407 L666	G407-L411 WeakPolarHBondContact O-CA 3.24Å; G407-L411 VanDerWaalsContact O-CB 3.23Å; G407-L411 WeakPolarHBondContact O-CB 3.06Å; G407-L411 PolarHBondContact O-N 2.93Å; L411-L666 HydrophobicContact CD1-CB 4.05Å; L411-L666 HydrophobicContact CD1-CD1 4.49Å
412	H	83.1	Confident	79.4	Confident	14 Å²	14	36 Å²	36	7%	0.065	20%	0.196	C	C	.	.	I	π-helix	trans	-117.6	-61.3	-177.2	177.5	-128.5	0	0	0	111.3	D408 Q416 T559	D408-H412 WeakPolarHBondContact O-CB 3.49Å; D408-H412 PolarHBondContact O-N 3.27Å; D408-H412 WeakPolarHBondContact OD1-CB 3.48Å; D408-H412 IonicContact OD1-CE1 2.71Å; D408-H412 IonicContact OD1-CG 3.45Å; D408-H412 IonicContact OD1-ND1 2.66Å; D408-H412 PolarHBondContact OD1-ND1 3.19Å; H412-Q416 PolarHBondContact CD2-NE2 3.09Å; H412-Q416 PolarHBondContact NE2-NE2 2.99Å; H412-Q416 WeakPolarHBondContact O-CG 3.25Å; H412-Q416 PolarHBondContact O-N 3Å; H412-T559 PolarHBondContact CE1-OG1 3.2Å
413	L	86	Confident	76.7	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.231	C	C	.	.	I	π-helix	trans	-70.4	-54.5	-177.3	-60.6	178.8	0	0	0	113.5	D408 Q416 I417 V544 F620 A624 F627	D408-L413 PolarHBondContact O-N 3.38Å; L413-Q416 WeakPolarHBondContact O-CB 3.42Å; L413-Q416 PolarHBondContact O-N 3.29Å; L413-Q416 VanDerWaalsContact O-N 3.09Å; L413-I417 HydrophobicContact CB-CD1 4.43Å; L413-I417 VanDerWaalsContact O-CD1 3.23Å; L413-I417 WeakPolarHBondContact O-CD1 3.39Å; L413-I417 VanDerWaalsContact O-CG1 3.28Å; L413-I417 WeakPolarHBondContact O-CG1 3.27Å; L413-I417 PolarHBondContact O-N 3.38Å; L413-V544 HydrophobicContact CD2-CG1 4.2Å; L413-F620 HydrophobicContact CD2-CB 4.4Å; L413-F620 HydrophobicContact CD2-CD1 4.25Å; L413-F620 HydrophobicContact CD2-CG 4.29Å; L413-A624 HydrophobicContact CB-CB 3.82Å; L413-A624 HydrophobicContact CD1-CB 4.06Å; L413-F627 HydrophobicContact CD1-CD2 3.78Å; L413-F627 HydrophobicContact CD1-CE2 3.9Å
414	I	87.9	Confident	74	Confident	32 Å²	32	46.8 Å²	46.8	16%	0.164	27%	0.266	C	S	.	.	H	α-helix	trans	-54.5	-46.8	-178.9	-77.7	163.8	0	0	0	112.8	A409 L410 Q416 I417 L418 L445 A624 L628	A409-I414 VanDerWaalsContact O-CB 3.26Å; A409-I414 WeakPolarHBondContact O-CB 3.37Å; A409-I414 WeakPolarHBondContact O-CD1 3.47Å; A409-I414 WeakPolarHBondContact O-CG1 3.39Å; A409-I414 PolarHBondContact O-N 3.43Å; L410-I414 HydrophobicContact CD2-CD1 3.91Å; I414-Q416 VanDerWaalsContact C-N 3.34Å; I414-Q416 PolarHBondContact O-N 2.91Å; I414-I417 PolarHBondContact O-N 2.92Å; I414-L418 HydrophobicContact CG2-CD1 3.66Å; I414-L418 HydrophobicContact CG2-CG 4.32Å; I414-L418 WeakPolarHBondContact O-CB 3.42Å; I414-L418 WeakPolarHBondContact O-CG 3.38Å; I414-L418 PolarHBondContact O-N 3.34Å; I414-L445 HydrophobicContact CD1-CD1 3.69Å; I414-L445 HydrophobicContact CG1-CD1 3.6Å; I414-A624 HydrophobicContact CG1-CB 4.24Å; I414-L628 HydrophobicContact CD1-CD1 4.08Å
415	P	82	Confident	71.4	Confident	28 Å²	28	53.8 Å²	53.8	18%	0.182	30%	0.298	C	S	.	.	H	α-helix	trans	-64.6	-33.5	177.1	-25.8	37.7	0	0	0	114	L410 A419 L420	L410-P415 WeakPolarHBondContact O-CD 3.39Å; P415-A419 PolarHBondContact O-N 2.96Å; P415-L420 PolarHBondContact O-N 3.21Å
416	Q	76.5	Confident	68.6	Low	40 Å²	40	58.5 Å²	58.5	19%	0.187	33%	0.332	C	S	.	.	H	α-helix	trans	-65.5	-39.8	173.8	-74.9	171	0.4	0	0	111.8	H412 L413 I414	H412-Q416 PolarHBondContact CD2-NE2 3.09Å; H412-Q416 PolarHBondContact NE2-NE2 2.99Å; H412-Q416 WeakPolarHBondContact O-CG 3.25Å; H412-Q416 PolarHBondContact O-N 3Å; L413-Q416 WeakPolarHBondContact O-CB 3.42Å; L413-Q416 PolarHBondContact O-N 3.29Å; L413-Q416 VanDerWaalsContact O-N 3.09Å; I414-Q416 VanDerWaalsContact C-N 3.34Å; I414-Q416 PolarHBondContact O-N 2.91Å
417	I	79.9	Confident	65.8	Low	5 Å²	5	67.6 Å²	67.6	3%	0.026	37%	0.373	C	S	.	.	H	α-helix	trans	-70.9	-43.1	179.7	-62	149.6	0	0	0	111.8	L413 I414 A419 K441 F620 A624	L413-I417 HydrophobicContact CB-CD1 4.43Å; L413-I417 VanDerWaalsContact O-CD1 3.23Å; L413-I417 WeakPolarHBondContact O-CD1 3.39Å; L413-I417 VanDerWaalsContact O-CG1 3.28Å; L413-I417 WeakPolarHBondContact O-CG1 3.27Å; L413-I417 PolarHBondContact O-N 3.38Å; I414-I417 PolarHBondContact O-N 2.92Å; I417-A419 PolarHBondContact O-N 3Å; I417-K441 HydrophobicContact CG2-CB 3.61Å; I417-K441 HydrophobicContact CG2-CD 3.89Å; I417-K441 HydrophobicContact CG2-CG 3.92Å; I417-F620 HydrophobicContact CD1-CB 4.16Å; I417-F620 HydrophobicContact CG1-CB 3.86Å; I417-A624 HydrophobicContact CD1-CB 4.13Å
418	L	75.1	Confident	63.1	Low	51 Å²	51	75.3 Å²	75.3	27%	0.267	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	2.5	-175.9	-66.2	177.5	0	0	0	114.1	I414 L420 I442	I414-L418 HydrophobicContact CG2-CD1 3.66Å; I414-L418 HydrophobicContact CG2-CG 4.32Å; I414-L418 WeakPolarHBondContact O-CB 3.42Å; I414-L418 WeakPolarHBondContact O-CG 3.38Å; I414-L418 PolarHBondContact O-N 3.34Å; L418-L420 HydrophobicContact CB-CD1 3.88Å; L418-L420 HydrophobicContact CB-CG 3.84Å; L418-L420 HydrophobicContact CD1-CD1 3.92Å; L418-L420 PolarHBondContact O-N 3.46Å; L418-I442 HydrophobicContact CD2-CD1 4.11Å; L418-I442 HydrophobicContact CD2-CG1 4.04Å
419	A	60.7	Low	60.8	Low	68 Å²	68	79.5 Å²	79.5	56%	0.562	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	21.6	-177	0	0	0	0	0	115	P415 I417 H421 D422	P415-A419 PolarHBondContact O-N 2.96Å; I417-A419 PolarHBondContact O-N 3Å; A419-H421 PolarHBondContact O-N 2.83Å; A419-D422 PolarHBondContact O-N 3.01Å; A419-D422 VanDerWaalsContact O-N 3.14Å
420	L	51.4	Low	58.1	Low	116 Å²	116	86 Å²	86	61%	0.607	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-1.7	-175.7	-73.9	170.4	0	0	0	114.2	P415 L418	P415-L420 PolarHBondContact O-N 3.21Å; L418-L420 HydrophobicContact CB-CD1 3.88Å; L418-L420 HydrophobicContact CB-CG 3.84Å; L418-L420 HydrophobicContact CD1-CD1 3.92Å; L418-L420 PolarHBondContact O-N 3.46Å
421	H	42.6	Very low	55.7	Low	141 Å²	141	88.7 Å²	88.7	65%	0.653	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-3.2	175.3	-111.8	95.9	0	0	0	114.5	A419	A419-H421 PolarHBondContact O-N 2.83Å
422	D	38.1	Very low	53.6	Low	102 Å²	102	90.1 Å²	90.1	55%	0.545	52%	0.518	S	S	.	.			trans	-109.5	33.7	179.2	-132.2	-15.7	0	0	0	112.8	A419 T424	A419-D422 PolarHBondContact O-N 3.01Å; A419-D422 VanDerWaalsContact O-N 3.14Å; D422-T424 PolarHBondContact O-N 3.02Å
423	S	32.2	Very low	51.5	Low	109 Å²	109	95.9 Å²	95.9	76%	0.762	55%	0.549	S	S	*	.			trans	-75.1	54	-179.1	67.6	0	0	0	0	113.3
424	T	35.2	Very low	49.9	Very low	120 Å²	120	104.4 Å²	104.4	74%	0.736	59%	0.589	S	S	*	*			trans	-132.7	29.9	170.3	23	0	0	0	0	113.3	D422	D422-T424 PolarHBondContact O-N 3.02Å
425	H	38.5	Very low	48.3	Very low	147 Å²	147	107.7 Å²	107.7	68%	0.681	61%	0.607	S	S	*	*			trans	-117	107.2	169.4	-78.7	-74.4	0	0	0	113.1
426	S	30.3	Very low	47.4	Very low	100 Å²	100	112.2 Å²	112.2	70%	0.699	62%	0.624	S	S	*	*			trans	14.8	112.3	141.6	48.9	0	0	0	0	117.7	D428	S426-D428 PolarHBondContact O-N 3.38Å; S426-D428 VanDerWaalsContact O-N 3.16Å
427	H	34	Very low	47.3	Very low	195 Å²	195	114 Å²	114	90%	0.903	63%	0.634	S	S	*	*			trans	-63.9	108.6	153.6	-69	-74.4	0	0	0	109.6
428	D	33.2	Very low	47.2	Very low	163 Å²	163	119.1 Å²	119.1	87%	0.872	65%	0.654	S	S	*	*			trans	-147	140.9	146	-104.3	-39.1	0	0	0	109.8	S426	S426-D428 PolarHBondContact O-N 3.38Å; S426-D428 VanDerWaalsContact O-N 3.16Å
429	A	40.4	Very low	47.6	Very low	88 Å²	88	120.8 Å²	120.8	73%	0.727	66%	0.663	S	S	*	*			trans	-87.9	118.3	-158.3	0	0	0	0	0	113.6
430	V	34.9	Very low	48.8	Very low	137 Å²	137	124.7 Å²	124.7	83%	0.83	66%	0.663	S	S	*	*			trans	-122	96.2	155.3	-177.1	0	0	0	0	108.3
431	L	41.2	Very low	50.3	Low	142 Å²	142	120 Å²	120	74%	0.743	64%	0.638	S	S	*	*			trans	-64.3	150.5	172.2	-90.4	102.9	0	0	0	111.1
432	S	42.1	Very low	52.5	Low	95 Å²	95	116.6 Å²	116.6	66%	0.664	62%	0.624	S	S	*	*	S	Bend	trans	82.7	67	162.5	69.6	0	0	0	0	118.9
433	N	40	Very low	55	Low	135 Å²	135	116 Å²	116	72%	0.722	62%	0.62	S	S	*	*	S	Bend		-177.4	-14.6	107.3	-92.2	-34.6	0	0	0	114.6
434	E	51.9	Low	57.8	Low	178 Å²	178	110.9 Å²	110.9	83%	0.832	59%	0.585	S	S	*	*	S	Bend	trans	-77.3	-22.1	-174.8	-61.9	-176.8	145	0	0	114	K436 D437	E434-K436 PolarHBondContact O-N 3.12Å; E434-D437 PolarHBondContact O-N 3.46Å
435	D	53.2	Low	60.5	Low	102 Å²	102	106.4 Å²	106.4	55%	0.545	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	-62.2	13.2	177.7	-64	-48.2	0	0	0	116.1	Y438	D435-Y438 WeakPolarHBondContact O-CE1 3.33Å
436	K	63.1	Low	63.1	Low	123 Å²	123	103.6 Å²	103.6	54%	0.535	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.9	-11	-179.3	-65.7	-176.5	-177.9	168.3	0	114.4	E434 Y438 L439 W440	E434-K436 PolarHBondContact O-N 3.12Å; K436-Y438 VanDerWaalsContact C-N 3.35Å; K436-Y438 PolarHBondContact O-N 3.03Å; K436-L439 HydrophobicContact CG-CD1 4.29Å; K436-L439 WeakPolarHBondContact O-CB 3.3Å; K436-L439 PolarHBondContact O-N 3.43Å; K436-W440 VanDerWaalsContact O-CD1 3.23Å; K436-W440 PolarHBondContact O-N 3.31Å; K436-W440 VanDerWaalsContact O-N 3.14Å
437	D	74.8	Confident	66.1	Low	77 Å²	77	101.4 Å²	101.4	41%	0.412	53%	0.533	S	S	.	.	H	α-helix	trans	-62.8	-43	-179.8	177.8	54.1	0	0	0	111.6	E434 L439 W440 K441	E434-D437 PolarHBondContact O-N 3.46Å; D437-L439 PolarHBondContact O-N 2.97Å; D437-W440 PolarHBondContact O-N 3.07Å; D437-W440 VanDerWaalsContact O-N 3.13Å; D437-K441 WeakPolarHBondContact O-CG 3.33Å; D437-K441 PolarHBondContact O-N 3.35Å; D437-K441 WeakPolarHBondContact OD2-CD 3.33Å; D437-K441 WeakPolarHBondContact OD2-CE 3.42Å; D437-K441 IonicContact OD2-NZ 3.84Å; D437-K441 PolarHBondContact OD2-NZ 3.18Å
438	Y	78.8	Confident	68.9	Low	112 Å²	112	92.2 Å²	92.2	44%	0.439	49%	0.491	S	S	.	.	H	α-helix	trans	-60.8	-28.6	173.3	75.8	-94.7	0	0	0	113.3	D435 K436 I442	D435-Y438 WeakPolarHBondContact O-CE1 3.33Å; K436-Y438 VanDerWaalsContact C-N 3.35Å; K436-Y438 PolarHBondContact O-N 3.03Å; Y438-I442 HydrophobicContact CD2-CD1 4.08Å; Y438-I442 WeakPolarHBondContact O-CB 3.34Å; Y438-I442 VanDerWaalsContact O-CG1 3.23Å; Y438-I442 WeakPolarHBondContact O-CG1 3.2Å; Y438-I442 PolarHBondContact O-N 2.89Å
439	L	83.6	Confident	71.7	Confident	87 Å²	87	87.2 Å²	87.2	46%	0.455	46%	0.464	S	S	.	.	H	α-helix	trans	-72.2	-40.8	175.6	-64.2	174.5	0	0	0	111.6	K436 D437 K441 I442 L443	K436-L439 HydrophobicContact CG-CD1 4.29Å; K436-L439 WeakPolarHBondContact O-CB 3.3Å; K436-L439 PolarHBondContact O-N 3.43Å; D437-L439 PolarHBondContact O-N 2.97Å; L439-K441 VanDerWaalsContact C-N 3.34Å; L439-I442 PolarHBondContact O-N 3.49Å; L439-L443 WeakPolarHBondContact O-CB 3.18Å; L439-L443 PolarHBondContact O-N 3.12Å
440	W	84.6	Confident	74.2	Confident	150 Å²	150	89.6 Å²	89.6	57%	0.568	46%	0.455	S	S	*	.	H	α-helix	trans	-64.5	-40.8	173.7	-74	112.5	0	0	0	111.5	K436 D437 L443 G444 W618	K436-W440 VanDerWaalsContact O-CD1 3.23Å; K436-W440 PolarHBondContact O-N 3.31Å; K436-W440 VanDerWaalsContact O-N 3.14Å; D437-W440 PolarHBondContact O-N 3.07Å; D437-W440 VanDerWaalsContact O-N 3.13Å; W440-L443 HydrophobicContact CE3-CD2 3.85Å; W440-L443 HydrophobicContact CZ3-CD2 3.82Å; W440-L443 WeakPolarHBondContact O-CB 3.05Å; W440-L443 PolarHBondContact O-N 3.26Å; W440-G444 PolarHBondContact O-N 3.19Å; W440-W618 HydrophobicContact CB-CH2 3.9Å; W440-W618 HydrophobicContact CB-CZ2 4.05Å; W440-W618 VanDerWaalsContact O-CH2 3.24Å; W440-W618 WeakPolarHBondContact O-CH2 3.3Å; W440-W618 WeakPolarHBondContact O-CZ3 3.34Å
441	K	84.1	Confident	76.8	Confident	17 Å²	17	84.2 Å²	84.2	7%	0.074	43%	0.428	C	S	.	.	H	α-helix	trans	-61.5	-49.4	173.1	-74.4	165.8	172.4	175.2	0	112.2	I417 D437 L439 L443 G444 L445 S621	I417-K441 HydrophobicContact CG2-CB 3.61Å; I417-K441 HydrophobicContact CG2-CD 3.89Å; I417-K441 HydrophobicContact CG2-CG 3.92Å; D437-K441 WeakPolarHBondContact O-CG 3.33Å; D437-K441 PolarHBondContact O-N 3.35Å; D437-K441 WeakPolarHBondContact OD2-CD 3.33Å; D437-K441 WeakPolarHBondContact OD2-CE 3.42Å; D437-K441 IonicContact OD2-NZ 3.84Å; D437-K441 PolarHBondContact OD2-NZ 3.18Å; L439-K441 VanDerWaalsContact C-N 3.34Å; K441-L443 PolarHBondContact O-N 3.02Å; K441-G444 WeakPolarHBondContact O-CA 3.09Å; K441-G444 PolarHBondContact O-N 3.09Å; K441-L445 PolarHBondContact O-N 3.4Å; K441-L445 VanDerWaalsContact O-N 3.12Å; K441-S621 PolarHBondContact O-OG 2.94Å
442	I	88.8	Confident	78.9	Confident	70 Å²	70	78.1 Å²	78.1	36%	0.359	40%	0.395	S	S	.	.	H	α-helix	trans	-60.5	-35.3	174.6	-70	167.3	0	0	0	111.4	L418 Y438 L439 G444 L445 I446	L418-I442 HydrophobicContact CD2-CD1 4.11Å; L418-I442 HydrophobicContact CD2-CG1 4.04Å; Y438-I442 HydrophobicContact CD2-CD1 4.08Å; Y438-I442 WeakPolarHBondContact O-CB 3.34Å; Y438-I442 VanDerWaalsContact O-CG1 3.23Å; Y438-I442 WeakPolarHBondContact O-CG1 3.2Å; Y438-I442 PolarHBondContact O-N 2.89Å; L439-I442 PolarHBondContact O-N 3.49Å; I442-G444 VanDerWaalsContact C-N 3.32Å; I442-G444 PolarHBondContact O-N 3.46Å; I442-L445 WeakPolarHBondContact O-CB 3.47Å; I442-L445 PolarHBondContact O-N 2.91Å; I442-I446 HydrophobicContact CG2-CD1 4.03Å; I442-I446 WeakPolarHBondContact O-CG1 3.21Å; I442-I446 PolarHBondContact O-N 3.11Å
443	L	90.4	Very high	81.1	Confident	88 Å²	88	77.2 Å²	77.2	46%	0.461	38%	0.38	S	S	.	.	H	α-helix	trans	-64.1	-36.5	172.8	-176.1	64.4	0	0	0	111.9	L439 W440 K441 L445 I446 A447	L439-L443 WeakPolarHBondContact O-CB 3.18Å; L439-L443 PolarHBondContact O-N 3.12Å; W440-L443 HydrophobicContact CE3-CD2 3.85Å; W440-L443 HydrophobicContact CZ3-CD2 3.82Å; W440-L443 WeakPolarHBondContact O-CB 3.05Å; W440-L443 PolarHBondContact O-N 3.26Å; K441-L443 PolarHBondContact O-N 3.02Å; L443-L445 VanDerWaalsContact C-N 3.35Å; L443-I446 PolarHBondContact O-N 2.96Å; L443-A447 VanDerWaalsContact O-CB 3.29Å; L443-A447 WeakPolarHBondContact O-CB 3.34Å; L443-A447 PolarHBondContact O-N 3.41Å
444	G	90	Very high	83.4	Confident	3 Å²	3	73.8 Å²	73.8	3%	0.031	36%	0.361	C	S	.	.	H	α-helix	trans	-59.1	-41.9	170.4	0	0	0	0	0	113	W440 K441 I442 A447 G448	W440-G444 PolarHBondContact O-N 3.19Å; K441-G444 WeakPolarHBondContact O-CA 3.09Å; K441-G444 PolarHBondContact O-N 3.09Å; I442-G444 VanDerWaalsContact C-N 3.32Å; I442-G444 PolarHBondContact O-N 3.46Å; G444-A447 WeakPolarHBondContact O-CB 3.23Å; G444-A447 PolarHBondContact O-N 2.84Å; G444-G448 PolarHBondContact O-N 3.13Å
445	L	93.1	Very high	85	Confident	25 Å²	25	68.3 Å²	68.3	13%	0.131	34%	0.337	C	S	.	.	H	α-helix	trans	-64.8	-45.1	175.1	-177.8	150.6	0	0	0	111.9	I414 K441 I442 L443 A447 G448 I449 S621 A624 G625 L628	I414-L445 HydrophobicContact CD1-CD1 3.69Å; I414-L445 HydrophobicContact CG1-CD1 3.6Å; K441-L445 PolarHBondContact O-N 3.4Å; K441-L445 VanDerWaalsContact O-N 3.12Å; I442-L445 WeakPolarHBondContact O-CB 3.47Å; I442-L445 PolarHBondContact O-N 2.91Å; L443-L445 VanDerWaalsContact C-N 3.35Å; L445-A447 VanDerWaalsContact C-N 3.27Å; L445-A447 PolarHBondContact O-N 2.86Å; L445-G448 PolarHBondContact O-N 2.79Å; L445-G448 VanDerWaalsContact O-N 3.17Å; L445-I449 HydrophobicContact CD2-CD1 3.73Å; L445-I449 HydrophobicContact CD2-CG1 4.49Å; L445-I449 PolarHBondContact O-N 3.16Å; L445-I449 VanDerWaalsContact O-N 3.09Å; L445-S621 VanDerWaalsContact CA-O 3.31Å; L445-S621 WeakPolarHBondContact CA-O 3.43Å; L445-S621 PolarHBondContact N-OG 3.36Å; L445-S621 VanDerWaalsContact N-OG 3.15Å; L445-A624 HydrophobicContact CD1-CB 3.96Å; L445-G625 WeakPolarHBondContact O-CA 3.38Å; L445-L628 HydrophobicContact CD1-CD1 4.32Å; L445-L628 HydrophobicContact CD2-CD1 4.24Å
446	I	93.6	Very high	86.2	Confident	89 Å²	89	65.5 Å²	65.5	46%	0.456	32%	0.32	S	S	.	.	H	α-helix	trans	-62.5	-37.4	174.6	-66.1	166.9	0	0	0	110.6	I442 L443 I449 Y450	I442-I446 HydrophobicContact CG2-CD1 4.03Å; I442-I446 WeakPolarHBondContact O-CG1 3.21Å; I442-I446 PolarHBondContact O-N 3.11Å; L443-I446 PolarHBondContact O-N 2.96Å; I446-I449 PolarHBondContact O-N 3.2Å; I446-Y450 WeakPolarHBondContact O-CB 3.28Å; I446-Y450 PolarHBondContact O-N 3.22Å
447	A	92.9	Very high	87.2	Confident	53 Å²	53	64.6 Å²	64.6	44%	0.438	31%	0.313	S	S	.	.	H	α-helix	trans	-67	-33.8	175.1	0	0	0	0	0	112.5	L443 G444 L445 G451	L443-A447 VanDerWaalsContact O-CB 3.29Å; L443-A447 WeakPolarHBondContact O-CB 3.34Å; L443-A447 PolarHBondContact O-N 3.41Å; G444-A447 WeakPolarHBondContact O-CB 3.23Å; G444-A447 PolarHBondContact O-N 2.84Å; L445-A447 VanDerWaalsContact C-N 3.27Å; L445-A447 PolarHBondContact O-N 2.86Å; A447-G451 WeakPolarHBondContact O-CA 3.37Å; A447-G451 PolarHBondContact O-N 3.05Å
448	G	91.4	Very high	87.7	Confident	2 Å²	2	65.1 Å²	65.1	2%	0.021	32%	0.315	C	S	.	.	H	α-helix	trans	-61.7	-52.1	170.3	0	0	0	0	0	112.3	G444 L445 Y450 G451 F452	G444-G448 PolarHBondContact O-N 3.13Å; L445-G448 PolarHBondContact O-N 2.79Å; L445-G448 VanDerWaalsContact O-N 3.17Å; G448-Y450 PolarHBondContact O-N 3.24Å; G448-G451 PolarHBondContact O-N 2.87Å; G448-F452 PolarHBondContact O-N 3.16Å
449	I	92.6	Very high	87.5	Confident	58 Å²	58	64 Å²	64	30%	0.297	31%	0.313	S	S	.	.	H	α-helix	trans	-55.5	-51.8	175.9	-65	170.9	0	0	0	110.8	L445 I446 F453 G625 Y629	L445-I449 HydrophobicContact CD2-CD1 3.73Å; L445-I449 HydrophobicContact CD2-CG1 4.49Å; L445-I449 PolarHBondContact O-N 3.16Å; L445-I449 VanDerWaalsContact O-N 3.09Å; I446-I449 PolarHBondContact O-N 3.2Å; I449-F453 WeakPolarHBondContact O-CB 3.46Å; I449-F453 PolarHBondContact O-N 3.46Å; I449-F453 VanDerWaalsContact O-N 3.14Å; I449-G625 WeakPolarHBondContact CG1-O 3.5Å; I449-Y629 HydrophobicContact CG2-CD2 4.06Å
450	Y	92.7	Very high	86.9	Confident	138 Å²	138	62.5 Å²	62.5	54%	0.541	31%	0.309	S	S	.	.	H	α-helix	trans	-70.5	-34.8	-177	-179.3	-115.3	0	0	0	112.7	I446 G448 F453 L454	I446-Y450 WeakPolarHBondContact O-CB 3.28Å; I446-Y450 PolarHBondContact O-N 3.22Å; G448-Y450 PolarHBondContact O-N 3.24Å; Y450-F453 HydrophobicContact CD2-CD1 4.21Å; Y450-F453 HydrophobicContact CE2-CD1 4.31Å; Y450-L454 HydrophobicContact CD1-CD1 3.97Å; Y450-L454 HydrophobicContact CD1-CG 4.33Å; Y450-L454 HydrophobicContact CD2-CG 4.41Å; Y450-L454 HydrophobicContact CE1-CD1 3.39Å; Y450-L454 HydrophobicContact CE1-CG 3.92Å; Y450-L454 HydrophobicContact CE2-CD1 4.36Å; Y450-L454 HydrophobicContact CE2-CD2 4.14Å; Y450-L454 HydrophobicContact CE2-CG 3.98Å; Y450-L454 WeakPolarHBondContact O-CB 3.45Å; Y450-L454 WeakPolarHBondContact O-CG 3.34Å; Y450-L454 PolarHBondContact O-N 2.99Å
451	G	90.3	Very high	86.6	Confident	25 Å²	25	63.6 Å²	63.6	26%	0.258	32%	0.318	S	S	.	.	H	α-helix	trans	-62.8	-49	176.3	0	0	0	0	0	111.7	A447 G448 L454 I455	A447-G451 WeakPolarHBondContact O-CA 3.37Å; A447-G451 PolarHBondContact O-N 3.05Å; G448-G451 PolarHBondContact O-N 2.87Å; G451-L454 PolarHBondContact O-N 3.5Å; G451-I455 WeakPolarHBondContact O-CD1 3.27Å; G451-I455 VanDerWaalsContact O-CG1 3.25Å; G451-I455 WeakPolarHBondContact O-CG1 3.08Å; G451-I455 PolarHBondContact O-N 2.98Å
452	F	85.5	Confident	86	Confident	13 Å²	13	68.5 Å²	68.5	6%	0.057	35%	0.345	C	S	.	.	H	α-helix	trans	-65.3	-43.2	178.3	-149.2	-86.4	0	0	0	111.8	G448 L454 I455 E456 L536 I626 Y629 L630	G448-F452 PolarHBondContact O-N 3.16Å; F452-L454 VanDerWaalsContact C-N 3.35Å; F452-L454 PolarHBondContact O-N 3.29Å; F452-I455 PolarHBondContact O-N 3.44Å; F452-I455 VanDerWaalsContact O-N 3.17Å; F452-E456 PolarHBondContact O-N 2.95Å; F452-L536 HydrophobicContact CE2-CB 3.76Å; F452-L536 HydrophobicContact CZ-CB 4.13Å; F452-I626 HydrophobicContact CB-CG1 4.47Å; F452-I626 HydrophobicContact CD2-CG1 4.16Å; F452-I626 HydrophobicContact CD2-CG2 3.72Å; F452-I626 HydrophobicContact CE2-CG2 3.96Å; F452-I626 HydrophobicContact CG-CG2 4.4Å; F452-Y629 HydrophobicContact CB-CD1 4.15Å; F452-Y629 HydrophobicContact CB-CG 4.47Å; F452-Y629 AromaticContact CD1-CD1 3.6Å; F452-Y629 HydrophobicContact CD1-CD1 3.6Å; F452-Y629 AromaticContact CD1-CE1 3.84Å; F452-Y629 HydrophobicContact CD1-CE1 3.84Å; F452-Y629 HydrophobicContact CE1-CD1 4.45Å; F452-Y629 HydrophobicContact CG-CD1 4.23Å; F452-L630 HydrophobicContact CD1-CD2 4.36Å; F452-L630 HydrophobicContact CE1-CD2 3.6Å; F452-L630 HydrophobicContact CE1-CG 4.38Å; F452-L630 HydrophobicContact CZ-CD2 3.75Å; F452-L630 HydrophobicContact CZ-CG 4.46Å
453	F	87.8	Confident	84.7	Confident	77 Å²	77	67.1 Å²	67.1	34%	0.338	34%	0.344	S	S	.	.	H	α-helix	trans	-54.6	-47.1	170.6	170.7	-96.9	0	0	0	112.4	I449 Y450 I455 E456 R457 Y629	I449-F453 WeakPolarHBondContact O-CB 3.46Å; I449-F453 PolarHBondContact O-N 3.46Å; I449-F453 VanDerWaalsContact O-N 3.14Å; Y450-F453 HydrophobicContact CD2-CD1 4.21Å; Y450-F453 HydrophobicContact CE2-CD1 4.31Å; F453-I455 VanDerWaalsContact C-N 3.33Å; F453-I455 PolarHBondContact O-N 3.24Å; F453-E456 PolarHBondContact O-N 2.85Å; F453-R457 HydrophobicContact CD1-CG 4.32Å; F453-R457 HydrophobicContact CD2-CG 4.23Å; F453-R457 HydrophobicContact CE1-CG 3.95Å; F453-R457 HydrophobicContact CE2-CG 3.86Å; F453-R457 HydrophobicContact CG-CG 4.45Å; F453-R457 HydrophobicContact CZ-CG 3.71Å; F453-R457 WeakPolarHBondContact O-CB 3.41Å; F453-R457 WeakPolarHBondContact O-CG 3.32Å; F453-R457 PolarHBondContact O-N 3.21Å; F453-Y629 HydrophobicContact CB-CD2 4.46Å; F453-Y629 HydrophobicContact CB-CE2 3.74Å; F453-Y629 HydrophobicContact CD2-CE2 4.18Å; F453-Y629 HydrophobicContact CG-CE2 4.45Å
454	L	89.2	Confident	82.8	Confident	63 Å²	63	67.3 Å²	67.3	33%	0.33	35%	0.35	S	S	.	.	H	α-helix	trans	-61.8	-42.2	177.6	-82.3	-176	0	0	0	111.7	Y450 G451 F452 R457 I458	Y450-L454 HydrophobicContact CD1-CD1 3.97Å; Y450-L454 HydrophobicContact CD1-CG 4.33Å; Y450-L454 HydrophobicContact CD2-CG 4.41Å; Y450-L454 HydrophobicContact CE1-CD1 3.39Å; Y450-L454 HydrophobicContact CE1-CG 3.92Å; Y450-L454 HydrophobicContact CE2-CD1 4.36Å; Y450-L454 HydrophobicContact CE2-CD2 4.14Å; Y450-L454 HydrophobicContact CE2-CG 3.98Å; Y450-L454 WeakPolarHBondContact O-CB 3.45Å; Y450-L454 WeakPolarHBondContact O-CG 3.34Å; Y450-L454 PolarHBondContact O-N 2.99Å; G451-L454 PolarHBondContact O-N 3.5Å; F452-L454 VanDerWaalsContact C-N 3.35Å; F452-L454 PolarHBondContact O-N 3.29Å; L454-R457 PolarHBondContact O-N 2.85Å; L454-I458 WeakPolarHBondContact O-CB 3.29Å; L454-I458 WeakPolarHBondContact O-CD1 3.29Å; L454-I458 WeakPolarHBondContact O-CG1 3.48Å; L454-I458 PolarHBondContact O-N 3.2Å
455	I	83.8	Confident	80.5	Confident	63 Å²	63	72.4 Å²	72.4	32%	0.323	39%	0.386	S	S	.	.	H	α-helix	trans	-62.3	-49.6	179.6	-68	163.1	0	0	0	110.5	G451 F452 F453 R457 I458 F459 L536	G451-I455 WeakPolarHBondContact O-CD1 3.27Å; G451-I455 VanDerWaalsContact O-CG1 3.25Å; G451-I455 WeakPolarHBondContact O-CG1 3.08Å; G451-I455 PolarHBondContact O-N 2.98Å; F452-I455 PolarHBondContact O-N 3.44Å; F452-I455 VanDerWaalsContact O-N 3.17Å; F453-I455 VanDerWaalsContact C-N 3.33Å; F453-I455 PolarHBondContact O-N 3.24Å; I455-R457 VanDerWaalsContact C-N 3.32Å; I455-R457 PolarHBondContact O-N 3.28Å; I455-I458 PolarHBondContact O-N 3.28Å; I455-F459 HydrophobicContact CG2-CD2 3.56Å; I455-F459 HydrophobicContact CG2-CE2 3.46Å; I455-F459 VanDerWaalsContact CG2-CE2 3.46Å; I455-F459 VanDerWaalsContact O-CD2 3.27Å; I455-F459 WeakPolarHBondContact O-CD2 3.46Å; I455-F459 PolarHBondContact O-N 3.45Å; I455-L536 HydrophobicContact CG2-CD1 3.53Å
456	E	79.3	Confident	77.7	Confident	42 Å²	42	80 Å²	80	20%	0.196	42%	0.42	C	S	.	.	H	α-helix	trans	-55.5	-45	175.1	-173.8	-152.4	121.3	0	0	111.7	F452 F453 S460 Y629	F452-E456 PolarHBondContact O-N 2.95Å; F453-E456 PolarHBondContact O-N 2.85Å; E456-S460 WeakPolarHBondContact O-CB 3.39Å; E456-S460 PolarHBondContact O-N 3.44Å; E456-S460 PolarHBondContact O-OG 2.96Å; E456-Y629 WeakPolarHBondContact OE2-CE1 3.2Å; E456-Y629 PolarHBondContact OE2-OH 2.52Å
457	R	83.3	Confident	74.7	Confident	105 Å²	105	78.7 Å²	78.7	40%	0.396	43%	0.429	S	S	.	.	H	α-helix	trans	-66.9	-42.7	178.9	-65.4	-69.4	145.8	-160.3	-13.2	112	F453 L454 I455 S460 F461	F453-R457 HydrophobicContact CD1-CG 4.32Å; F453-R457 HydrophobicContact CD2-CG 4.23Å; F453-R457 HydrophobicContact CE1-CG 3.95Å; F453-R457 HydrophobicContact CE2-CG 3.86Å; F453-R457 HydrophobicContact CG-CG 4.45Å; F453-R457 HydrophobicContact CZ-CG 3.71Å; F453-R457 WeakPolarHBondContact O-CB 3.41Å; F453-R457 WeakPolarHBondContact O-CG 3.32Å; F453-R457 PolarHBondContact O-N 3.21Å; L454-R457 PolarHBondContact O-N 2.85Å; I455-R457 VanDerWaalsContact C-N 3.32Å; I455-R457 PolarHBondContact O-N 3.28Å; R457-S460 WeakPolarHBondContact O-CB 3.39Å; R457-S460 PolarHBondContact O-N 3.23Å; R457-F461 WeakPolarHBondContact O-CD2 3.47Å; R457-F461 PolarHBondContact O-N 3.5Å
458	I	84.8	Confident	72.1	Confident	87 Å²	87	86 Å²	86	45%	0.446	45%	0.453	S	S	.	.	H	α-helix	trans	-62	-47.5	177.5	-72.1	165	0	0	0	109.7	L454 I455 S460 F461 L462	L454-I458 WeakPolarHBondContact O-CB 3.29Å; L454-I458 WeakPolarHBondContact O-CD1 3.29Å; L454-I458 WeakPolarHBondContact O-CG1 3.48Å; L454-I458 PolarHBondContact O-N 3.2Å; I455-I458 PolarHBondContact O-N 3.28Å; I458-S460 VanDerWaalsContact C-N 3.33Å; I458-S460 PolarHBondContact O-N 3.25Å; I458-F461 PolarHBondContact O-N 3.47Å; I458-F461 VanDerWaalsContact O-N 3.11Å; I458-L462 HydrophobicContact CG2-CD1 3.95Å; I458-L462 HydrophobicContact CG2-CD2 4.38Å; I458-L462 WeakPolarHBondContact O-CB 3.47Å; I458-L462 WeakPolarHBondContact O-CD1 3.42Å; I458-L462 PolarHBondContact O-N 2.72Å
459	F	75.4	Confident	69	Low	90 Å²	90	88.9 Å²	88.9	40%	0.395	48%	0.482	S	S	.	.	H	α-helix	trans	-62.4	-38.7	175.5	-78.8	-62.8	0	0	0	112.7	I455 F461 L462 A463 V532 L536	I455-F459 HydrophobicContact CG2-CD2 3.56Å; I455-F459 HydrophobicContact CG2-CE2 3.46Å; I455-F459 VanDerWaalsContact CG2-CE2 3.46Å; I455-F459 VanDerWaalsContact O-CD2 3.27Å; I455-F459 WeakPolarHBondContact O-CD2 3.46Å; I455-F459 PolarHBondContact O-N 3.45Å; F459-F461 VanDerWaalsContact C-N 3.25Å; F459-F461 PolarHBondContact O-N 3.4Å; F459-L462 PolarHBondContact O-N 3.12Å; F459-A463 WeakPolarHBondContact O-CB 3.48Å; F459-A463 PolarHBondContact O-N 2.93Å; F459-V532 HydrophobicContact CD1-CG1 4.32Å; F459-V532 HydrophobicContact CD2-CG1 3.69Å; F459-V532 HydrophobicContact CE1-CG1 4.07Å; F459-V532 HydrophobicContact CE2-CG1 3.38Å; F459-V532 HydrophobicContact CG-CG1 4.16Å; F459-V532 HydrophobicContact CZ-CG1 3.6Å; F459-L536 HydrophobicContact CE2-CD1 4.5Å
460	S	71.9	Confident	66.1	Low	54 Å²	54	94.9 Å²	94.9	38%	0.378	51%	0.509	S	S	.	.	H	α-helix	trans	-60.8	-30.5	173.4	-61.2	0	0	0	0	113.5	E456 R457 I458	E456-S460 WeakPolarHBondContact O-CB 3.39Å; E456-S460 PolarHBondContact O-N 3.44Å; E456-S460 PolarHBondContact O-OG 2.96Å; R457-S460 WeakPolarHBondContact O-CB 3.39Å; R457-S460 PolarHBondContact O-N 3.23Å; I458-S460 VanDerWaalsContact C-N 3.33Å; I458-S460 PolarHBondContact O-N 3.25Å
461	F	76.9	Confident	63	Low	173 Å²	173	94.2 Å²	94.2	76%	0.759	52%	0.523	S	S	*	.	H	α-helix	trans	-85.6	-33.5	174.6	-74.7	-61.8	0	0	0	113.4	R457 I458 F459	R457-F461 WeakPolarHBondContact O-CD2 3.47Å; R457-F461 PolarHBondContact O-N 3.5Å; I458-F461 PolarHBondContact O-N 3.47Å; I458-F461 VanDerWaalsContact O-N 3.11Å; F459-F461 VanDerWaalsContact C-N 3.25Å; F459-F461 PolarHBondContact O-N 3.4Å
462	L	71.2	Confident	60	Low	120 Å²	120	98 Å²	98	63%	0.628	55%	0.546	S	S	*	.	H	α-helix	trans	-77.1	-25.5	-178.2	-97.6	65.2	0	0	0	113.2	I458 F459 P464	I458-L462 HydrophobicContact CG2-CD1 3.95Å; I458-L462 HydrophobicContact CG2-CD2 4.38Å; I458-L462 WeakPolarHBondContact O-CB 3.47Å; I458-L462 WeakPolarHBondContact O-CD1 3.42Å; I458-L462 PolarHBondContact O-N 2.72Å; F459-L462 PolarHBondContact O-N 3.12Å; L462-P464 WeakPolarHBondContact O-CD 3.47Å
463	A	62.9	Low	57.3	Low	42 Å²	42	104.7 Å²	104.7	35%	0.347	58%	0.582	S	S	.	*	S	Bend	trans	-78.7	102.4	175.5	0	0	0	0	0	110.9	F459 S465 V525	F459-A463 WeakPolarHBondContact O-CB 3.48Å; F459-A463 PolarHBondContact O-N 2.93Å; A463-S465 PolarHBondContact O-N 2.94Å; A463-V525 HydrophobicContact CB-CG1 3.66Å
464	P	49	Very low	54.4	Low	91 Å²	91	109.3 Å²	109.3	59%	0.591	61%	0.609	S	S	*	*			trans	-79.8	129.2	-170.8	-8.3	28	0	0	0	109.9	L462 H466	L462-P464 WeakPolarHBondContact O-CD 3.47Å; P464-H466 VanDerWaalsContact C-N 3.32Å; P464-H466 PolarHBondContact O-N 3.24Å
465	S	42.8	Very low	51.8	Low	111 Å²	111	111 Å²	111	78%	0.776	62%	0.624	S	S	*	*			trans	-67.8	92.9	164.4	-174.2	0	0	0	0	109.4	A463	A463-S465 PolarHBondContact O-N 2.94Å
466	H	35.2	Very low	49.1	Very low	185 Å²	185	116.2 Å²	116.2	86%	0.856	65%	0.652	S	S	*	*			trans	-115	86.2	169.8	-87.4	11.8	0	0	0	109.4	P464	P464-H466 VanDerWaalsContact C-N 3.32Å; P464-H466 PolarHBondContact O-N 3.24Å
467	G	30.6	Very low	46.5	Very low	61 Å²	61	120.5 Å²	120.5	63%	0.629	68%	0.676	S	S	*	*			trans	-166.2	35.2	-174.1	0	0	0	0	0	113.9	G469	G467-G469 PolarHBondContact O-N 3.5Å
468	H	36.7	Very low	43.9	Very low	207 Å²	207	123.9 Å²	123.9	96%	0.958	70%	0.701	S	S	*	*			trans	-72.9	71.1	162.6	-81.4	-56	0	0	0	109.9
469	G	27.7	Very low	41	Very low	61 Å²	61	125 Å²	125	63%	0.629	71%	0.708	S	S	*	*			trans	-110.7	131.7	164.3	0	0	0	0	0	108.5	G467 C471	G467-G469 PolarHBondContact O-N 3.5Å; G469-C471 PolarHBondContact O-N 3.06Å
470	H	30.5	Very low	38.5	Very low	184 Å²	184	127 Å²	127	85%	0.852	73%	0.731	S	S	*	*			trans	-57.8	131.2	-171.3	-71.5	-93.9	0	0	0	112.8	S472	H470-S472 PolarHBondContact O-N 2.99Å
471	C	27.2	Very low	36.3	Very low	124 Å²	124	131.7 Å²	131.7	84%	0.838	75%	0.752	S	S	*	*			trans	-61.7	120	170.1	-164.8	0	0	0	0	108.7	G469	G469-C471 PolarHBondContact O-N 3.06Å
472	S	28.2	Very low	33.8	Very low	106 Å²	106	127 Å²	127	74%	0.741	75%	0.753	S	S	*	*			trans	-120.7	121.5	169.2	-55.5	0	0	0	0	106.9	H470	H470-S472 PolarHBondContact O-N 2.99Å
473	D	29.4	Very low	31.5	Very low	153 Å²	153	130.8 Å²	130.8	82%	0.818	77%	0.767	S	S	*	*			trans	-62.9	139.3	-175.2	-61.3	-69.4	0	0	0	112.9
474	L	26.5	Very low	29.7	Very low	173 Å²	173	133.7 Å²	133.7	91%	0.906	79%	0.785	S	S	*	*			trans	-147.7	140.2	146.8	-104.3	134.3	0	0	0	109.1
475	P	33.8	Very low	28.7	Very low	98 Å²	98	138.5 Å²	138.5	64%	0.636	80%	0.8	S	S	*	*			trans	-101.5	154.3	-151.2	37.8	-33.4	0	0	0	113.7
476	L	27.8	Very low	28	Very low	174 Å²	174	142.5 Å²	142.5	91%	0.911	80%	0.798	S	S	*	*			trans	-126.8	85.6	151.7	-101	166.5	0	0	0	108.7	L478	L476-L478 PolarHBondContact O-N 2.72Å
477	D	25	Very low	27.5	Very low	131 Å²	131	139.9 Å²	139.9	70%	0.701	80%	0.8	S	S	*	*			trans	-63.4	116.6	168.9	-91.4	-56.2	0	0	0	110.6
478	L	28.7	Very low	27.3	Very low	176 Å²	176	144 Å²	144	92%	0.921	80%	0.801	S	S	*	*			trans	-138.4	70	147.4	-104.4	141.9	0	0	0	107.6	L476 C480	L476-L478 PolarHBondContact O-N 2.72Å; L478-C480 PolarHBondContact O-N 3.32Å
479	N	23.6	Very low	26.9	Very low	112 Å²	112	139.8 Å²	139.8	60%	0.599	79%	0.794	S	S	*	*			trans	-67.5	121.2	177.2	178.3	11.7	0	0	0	111.4	N481	N479-N481 PolarHBondContact OD1-N 2.76Å
480	C	23.7	Very low	26.9	Very low	130 Å²	130	145.3 Å²	145.3	88%	0.878	81%	0.807	S	S	*	*			trans	-143.6	79.2	146.2	-96.3	0	0	0	0	110.1	L478	L478-C480 PolarHBondContact O-N 3.32Å
481	N	24.4	Very low	26.7	Very low	154 Å²	154	141 Å²	141	82%	0.824	80%	0.798	S	S	*	*			trans	23.2	125.6	149.4	-98.4	-13.2	0	0	0	119.8	N479	N479-N481 PolarHBondContact OD1-N 2.76Å
482	G	24	Very low	26.8	Very low	74 Å²	74	141.7 Å²	141.7	76%	0.763	80%	0.799	S	S	*	*			trans	142.8	84	145	0	0	0	0	0	117.7
483	Q	24.1	Very low	26.9	Very low	199 Å²	199	144.5 Å²	144.5	93%	0.93	80%	0.804	S	S	*	*			trans	58.1	93.4	160.3	-78.6	175.5	-17.9	0	0	118.9
484	S	25.6	Very low	26.7	Very low	104 Å²	104	146.6 Å²	146.6	73%	0.727	81%	0.809	S	S	*	*			trans	-88.4	112.3	155.5	-177.8	0	0	0	0	110.5	R486	S484-R486 PolarHBondContact O-N 2.66Å
485	Q	26.4	Very low	26.6	Very low	192 Å²	192	146.9 Å²	146.9	90%	0.897	81%	0.81	S	S	*	*			trans	-85.9	95.7	159.9	-83	-160.8	-3.7	0	0	110.4	S487	Q485-S487 PolarHBondContact O-N 3.5Å
486	R	27.8	Very low	26	Very low	195 Å²	195	145.7 Å²	145.7	74%	0.736	82%	0.816	S	S	*	*			trans	-15.1	110.5	156.2	-170.5	-177.3	-166.2	160.1	4.7	115.8	S484 K488	S484-R486 PolarHBondContact O-N 2.66Å; R486-K488 HydrophobicContact CG-CG 4.17Å; R486-K488 PolarHBondContact O-N 3.15Å
487	S	25.9	Very low	25.8	Very low	129 Å²	129	142.9 Å²	142.9	90%	0.902	81%	0.811	S	S	*	*			trans	-65	96.2	157.3	-67.4	0	0	0	0	109.9	Q485	Q485-S487 PolarHBondContact O-N 3.5Å
488	K	27.3	Very low	25.9	Very low	149 Å²	149	141.7 Å²	141.7	65%	0.648	81%	0.808	S	S	*	*			trans	-85.1	132.6	157.4	-83.4	-177.6	173.2	-177.6	0	108	R486 I490	R486-K488 HydrophobicContact CG-CG 4.17Å; R486-K488 PolarHBondContact O-N 3.15Å; K488-I490 PolarHBondContact O-N 2.88Å
489	S	28.3	Very low	25.9	Very low	117 Å²	117	141.5 Å²	141.5	82%	0.818	80%	0.802	S	S	*	*			trans	-52.4	130.2	166.8	-50.2	0	0	0	0	110.2	S491	S489-S491 PolarHBondContact O-N 2.85Å
490	I	27.4	Very low	26	Very low	177 Å²	177	142.6 Å²	142.6	91%	0.908	81%	0.808	S	S	*	*			trans	-82.2	100.4	176	-64	175.7	0	0	0	108.7	K488	K488-I490 PolarHBondContact O-N 2.88Å
491	S	25.8	Very low	26.2	Very low	95 Å²	95	141.5 Å²	141.5	66%	0.664	80%	0.797	S	S	*	*			trans	-143	127.5	149.7	44.8	0	0	0	0	109.7	S489	S489-S491 PolarHBondContact O-N 2.85Å
492	T	28.9	Very low	26.2	Very low	137 Å²	137	143 Å²	143	84%	0.84	80%	0.799	S	S	*	*			trans	59.4	103.7	167.4	43.7	0	0	0	0	119.8
493	I	30.4	Very low	26.2	Very low	165 Å²	165	142.7 Å²	142.7	85%	0.846	80%	0.796	S	S	*	*			trans	-10.9	125	147.1	-54	161.2	0	0	0	116.5
494	Q	25.3	Very low	26.2	Very low	198 Å²	198	139.5 Å²	139.5	93%	0.925	80%	0.796	S	S	*	*				-174.9	175	128	-102.2	177.8	9.5	0	0	113.1
495	L	23.6	Very low	26.2	Very low	178 Å²	178	143.1 Å²	143.1	93%	0.932	80%	0.801	S	S	*	*			trans	-133.6	144.1	-147.8	-178.9	73.9	0	0	0	114
496	G	23	Very low	26.2	Very low	74 Å²	74	140.5 Å²	140.5	76%	0.763	79%	0.792	S	S	*	*			trans	86.9	155.8	171.3	0	0	0	0	0	115.3
497	S	22.6	Very low	26.1	Very low	115 Å²	115	141.5 Å²	141.5	80%	0.804	80%	0.797	S	S	*	*			cis	-153.8	168.6	-2.2	-172.8	0	0	0	0	111.2
498	V	26.7	Very low	26.4	Very low	106 Å²	106	141 Å²	141	64%	0.642	79%	0.791	S	S	*	*			trans	-54.9	143	175.9	-156.7	0	0	0	0	112.6
499	E	28.6	Very low	26.2	Very low	172 Å²	172	143 Å²	143	80%	0.804	80%	0.799	S	S	*	*				157.5	158.3	110.4	-85	149.3	-126.3	0	0	109.4
500	D	25.4	Very low	26.3	Very low	135 Å²	135	149 Å²	149	72%	0.722	80%	0.804	S	S	*	*			cis	-169.7	160.6	-39.1	-122.7	38.7	0	0	0	113.2
501	V	29.1	Very low	26.2	Very low	106 Å²	106	145.8 Å²	145.8	64%	0.642	79%	0.793	S	S	*	*			trans	81.1	137.2	145.7	171.2	0	0	0	0	124.4
502	E	24.9	Very low	26.3	Very low	187 Å²	187	149 Å²	149	87%	0.874	80%	0.803	S	S	*	*			trans	55	148.7	160.6	-76.2	156.7	-175.3	0	0	121.8
503	G	22.8	Very low	26.3	Very low	66 Å²	66	148.4 Å²	148.4	68%	0.68	80%	0.799	S	S	*	*			cis	128.9	111.4	-3.1	0	0	0	0	0	114
504	S	25.4	Very low	26.1	Very low	133 Å²	133	148.8 Å²	148.8	93%	0.93	80%	0.797	S	S	*	*			trans	-176.8	155	162.2	-84.6	0	0	0	0	113.7
505	E	23.8	Very low	26.3	Very low	179 Å²	179	145 Å²	145	84%	0.836	79%	0.792	S	S	*	*			trans	-119.9	-176.8	-167.5	-57	-175.9	129	0	0	115.5
506	I	27.1	Very low	26.5	Very low	138 Å²	138	142.9 Å²	142.9	71%	0.708	79%	0.787	S	S	*	*			trans	105.9	95.1	148.5	-64.5	153.9	0	0	0	120
507	Y	25.1	Very low	27.2	Very low	215 Å²	215	145.3 Å²	145.3	84%	0.843	79%	0.789	S	S	*	*				67.1	162.3	126.3	-81	-63	0	0	0	123.1
508	P	33.7	Very low	27.7	Very low	119 Å²	119	143.5 Å²	143.5	77%	0.773	79%	0.789	S	S	*	*				-121.1	169.9	-125.2	43	-29	0	0	0	115.2
509	K	23.5	Very low	27.9	Very low	190 Å²	190	147.2 Å²	147.2	83%	0.826	80%	0.799	S	S	*	*			trans	-132.7	115.9	171.2	-162.5	170.9	-174.9	177.4	0	112.3
510	R	28.6	Very low	28.3	Very low	243 Å²	243	149.1 Å²	149.1	92%	0.917	81%	0.805	S	S	*	*			trans	-73.3	130.4	163.5	-88.9	-177.1	171.4	177.5	-2.6	109.5
511	T	25.7	Very low	29.4	Very low	111 Å²	111	151.3 Å²	151.3	68%	0.681	81%	0.811	S	S	*	*			trans	-139.7	122.5	154.4	37.5	0	0	0	0	108.6
512	N	28.8	Very low	30.8	Very low	163 Å²	163	149.4 Å²	149.4	87%	0.872	81%	0.812	S	S	*	*			trans	-69	131.7	165.5	-62.4	-27.9	0	0	0	107.8
513	T	27.9	Very low	32.8	Very low	123 Å²	123	143.8 Å²	143.8	76%	0.755	79%	0.791	S	S	*	*			trans	-139.7	137.6	162.2	-41.2	0	0	0	0	109.8
514	E	26.7	Very low	35.5	Very low	174 Å²	174	142.8 Å²	142.8	81%	0.813	77%	0.772	S	S	*	*			trans	-59.9	151.7	-166.7	-64.3	148	134	0	0	115.1	T516	E514-T516 PolarHBondContact O-N 3.06Å
515	S	29.3	Very low	37.9	Very low	118 Å²	118	140.4 Å²	140.4	83%	0.825	75%	0.752	S	S	*	*			trans	-59.3	121.1	167.8	51.6	0	0	0	0	111.8
516	T	27.3	Very low	40.2	Very low	134 Å²	134	136.2 Å²	136.2	82%	0.822	74%	0.735	S	S	*	*			trans	-114.8	117.6	163.8	-54.6	0	0	0	0	109.4	E514	E514-T516 PolarHBondContact O-N 3.06Å
517	P	37.6	Very low	42.7	Very low	124 Å²	124	129.7 Å²	129.7	81%	0.805	70%	0.701	S	S	*	*			trans	-86.3	130.6	177.2	32.8	-31	0	0	0	110.9
518	G	34.6	Very low	45.5	Very low	77 Å²	77	122.8 Å²	122.8	79%	0.794	68%	0.681	S	S	*	*			trans	129.1	53.1	164.6	0	0	0	0	0	117.8
519	Q	31.1	Very low	47.7	Very low	184 Å²	184	120.4 Å²	120.4	86%	0.86	66%	0.661	S	S	*	*			trans	-109	113.2	148.5	-92.4	-175.3	-18.3	0	0	109	Q521	Q519-Q521 PolarHBondContact O-N 3.5Å
520	K	36.7	Very low	50.4	Low	213 Å²	213	112 Å²	112	93%	0.926	63%	0.625	S	S	*	*			trans	-71.3	95.7	165	-69.1	-177.3	178.9	-178.1	0	107.1	G522	K520-G522 PolarHBondContact O-N 3.09Å
521	Q	47	Very low	53.1	Low	181 Å²	181	101.2 Å²	101.2	85%	0.846	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-58	128.1	165.9	-74.8	171.4	-27.5	0	0	108	Q519	Q519-Q521 PolarHBondContact O-N 3.5Å
522	G	58.5	Low	56	Low	65 Å²	65	97.9 Å²	97.9	67%	0.67	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-64.6	156.6	176.1	0	0	0	0	0	110.9	K520	K520-G522 PolarHBondContact O-N 3.09Å
523	V	68.8	Low	58.6	Low	70 Å²	70	90.8 Å²	90.8	42%	0.424	53%	0.531	S	S	.	.	P	Polyproline II helix	trans	-59.8	131.7	174.2	-178.7	0	0	0	0	108.6	A527 V528 L583	V523-A527 HydrophobicContact CG1-CB 3.9Å; V523-V528 HydrophobicContact CB-CG2 4.06Å; V523-V528 HydrophobicContact CG1-CG2 3.72Å; V523-L583 HydrophobicContact CG1-CD1 4.43Å; V523-L583 HydrophobicContact CG1-CD2 4.36Å
524	P	78.1	Confident	61.4	Low	45 Å²	45	85.1 Å²	85.1	29%	0.292	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-56.3	140.5	178.3	-20.6	27.8	0	0	0	111.6	L526 A527 V528 S581	P524-L526 PolarHBondContact O-N 3.3Å; P524-A527 HydrophobicContact CB-CB 4.23Å; P524-A527 HydrophobicContact CG-CB 4.39Å; P524-A527 WeakPolarHBondContact O-CB 3.37Å; P524-A527 PolarHBondContact O-N 3.21Å; P524-V528 PolarHBondContact O-N 3.47Å; P524-S581 WeakPolarHBondContact CG-O 3.4Å
525	V	77	Confident	64.4	Low	83 Å²	83	78.2 Å²	78.2	50%	0.503	47%	0.467	S	S	.	.	H	α-helix	trans	-55.4	-39.6	178.9	172.6	0	0	0	0	112.2	A463 A527 V528 M529	A463-V525 HydrophobicContact CB-CG1 3.66Å; V525-A527 VanDerWaalsContact C-N 3.34Å; V525-A527 PolarHBondContact O-N 3.2Å; V525-V528 PolarHBondContact O-N 3.18Å; V525-M529 PolarHBondContact O-N 3.21Å
526	L	72.4	Confident	67.2	Low	91 Å²	91	75.4 Å²	75.4	48%	0.476	44%	0.442	S	S	.	.	H	α-helix	trans	-58	-44.9	175	179.5	61.6	0	0	0	112.2	P524 M529 V530 V577	P524-L526 PolarHBondContact O-N 3.3Å; L526-M529 HydrophobicContact CD1-CE 4.45Å; L526-M529 WeakPolarHBondContact O-CB 3.34Å; L526-M529 PolarHBondContact O-N 3.4Å; L526-V530 WeakPolarHBondContact O-CG2 3.42Å; L526-V530 PolarHBondContact O-N 3.47Å; L526-V577 HydrophobicContact CD2-CG1 4.49Å
527	A	79.4	Confident	70.1	Confident	0 Å²	0	69 Å²	69	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-66.7	-38.2	178.6	0	0	0	0	0	112.4	V523 P524 V525 M529 V530 I531 L578 L583	V523-A527 HydrophobicContact CG1-CB 3.9Å; P524-A527 HydrophobicContact CB-CB 4.23Å; P524-A527 HydrophobicContact CG-CB 4.39Å; P524-A527 WeakPolarHBondContact O-CB 3.37Å; P524-A527 PolarHBondContact O-N 3.21Å; V525-A527 VanDerWaalsContact C-N 3.34Å; V525-A527 PolarHBondContact O-N 3.2Å; A527-M529 VanDerWaalsContact C-N 3.32Å; A527-V530 PolarHBondContact O-N 3.11Å; A527-I531 VanDerWaalsContact O-CD1 3.26Å; A527-I531 WeakPolarHBondContact O-CD1 3.47Å; A527-I531 VanDerWaalsContact O-CG1 3.24Å; A527-I531 WeakPolarHBondContact O-CG1 3.49Å; A527-I531 PolarHBondContact O-N 3.42Å; A527-L578 HydrophobicContact CB-CD2 3.5Å; A527-L578 VanDerWaalsContact CB-CD2 3.5Å; A527-L583 HydrophobicContact CB-CD1 3.39Å
528	V	82.7	Confident	72.7	Confident	70 Å²	70	63.1 Å²	63.1	42%	0.424	36%	0.364	S	S	.	.	H	α-helix	trans	-62.9	-40.6	173.5	-179.9	0	0	0	0	111	V523 P524 V525 V532	V523-V528 HydrophobicContact CB-CG2 4.06Å; V523-V528 HydrophobicContact CG1-CG2 3.72Å; P524-V528 PolarHBondContact O-N 3.47Å; V525-V528 PolarHBondContact O-N 3.18Å; V528-V532 HydrophobicContact CG1-CG2 4.39Å; V528-V532 WeakPolarHBondContact O-CB 3.22Å; V528-V532 VanDerWaalsContact O-CG2 3.27Å; V528-V532 WeakPolarHBondContact O-CG2 3.3Å; V528-V532 PolarHBondContact O-N 3.31Å
529	M	79.3	Confident	75.5	Confident	69 Å²	69	62.9 Å²	62.9	34%	0.34	34%	0.342	S	S	.	.	H	α-helix	trans	-62.4	-47.7	177.9	-166.4	-175	87.3	0	0	111.8	V525 L526 A527 V532 G533	V525-M529 PolarHBondContact O-N 3.21Å; L526-M529 HydrophobicContact CD1-CE 4.45Å; L526-M529 WeakPolarHBondContact O-CB 3.34Å; L526-M529 PolarHBondContact O-N 3.4Å; A527-M529 VanDerWaalsContact C-N 3.32Å; M529-V532 PolarHBondContact O-N 2.99Å; M529-G533 PolarHBondContact O-N 2.87Å
530	V	81.5	Confident	78.3	Confident	14 Å²	14	54.3 Å²	54.3	9%	0.085	30%	0.303	C	S	.	.	H	α-helix	trans	-58	-52.9	176.8	171.2	0	0	0	0	110.9	L526 A527 V532 G533 D534 D574 V577 L578	L526-V530 WeakPolarHBondContact O-CG2 3.42Å; L526-V530 PolarHBondContact O-N 3.47Å; A527-V530 PolarHBondContact O-N 3.11Å; V530-V532 VanDerWaalsContact C-N 3.26Å; V530-V532 PolarHBondContact O-N 2.93Å; V530-G533 PolarHBondContact O-N 3.49Å; V530-G533 VanDerWaalsContact O-N 3.13Å; V530-D534 WeakPolarHBondContact O-CB 3.49Å; V530-D534 PolarHBondContact O-N 2.9Å; V530-D574 HydrophobicContact CG1-CB 3.86Å; V530-V577 HydrophobicContact CG2-CG1 3.89Å; V530-L578 HydrophobicContact CB-CD2 4.49Å; V530-L578 HydrophobicContact CG1-CD2 4.44Å
531	I	85.8	Confident	80.9	Confident	17 Å²	17	44.3 Å²	44.3	9%	0.087	26%	0.259	C	S	.	.	H	α-helix	trans	-59.7	-36.9	-178.6	-66.8	158.3	0	0	0	111.8	A527 S535 L578 M591 S595	A527-I531 VanDerWaalsContact O-CD1 3.26Å; A527-I531 WeakPolarHBondContact O-CD1 3.47Å; A527-I531 VanDerWaalsContact O-CG1 3.24Å; A527-I531 WeakPolarHBondContact O-CG1 3.49Å; A527-I531 PolarHBondContact O-N 3.42Å; I531-S535 VanDerWaalsContact O-CB 3.23Å; I531-S535 WeakPolarHBondContact O-CB 3.45Å; I531-S535 PolarHBondContact O-N 3.18Å; I531-S535 PolarHBondContact O-OG 2.92Å; I531-L578 HydrophobicContact CD1-CD1 4.25Å; I531-L578 HydrophobicContact CD1-CD2 3.93Å; I531-L578 HydrophobicContact CG1-CD1 4.13Å; I531-L578 HydrophobicContact CG1-CD2 3.97Å; I531-M591 HydrophobicContact CD1-CB 3.6Å; I531-M591 HydrophobicContact CD1-CE 3.82Å; I531-M591 HydrophobicContact CD1-CG 3.86Å; I531-M591 HydrophobicContact CG1-CB 4.11Å; I531-M591 HydrophobicContact CG2-CE 4.19Å; I531-S595 PolarHBondContact O-OG 3.3Å
532	V	85.2	Confident	83.1	Confident	40 Å²	40	35.8 Å²	35.8	24%	0.242	22%	0.219	C	C	.	.	H	α-helix	trans	-72.8	-38.1	178.3	170	0	0	0	0	112	F459 V528 M529 V530 L536	F459-V532 HydrophobicContact CD1-CG1 4.32Å; F459-V532 HydrophobicContact CD2-CG1 3.69Å; F459-V532 HydrophobicContact CE1-CG1 4.07Å; F459-V532 HydrophobicContact CE2-CG1 3.38Å; F459-V532 HydrophobicContact CG-CG1 4.16Å; F459-V532 HydrophobicContact CZ-CG1 3.6Å; V528-V532 HydrophobicContact CG1-CG2 4.39Å; V528-V532 WeakPolarHBondContact O-CB 3.22Å; V528-V532 VanDerWaalsContact O-CG2 3.27Å; V528-V532 WeakPolarHBondContact O-CG2 3.3Å; V528-V532 PolarHBondContact O-N 3.31Å; M529-V532 PolarHBondContact O-N 2.99Å; V530-V532 VanDerWaalsContact C-N 3.26Å; V530-V532 PolarHBondContact O-N 2.93Å; V532-L536 HydrophobicContact CG1-CD1 4.34Å; V532-L536 WeakPolarHBondContact O-CD1 3.4Å; V532-L536 WeakPolarHBondContact O-CG 3.45Å; V532-L536 PolarHBondContact O-N 3.48Å
533	G	83.2	Confident	84.8	Confident	15 Å²	15	34 Å²	34	16%	0.155	19%	0.194	C	C	.	.	H	α-helix	trans	-63.5	-50.8	174.1	0	0	0	0	0	111.6	M529 V530 S535 L536 H537	M529-G533 PolarHBondContact O-N 2.87Å; V530-G533 PolarHBondContact O-N 3.49Å; V530-G533 VanDerWaalsContact O-N 3.13Å; G533-S535 PolarHBondContact O-N 3.36Å; G533-L536 WeakPolarHBondContact O-CB 3.06Å; G533-L536 PolarHBondContact O-N 3.47Å; G533-H537 PolarHBondContact O-N 2.94Å
534	D	87	Confident	85.8	Confident	3 Å²	3	30.6 Å²	30.6	2%	0.016	17%	0.174	C	C	.	.	H	α-helix	trans	-56.9	-44	174.8	173.1	37.1	0	0	0	112.1	V530 L536 H537 N538 S595	V530-D534 WeakPolarHBondContact O-CB 3.49Å; V530-D534 PolarHBondContact O-N 2.9Å; D534-L536 PolarHBondContact O-N 3.29Å; D534-L536 VanDerWaalsContact O-N 3.16Å; D534-H537 WeakPolarHBondContact O-CB 3.3Å; D534-H537 PolarHBondContact O-N 2.72Å; D534-H537 VanDerWaalsContact O-N 3.12Å; D534-N538 WeakPolarHBondContact O-CB 3.27Å; D534-N538 PolarHBondContact O-N 2.96Å; D534-N538 PolarHBondContact OD1-ND2 3.02Å; D534-S595 WeakPolarHBondContact OD2-CB 3.35Å; D534-S595 PolarHBondContact OD2-OG 3.25Å
535	S	90.3	Very high	86.5	Confident	30 Å²	30	28.5 Å²	28.5	21%	0.21	16%	0.16	C	C	.	.	H	α-helix	trans	-63.4	-22.9	175.7	-75.9	0	0	0	0	114	I531 G533 F539 S595 T598	I531-S535 VanDerWaalsContact O-CB 3.23Å; I531-S535 WeakPolarHBondContact O-CB 3.45Å; I531-S535 PolarHBondContact O-N 3.18Å; I531-S535 PolarHBondContact O-OG 2.92Å; G533-S535 PolarHBondContact O-N 3.36Å; S535-F539 WeakPolarHBondContact O-CB 3.46Å; S535-F539 PolarHBondContact O-N 2.96Å; S535-S595 VanDerWaalsContact CA-OG 3.26Å; S535-S595 WeakPolarHBondContact CA-OG 3.31Å; S535-S595 PolarHBondContact N-OG 3.19Å; S535-S595 WeakPolarHBondContact OG-CA 3.41Å; S535-S595 WeakPolarHBondContact OG-CB 3.39Å; S535-S595 PolarHBondContact OG-OG 3.18Å; S535-T598 PolarHBondContact O-OG1 3.35Å
536	L	87.9	Confident	87.2	Confident	58 Å²	58	24.6 Å²	24.6	30%	0.304	14%	0.136	S	C	.	.	H	α-helix	trans	-88.2	-32.6	174.7	-68.6	165.9	0	0	0	111.8	F452 I455 F459 V532 G533 D534 A540	F452-L536 HydrophobicContact CE2-CB 3.76Å; F452-L536 HydrophobicContact CZ-CB 4.13Å; I455-L536 HydrophobicContact CG2-CD1 3.53Å; F459-L536 HydrophobicContact CE2-CD1 4.5Å; V532-L536 HydrophobicContact CG1-CD1 4.34Å; V532-L536 WeakPolarHBondContact O-CD1 3.4Å; V532-L536 WeakPolarHBondContact O-CG 3.45Å; V532-L536 PolarHBondContact O-N 3.48Å; G533-L536 WeakPolarHBondContact O-CB 3.06Å; G533-L536 PolarHBondContact O-N 3.47Å; D534-L536 PolarHBondContact O-N 3.29Å; D534-L536 VanDerWaalsContact O-N 3.16Å; L536-A540 PolarHBondContact O-N 3.23Å; L536-A540 VanDerWaalsContact O-N 3.12Å
537	H	88	Confident	88	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-61.8	-59	170.5	-170.5	167.8	0	0	0	110.1	G533 D534 F539 A540 D541 H570 L630	G533-H537 PolarHBondContact O-N 2.94Å; D534-H537 WeakPolarHBondContact O-CB 3.3Å; D534-H537 PolarHBondContact O-N 2.72Å; D534-H537 VanDerWaalsContact O-N 3.12Å; H537-F539 VanDerWaalsContact C-N 3.25Å; H537-F539 PolarHBondContact O-N 2.91Å; H537-A540 WeakPolarHBondContact O-CA 3.45Å; H537-A540 WeakPolarHBondContact O-CB 3.39Å; H537-A540 PolarHBondContact O-N 3.23Å; H537-D541 IonicContact CD2-OD1 3.38Å; H537-D541 PolarHBondContact CD2-OD1 3.33Å; H537-D541 IonicContact CD2-OD2 3.87Å; H537-D541 IonicContact NE2-OD1 3.75Å; H537-D541 PolarHBondContact O-N 3.43Å; H537-H570 AromaticContact CE1-CD2 3.42Å; H537-H570 PolarHBondContact CE1-CD2 3.23Å; H537-H570 VanDerWaalsContact CE1-CD2 3.42Å; H537-H570 AromaticContact CE1-NE2 3.49Å; H537-H570 PolarHBondContact CE1-NE2 2.96Å; H537-H570 AromaticContact ND1-CD2 3.48Å; H537-H570 PolarHBondContact ND1-CD2 2.61Å; H537-H570 AromaticContact ND1-CE1 3.44Å; H537-H570 PolarHBondContact ND1-CE1 2.71Å; H537-H570 AromaticContact ND1-NE2 3.03Å; H537-H570 PolarHBondContact ND1-NE2 2.86Å; H537-L630 HydrophobicContact CB-CD1 4.18Å
538	N	92.1	Very high	88.4	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-55.3	-38.5	178.5	-100.7	-79.2	0	0	0	112.5	D534 D541 G542 E567 T598 A599	D534-N538 WeakPolarHBondContact O-CB 3.27Å; D534-N538 PolarHBondContact O-N 2.96Å; D534-N538 PolarHBondContact OD1-ND2 3.02Å; N538-D541 PolarHBondContact O-N 2.87Å; N538-G542 PolarHBondContact O-N 3.05Å; N538-E567 PolarHBondContact ND2-OE1 3.45Å; N538-E567 PolarHBondContact OD1-OE1 2.99Å; N538-T598 VanDerWaalsContact CB-OG1 3.27Å; N538-T598 WeakPolarHBondContact CB-OG1 3.31Å; N538-A599 HydrophobicContact CB-CB 4.42Å; N538-A599 WeakPolarHBondContact O-CA 3.27Å; N538-A599 VanDerWaalsContact O-CB 3.26Å; N538-A599 WeakPolarHBondContact O-CB 3.15Å
539	F	92.7	Very high	88.7	Confident	73 Å²	73	17 Å²	17	32%	0.32	9%	0.094	S	C	.	.	H	α-helix	trans	-62	-42.5	171.6	177.7	-91.9	0	0	0	113.1	S535 H537 G542 L543 T598 M601 G602 V605	S535-F539 WeakPolarHBondContact O-CB 3.46Å; S535-F539 PolarHBondContact O-N 2.96Å; H537-F539 VanDerWaalsContact C-N 3.25Å; H537-F539 PolarHBondContact O-N 2.91Å; F539-G542 PolarHBondContact O-N 3.08Å; F539-L543 WeakPolarHBondContact O-CB 3.38Å; F539-L543 PolarHBondContact O-N 3.1Å; F539-T598 PolarHBondContact N-OG1 3.16Å; F539-M601 HydrophobicContact CD2-CB 4.23Å; F539-M601 HydrophobicContact CE2-CB 4.34Å; F539-G602 WeakPolarHBondContact O-CA 3.31Å; F539-V605 HydrophobicContact CE2-CG2 4.46Å
540	A	90.6	Very high	88.9	Confident	4 Å²	4	14.3 Å²	14.3	3%	0.033	8%	0.082	C	C	.	.	H	α-helix	trans	-66.9	-38	178.6	0	0	0	0	0	112.1	L536 H537 L543 V544 T623 I626	L536-A540 PolarHBondContact O-N 3.23Å; L536-A540 VanDerWaalsContact O-N 3.12Å; H537-A540 WeakPolarHBondContact O-CA 3.45Å; H537-A540 WeakPolarHBondContact O-CB 3.39Å; H537-A540 PolarHBondContact O-N 3.23Å; A540-L543 WeakPolarHBondContact O-CB 3.49Å; A540-L543 PolarHBondContact O-N 2.04Å; A540-V544 WeakPolarHBondContact O-CG2 3.41Å; A540-V544 PolarHBondContact O-N 3.08Å; A540-T623 HydrophobicContact CB-CG2 4.09Å; A540-I626 HydrophobicContact CB-CD1 4.44Å
541	D	91.9	Very high	88.8	Confident	3 Å²	3	15.4 Å²	15.4	2%	0.016	9%	0.091	C	C	.	.	H	α-helix	trans	-60.1	-51.5	173.6	-73.5	8.6	0	0	0	111.2	H537 N538 L543 V544 V545 I563 H566 F627	H537-D541 IonicContact CD2-OD1 3.38Å; H537-D541 PolarHBondContact CD2-OD1 3.33Å; H537-D541 IonicContact CD2-OD2 3.87Å; H537-D541 IonicContact NE2-OD1 3.75Å; H537-D541 PolarHBondContact O-N 3.43Å; N538-D541 PolarHBondContact O-N 2.87Å; D541-L543 VanDerWaalsContact C-N 3.27Å; D541-L543 PolarHBondContact O-N 3.47Å; D541-V544 PolarHBondContact O-N 3.33Å; D541-V544 VanDerWaalsContact O-N 3.14Å; D541-V545 WeakPolarHBondContact O-CG2 3.46Å; D541-V545 PolarHBondContact O-N 3.17Å; D541-I563 HydrophobicContact CB-CD1 4.1Å; D541-I563 HydrophobicContact CB-CG2 4.07Å; D541-I563 VanDerWaalsContact OD2-CG2 3.31Å; D541-I563 WeakPolarHBondContact OD2-CG2 3.42Å; D541-H566 IonicContact OD1-NE2 3.94Å; D541-H566 IonicContact OD2-NE2 3.78Å; D541-F627 WeakPolarHBondContact OD1-CE1 3.2Å; D541-F627 WeakPolarHBondContact OD1-CZ 3.44Å
542	G	93.7	Very high	88.6	Confident	1 Å²	1	14.6 Å²	14.6	1%	0.01	9%	0.086	C	C	.	.	H	α-helix	trans	-53	-46.3	173.7	0	0	0	0	0	112	N538 F539 V544 V545 G546 A599 L603	N538-G542 PolarHBondContact O-N 3.05Å; F539-G542 PolarHBondContact O-N 3.08Å; G542-V544 VanDerWaalsContact C-N 3.34Å; G542-V544 PolarHBondContact O-N 3.18Å; G542-V545 PolarHBondContact O-N 3.1Å; G542-G546 PolarHBondContact O-N 2.99Å; G542-A599 VanDerWaalsContact CA-O 3.26Å; G542-A599 WeakPolarHBondContact CA-O 3.24Å; G542-L603 VanDerWaalsContact C-N 3.3Å; G542-L603 WeakPolarHBondContact O-CA 3.35Å; G542-L603 PolarHBondContact O-N 3.04Å
543	L	92.4	Very high	88.5	Confident	27 Å²	27	14.1 Å²	14.1	14%	0.141	9%	0.086	C	C	.	.	H	α-helix	trans	-59.3	-43.1	179	-170.5	75	0	0	0	112	F539 A540 D541 G546 A547 G602 V605 I619	F539-L543 WeakPolarHBondContact O-CB 3.38Å; F539-L543 PolarHBondContact O-N 3.1Å; A540-L543 WeakPolarHBondContact O-CB 3.49Å; A540-L543 PolarHBondContact O-N 2.04Å; D541-L543 VanDerWaalsContact C-N 3.27Å; D541-L543 PolarHBondContact O-N 3.47Å; L543-G546 PolarHBondContact O-N 3.46Å; L543-A547 WeakPolarHBondContact O-CB 3.32Å; L543-A547 PolarHBondContact O-N 2.99Å; L543-G602 WeakPolarHBondContact CA-O 3.47Å; L543-V605 HydrophobicContact CD1-CB 4.19Å; L543-V605 HydrophobicContact CD1-CG1 3.79Å; L543-I619 HydrophobicContact CD2-CG1 4.38Å; L543-I619 HydrophobicContact CD2-CG2 3.86Å; L543-I619 HydrophobicContact CG-CG2 3.81Å
544	V	91.1	Very high	88.4	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-71.7	-39.2	178.1	174.6	0	0	0	0	112	L413 A540 D541 G542 G546 A547 A548 T559 I619 F620 T623	L413-V544 HydrophobicContact CD2-CG1 4.2Å; A540-V544 WeakPolarHBondContact O-CG2 3.41Å; A540-V544 PolarHBondContact O-N 3.08Å; D541-V544 PolarHBondContact O-N 3.33Å; D541-V544 VanDerWaalsContact O-N 3.14Å; G542-V544 VanDerWaalsContact C-N 3.34Å; G542-V544 PolarHBondContact O-N 3.18Å; V544-G546 VanDerWaalsContact C-N 3.32Å; V544-G546 PolarHBondContact O-N 3.42Å; V544-A547 PolarHBondContact O-N 3.44Å; V544-A548 VanDerWaalsContact O-CB 3.25Å; V544-A548 WeakPolarHBondContact O-CB 3.34Å; V544-A548 PolarHBondContact O-N 3.41Å; V544-T559 HydrophobicContact CG1-CG2 3.76Å; V544-I619 HydrophobicContact CG2-CG2 4.42Å; V544-F620 HydrophobicContact CG1-CD1 4.14Å; V544-F620 HydrophobicContact CG1-CE1 3.99Å; V544-F620 HydrophobicContact CG2-CD1 4.46Å; V544-T623 VanDerWaalsContact CG2-CB 3.45Å; V544-T623 HydrophobicContact CG2-CG2 3.44Å; V544-T623 VanDerWaalsContact CG2-CG2 3.44Å; V544-T623 WeakPolarHBondContact CG2-OG1 3.24Å
545	V	92.4	Very high	88.1	Confident	1 Å²	1	16.6 Å²	16.6	1%	0.006	9%	0.094	C	C	.	.	H	α-helix	trans	-59.6	-44.6	171.9	176.1	0	0	0	0	110.5	A366 V367 I370 D541 G542 A548 F549 T559 I563 L603	A366-V545 HydrophobicContact CB-CG1 4.26Å; V367-V545 HydrophobicContact CG2-CB 4.29Å; V367-V545 HydrophobicContact CG2-CG1 3.96Å; I370-V545 HydrophobicContact CD1-CG2 4.14Å; D541-V545 WeakPolarHBondContact O-CG2 3.46Å; D541-V545 PolarHBondContact O-N 3.17Å; G542-V545 PolarHBondContact O-N 3.1Å; V545-A548 PolarHBondContact O-N 3.38Å; V545-F549 HydrophobicContact CG1-CD2 3.65Å; V545-F549 HydrophobicContact CG1-CE2 3.81Å; V545-F549 WeakPolarHBondContact O-CD2 3.22Å; V545-F549 PolarHBondContact O-N 2.83Å; V545-T559 HydrophobicContact CG2-CG2 4.16Å; V545-I563 HydrophobicContact CG2-CD1 3.53Å; V545-L603 HydrophobicContact CB-CD1 4.31Å; V545-L603 HydrophobicContact CG1-CD1 3.91Å
546	G	91.4	Very high	87.9	Confident	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-62.8	-42.5	177.4	0	0	0	0	0	113.1	G542 L543 V544 S550	G542-G546 PolarHBondContact O-N 2.99Å; L543-G546 PolarHBondContact O-N 3.46Å; V544-G546 VanDerWaalsContact C-N 3.32Å; V544-G546 PolarHBondContact O-N 3.42Å; G546-S550 WeakPolarHBondContact O-CB 3.33Å; G546-S550 PolarHBondContact O-N 2.94Å; G546-S550 VanDerWaalsContact O-N 3.13Å; G546-S550 PolarHBondContact O-OG 3.35Å
547	A	88.9	Confident	87.9	Confident	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-66.4	-41.2	174.3	0	0	0	0	0	112.6	L543 V544 S550 S551 Q616 I619 F620	L543-A547 WeakPolarHBondContact O-CB 3.32Å; L543-A547 PolarHBondContact O-N 2.99Å; V544-A547 PolarHBondContact O-N 3.44Å; A547-S550 WeakPolarHBondContact O-CB 3.37Å; A547-S550 PolarHBondContact O-N 2.65Å; A547-S551 PolarHBondContact O-N 2.89Å; A547-Q616 HydrophobicContact CB-CG 4.01Å; A547-I619 HydrophobicContact CB-CD1 4.46Å; A547-I619 HydrophobicContact CB-CG2 4Å; A547-F620 HydrophobicContact CB-CD1 4.3Å; A547-F620 HydrophobicContact CB-CE1 3.63Å; A547-F620 HydrophobicContact CB-CZ 4.26Å
548	A	88	Confident	87.8	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-67.1	-48.1	-179.4	0	0	0	0	0	112.5	V544 V545 S550 S551 S552 T555 T559 F620	V544-A548 VanDerWaalsContact O-CB 3.25Å; V544-A548 WeakPolarHBondContact O-CB 3.34Å; V544-A548 PolarHBondContact O-N 3.41Å; V545-A548 PolarHBondContact O-N 3.38Å; A548-S550 VanDerWaalsContact C-N 3.28Å; A548-S550 PolarHBondContact O-N 3.07Å; A548-S551 WeakPolarHBondContact O-CB 3.49Å; A548-S551 PolarHBondContact O-N 2.67Å; A548-S552 PolarHBondContact O-N 3.39Å; A548-S552 VanDerWaalsContact O-O 3.08Å; A548-T555 HydrophobicContact CB-CG2 4.38Å; A548-T559 HydrophobicContact CB-CG2 4.1Å; A548-T559 WeakPolarHBondContact CB-OG1 3.48Å; A548-F620 HydrophobicContact CB-CZ 4.34Å
549	F	88.4	Confident	87.6	Confident	1 Å²	1	15.4 Å²	15.4	0%	0.004	9%	0.085	C	C	.	.	H	α-helix	trans	-68.7	-22.4	174.6	-82.7	-74.7	0	0	0	113.8	A366 V545 S551 G556 M557 T560	A366-F549 HydrophobicContact CB-CE2 3.65Å; A366-F549 HydrophobicContact CB-CZ 4.05Å; V545-F549 HydrophobicContact CG1-CD2 3.65Å; V545-F549 HydrophobicContact CG1-CE2 3.81Å; V545-F549 WeakPolarHBondContact O-CD2 3.22Å; V545-F549 PolarHBondContact O-N 2.83Å; F549-S551 VanDerWaalsContact C-N 3.26Å; F549-G556 VanDerWaalsContact CE2-C 3.48Å; F549-G556 WeakPolarHBondContact CE2-O 3.37Å; F549-G556 VanDerWaalsContact CZ-C 3.42Å; F549-M557 HydrophobicContact CE1-CG 4.23Å; F549-M557 HydrophobicContact CE1-SD 4.4Å; F549-M557 HydrophobicContact CZ-CG 4.18Å; F549-M557 HydrophobicContact CZ-SD 3.98Å; F549-T560 WeakPolarHBondContact CE2-OG1 3.38Å
550	S	85.3	Confident	87.5	Confident	13 Å²	13	12.4 Å²	12.4	9%	0.091	7%	0.073	C	C	.	.	H	α-helix	trans	-66	-30.8	168.9	-75.3	0	0	0	0	112.3	K359 G546 A547 A548 S610	K359-S550 WeakPolarHBondContact CE-O 3.41Å; K359-S550 PolarHBondContact NZ-O 3.02Å; G546-S550 WeakPolarHBondContact O-CB 3.33Å; G546-S550 PolarHBondContact O-N 2.94Å; G546-S550 VanDerWaalsContact O-N 3.13Å; G546-S550 PolarHBondContact O-OG 3.35Å; A547-S550 WeakPolarHBondContact O-CB 3.37Å; A547-S550 PolarHBondContact O-N 2.65Å; A548-S550 VanDerWaalsContact C-N 3.28Å; A548-S550 PolarHBondContact O-N 3.07Å; S550-S610 WeakPolarHBondContact CB-OG 3.44Å
551	S	79.6	Confident	87.4	Confident	38 Å²	38	14.6 Å²	14.6	27%	0.266	9%	0.086	S	C	.	.	H	α-helix	trans	-81.8	-60.9	176.9	-166.2	0	0	0	0	112.3	A547 A548 F549 Q616	A547-S551 PolarHBondContact O-N 2.89Å; A548-S551 WeakPolarHBondContact O-CB 3.49Å; A548-S551 PolarHBondContact O-N 2.67Å; F549-S551 VanDerWaalsContact C-N 3.26Å; S551-Q616 VanDerWaalsContact CB-NE2 3.34Å
552	S	80.4	Confident	87.1	Confident	0 Å²	0	14.6 Å²	14.6	0%	0	9%	0.086	C	C	.	.			trans	-154.8	158	179.3	70.9	0	0	0	0	112.7	R350 A548 E554 T555 G556	R350-S552 WeakPolarHBondContact O-CB 3.3Å; A548-S552 PolarHBondContact O-N 3.39Å; A548-S552 VanDerWaalsContact O-O 3.08Å; S552-E554 VanDerWaalsContact C-N 3.34Å; S552-T555 VanDerWaalsContact OG-CB 3.29Å; S552-T555 WeakPolarHBondContact OG-CB 3.44Å; S552-T555 PolarHBondContact OG-N 2.86Å; S552-T555 PolarHBondContact OG-OG1 3.49Å; S552-T555 VanDerWaalsContact OG-OG1 3.14Å; S552-G556 PolarHBondContact O-N 3.36Å
553	A	82.5	Confident	86.9	Confident	29 Å²	29	14.5 Å²	14.5	24%	0.24	9%	0.085	C	C	.	.	H	α-helix	trans	-68.8	-36.6	174.5	0	0	0	0	0	111.2	G556 M557	A553-G556 PolarHBondContact O-N 3.3Å; A553-M557 WeakPolarHBondContact O-CB 3.44Å; A553-M557 WeakPolarHBondContact O-CG 3.04Å; A553-M557 PolarHBondContact O-N 3.14Å
554	E	81.3	Confident	86.7	Confident	67 Å²	67	15.3 Å²	15.3	31%	0.313	9%	0.089	S	C	.	.	H	α-helix	trans	-65.2	-51.6	-178.9	-61.8	89.7	154.1	0	0	111.8	G351 S552 M557 A558	G351-E554 VanDerWaalsContact CA-OE1 3.26Å; G351-E554 WeakPolarHBondContact CA-OE1 3.4Å; G351-E554 VanDerWaalsContact CA-OE2 3.29Å; G351-E554 WeakPolarHBondContact CA-OE2 3.36Å; G351-E554 PolarHBondContact N-OE1 3.17Å; G351-E554 PolarHBondContact N-OE2 3.34Å; S552-E554 VanDerWaalsContact C-N 3.34Å; E554-M557 PolarHBondContact O-N 3.01Å; E554-A558 PolarHBondContact O-N 3.38Å
555	T	80.5	Confident	86.5	Confident	4 Å²	4	17.1 Å²	17.1	3%	0.025	10%	0.102	C	C	.	.	H	α-helix	trans	-66.8	-39.6	175.6	-56	0	0	0	0	110.7	A548 S552 M557 A558 T559 E672	A548-T555 HydrophobicContact CB-CG2 4.38Å; S552-T555 VanDerWaalsContact OG-CB 3.29Å; S552-T555 WeakPolarHBondContact OG-CB 3.44Å; S552-T555 PolarHBondContact OG-N 2.86Å; S552-T555 PolarHBondContact OG-OG1 3.49Å; S552-T555 VanDerWaalsContact OG-OG1 3.14Å; T555-M557 VanDerWaalsContact C-N 3.34Å; T555-M557 PolarHBondContact O-N 3.36Å; T555-A558 PolarHBondContact O-N 2.7Å; T555-T559 WeakPolarHBondContact O-CB 3.4Å; T555-T559 PolarHBondContact O-N 3.42Å; T555-T559 PolarHBondContact O-OG1 3.15Å; T555-E672 PolarHBondContact OG1-OE1 3.07Å
556	G	87.8	Confident	86.2	Confident	0 Å²	0	17 Å²	17	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-56.5	-43.6	173.5	0	0	0	0	0	113.6	F549 S552 A553 T560	F549-G556 VanDerWaalsContact CE2-C 3.48Å; F549-G556 WeakPolarHBondContact CE2-O 3.37Å; F549-G556 VanDerWaalsContact CZ-C 3.42Å; S552-G556 PolarHBondContact O-N 3.36Å; A553-G556 PolarHBondContact O-N 3.3Å; G556-T560 WeakPolarHBondContact O-CB 3.39Å; G556-T560 PolarHBondContact O-N 3.23Å; G556-T560 PolarHBondContact O-OG1 3.41Å
557	M	87.3	Confident	86	Confident	58 Å²	58	17.1 Å²	17.1	29%	0.286	10%	0.101	S	C	.	.	H	α-helix	trans	-68.7	-40	175.4	-72.6	-65.5	-65.5	0	0	112.4	F549 A553 E554 T555 T560 V561 F677	F549-M557 HydrophobicContact CE1-CG 4.23Å; F549-M557 HydrophobicContact CE1-SD 4.4Å; F549-M557 HydrophobicContact CZ-CG 4.18Å; F549-M557 HydrophobicContact CZ-SD 3.98Å; A553-M557 WeakPolarHBondContact O-CB 3.44Å; A553-M557 WeakPolarHBondContact O-CG 3.04Å; A553-M557 PolarHBondContact O-N 3.14Å; E554-M557 PolarHBondContact O-N 3.01Å; T555-M557 VanDerWaalsContact C-N 3.34Å; T555-M557 PolarHBondContact O-N 3.36Å; M557-T560 WeakPolarHBondContact O-CB 3Å; M557-T560 PolarHBondContact O-N 2.86Å; M557-V561 WeakPolarHBondContact O-CG2 3.39Å; M557-V561 PolarHBondContact O-N 2.04Å; M557-V561 VanDerWaalsContact O-N 3.1Å; M557-F677 HydrophobicContact CB-CD2 3.59Å; M557-F677 HydrophobicContact CB-CE2 3.4Å; M557-F677 VanDerWaalsContact CB-CE2 3.4Å; M557-F677 HydrophobicContact CB-CG 4.22Å; M557-F677 HydrophobicContact CB-CZ 3.91Å; M557-F677 HydrophobicContact CE-CD1 3.8Å; M557-F677 HydrophobicContact CE-CE1 3.85Å; M557-F677 HydrophobicContact CE-CG 4.2Å; M557-F677 HydrophobicContact CE-CZ 4.31Å; M557-F677 HydrophobicContact CG-CD2 3.92Å; M557-F677 HydrophobicContact CG-CE2 4.21Å; M557-F677 HydrophobicContact CG-CG 4.14Å
558	A	85.1	Confident	85.8	Confident	4 Å²	4	19.3 Å²	19.3	3%	0.033	11%	0.113	C	C	.	.	H	α-helix	trans	-61.6	-48.8	175.4	0	0	0	0	0	111.7	E554 T555 T560 V561 A562 E672	E554-A558 PolarHBondContact O-N 3.38Å; T555-A558 PolarHBondContact O-N 2.7Å; A558-T560 VanDerWaalsContact C-N 3.31Å; A558-T560 PolarHBondContact O-N 2.91Å; A558-V561 PolarHBondContact O-N 2.9Å; A558-A562 PolarHBondContact O-N 2.91Å; A558-E672 HydrophobicContact CB-CG 4.14Å
559	T	87.8	Confident	85.3	Confident	1 Å²	1	19.5 Å²	19.5	1%	0.006	11%	0.114	C	C	.	.	H	α-helix	trans	-54.6	-44.3	171.9	-63.3	0	0	0	0	112.1	H412 V544 V545 A548 T555 V561 A562 I563	H412-T559 PolarHBondContact CE1-OG1 3.2Å; V544-T559 HydrophobicContact CG1-CG2 3.76Å; V545-T559 HydrophobicContact CG2-CG2 4.16Å; A548-T559 HydrophobicContact CB-CG2 4.1Å; A548-T559 WeakPolarHBondContact CB-OG1 3.48Å; T555-T559 WeakPolarHBondContact O-CB 3.4Å; T555-T559 PolarHBondContact O-N 3.42Å; T555-T559 PolarHBondContact O-OG1 3.15Å; T559-V561 VanDerWaalsContact C-N 3.32Å; T559-V561 PolarHBondContact O-N 3.44Å; T559-A562 PolarHBondContact O-N 3.2Å; T559-I563 HydrophobicContact CG2-CD1 3.73Å; T559-I563 WeakPolarHBondContact O-CG1 3.31Å; T559-I563 PolarHBondContact O-N 3.38Å
560	T	91.1	Very high	85	Confident	9 Å²	9	19.9 Å²	19.9	6%	0.055	12%	0.116	C	C	.	.	H	α-helix	trans	-60.2	-41.9	179.1	-59	0	0	0	0	112	A366 I370 F549 G556 M557 A558 L564	A366-T560 HydrophobicContact CB-CG2 3.59Å; A366-T560 WeakPolarHBondContact CB-OG1 3.37Å; I370-T560 HydrophobicContact CD1-CG2 4.09Å; I370-T560 HydrophobicContact CG1-CG2 4.24Å; F549-T560 WeakPolarHBondContact CE2-OG1 3.38Å; G556-T560 WeakPolarHBondContact O-CB 3.39Å; G556-T560 PolarHBondContact O-N 3.23Å; G556-T560 PolarHBondContact O-OG1 3.41Å; M557-T560 WeakPolarHBondContact O-CB 3Å; M557-T560 PolarHBondContact O-N 2.86Å; A558-T560 VanDerWaalsContact C-N 3.31Å; A558-T560 PolarHBondContact O-N 2.91Å; T560-L564 VanDerWaalsContact O-CB 3.29Å; T560-L564 WeakPolarHBondContact O-CB 3.26Å; T560-L564 PolarHBondContact O-N 3.49Å
561	V	88.6	Confident	85	Confident	51 Å²	51	19.2 Å²	19.2	31%	0.309	11%	0.111	S	C	.	.	H	α-helix	trans	-70.8	-40.9	177.5	177	0	0	0	0	111	M557 A558 T559 I563 L564 C565 L668	M557-V561 WeakPolarHBondContact O-CG2 3.39Å; M557-V561 PolarHBondContact O-N 2.04Å; M557-V561 VanDerWaalsContact O-N 3.1Å; A558-V561 PolarHBondContact O-N 2.9Å; T559-V561 VanDerWaalsContact C-N 3.32Å; T559-V561 PolarHBondContact O-N 3.44Å; V561-I563 PolarHBondContact O-N 3.47Å; V561-L564 PolarHBondContact O-N 3.39Å; V561-C565 WeakPolarHBondContact O-CB 3.39Å; V561-C565 PolarHBondContact O-N 3.06Å; V561-C565 VanDerWaalsContact O-N 3.08Å; V561-C565 PolarHBondContact O-SG 3.03Å; V561-L668 HydrophobicContact CB-CD2 4.48Å; V561-L668 HydrophobicContact CG1-CD1 4.11Å; V561-L668 HydrophobicContact CG1-CD2 4.04Å
562	A	85.4	Confident	85.1	Confident	2 Å²	2	17.6 Å²	17.6	2%	0.017	10%	0.1	C	C	.	.	H	α-helix	trans	-57.6	-47.4	176	0	0	0	0	0	112.1	A558 T559 C565 H566 L665 L668	A558-A562 PolarHBondContact O-N 2.91Å; T559-A562 PolarHBondContact O-N 3.2Å; A562-C565 PolarHBondContact O-N 2.84Å; A562-H566 PolarHBondContact O-N 3.36Å; A562-H566 PolarHBondContact O-ND1 2.9Å; A562-H566 VanDerWaalsContact O-ND1 3.17Å; A562-L665 HydrophobicContact CB-CD1 3.74Å; A562-L668 HydrophobicContact CB-CD1 4.42Å
563	I	89.8	Confident	85	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-66.2	-49.5	177.9	-68.8	166.8	0	0	0	111.4	I370 D541 V545 T559 V561 C565 H566 E567	I370-I563 HydrophobicContact CD1-CB 4.18Å; I370-I563 HydrophobicContact CD1-CG2 3.82Å; I370-I563 HydrophobicContact CG1-CG2 4.32Å; I370-I563 HydrophobicContact CG2-CG2 4.01Å; D541-I563 HydrophobicContact CB-CD1 4.1Å; D541-I563 HydrophobicContact CB-CG2 4.07Å; D541-I563 VanDerWaalsContact OD2-CG2 3.31Å; D541-I563 WeakPolarHBondContact OD2-CG2 3.42Å; V545-I563 HydrophobicContact CG2-CD1 3.53Å; T559-I563 HydrophobicContact CG2-CD1 3.73Å; T559-I563 WeakPolarHBondContact O-CG1 3.31Å; T559-I563 PolarHBondContact O-N 3.38Å; V561-I563 PolarHBondContact O-N 3.47Å; I563-C565 PolarHBondContact O-N 3.16Å; I563-H566 VanDerWaalsContact CA-CE1 3.49Å; I563-H566 WeakPolarHBondContact CA-CE1 3.36Å; I563-H566 PolarHBondContact O-N 2.95Å; I563-E567 HydrophobicContact CG2-CB 4.42Å; I563-E567 WeakPolarHBondContact O-CB 3.18Å; I563-E567 PolarHBondContact O-N 2.8Å
564	L	89.1	Confident	84.9	Confident	43 Å²	43	17.7 Å²	17.7	23%	0.225	10%	0.099	C	C	.	.	H	α-helix	trans	-53.7	-33.2	176.6	-175.7	71.1	0	0	0	112.6	I369 I370 T560 V561 I568	I369-L564 HydrophobicContact CG2-CD2 4.46Å; I370-L564 HydrophobicContact CG1-CB 4.39Å; T560-L564 VanDerWaalsContact O-CB 3.29Å; T560-L564 WeakPolarHBondContact O-CB 3.26Å; T560-L564 PolarHBondContact O-N 3.49Å; V561-L564 PolarHBondContact O-N 3.39Å; L564-I568 HydrophobicContact CD1-CD1 3.84Å; L564-I568 HydrophobicContact CD1-CG1 4.17Å; L564-I568 HydrophobicContact CG-CD1 4.02Å; L564-I568 WeakPolarHBondContact O-CG1 3.32Å
565	C	85.1	Confident	85.1	Confident	38 Å²	38	14.7 Å²	14.7	26%	0.257	9%	0.085	S	C	.	.	H	α-helix	trans	-74.7	-19.9	177.1	-74.5	0	0	0	0	115.2	T404 V561 A562 I563	T404-C565 HydrophobicContact CG2-CB 4.03Å; T404-C565 PolarHBondContact OG1-O 3.28Å; V561-C565 WeakPolarHBondContact O-CB 3.39Å; V561-C565 PolarHBondContact O-N 3.06Å; V561-C565 VanDerWaalsContact O-N 3.08Å; V561-C565 PolarHBondContact O-SG 3.03Å; A562-C565 PolarHBondContact O-N 2.84Å; I563-C565 PolarHBondContact O-N 3.16Å
566	H	86.3	Confident	84.9	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-102.4	-24.9	170.4	53.9	-114.7	0	0	0	114.6	T404 L405 D408 D541 A562 I563 P569 H570	T404-H566 WeakPolarHBondContact OG1-CA 3.33Å; T404-H566 VanDerWaalsContact OG1-CB 3.25Å; T404-H566 WeakPolarHBondContact OG1-CB 3.46Å; L405-H566 HydrophobicContact CD1-CB 4.31Å; L405-H566 HydrophobicContact CD2-CB 4.26Å; L405-H566 HydrophobicContact CG-CB 3.68Å; D408-H566 IonicContact OD2-CE1 3.62Å; D541-H566 IonicContact OD1-NE2 3.94Å; D541-H566 IonicContact OD2-NE2 3.78Å; A562-H566 PolarHBondContact O-N 3.36Å; A562-H566 PolarHBondContact O-ND1 2.9Å; A562-H566 VanDerWaalsContact O-ND1 3.17Å; I563-H566 VanDerWaalsContact CA-CE1 3.49Å; I563-H566 WeakPolarHBondContact CA-CE1 3.36Å; I563-H566 PolarHBondContact O-N 2.95Å; H566-P569 VanDerWaalsContact O-CD 3.29Å; H566-P569 WeakPolarHBondContact O-CD 3.08Å; H566-H570 VanDerWaalsContact O-CB 3.23Å; H566-H570 WeakPolarHBondContact O-CB 3.31Å; H566-H570 PolarHBondContact O-N 3.44Å; H566-H570 VanDerWaalsContact O-N 3.1Å
567	E	87.6	Confident	84.4	Confident	1 Å²	1	17.6 Å²	17.6	1%	0.005	11%	0.105	C	C	.	.	H	α-helix	trans	-76.2	-40.3	-175.5	-171	59.1	-171.2	0	0	112.5	I370 N538 I563 H570 E571	I370-E567 HydrophobicContact CG2-CB 4.22Å; I370-E567 HydrophobicContact CG2-CG 3.93Å; N538-E567 PolarHBondContact ND2-OE1 3.45Å; N538-E567 PolarHBondContact OD1-OE1 2.99Å; I563-E567 HydrophobicContact CG2-CB 4.42Å; I563-E567 WeakPolarHBondContact O-CB 3.18Å; I563-E567 PolarHBondContact O-N 2.8Å; E567-H570 PolarHBondContact O-N 2.85Å; E567-E571 HydrophobicContact CG-CG 4.26Å; E567-E571 WeakPolarHBondContact O-CB 3.29Å; E567-E571 PolarHBondContact O-N 3.3Å; E567-E571 VanDerWaalsContact OE1-CG 3.22Å; E567-E571 WeakPolarHBondContact OE1-CG 3.23Å
568	I	84.5	Confident	84.1	Confident	47 Å²	47	14.9 Å²	14.9	24%	0.241	9%	0.091	C	C	.	.	H	α-helix	trans	-55.5	-49.9	175.4	-66.1	170	0	0	0	111.6	L564 M572	L564-I568 HydrophobicContact CD1-CD1 3.84Å; L564-I568 HydrophobicContact CD1-CG1 4.17Å; L564-I568 HydrophobicContact CG-CD1 4.02Å; L564-I568 WeakPolarHBondContact O-CG1 3.32Å; I568-M572 HydrophobicContact CG2-SD 4.06Å; I568-M572 WeakPolarHBondContact O-CG 3.42Å; I568-M572 PolarHBondContact O-N 3.47Å; I568-M572 VanDerWaalsContact O-SD 3.38Å
569	P	78	Confident	83.9	Confident	4 Å²	4	17.5 Å²	17.5	3%	0.026	10%	0.104	C	C	.	.	H	α-helix	trans	-73.7	-27.9	177.1	-9.3	22.6	0	0	0	114.8	F397 L400 A401 H566 G573	F397-P569 HydrophobicContact CB-CB 3.87Å; F397-P569 HydrophobicContact CD1-CB 4.03Å; F397-P569 HydrophobicContact CD1-CG 4.02Å; F397-P569 HydrophobicContact CG-CB 4.37Å; F397-P569 WeakPolarHBondContact O-CB 3.36Å; L400-P569 HydrophobicContact CD2-CG 4.19Å; L400-P569 HydrophobicContact CG-CG 4.48Å; A401-P569 HydrophobicContact CB-CB 3.84Å; A401-P569 HydrophobicContact CB-CG 4.28Å; H566-P569 VanDerWaalsContact O-CD 3.29Å; H566-P569 WeakPolarHBondContact O-CD 3.08Å; P569-G573 PolarHBondContact O-N 3.3Å
570	H	82.9	Confident	83.2	Confident	8 Å²	8	22 Å²	22	4%	0.037	14%	0.136	C	C	.	.	H	α-helix	trans	-65.4	-55.4	177.8	-173.6	-79.4	0	0	0	111.3	H537 H566 E567 M572 G573 D574 M635	H537-H570 AromaticContact CE1-CD2 3.42Å; H537-H570 PolarHBondContact CE1-CD2 3.23Å; H537-H570 VanDerWaalsContact CE1-CD2 3.42Å; H537-H570 AromaticContact CE1-NE2 3.49Å; H537-H570 PolarHBondContact CE1-NE2 2.96Å; H537-H570 AromaticContact ND1-CD2 3.48Å; H537-H570 PolarHBondContact ND1-CD2 2.61Å; H537-H570 AromaticContact ND1-CE1 3.44Å; H537-H570 PolarHBondContact ND1-CE1 2.71Å; H537-H570 AromaticContact ND1-NE2 3.03Å; H537-H570 PolarHBondContact ND1-NE2 2.86Å; H566-H570 VanDerWaalsContact O-CB 3.23Å; H566-H570 WeakPolarHBondContact O-CB 3.31Å; H566-H570 PolarHBondContact O-N 3.44Å; H566-H570 VanDerWaalsContact O-N 3.1Å; E567-H570 PolarHBondContact O-N 2.85Å; H570-M572 VanDerWaalsContact C-N 3.26Å; H570-M572 PolarHBondContact O-N 3.46Å; H570-G573 VanDerWaalsContact O-CA 3.31Å; H570-G573 WeakPolarHBondContact O-CA 3.5Å; H570-G573 PolarHBondContact O-N 3.32Å; H570-D574 IonicContact CE1-OD2 3.03Å; H570-D574 PolarHBondContact CE1-OD2 3.11Å; H570-D574 IonicContact ND1-OD2 3.2Å; H570-D574 PolarHBondContact ND1-OD2 2.94Å; H570-D574 PolarHBondContact O-N 3.49Å; H570-M635 HydrophobicContact CB-CE 4.07Å; H570-M635 WeakPolarHBondContact CD2-CE 3.49Å
571	E	85.3	Confident	82.5	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-59.6	-33.4	178.7	-78.6	-112.5	-115.9	0	0	113.4	S374 M375 I378 E567 G573 F575 N592	S374-E571 VanDerWaalsContact CB-OE1 3.32Å; S374-E571 WeakPolarHBondContact CB-OE1 3.2Å; S374-E571 PolarHBondContact OG-OE1 3.3Å; M375-E571 VanDerWaalsContact CE-CD 3.5Å; M375-E571 WeakPolarHBondContact CE-OE1 3.37Å; M375-E571 WeakPolarHBondContact CE-OE2 3.46Å; I378-E571 HydrophobicContact CD1-CB 4.39Å; E567-E571 HydrophobicContact CG-CG 4.26Å; E567-E571 WeakPolarHBondContact O-CB 3.29Å; E567-E571 PolarHBondContact O-N 3.3Å; E567-E571 VanDerWaalsContact OE1-CG 3.22Å; E567-E571 WeakPolarHBondContact OE1-CG 3.23Å; E571-G573 VanDerWaalsContact C-N 3.3Å; E571-G573 PolarHBondContact O-N 2.89Å; E571-F575 VanDerWaalsContact O-CB 3.24Å; E571-F575 WeakPolarHBondContact O-CB 3.34Å; E571-F575 PolarHBondContact O-N 3.36Å; E571-N592 PolarHBondContact O-ND2 3.2Å; E571-N592 VanDerWaalsContact OE2-CB 3.31Å; E571-N592 WeakPolarHBondContact OE2-CB 3.3Å; E571-N592 PolarHBondContact OE2-ND2 3.05Å
572	M	81.1	Confident	82	Confident	4 Å²	4	23.7 Å²	23.7	2%	0.02	16%	0.162	C	C	.	.	H	α-helix	trans	-65.1	-32.7	171.2	-74.8	170.6	55.5	0	0	113	L381 F397 I568 H570 A576	L381-M572 HydrophobicContact CD1-CB 4.16Å; L381-M572 HydrophobicContact CD1-CE 4.44Å; L381-M572 HydrophobicContact CD1-CG 4.13Å; L381-M572 HydrophobicContact CD2-CE 3.59Å; L381-M572 HydrophobicContact CG-CE 4.09Å; L381-M572 HydrophobicContact CG-CG 4.44Å; F397-M572 HydrophobicContact CB-CE 4.49Å; F397-M572 HydrophobicContact CD2-CE 3.54Å; F397-M572 HydrophobicContact CE2-CE 3.84Å; F397-M572 HydrophobicContact CG-CE 4.01Å; I568-M572 HydrophobicContact CG2-SD 4.06Å; I568-M572 WeakPolarHBondContact O-CG 3.42Å; I568-M572 PolarHBondContact O-N 3.47Å; I568-M572 VanDerWaalsContact O-SD 3.38Å; H570-M572 VanDerWaalsContact C-N 3.26Å; H570-M572 PolarHBondContact O-N 3.46Å; M572-A576 PolarHBondContact O-N 2.73Å
573	G	77.7	Confident	81.8	Confident	12 Å²	12	24.7 Å²	24.7	12%	0.124	17%	0.166	C	C	.	.	H	α-helix	trans	-70.6	-52.1	174.3	0	0	0	0	0	111.9	P569 H570 E571 F575 A576 V577	P569-G573 PolarHBondContact O-N 3.3Å; H570-G573 VanDerWaalsContact O-CA 3.31Å; H570-G573 WeakPolarHBondContact O-CA 3.5Å; H570-G573 PolarHBondContact O-N 3.32Å; E571-G573 VanDerWaalsContact C-N 3.3Å; E571-G573 PolarHBondContact O-N 2.89Å; G573-F575 PolarHBondContact O-N 3Å; G573-A576 WeakPolarHBondContact O-CA 3.41Å; G573-A576 WeakPolarHBondContact O-CB 3.28Å; G573-A576 PolarHBondContact O-N 3.17Å; G573-V577 PolarHBondContact O-N 3.31Å
574	D	81.7	Confident	81.7	Confident	19 Å²	19	27.7 Å²	27.7	10%	0.102	19%	0.188	C	C	.	.	H	α-helix	trans	-61.7	-43.4	-179.2	-72.2	-19.2	0	0	0	112	V530 H570 A576 V577 L578	V530-D574 HydrophobicContact CG1-CB 3.86Å; H570-D574 IonicContact CE1-OD2 3.03Å; H570-D574 PolarHBondContact CE1-OD2 3.11Å; H570-D574 IonicContact ND1-OD2 3.2Å; H570-D574 PolarHBondContact ND1-OD2 2.94Å; H570-D574 PolarHBondContact O-N 3.49Å; D574-A576 VanDerWaalsContact C-N 3.25Å; D574-A576 PolarHBondContact O-N 3.35Å; D574-V577 PolarHBondContact O-N 2.95Å; D574-L578 WeakPolarHBondContact O-CG 3.43Å; D574-L578 PolarHBondContact O-N 3.22Å
575	F	84.1	Confident	81.5	Confident	4 Å²	4	28.7 Å²	28.7	2%	0.018	20%	0.195	C	C	.	.	H	α-helix	trans	-56	-40.4	173.1	179.5	-104.8	0	0	0	112.2	I378 L381 F382 E571 G573 L578 L579 V585 A588 M589	I378-F575 HydrophobicContact CD1-CB 4.09Å; I378-F575 HydrophobicContact CD1-CD2 4.48Å; I378-F575 HydrophobicContact CD1-CG 4.36Å; I378-F575 HydrophobicContact CG1-CB 4.23Å; I378-F575 HydrophobicContact CG1-CG 4.43Å; I378-F575 HydrophobicContact CG2-CB 4.44Å; I378-F575 HydrophobicContact CG2-CD1 3.7Å; I378-F575 HydrophobicContact CG2-CD2 3.89Å; I378-F575 HydrophobicContact CG2-CE1 3.79Å; I378-F575 HydrophobicContact CG2-CE2 3.99Å; I378-F575 HydrophobicContact CG2-CG 3.74Å; I378-F575 HydrophobicContact CG2-CZ 3.94Å; L381-F575 HydrophobicContact CD1-CD1 4.19Å; F382-F575 HydrophobicContact CZ-CE1 4.49Å; F382-F575 HydrophobicContact CZ-CZ 4.01Å; E571-F575 VanDerWaalsContact O-CB 3.24Å; E571-F575 WeakPolarHBondContact O-CB 3.34Å; E571-F575 PolarHBondContact O-N 3.36Å; G573-F575 PolarHBondContact O-N 3Å; F575-L578 PolarHBondContact O-N 3.13Å; F575-L579 HydrophobicContact CD1-CD1 4.02Å; F575-L579 HydrophobicContact CE1-CD1 3.46Å; F575-L579 VanDerWaalsContact CE1-CD1 3.46Å; F575-L579 HydrophobicContact CE1-CG 4.17Å; F575-L579 HydrophobicContact CE2-CD1 4.49Å; F575-L579 HydrophobicContact CE2-CG 4.41Å; F575-L579 HydrophobicContact CZ-CD1 3.73Å; F575-L579 HydrophobicContact CZ-CD2 4.3Å; F575-L579 HydrophobicContact CZ-CG 4.11Å; F575-L579 WeakPolarHBondContact O-CG 3.48Å; F575-L579 PolarHBondContact O-N 3.12Å; F575-V585 HydrophobicContact CZ-CG1 4.31Å; F575-A588 HydrophobicContact CD2-CB 3.89Å; F575-A588 HydrophobicContact CE2-CB 3.82Å; F575-M589 HydrophobicContact CE2-CB 4.19Å
576	A	76.9	Confident	81.6	Confident	22 Å²	22	35.4 Å²	35.4	18%	0.182	22%	0.22	C	C	.	.	H	α-helix	trans	-66.1	-39.1	175.6	0	0	0	0	0	112.3	Y390 L394 M572 G573 D574 L579 S580	Y390-A576 WeakPolarHBondContact OH-CB 3.41Å; L394-A576 HydrophobicContact CD1-CB 3.79Å; M572-A576 PolarHBondContact O-N 2.73Å; G573-A576 WeakPolarHBondContact O-CA 3.41Å; G573-A576 WeakPolarHBondContact O-CB 3.28Å; G573-A576 PolarHBondContact O-N 3.17Å; D574-A576 VanDerWaalsContact C-N 3.25Å; D574-A576 PolarHBondContact O-N 3.35Å; A576-L579 PolarHBondContact O-N 2.85Å; A576-S580 WeakPolarHBondContact O-CB 3.27Å; A576-S580 PolarHBondContact O-N 2.93Å
577	V	77.3	Confident	81.7	Confident	43 Å²	43	38 Å²	38	26%	0.261	24%	0.236	S	C	.	.	H	α-helix	trans	-66.6	-42.6	175.9	179.4	0	0	0	0	111.3	L526 V530 G573 D574 L579 S580 S581	L526-V577 HydrophobicContact CD2-CG1 4.49Å; V530-V577 HydrophobicContact CG2-CG1 3.89Å; G573-V577 PolarHBondContact O-N 3.31Å; D574-V577 PolarHBondContact O-N 2.95Å; V577-L579 PolarHBondContact O-N 2.97Å; V577-S580 PolarHBondContact O-N 3.22Å; V577-S580 PolarHBondContact O-OG 3.18Å; V577-S581 WeakPolarHBondContact O-CB 3.4Å; V577-S581 PolarHBondContact O-N 2.96Å; V577-S581 PolarHBondContact O-OG 3.41Å
578	L	81.7	Confident	81.6	Confident	0 Å²	0	38 Å²	38	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-62.5	-42.6	176	-64.9	-174.6	0	0	0	112.2	A527 V530 I531 D574 F575 S581 G582 L583 A588 M591 N592	A527-L578 HydrophobicContact CB-CD2 3.5Å; A527-L578 VanDerWaalsContact CB-CD2 3.5Å; V530-L578 HydrophobicContact CB-CD2 4.49Å; V530-L578 HydrophobicContact CG1-CD2 4.44Å; I531-L578 HydrophobicContact CD1-CD1 4.25Å; I531-L578 HydrophobicContact CD1-CD2 3.93Å; I531-L578 HydrophobicContact CG1-CD1 4.13Å; I531-L578 HydrophobicContact CG1-CD2 3.97Å; D574-L578 WeakPolarHBondContact O-CG 3.43Å; D574-L578 PolarHBondContact O-N 3.22Å; F575-L578 PolarHBondContact O-N 3.13Å; L578-S581 WeakPolarHBondContact O-CB 3.35Å; L578-S581 PolarHBondContact O-N 2.89Å; L578-G582 PolarHBondContact O-N 3.05Å; L578-L583 HydrophobicContact CB-CD1 4.02Å; L578-L583 HydrophobicContact CD2-CD1 3.93Å; L578-L583 HydrophobicContact CG-CD1 4.49Å; L578-L583 WeakPolarHBondContact O-CB 3.28Å; L578-L583 PolarHBondContact O-N 3.39Å; L578-A588 HydrophobicContact CB-CB 3.8Å; L578-A588 HydrophobicContact CD1-CB 4.14Å; L578-M591 HydrophobicContact CD1-CB 4.41Å; L578-N592 WeakPolarHBondContact CD1-OD1 3.46Å
579	L	80.9	Confident	81.7	Confident	59 Å²	59	39 Å²	39	31%	0.309	24%	0.24	S	C	.	.	H	α-helix	trans	-62.1	-44.2	173	-71.7	-176.9	0	0	0	112	F575 A576 V577 S581 G582 V585 A588	F575-L579 HydrophobicContact CD1-CD1 4.02Å; F575-L579 HydrophobicContact CE1-CD1 3.46Å; F575-L579 VanDerWaalsContact CE1-CD1 3.46Å; F575-L579 HydrophobicContact CE1-CG 4.17Å; F575-L579 HydrophobicContact CE2-CD1 4.49Å; F575-L579 HydrophobicContact CE2-CG 4.41Å; F575-L579 HydrophobicContact CZ-CD1 3.73Å; F575-L579 HydrophobicContact CZ-CD2 4.3Å; F575-L579 HydrophobicContact CZ-CG 4.11Å; F575-L579 WeakPolarHBondContact O-CG 3.48Å; F575-L579 PolarHBondContact O-N 3.12Å; A576-L579 PolarHBondContact O-N 2.85Å; V577-L579 PolarHBondContact O-N 2.97Å; L579-S581 PolarHBondContact O-N 2.89Å; L579-G582 PolarHBondContact O-N 2.86Å; L579-V585 HydrophobicContact CD2-CB 4.39Å; L579-V585 HydrophobicContact CD2-CG2 3.75Å; L579-A588 HydrophobicContact CD2-CB 4.26Å
580	S	71.4	Confident	82.3	Confident	97 Å²	97	43.2 Å²	43.2	68%	0.678	26%	0.262	S	S	*	.	H	α-helix	trans	-64.1	-26.4	177.3	80.7	0	0	0	0	112.8	A576 V577 G582	A576-S580 WeakPolarHBondContact O-CB 3.27Å; A576-S580 PolarHBondContact O-N 2.93Å; V577-S580 PolarHBondContact O-N 3.22Å; V577-S580 PolarHBondContact O-OG 3.18Å; S580-G582 PolarHBondContact O-N 3.35Å
581	S	76.2	Confident	82.6	Confident	26 Å²	26	45.5 Å²	45.5	18%	0.182	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-2.5	173.8	-57.9	0	0	0	0	113.3	P524 V577 L578 L579	P524-S581 WeakPolarHBondContact CG-O 3.4Å; V577-S581 WeakPolarHBondContact O-CB 3.4Å; V577-S581 PolarHBondContact O-N 2.96Å; V577-S581 PolarHBondContact O-OG 3.41Å; L578-S581 WeakPolarHBondContact O-CB 3.35Å; L578-S581 PolarHBondContact O-N 2.89Å; L579-S581 PolarHBondContact O-N 2.89Å
582	G	78.1	Confident	82.7	Confident	69 Å²	69	45.5 Å²	45.5	71%	0.711	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.5	11.3	176.2	0	0	0	0	0	115.4	L578 L579 S580	L578-G582 PolarHBondContact O-N 3.05Å; L579-G582 PolarHBondContact O-N 2.86Å; S580-G582 PolarHBondContact O-N 3.35Å
583	L	82.6	Confident	83.2	Confident	22 Å²	22	49.5 Å²	49.5	12%	0.115	29%	0.291	C	S	.	.			trans	-72.3	145.2	173.6	-76.6	138.8	0	0	0	111.3	V523 A527 L578 T587 A588	V523-L583 HydrophobicContact CG1-CD1 4.43Å; V523-L583 HydrophobicContact CG1-CD2 4.36Å; A527-L583 HydrophobicContact CB-CD1 3.39Å; L578-L583 HydrophobicContact CB-CD1 4.02Å; L578-L583 HydrophobicContact CD2-CD1 3.93Å; L578-L583 HydrophobicContact CG-CD1 4.49Å; L578-L583 WeakPolarHBondContact O-CB 3.28Å; L578-L583 PolarHBondContact O-N 3.39Å; L583-T587 HydrophobicContact CD2-CG2 3.7Å; L583-A588 HydrophobicContact CB-CB 4.4Å
584	S	87.2	Confident	83.8	Confident	64 Å²	64	53.3 Å²	53.3	45%	0.448	31%	0.308	S	S	.	.			trans	-65.6	144.6	172.2	94.2	0	0	0	0	110.2	K586 T587 A588	S584-K586 PolarHBondContact O-N 3.33Å; S584-K586 VanDerWaalsContact O-N 3.13Å; S584-T587 CarbonylContact O-C 3.58Å; S584-T587 WeakPolarHBondContact O-CA 3.47Å; S584-T587 WeakPolarHBondContact O-CB 3.44Å; S584-T587 PolarHBondContact O-N 3.48Å; S584-T587 PolarHBondContact OG-N 2.93Å; S584-T587 PolarHBondContact OG-OG1 3.49Å; S584-A588 PolarHBondContact O-N 2.73Å
585	V	85.3	Confident	84.3	Confident	63 Å²	63	52.4 Å²	52.4	38%	0.382	30%	0.304	S	S	.	.	H	α-helix	trans	-45.6	-45.6	176.8	168.3	0	0	0	0	112.9	F382 F575 L579 T587 M589	F382-V585 HydrophobicContact CE1-CG1 3.72Å; F382-V585 HydrophobicContact CZ-CG1 3.52Å; F575-V585 HydrophobicContact CZ-CG1 4.31Å; L579-V585 HydrophobicContact CD2-CB 4.39Å; L579-V585 HydrophobicContact CD2-CG2 3.75Å; V585-T587 VanDerWaalsContact C-N 3.3Å; V585-T587 PolarHBondContact O-N 3.11Å; V585-M589 WeakPolarHBondContact O-CB 3.5Å; V585-M589 PolarHBondContact O-N 3.1Å
586	K	87.5	Confident	84.7	Confident	179 Å²	179	52.2 Å²	52.2	78%	0.778	30%	0.303	S	S	*	.	H	α-helix	trans	-67.5	-32.4	-179.9	-61.7	-173.4	-179.6	-176.4	0	112.5	S584 L590	S584-K586 PolarHBondContact O-N 3.33Å; S584-K586 VanDerWaalsContact O-N 3.13Å; K586-L590 VanDerWaalsContact O-CB 3.26Å; K586-L590 WeakPolarHBondContact O-CB 3.35Å; K586-L590 PolarHBondContact O-N 3.12Å
587	T	87.8	Confident	85.5	Confident	56 Å²	56	54.4 Å²	54.4	34%	0.344	31%	0.311	S	S	.	.	H	α-helix	trans	-76.2	-47.4	177.6	-46.1	0	0	0	0	110.6	L583 S584 V585 M589 L590 M591	L583-T587 HydrophobicContact CD2-CG2 3.7Å; S584-T587 CarbonylContact O-C 3.58Å; S584-T587 WeakPolarHBondContact O-CA 3.47Å; S584-T587 WeakPolarHBondContact O-CB 3.44Å; S584-T587 PolarHBondContact O-N 3.48Å; S584-T587 PolarHBondContact OG-N 2.93Å; S584-T587 PolarHBondContact OG-OG1 3.49Å; V585-T587 VanDerWaalsContact C-N 3.3Å; V585-T587 PolarHBondContact O-N 3.11Å; T587-M589 PolarHBondContact O-N 2.89Å; T587-L590 PolarHBondContact O-N 2.93Å; T587-M591 HydrophobicContact CG2-CG 4.38Å; T587-M591 VanDerWaalsContact O-CG 3.31Å; T587-M591 WeakPolarHBondContact O-CG 3.44Å; T587-M591 PolarHBondContact O-N 3.49Å
588	A	86.1	Confident	86.3	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-57	-49.8	176.5	0	0	0	0	0	111.5	F575 L578 L579 L583 S584 L590 M591 N592	F575-A588 HydrophobicContact CD2-CB 3.89Å; F575-A588 HydrophobicContact CE2-CB 3.82Å; L578-A588 HydrophobicContact CB-CB 3.8Å; L578-A588 HydrophobicContact CD1-CB 4.14Å; L579-A588 HydrophobicContact CD2-CB 4.26Å; L583-A588 HydrophobicContact CB-CB 4.4Å; S584-A588 PolarHBondContact O-N 2.73Å; A588-L590 VanDerWaalsContact C-N 3.32Å; A588-L590 PolarHBondContact O-N 3.44Å; A588-M591 PolarHBondContact O-N 3.03Å; A588-N592 PolarHBondContact O-N 3.35Å
589	M	86.4	Confident	86.9	Confident	67 Å²	67	54 Å²	54	33%	0.33	31%	0.309	S	S	.	.	H	α-helix	trans	-60.7	-38.4	176.7	-172.2	-175.8	-175.6	0	0	112.8	F575 V585 T587 F593	F575-M589 HydrophobicContact CE2-CB 4.19Å; V585-M589 WeakPolarHBondContact O-CB 3.5Å; V585-M589 PolarHBondContact O-N 3.1Å; T587-M589 PolarHBondContact O-N 2.89Å; M589-F593 WeakPolarHBondContact O-CB 3.48Å; M589-F593 PolarHBondContact O-N 2.73Å
590	L	90	Very high	87.6	Confident	94 Å²	94	53.2 Å²	53.2	49%	0.492	30%	0.303	S	S	.	.	H	α-helix	trans	-69.5	-37.3	176.6	-179.7	63.3	0	0	0	112.2	K586 T587 A588 L594	K586-L590 VanDerWaalsContact O-CB 3.26Å; K586-L590 WeakPolarHBondContact O-CB 3.35Å; K586-L590 PolarHBondContact O-N 3.12Å; T587-L590 PolarHBondContact O-N 2.93Å; A588-L590 VanDerWaalsContact C-N 3.32Å; A588-L590 PolarHBondContact O-N 3.44Å; L590-L594 HydrophobicContact CD1-CD1 4.34Å; L590-L594 HydrophobicContact CD1-CG 4.33Å; L590-L594 HydrophobicContact CG-CD1 4.11Å; L590-L594 WeakPolarHBondContact O-CB 3.33Å; L590-L594 VanDerWaalsContact O-CG 3.23Å; L590-L594 WeakPolarHBondContact O-CG 3.32Å; L590-L594 PolarHBondContact O-N 3.44Å
591	M	88.8	Confident	88.8	Confident	55 Å²	55	54.7 Å²	54.7	27%	0.271	30%	0.301	S	S	.	.	H	α-helix	trans	-69.4	-45.6	179.1	-65.2	-53.2	-66.8	0	0	111.5	I531 L578 T587 A588 L594 S595	I531-M591 HydrophobicContact CD1-CB 3.6Å; I531-M591 HydrophobicContact CD1-CE 3.82Å; I531-M591 HydrophobicContact CD1-CG 3.86Å; I531-M591 HydrophobicContact CG1-CB 4.11Å; I531-M591 HydrophobicContact CG2-CE 4.19Å; L578-M591 HydrophobicContact CD1-CB 4.41Å; T587-M591 HydrophobicContact CG2-CG 4.38Å; T587-M591 VanDerWaalsContact O-CG 3.31Å; T587-M591 WeakPolarHBondContact O-CG 3.44Å; T587-M591 PolarHBondContact O-N 3.49Å; A588-M591 PolarHBondContact O-N 3.03Å; M591-L594 PolarHBondContact O-N 2.9Å; M591-S595 WeakPolarHBondContact O-CB 3.36Å; M591-S595 PolarHBondContact O-N 3.46Å
592	N	88.5	Confident	89.6	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-58.2	-48.2	171.8	-85.4	57	0	0	0	111.3	M375 I378 E571 L578 A588 L594 S595 A596	M375-N592 HydrophobicContact CE-CB 4.11Å; I378-N592 HydrophobicContact CD1-CB 4.44Å; E571-N592 PolarHBondContact O-ND2 3.2Å; E571-N592 VanDerWaalsContact OE2-CB 3.31Å; E571-N592 WeakPolarHBondContact OE2-CB 3.3Å; E571-N592 PolarHBondContact OE2-ND2 3.05Å; L578-N592 WeakPolarHBondContact CD1-OD1 3.46Å; A588-N592 PolarHBondContact O-N 3.35Å; N592-L594 VanDerWaalsContact C-N 3.31Å; N592-L594 PolarHBondContact O-N 2.96Å; N592-S595 CarbonylContact O-C 3.55Å; N592-S595 WeakPolarHBondContact O-CA 3.49Å; N592-S595 WeakPolarHBondContact O-CB 3.46Å; N592-S595 PolarHBondContact O-N 2.75Å; N592-A596 PolarHBondContact O-N 2.97Å
593	F	90.6	Very high	90.4	Very high	89 Å²	89	50.1 Å²	50.1	39%	0.39	26%	0.258	S	S	.	.	H	α-helix	trans	-58.3	-40.7	176.7	178.8	-104.9	0	0	0	113.2	M375 M589 S595 A596 L597	M375-F593 HydrophobicContact CG-CD2 4.13Å; M375-F593 HydrophobicContact SD-CB 3.96Å; M375-F593 HydrophobicContact SD-CD2 4.28Å; M589-F593 WeakPolarHBondContact O-CB 3.48Å; M589-F593 PolarHBondContact O-N 2.73Å; F593-S595 VanDerWaalsContact C-N 3.29Å; F593-S595 PolarHBondContact O-N 3.2Å; F593-A596 PolarHBondContact O-N 3.46Å; F593-L597 HydrophobicContact CD1-CD1 4.48Å; F593-L597 HydrophobicContact CE1-CD1 3.96Å; F593-L597 HydrophobicContact CE1-CG 4.31Å; F593-L597 HydrophobicContact CE2-CD2 4.5Å; F593-L597 HydrophobicContact CZ-CD1 4.33Å; F593-L597 HydrophobicContact CZ-CD2 4.08Å; F593-L597 HydrophobicContact CZ-CG 4.31Å; F593-L597 WeakPolarHBondContact O-CG 3.41Å; F593-L597 PolarHBondContact O-N 3.42Å
594	L	91.8	Very high	91	Very high	91 Å²	91	54 Å²	54	48%	0.476	27%	0.272	S	S	.	.	H	α-helix	trans	-66.7	-31.8	175.3	-74.4	170.5	0	0	0	112.7	L590 M591 N592 L597	L590-L594 HydrophobicContact CD1-CD1 4.34Å; L590-L594 HydrophobicContact CD1-CG 4.33Å; L590-L594 HydrophobicContact CG-CD1 4.11Å; L590-L594 WeakPolarHBondContact O-CB 3.33Å; L590-L594 VanDerWaalsContact O-CG 3.23Å; L590-L594 WeakPolarHBondContact O-CG 3.32Å; L590-L594 PolarHBondContact O-N 3.44Å; M591-L594 PolarHBondContact O-N 2.9Å; N592-L594 VanDerWaalsContact C-N 3.31Å; N592-L594 PolarHBondContact O-N 2.96Å; L594-L597 HydrophobicContact CD2-CD1 4.37Å
595	S	91.9	Very high	91.2	Very high	1 Å²	1	54 Å²	54	1%	0.007	27%	0.269	C	S	.	.	H	α-helix	trans	-69.1	-48.6	175	-163.6	0	0	0	0	111.2	I531 D534 S535 M591 N592 F593 L597 T598	I531-S595 PolarHBondContact O-OG 3.3Å; D534-S595 WeakPolarHBondContact OD2-CB 3.35Å; D534-S595 PolarHBondContact OD2-OG 3.25Å; S535-S595 VanDerWaalsContact CA-OG 3.26Å; S535-S595 WeakPolarHBondContact CA-OG 3.31Å; S535-S595 PolarHBondContact N-OG 3.19Å; S535-S595 WeakPolarHBondContact OG-CA 3.41Å; S535-S595 WeakPolarHBondContact OG-CB 3.39Å; S535-S595 PolarHBondContact OG-OG 3.18Å; M591-S595 WeakPolarHBondContact O-CB 3.36Å; M591-S595 PolarHBondContact O-N 3.46Å; N592-S595 CarbonylContact O-C 3.55Å; N592-S595 WeakPolarHBondContact O-CA 3.49Å; N592-S595 WeakPolarHBondContact O-CB 3.46Å; N592-S595 PolarHBondContact O-N 2.75Å; F593-S595 VanDerWaalsContact C-N 3.29Å; F593-S595 PolarHBondContact O-N 3.2Å; S595-L597 PolarHBondContact O-N 3.11Å; S595-L597 VanDerWaalsContact O-N 3.15Å; S595-T598 VanDerWaalsContact O-CB 3.28Å; S595-T598 WeakPolarHBondContact O-CB 3.43Å; S595-T598 VanDerWaalsContact O-CG2 3.28Å; S595-T598 WeakPolarHBondContact O-CG2 3.45Å; S595-T598 PolarHBondContact O-N 3.06Å; S595-T598 PolarHBondContact O-OG1 3.33Å
596	A	91.4	Very high	91.4	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-58.1	-28.1	175.6	0	0	0	0	0	113.8	T371 N592 F593 T598 A599	T371-A596 HydrophobicContact CG2-CB 4.08Å; T371-A596 WeakPolarHBondContact CG2-O 3.28Å; N592-A596 PolarHBondContact O-N 2.97Å; F593-A596 PolarHBondContact O-N 3.46Å; A596-T598 PolarHBondContact O-N 2.03Å; A596-A599 WeakPolarHBondContact O-CB 3.35Å; A596-A599 PolarHBondContact O-N 3.17Å
597	L	93.2	Very high	91.5	Very high	68 Å²	68	42.8 Å²	42.8	36%	0.356	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-18.7	173.5	-70.8	178.6	0	0	0	113.8	F593 L594 S595 A599 F600	F593-L597 HydrophobicContact CD1-CD1 4.48Å; F593-L597 HydrophobicContact CE1-CD1 3.96Å; F593-L597 HydrophobicContact CE1-CG 4.31Å; F593-L597 HydrophobicContact CE2-CD2 4.5Å; F593-L597 HydrophobicContact CZ-CD1 4.33Å; F593-L597 HydrophobicContact CZ-CD2 4.08Å; F593-L597 HydrophobicContact CZ-CG 4.31Å; F593-L597 WeakPolarHBondContact O-CG 3.41Å; F593-L597 PolarHBondContact O-N 3.42Å; L594-L597 HydrophobicContact CD2-CD1 4.37Å; S595-L597 PolarHBondContact O-N 3.11Å; S595-L597 VanDerWaalsContact O-N 3.15Å; L597-A599 PolarHBondContact O-N 3.24Å; L597-F600 HydrophobicContact CD2-CD2 4.11Å; L597-F600 HydrophobicContact CD2-CE2 4.19Å; L597-F600 PolarHBondContact O-N 2.96Å
598	T	94.7	Very high	91.5	Very high	31 Å²	31	47.5 Å²	47.5	19%	0.19	23%	0.231	C	C	.	.	H	α-helix	trans	-65	-23.8	174.8	64.1	0	0	0	0	112.6	S535 N538 F539 S595 A596 F600 M601 G602	S535-T598 PolarHBondContact O-OG1 3.35Å; N538-T598 VanDerWaalsContact CB-OG1 3.27Å; N538-T598 WeakPolarHBondContact CB-OG1 3.31Å; F539-T598 PolarHBondContact N-OG1 3.16Å; S595-T598 VanDerWaalsContact O-CB 3.28Å; S595-T598 WeakPolarHBondContact O-CB 3.43Å; S595-T598 VanDerWaalsContact O-CG2 3.28Å; S595-T598 WeakPolarHBondContact O-CG2 3.45Å; S595-T598 PolarHBondContact O-N 3.06Å; S595-T598 PolarHBondContact O-OG1 3.33Å; A596-T598 PolarHBondContact O-N 2.03Å; T598-F600 VanDerWaalsContact C-N 3.25Å; T598-F600 PolarHBondContact O-N 3.37Å; T598-M601 WeakPolarHBondContact O-CA 3.39Å; T598-M601 WeakPolarHBondContact O-CB 3.02Å; T598-M601 PolarHBondContact O-N 3.39Å; T598-G602 PolarHBondContact O-N 3.1Å
599	A	94.9	Very high	91.5	Very high	3 Å²	3	50.4 Å²	50.4	3%	0.025	25%	0.249	C	C	.	.	H	α-helix	trans	-60.6	-32.3	172.8	0	0	0	0	0	112.8	V367 N538 G542 A596 L597 G602 L603	V367-A599 HydrophobicContact CG1-CB 3.73Å; N538-A599 HydrophobicContact CB-CB 4.42Å; N538-A599 WeakPolarHBondContact O-CA 3.27Å; N538-A599 VanDerWaalsContact O-CB 3.26Å; N538-A599 WeakPolarHBondContact O-CB 3.15Å; G542-A599 VanDerWaalsContact CA-O 3.26Å; G542-A599 WeakPolarHBondContact CA-O 3.24Å; A596-A599 WeakPolarHBondContact O-CB 3.35Å; A596-A599 PolarHBondContact O-N 3.17Å; L597-A599 PolarHBondContact O-N 3.24Å; A599-G602 PolarHBondContact O-N 3.15Å; A599-L603 VanDerWaalsContact O-CB 3.3Å; A599-L603 WeakPolarHBondContact O-CB 3.33Å; A599-L603 PolarHBondContact O-N 3.31Å
600	F	95.8	Very high	91.1	Very high	43 Å²	43	47.7 Å²	47.7	19%	0.189	24%	0.236	C	C	.	.	H	α-helix	trans	-68.8	-33.7	172.1	-70.9	-83.1	0	0	0	112.3	T364 V367 L368 T371 L597 T598 Y604	T364-F600 HydrophobicContact CG2-CD1 4.45Å; T364-F600 HydrophobicContact CG2-CE1 4.03Å; V367-F600 HydrophobicContact CB-CD1 4.39Å; V367-F600 HydrophobicContact CB-CE1 4.12Å; V367-F600 HydrophobicContact CB-CZ 4.37Å; V367-F600 HydrophobicContact CG1-CD1 3.93Å; V367-F600 HydrophobicContact CG1-CD2 3.93Å; V367-F600 HydrophobicContact CG1-CE1 3.88Å; V367-F600 HydrophobicContact CG1-CE2 3.88Å; V367-F600 HydrophobicContact CG1-CG 3.97Å; V367-F600 HydrophobicContact CG1-CZ 3.86Å; L368-F600 HydrophobicContact CB-CZ 4.17Å; L368-F600 HydrophobicContact CD1-CZ 4.33Å; T371-F600 HydrophobicContact CG2-CE2 4.08Å; L597-F600 HydrophobicContact CD2-CD2 4.11Å; L597-F600 HydrophobicContact CD2-CE2 4.19Å; L597-F600 PolarHBondContact O-N 2.96Å; T598-F600 VanDerWaalsContact C-N 3.25Å; T598-F600 PolarHBondContact O-N 3.37Å; F600-Y604 WeakPolarHBondContact O-CD2 3.43Å; F600-Y604 PolarHBondContact O-N 3.35Å
601	M	95.1	Very high	90.1	Very high	127 Å²	127	48.5 Å²	48.5	63%	0.626	25%	0.25	S	S	*	.	H	α-helix	trans	-67.4	-45.6	173.9	-62.1	-112.6	69.7	0	0	110.5	F539 T598 L603 Y604 V605	F539-M601 HydrophobicContact CD2-CB 4.23Å; F539-M601 HydrophobicContact CE2-CB 4.34Å; T598-M601 WeakPolarHBondContact O-CA 3.39Å; T598-M601 WeakPolarHBondContact O-CB 3.02Å; T598-M601 PolarHBondContact O-N 3.39Å; M601-L603 VanDerWaalsContact C-N 3.34Å; M601-L603 PolarHBondContact O-N 3.17Å; M601-Y604 PolarHBondContact O-N 3.12Å; M601-V605 WeakPolarHBondContact O-CG2 3.13Å; M601-V605 PolarHBondContact O-N 2.66Å; M601-V605 VanDerWaalsContact O-N 3.15Å
602	G	94.5	Very high	89.4	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-55.8	-47.5	173.7	0	0	0	0	0	112	F539 L543 T598 A599 Y604 V605 G606	F539-G602 WeakPolarHBondContact O-CA 3.31Å; L543-G602 WeakPolarHBondContact CA-O 3.47Å; T598-G602 PolarHBondContact O-N 3.1Å; A599-G602 PolarHBondContact O-N 3.15Å; G602-Y604 PolarHBondContact O-N 2.96Å; G602-V605 PolarHBondContact O-N 2.94Å; G602-G606 PolarHBondContact O-N 3.16Å
603	L	94.9	Very high	88.5	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-54.3	-53.8	179	177.9	70.8	0	0	0	113.1	S363 V367 G542 V545 A599 M601 V605 G606 L607	S363-L603 VanDerWaalsContact CB-CD1 3.46Å; S363-L603 WeakPolarHBondContact OG-CD1 3.26Å; V367-L603 HydrophobicContact CB-CD2 4.33Å; V367-L603 HydrophobicContact CG2-CB 4.16Å; V367-L603 HydrophobicContact CG2-CD1 4.04Å; V367-L603 HydrophobicContact CG2-CD2 3.94Å; V367-L603 HydrophobicContact CG2-CG 4.25Å; G542-L603 VanDerWaalsContact C-N 3.3Å; G542-L603 WeakPolarHBondContact O-CA 3.35Å; G542-L603 PolarHBondContact O-N 3.04Å; V545-L603 HydrophobicContact CB-CD1 4.31Å; V545-L603 HydrophobicContact CG1-CD1 3.91Å; A599-L603 VanDerWaalsContact O-CB 3.3Å; A599-L603 WeakPolarHBondContact O-CB 3.33Å; A599-L603 PolarHBondContact O-N 3.31Å; M601-L603 VanDerWaalsContact C-N 3.34Å; M601-L603 PolarHBondContact O-N 3.17Å; L603-V605 VanDerWaalsContact C-N 3.32Å; L603-V605 PolarHBondContact O-N 2.96Å; L603-G606 PolarHBondContact O-N 3.2Å; L603-L607 HydrophobicContact CD1-CD1 4.33Å; L603-L607 HydrophobicContact CD1-CG 4.41Å; L603-L607 HydrophobicContact CG-CD1 4.13Å; L603-L607 WeakPolarHBondContact O-CG 3.43Å; L603-L607 PolarHBondContact O-N 3.45Å
604	Y	93.8	Very high	87.7	Confident	104 Å²	104	54.5 Å²	54.5	41%	0.408	29%	0.291	S	S	.	.	H	α-helix	trans	-70.4	-30.4	-177.1	-66.5	-58.9	0	0	0	112.5	Y360 T364 F600 M601 G602 L607 F608	Y360-Y604 HydrophobicContact CD1-CD1 4.27Å; Y360-Y604 HydrophobicContact CD1-CE1 4.19Å; Y360-Y604 HydrophobicContact CE1-CD1 4.38Å; T364-Y604 PolarHBondContact OG1-OH 3.1Å; F600-Y604 WeakPolarHBondContact O-CD2 3.43Å; F600-Y604 PolarHBondContact O-N 3.35Å; M601-Y604 PolarHBondContact O-N 3.12Å; G602-Y604 PolarHBondContact O-N 2.96Å; Y604-L607 HydrophobicContact CD1-CD1 4.08Å; Y604-L607 HydrophobicContact CE1-CD1 4.48Å; Y604-F608 VanDerWaalsContact O-CB 3.32Å; Y604-F608 WeakPolarHBondContact O-CB 3.29Å; Y604-F608 PolarHBondContact O-N 3.12Å; Y604-F608 VanDerWaalsContact O-N 3.15Å
605	V	92.4	Very high	87.2	Confident	62 Å²	62	52.5 Å²	52.5	38%	0.376	28%	0.282	S	S	.	.	H	α-helix	trans	-65.2	-45.8	169.4	174	0	0	0	0	110.3	F539 L543 M601 G602 L603 F608 V609	F539-V605 HydrophobicContact CE2-CG2 4.46Å; L543-V605 HydrophobicContact CD1-CB 4.19Å; L543-V605 HydrophobicContact CD1-CG1 3.79Å; M601-V605 WeakPolarHBondContact O-CG2 3.13Å; M601-V605 PolarHBondContact O-N 2.66Å; M601-V605 VanDerWaalsContact O-N 3.15Å; G602-V605 PolarHBondContact O-N 2.94Å; L603-V605 VanDerWaalsContact C-N 3.32Å; L603-V605 PolarHBondContact O-N 2.96Å; V605-F608 PolarHBondContact O-N 3.39Å; V605-V609 HydrophobicContact CG1-CG2 4.04Å; V605-V609 VanDerWaalsContact O-CB 3.27Å; V605-V609 WeakPolarHBondContact O-CB 3.31Å; V605-V609 VanDerWaalsContact O-CG2 3.25Å; V605-V609 WeakPolarHBondContact O-CG2 3.39Å; V605-V609 PolarHBondContact O-N 3.14Å
606	G	89.8	Confident	86.5	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-62	-46.6	179.4	0	0	0	0	0	112.6	G602 L603 F608 S610	G602-G606 PolarHBondContact O-N 3.16Å; L603-G606 PolarHBondContact O-N 3.2Å; G606-F608 VanDerWaalsContact C-N 3.31Å; G606-F608 PolarHBondContact O-N 3.03Å; G606-S610 WeakPolarHBondContact O-CB 3.42Å; G606-S610 PolarHBondContact O-N 2.73Å
607	L	89.1	Confident	86.1	Confident	8 Å²	8	56.2 Å²	56.2	4%	0.042	30%	0.3	C	S	.	.	H	α-helix	trans	-60	-37.9	174.7	-72.8	171.1	0	0	0	113.1	K359 Y360 L603 Y604	K359-L607 HydrophobicContact CB-CD2 4.48Å; Y360-L607 HydrophobicContact CD1-CD1 3.71Å; Y360-L607 HydrophobicContact CD2-CD1 4.47Å; Y360-L607 HydrophobicContact CE1-CB 4.37Å; Y360-L607 HydrophobicContact CE1-CD1 3.89Å; Y360-L607 HydrophobicContact CG-CD1 4.02Å; L603-L607 HydrophobicContact CD1-CD1 4.33Å; L603-L607 HydrophobicContact CD1-CG 4.41Å; L603-L607 HydrophobicContact CG-CD1 4.13Å; L603-L607 WeakPolarHBondContact O-CG 3.43Å; L603-L607 PolarHBondContact O-N 3.45Å; Y604-L607 HydrophobicContact CD1-CD1 4.08Å; Y604-L607 HydrophobicContact CE1-CD1 4.48Å
608	F	87.3	Confident	85.7	Confident	155 Å²	155	57.7 Å²	57.7	68%	0.68	30%	0.3	S	S	*	.	H	α-helix	trans	-74.5	-47.1	180	-178.9	-101.2	0	0	0	111.9	Y604 V605 G606 S611	Y604-F608 VanDerWaalsContact O-CB 3.32Å; Y604-F608 WeakPolarHBondContact O-CB 3.29Å; Y604-F608 PolarHBondContact O-N 3.12Å; Y604-F608 VanDerWaalsContact O-N 3.15Å; V605-F608 PolarHBondContact O-N 3.39Å; G606-F608 VanDerWaalsContact C-N 3.31Å; G606-F608 PolarHBondContact O-N 3.03Å; F608-S611 PolarHBondContact O-OG 3.19Å
609	V	85.8	Confident	85.3	Confident	60 Å²	60	57 Å²	57	36%	0.364	30%	0.296	S	S	.	.	H	α-helix	trans	-78.1	-31.4	-172.9	174.5	0	0	0	0	112	V605 S611 V615 I619	V605-V609 HydrophobicContact CG1-CG2 4.04Å; V605-V609 VanDerWaalsContact O-CB 3.27Å; V605-V609 WeakPolarHBondContact O-CB 3.31Å; V605-V609 VanDerWaalsContact O-CG2 3.25Å; V605-V609 WeakPolarHBondContact O-CG2 3.39Å; V605-V609 PolarHBondContact O-N 3.14Å; V609-S611 PolarHBondContact O-N 3.25Å; V609-V615 HydrophobicContact CG1-CG1 3.39Å; V609-I619 HydrophobicContact CG1-CD1 4.14Å
610	S	78.1	Confident	84.9	Confident	10 Å²	10	57.2 Å²	57.2	7%	0.07	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	28.2	177.4	-170	0	0	0	0	114.2	S550 G606 D612 Q616	S550-S610 WeakPolarHBondContact CB-OG 3.44Å; G606-S610 WeakPolarHBondContact O-CB 3.42Å; G606-S610 PolarHBondContact O-N 2.73Å; S610-D612 PolarHBondContact O-N 2.83Å; S610-Q616 WeakPolarHBondContact OG-CG 3.38Å
611	S	69.7	Low	84.7	Confident	112 Å²	112	55.2 Å²	55.2	78%	0.783	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-16	170.5	-62.7	0	0	0	0	112.6	F608 V609	F608-S611 PolarHBondContact O-OG 3.19Å; V609-S611 PolarHBondContact O-N 3.25Å
612	D	73.3	Confident	84.5	Confident	79 Å²	79	51.7 Å²	51.7	42%	0.422	27%	0.273	S	S	.	.	S	Bend	trans	-118.9	134.6	178.5	-172.9	-29.7	0	0	0	109.2	S610 D614 V615 Q616	S610-D612 PolarHBondContact O-N 2.83Å; D612-D614 VanDerWaalsContact C-N 3.32Å; D612-D614 PolarHBondContact O-N 2.8Å; D612-D614 PolarHBondContact OD1-N 3.24Å; D612-V615 HydrophobicContact CB-CB 4.29Å; D612-V615 HydrophobicContact CB-CG2 3.94Å; D612-V615 PolarHBondContact O-N 3.42Å; D612-Q616 PolarHBondContact O-N 2.76Å
613	T	70.6	Confident	84.2	Confident	93 Å²	93	51.8 Å²	51.8	57%	0.571	27%	0.273	S	S	*	.	H	α-helix	trans	-66.9	-30.6	-179.1	46.3	0	0	0	0	113.1	Q616 Q617	T613-Q616 WeakPolarHBondContact O-CB 3.35Å; T613-Q616 PolarHBondContact O-N 2.82Å; T613-Q617 WeakPolarHBondContact O-CG 3.44Å; T613-Q617 PolarHBondContact O-N 2.7Å
614	D	74.3	Confident	84.1	Confident	97 Å²	97	51.8 Å²	51.8	52%	0.519	27%	0.273	S	S	.	.	H	α-helix	trans	-69.4	-44.1	179.6	-70.5	-5.3	0	0	0	109.6	D612 Q616 Q617 W618	D612-D614 VanDerWaalsContact C-N 3.32Å; D612-D614 PolarHBondContact O-N 2.8Å; D612-D614 PolarHBondContact OD1-N 3.24Å; D614-Q616 VanDerWaalsContact C-N 3.29Å; D614-Q616 PolarHBondContact O-N 3.48Å; D614-Q617 PolarHBondContact O-N 2.75Å; D614-Q617 VanDerWaalsContact O-N 3.12Å; D614-W618 PolarHBondContact O-N 2.64Å; D614-W618 VanDerWaalsContact O-N 3.1Å
615	V	80.6	Confident	84	Confident	50 Å²	50	46.9 Å²	46.9	30%	0.303	25%	0.254	S	S	.	.	H	α-helix	trans	-63.6	-36.1	177.8	-177.2	0	0	0	0	111.3	V609 D612 Q617 W618 I619	V609-V615 HydrophobicContact CG1-CG1 3.39Å; D612-V615 HydrophobicContact CB-CB 4.29Å; D612-V615 HydrophobicContact CB-CG2 3.94Å; D612-V615 PolarHBondContact O-N 3.42Å; V615-Q617 VanDerWaalsContact C-N 3.33Å; V615-Q617 PolarHBondContact O-N 3.38Å; V615-W618 PolarHBondContact O-N 3.32Å; V615-I619 HydrophobicContact CG1-CD1 4.35Å; V615-I619 WeakPolarHBondContact O-CG1 3.44Å; V615-I619 PolarHBondContact O-N 3.15Å
616	Q	77.9	Confident	83.9	Confident	20 Å²	20	45 Å²	45	9%	0.093	24%	0.242	C	C	.	.	H	α-helix	trans	-57.6	-44	172.7	-167	-162.9	-31.6	0	0	111.9	A547 S551 S610 D612 T613 D614 I619 F620	A547-Q616 HydrophobicContact CB-CG 4.01Å; S551-Q616 VanDerWaalsContact CB-NE2 3.34Å; S610-Q616 WeakPolarHBondContact OG-CG 3.38Å; D612-Q616 PolarHBondContact O-N 2.76Å; T613-Q616 WeakPolarHBondContact O-CB 3.35Å; T613-Q616 PolarHBondContact O-N 2.82Å; D614-Q616 VanDerWaalsContact C-N 3.29Å; D614-Q616 PolarHBondContact O-N 3.48Å; Q616-I619 PolarHBondContact O-N 2.93Å; Q616-F620 HydrophobicContact CG-CE2 4.08Å; Q616-F620 HydrophobicContact CG-CZ 4.05Å; Q616-F620 VanDerWaalsContact NE2-CZ 3.25Å; Q616-F620 WeakPolarHBondContact O-CG 3.34Å; Q616-F620 PolarHBondContact O-N 2.81Å
617	Q	82.1	Confident	83.9	Confident	59 Å²	59	45 Å²	45	28%	0.276	24%	0.242	S	C	.	.	H	α-helix	trans	-69.3	-34.4	179.2	-65.1	174.4	13.2	0	0	112.1	T613 D614 V615 S621	T613-Q617 WeakPolarHBondContact O-CG 3.44Å; T613-Q617 PolarHBondContact O-N 2.7Å; D614-Q617 PolarHBondContact O-N 2.75Å; D614-Q617 VanDerWaalsContact O-N 3.12Å; V615-Q617 VanDerWaalsContact C-N 3.33Å; V615-Q617 PolarHBondContact O-N 3.38Å; Q617-S621 WeakPolarHBondContact O-CB 3.4Å; Q617-S621 PolarHBondContact O-N 2.65Å
618	W	86.3	Confident	84.1	Confident	99 Å²	99	45.8 Å²	45.8	38%	0.375	25%	0.246	S	C	.	.	H	α-helix	trans	-65.2	-41.4	171.4	-79.2	102.7	0	0	0	112.6	W440 D614 V615 S621 V622	W440-W618 HydrophobicContact CB-CH2 3.9Å; W440-W618 HydrophobicContact CB-CZ2 4.05Å; W440-W618 VanDerWaalsContact O-CH2 3.24Å; W440-W618 WeakPolarHBondContact O-CH2 3.3Å; W440-W618 WeakPolarHBondContact O-CZ3 3.34Å; D614-W618 PolarHBondContact O-N 2.64Å; D614-W618 VanDerWaalsContact O-N 3.1Å; V615-W618 PolarHBondContact O-N 3.32Å; W618-S621 PolarHBondContact O-N 3.32Å; W618-V622 WeakPolarHBondContact O-CG2 3.33Å; W618-V622 PolarHBondContact O-N 2.75Å
619	I	85.7	Confident	84.2	Confident	17 Å²	17	39.5 Å²	39.5	9%	0.087	22%	0.218	C	C	.	.	H	α-helix	trans	-58	-53.7	173.7	-73	166.9	0	0	0	110.2	L543 V544 A547 V609 V615 Q616 S621 V622 T623	L543-I619 HydrophobicContact CD2-CG1 4.38Å; L543-I619 HydrophobicContact CD2-CG2 3.86Å; L543-I619 HydrophobicContact CG-CG2 3.81Å; V544-I619 HydrophobicContact CG2-CG2 4.42Å; A547-I619 HydrophobicContact CB-CD1 4.46Å; A547-I619 HydrophobicContact CB-CG2 4Å; V609-I619 HydrophobicContact CG1-CD1 4.14Å; V615-I619 HydrophobicContact CG1-CD1 4.35Å; V615-I619 WeakPolarHBondContact O-CG1 3.44Å; V615-I619 PolarHBondContact O-N 3.15Å; Q616-I619 PolarHBondContact O-N 2.93Å; I619-S621 VanDerWaalsContact C-N 3.26Å; I619-S621 PolarHBondContact O-N 2.93Å; I619-V622 PolarHBondContact O-N 3.43Å; I619-T623 PolarHBondContact O-N 3.02Å; I619-T623 PolarHBondContact O-OG1 3.16Å
620	F	87	Confident	84.2	Confident	7 Å²	7	36.7 Å²	36.7	3%	0.031	20%	0.201	C	C	.	.	H	α-helix	trans	-58.1	-39.3	178.7	-67.4	-17.7	0	0	0	112.1	L413 I417 V544 A547 A548 Q616 T623 A624	L413-F620 HydrophobicContact CD2-CB 4.4Å; L413-F620 HydrophobicContact CD2-CD1 4.25Å; L413-F620 HydrophobicContact CD2-CG 4.29Å; I417-F620 HydrophobicContact CD1-CB 4.16Å; I417-F620 HydrophobicContact CG1-CB 3.86Å; V544-F620 HydrophobicContact CG1-CD1 4.14Å; V544-F620 HydrophobicContact CG1-CE1 3.99Å; V544-F620 HydrophobicContact CG2-CD1 4.46Å; A547-F620 HydrophobicContact CB-CD1 4.3Å; A547-F620 HydrophobicContact CB-CE1 3.63Å; A547-F620 HydrophobicContact CB-CZ 4.26Å; A548-F620 HydrophobicContact CB-CZ 4.34Å; Q616-F620 HydrophobicContact CG-CE2 4.08Å; Q616-F620 HydrophobicContact CG-CZ 4.05Å; Q616-F620 VanDerWaalsContact NE2-CZ 3.25Å; Q616-F620 WeakPolarHBondContact O-CG 3.34Å; Q616-F620 PolarHBondContact O-N 2.81Å; F620-T623 PolarHBondContact O-N 3.14Å; F620-A624 VanDerWaalsContact O-CB 3.31Å; F620-A624 WeakPolarHBondContact O-CB 3.31Å; F620-A624 PolarHBondContact O-N 3.03Å
621	S	90.3	Very high	84.7	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.007	20%	0.197	C	C	.	.	H	α-helix	trans	-65.7	-47.6	179.5	-167	0	0	0	0	113.4	K441 L445 Q617 W618 I619 T623 A624 G625	K441-S621 PolarHBondContact O-OG 2.94Å; L445-S621 VanDerWaalsContact CA-O 3.31Å; L445-S621 WeakPolarHBondContact CA-O 3.43Å; L445-S621 PolarHBondContact N-OG 3.36Å; L445-S621 VanDerWaalsContact N-OG 3.15Å; Q617-S621 WeakPolarHBondContact O-CB 3.4Å; Q617-S621 PolarHBondContact O-N 2.65Å; W618-S621 PolarHBondContact O-N 3.32Å; I619-S621 VanDerWaalsContact C-N 3.26Å; I619-S621 PolarHBondContact O-N 2.93Å; S621-T623 VanDerWaalsContact C-N 3.35Å; S621-T623 PolarHBondContact O-N 3.26Å; S621-A624 PolarHBondContact O-N 3.16Å; S621-G625 PolarHBondContact O-N 3.23Å
622	V	90.9	Very high	85.6	Confident	53 Å²	53	35.1 Å²	35.1	32%	0.321	18%	0.182	S	C	.	.	H	α-helix	trans	-61.8	-44.5	176.8	173.7	0	0	0	0	110.4	W618 I619 G625 I626	W618-V622 WeakPolarHBondContact O-CG2 3.33Å; W618-V622 PolarHBondContact O-N 2.75Å; I619-V622 PolarHBondContact O-N 3.43Å; V622-G625 PolarHBondContact O-N 3.21Å; V622-I626 HydrophobicContact CG1-CD1 4.03Å; V622-I626 WeakPolarHBondContact O-CG1 3.3Å; V622-I626 PolarHBondContact O-N 3.26Å
623	T	89.3	Confident	86.2	Confident	2 Å²	2	33.7 Å²	33.7	1%	0.012	18%	0.181	C	C	.	.	H	α-helix	trans	-70	-35.8	-179.6	-53.8	0	0	0	0	113.3	A540 V544 I619 F620 S621 G625 I626 F627	A540-T623 HydrophobicContact CB-CG2 4.09Å; V544-T623 VanDerWaalsContact CG2-CB 3.45Å; V544-T623 HydrophobicContact CG2-CG2 3.44Å; V544-T623 VanDerWaalsContact CG2-CG2 3.44Å; V544-T623 WeakPolarHBondContact CG2-OG1 3.24Å; I619-T623 PolarHBondContact O-N 3.02Å; I619-T623 PolarHBondContact O-OG1 3.16Å; F620-T623 PolarHBondContact O-N 3.14Å; S621-T623 VanDerWaalsContact C-N 3.35Å; S621-T623 PolarHBondContact O-N 3.26Å; T623-G625 PolarHBondContact O-N 3.36Å; T623-I626 WeakPolarHBondContact O-CA 3.46Å; T623-I626 WeakPolarHBondContact O-CB 3.25Å; T623-I626 PolarHBondContact O-N 3.29Å; T623-F627 HydrophobicContact CG2-CD1 3.81Å; T623-F627 HydrophobicContact CG2-CD2 4.17Å; T623-F627 HydrophobicContact CG2-CE1 3.45Å; T623-F627 VanDerWaalsContact CG2-CE1 3.45Å; T623-F627 HydrophobicContact CG2-CE2 3.84Å; T623-F627 HydrophobicContact CG2-CG 4.17Å; T623-F627 HydrophobicContact CG2-CZ 3.47Å; T623-F627 VanDerWaalsContact CG2-CZ 3.47Å; T623-F627 WeakPolarHBondContact O-CG 2.97Å; T623-F627 PolarHBondContact O-N 3.24Å
624	A	91.9	Very high	86.6	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-57.8	-35.4	171.5	0	0	0	0	0	111.9	A409 L413 I414 I417 L445 F620 S621 L628	A409-A624 HydrophobicContact CB-CB 4.49Å; L413-A624 HydrophobicContact CB-CB 3.82Å; L413-A624 HydrophobicContact CD1-CB 4.06Å; I414-A624 HydrophobicContact CG1-CB 4.24Å; I417-A624 HydrophobicContact CD1-CB 4.13Å; L445-A624 HydrophobicContact CD1-CB 3.96Å; F620-A624 VanDerWaalsContact O-CB 3.31Å; F620-A624 WeakPolarHBondContact O-CB 3.31Å; F620-A624 PolarHBondContact O-N 3.03Å; S621-A624 PolarHBondContact O-N 3.16Å; A624-L628 WeakPolarHBondContact O-CB 3.25Å; A624-L628 WeakPolarHBondContact O-CG 3.47Å; A624-L628 PolarHBondContact O-N 3.5Å; A624-L628 VanDerWaalsContact O-N 3.11Å
625	G	92.2	Very high	86.9	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-66.5	-43.6	171.5	0	0	0	0	0	113.3	L445 I449 S621 V622 T623 L628 Y629	L445-G625 WeakPolarHBondContact O-CA 3.38Å; I449-G625 WeakPolarHBondContact CG1-O 3.5Å; S621-G625 PolarHBondContact O-N 3.23Å; V622-G625 PolarHBondContact O-N 3.21Å; T623-G625 PolarHBondContact O-N 3.36Å; G625-L628 PolarHBondContact O-N 3.11Å; G625-Y629 PolarHBondContact O-N 3.15Å
626	I	90.4	Very high	87.1	Confident	24 Å²	24	28.7 Å²	28.7	12%	0.123	15%	0.147	C	C	.	.	H	α-helix	trans	-61.8	-48.6	176.8	-67.4	167.7	0	0	0	110.7	F452 A540 V622 T623 L628 Y629 L630	F452-I626 HydrophobicContact CB-CG1 4.47Å; F452-I626 HydrophobicContact CD2-CG1 4.16Å; F452-I626 HydrophobicContact CD2-CG2 3.72Å; F452-I626 HydrophobicContact CE2-CG2 3.96Å; F452-I626 HydrophobicContact CG-CG2 4.4Å; A540-I626 HydrophobicContact CB-CD1 4.44Å; V622-I626 HydrophobicContact CG1-CD1 4.03Å; V622-I626 WeakPolarHBondContact O-CG1 3.3Å; V622-I626 PolarHBondContact O-N 3.26Å; T623-I626 WeakPolarHBondContact O-CA 3.46Å; T623-I626 WeakPolarHBondContact O-CB 3.25Å; T623-I626 PolarHBondContact O-N 3.29Å; I626-L628 VanDerWaalsContact C-N 3.35Å; I626-L628 PolarHBondContact O-N 3.29Å; I626-Y629 WeakPolarHBondContact O-CB 3.49Å; I626-Y629 PolarHBondContact O-N 3.14Å; I626-L630 HydrophobicContact CG2-CD1 3.58Å; I626-L630 HydrophobicContact CG2-CG 4.29Å; I626-L630 WeakPolarHBondContact O-CG 3.3Å; I626-L630 PolarHBondContact O-N 2.88Å
627	F	90	Very high	87.2	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-62.5	-36.9	178.2	-69.3	-5.6	0	0	0	113.1	L405 D408 A409 L413 D541 T623 L630 S631	L405-F627 HydrophobicContact CD2-CB 4.24Å; L405-F627 HydrophobicContact CD2-CD1 3.94Å; L405-F627 HydrophobicContact CD2-CD2 4.49Å; L405-F627 HydrophobicContact CD2-CE1 4.38Å; L405-F627 HydrophobicContact CD2-CG 3.99Å; D408-F627 VanDerWaalsContact OD2-CE2 3.3Å; D408-F627 WeakPolarHBondContact OD2-CE2 3.04Å; A409-F627 HydrophobicContact CB-CB 4Å; L413-F627 HydrophobicContact CD1-CD2 3.78Å; L413-F627 HydrophobicContact CD1-CE2 3.9Å; D541-F627 WeakPolarHBondContact OD1-CE1 3.2Å; D541-F627 WeakPolarHBondContact OD1-CZ 3.44Å; T623-F627 HydrophobicContact CG2-CD1 3.81Å; T623-F627 HydrophobicContact CG2-CD2 4.17Å; T623-F627 HydrophobicContact CG2-CE1 3.45Å; T623-F627 VanDerWaalsContact CG2-CE1 3.45Å; T623-F627 HydrophobicContact CG2-CE2 3.84Å; T623-F627 HydrophobicContact CG2-CG 4.17Å; T623-F627 HydrophobicContact CG2-CZ 3.47Å; T623-F627 VanDerWaalsContact CG2-CZ 3.47Å; T623-F627 WeakPolarHBondContact O-CG 2.97Å; T623-F627 PolarHBondContact O-N 3.24Å; F627-L630 HydrophobicContact CD1-CD1 4.43Å; F627-S631 WeakPolarHBondContact O-CB 3.39Å; F627-S631 PolarHBondContact O-N 3.03Å; F627-S631 PolarHBondContact O-OG 3.09Å
628	L	92.6	Very high	86.9	Confident	23 Å²	23	31.4 Å²	31.4	12%	0.12	16%	0.163	C	C	.	.	H	α-helix	trans	-65	-39.1	171.4	-79.8	172.1	0	0	0	112.5	A409 L410 I414 L445 A624 G625 I626 S631 L632	A409-L628 HydrophobicContact CB-CD2 4.16Å; A409-L628 HydrophobicContact CB-CG 3.78Å; L410-L628 HydrophobicContact CD1-CD2 4.43Å; L410-L628 HydrophobicContact CD2-CD2 4.17Å; L410-L628 HydrophobicContact CG-CD2 4.07Å; I414-L628 HydrophobicContact CD1-CD1 4.08Å; L445-L628 HydrophobicContact CD1-CD1 4.32Å; L445-L628 HydrophobicContact CD2-CD1 4.24Å; A624-L628 WeakPolarHBondContact O-CB 3.25Å; A624-L628 WeakPolarHBondContact O-CG 3.47Å; A624-L628 PolarHBondContact O-N 3.5Å; A624-L628 VanDerWaalsContact O-N 3.11Å; G625-L628 PolarHBondContact O-N 3.11Å; I626-L628 VanDerWaalsContact C-N 3.35Å; I626-L628 PolarHBondContact O-N 3.29Å; L628-S631 PolarHBondContact O-OG 3.4Å; L628-L632 HydrophobicContact CD2-CD1 4.14Å; L628-L632 VanDerWaalsContact O-CB 3.31Å; L628-L632 WeakPolarHBondContact O-CB 3.22Å; L628-L632 WeakPolarHBondContact O-CG 3.07Å; L628-L632 PolarHBondContact O-N 3.12Å; L628-L632 VanDerWaalsContact O-N 3.17Å
629	Y	89.9	Confident	86.4	Confident	24 Å²	24	27 Å²	27	9%	0.094	15%	0.147	C	C	.	.	H	α-helix	trans	-65.4	-53.4	176.2	-173.8	-94.2	0	0	0	111.3	I449 F452 F453 E456 G625 I626 S631 L632 A633	I449-Y629 HydrophobicContact CG2-CD2 4.06Å; F452-Y629 HydrophobicContact CB-CD1 4.15Å; F452-Y629 HydrophobicContact CB-CG 4.47Å; F452-Y629 AromaticContact CD1-CD1 3.6Å; F452-Y629 HydrophobicContact CD1-CD1 3.6Å; F452-Y629 AromaticContact CD1-CE1 3.84Å; F452-Y629 HydrophobicContact CD1-CE1 3.84Å; F452-Y629 HydrophobicContact CE1-CD1 4.45Å; F452-Y629 HydrophobicContact CG-CD1 4.23Å; F453-Y629 HydrophobicContact CB-CD2 4.46Å; F453-Y629 HydrophobicContact CB-CE2 3.74Å; F453-Y629 HydrophobicContact CD2-CE2 4.18Å; F453-Y629 HydrophobicContact CG-CE2 4.45Å; E456-Y629 WeakPolarHBondContact OE2-CE1 3.2Å; E456-Y629 PolarHBondContact OE2-OH 2.52Å; G625-Y629 PolarHBondContact O-N 3.15Å; I626-Y629 WeakPolarHBondContact O-CB 3.49Å; I626-Y629 PolarHBondContact O-N 3.14Å; Y629-S631 PolarHBondContact O-N 3.49Å; Y629-L632 PolarHBondContact O-N 3.18Å; Y629-A633 HydrophobicContact CD1-CB 4.44Å; Y629-A633 HydrophobicContact CD2-CB 3.89Å; Y629-A633 HydrophobicContact CE1-CB 4.29Å; Y629-A633 HydrophobicContact CE2-CB 3.73Å; Y629-A633 HydrophobicContact CG-CB 4.25Å; Y629-A633 WeakPolarHBondContact O-CA 3.28Å; Y629-A633 WeakPolarHBondContact O-CB 3.09Å; Y629-A633 PolarHBondContact O-N 2.83Å
630	L	85.3	Confident	86	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.005	17%	0.172	C	C	.	.	I	π-helix	trans	-56.8	-49.7	-179.3	-69	163.7	0	0	0	111.9	F452 H537 I626 F627 E634 M635	F452-L630 HydrophobicContact CD1-CD2 4.36Å; F452-L630 HydrophobicContact CE1-CD2 3.6Å; F452-L630 HydrophobicContact CE1-CG 4.38Å; F452-L630 HydrophobicContact CZ-CD2 3.75Å; F452-L630 HydrophobicContact CZ-CG 4.46Å; H537-L630 HydrophobicContact CB-CD1 4.18Å; I626-L630 HydrophobicContact CG2-CD1 3.58Å; I626-L630 HydrophobicContact CG2-CG 4.29Å; I626-L630 WeakPolarHBondContact O-CG 3.3Å; I626-L630 PolarHBondContact O-N 2.88Å; F627-L630 HydrophobicContact CD1-CD1 4.43Å; L630-E634 WeakPolarHBondContact CD2-OE2 3.35Å; L630-E634 WeakPolarHBondContact O-CB 3.38Å; L630-E634 PolarHBondContact O-N 2.87Å; L630-M635 PolarHBondContact O-N 3.46Å
631	S	88.6	Confident	85.5	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.2	C	C	.	.	I	π-helix	trans	-65.7	-43.1	-179	56.5	0	0	0	0	113.6	F627 L628 Y629 L636	F627-S631 WeakPolarHBondContact O-CB 3.39Å; F627-S631 PolarHBondContact O-N 3.03Å; F627-S631 PolarHBondContact O-OG 3.09Å; L628-S631 PolarHBondContact O-OG 3.4Å; Y629-S631 PolarHBondContact O-N 3.49Å; S631-L636 VanDerWaalsContact O-CB 3.27Å; S631-L636 WeakPolarHBondContact O-CB 3.26Å; S631-L636 PolarHBondContact O-N 3.41Å; S631-L636 VanDerWaalsContact O-N 3.12Å
632	L	89.3	Confident	84.8	Confident	89 Å²	89	41.7 Å²	41.7	47%	0.466	22%	0.215	S	C	.	.	I	π-helix	trans	-95.9	-32	-170.9	-59.6	178.1	0	0	0	114.7	L628 Y629 L636 P637	L628-L632 HydrophobicContact CD2-CD1 4.14Å; L628-L632 VanDerWaalsContact O-CB 3.31Å; L628-L632 WeakPolarHBondContact O-CB 3.22Å; L628-L632 WeakPolarHBondContact O-CG 3.07Å; L628-L632 PolarHBondContact O-N 3.12Å; L628-L632 VanDerWaalsContact O-N 3.17Å; Y629-L632 PolarHBondContact O-N 3.18Å; L632-L636 HydrophobicContact CD2-CD2 4.18Å; L632-P637 WeakPolarHBondContact O-CD 3.43Å
633	A	84.8	Confident	84	Confident	49 Å²	49	48 Å²	48	41%	0.405	24%	0.238	S	C	.	.	I	π-helix	trans	-97	-27.5	-175.7	0	0	0	0	0	113.4	Y629 P637	Y629-A633 HydrophobicContact CD1-CB 4.44Å; Y629-A633 HydrophobicContact CD2-CB 3.89Å; Y629-A633 HydrophobicContact CE1-CB 4.29Å; Y629-A633 HydrophobicContact CE2-CB 3.73Å; Y629-A633 HydrophobicContact CG-CB 4.25Å; Y629-A633 WeakPolarHBondContact O-CA 3.28Å; Y629-A633 WeakPolarHBondContact O-CB 3.09Å; Y629-A633 PolarHBondContact O-N 2.83Å; A633-P637 WeakPolarHBondContact O-CG 3.47Å
634	E	79.3	Confident	83.6	Confident	67 Å²	67	49.3 Å²	49.3	31%	0.313	25%	0.246	S	C	.	.	I	π-helix	trans	-107.7	-61.1	-176.9	-177.7	160.1	-153.5	0	0	112.1	L630 P637	L630-E634 WeakPolarHBondContact CD2-OE2 3.35Å; L630-E634 WeakPolarHBondContact O-CB 3.38Å; L630-E634 PolarHBondContact O-N 2.87Å; E634-P637 WeakPolarHBondContact O-CD 3.37Å
635	M	80.1	Confident	83	Confident	16 Å²	16	55.8 Å²	55.8	8%	0.079	28%	0.281	C	S	.	.	I	π-helix	trans	-73.8	-45.4	-173.4	-63.7	-160.7	113	0	0	114.1	A401 V402 L405 H570 L630 E638 M639	A401-M635 HydrophobicContact CB-CE 4.18Å; A401-M635 HydrophobicContact CB-SD 4Å; V402-M635 HydrophobicContact CG2-CB 3.5Å; V402-M635 VanDerWaalsContact CG2-CB 3.5Å; L405-M635 HydrophobicContact CD1-SD 3.87Å; H570-M635 HydrophobicContact CB-CE 4.07Å; H570-M635 WeakPolarHBondContact CD2-CE 3.49Å; L630-M635 PolarHBondContact O-N 3.46Å; M635-E638 PolarHBondContact O-N 2.94Å; M635-M639 PolarHBondContact O-N 3.4Å
636	L	84.4	Confident	82.6	Confident	52 Å²	52	63.5 Å²	63.5	27%	0.272	31%	0.31	S	S	.	.	H	α-helix	trans	-62.1	-39.3	-178.2	-178.1	72.8	0	0	0	113.4	V402 S631 L632 M639 N640	V402-L636 HydrophobicContact CG1-CB 4.24Å; V402-L636 HydrophobicContact CG1-CD1 4.19Å; S631-L636 VanDerWaalsContact O-CB 3.27Å; S631-L636 WeakPolarHBondContact O-CB 3.26Å; S631-L636 PolarHBondContact O-N 3.41Å; S631-L636 VanDerWaalsContact O-N 3.12Å; L632-L636 HydrophobicContact CD2-CD2 4.18Å; L636-M639 HydrophobicContact CD1-CE 3.76Å; L636-N640 PolarHBondContact O-N 3.28Å; L636-N640 PolarHBondContact O-ND2 2.87Å
637	P	81.7	Confident	82.4	Confident	45 Å²	45	66.7 Å²	66.7	29%	0.292	33%	0.332	S	S	.	.	H	α-helix	trans	-67.6	-34.3	173.3	-26.9	39.2	0	0	0	114	L632 A633 E634 N640 R641	L632-P637 WeakPolarHBondContact O-CD 3.43Å; A633-P637 WeakPolarHBondContact O-CG 3.47Å; E634-P637 WeakPolarHBondContact O-CD 3.37Å; P637-N640 PolarHBondContact O-N 3.44Å; P637-R641 WeakPolarHBondContact O-CG 3.07Å; P637-R641 PolarHBondContact O-N 3.15Å
638	E	74.6	Confident	82.3	Confident	90 Å²	90	73.8 Å²	73.8	42%	0.421	36%	0.363	S	S	.	.	H	α-helix	trans	-71.5	-38.8	-179.7	-163.9	54.3	-145	0	0	111.7	M635 N640 R641	M635-E638 PolarHBondContact O-N 2.94Å; E638-N640 PolarHBondContact O-N 3.39Å; E638-R641 PolarHBondContact O-N 3.29Å; E638-R641 WeakPolarHBondContact OE2-CD 3.13Å; E638-R641 IonicContact OE2-CZ 3.74Å; E638-R641 IonicContact OE2-NE 3.92Å; E638-R641 IonicContact OE2-NH1 2.82Å; E638-R641 PolarHBondContact OE2-NH1 3.34Å
639	M	76.7	Confident	82.1	Confident	8 Å²	8	75.4 Å²	75.4	4%	0.039	37%	0.374	C	S	.	.	H	α-helix	trans	-52.6	-36.3	168.8	-168.3	-175.4	77.3	0	0	112.7	Q395 V398 M635 L636 Q654 L658	Q395-M639 PolarHBondContact OE1-O 3.13Å; V398-M639 HydrophobicContact CG1-CB 3.97Å; V398-M639 HydrophobicContact CG1-CG 4.22Å; M635-M639 PolarHBondContact O-N 3.4Å; L636-M639 HydrophobicContact CD1-CE 3.76Å; M639-Q654 HydrophobicContact CE-CB 4.02Å; M639-Q654 HydrophobicContact CE-CG 4.31Å; M639-Q654 HydrophobicContact CG-CB 4.4Å; M639-Q654 HydrophobicContact CG-CG 3.73Å; M639-Q654 PolarHBondContact O-NE2 3.28Å; M639-Q654 HydrophobicContact SD-CB 3.79Å; M639-Q654 HydrophobicContact SD-CG 3.77Å; M639-L658 HydrophobicContact CE-CD1 4.29Å
640	N	77.5	Confident	82	Confident	114 Å²	114	74.6 Å²	74.6	61%	0.61	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-9.4	179.4	-76.4	-60.2	0	0	0	114.8	L636 P637 E638	L636-N640 PolarHBondContact O-N 3.28Å; L636-N640 PolarHBondContact O-ND2 2.87Å; P637-N640 PolarHBondContact O-N 3.44Å; E638-N640 PolarHBondContact O-N 3.39Å
641	R	76.4	Confident	82.2	Confident	167 Å²	167	80.2 Å²	80.2	63%	0.63	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-17.5	-178.1	-74.7	168.3	177.5	170	1.7	114.1	P637 E638 K643	P637-R641 WeakPolarHBondContact O-CG 3.07Å; P637-R641 PolarHBondContact O-N 3.15Å; E638-R641 PolarHBondContact O-N 3.29Å; E638-R641 WeakPolarHBondContact OE2-CD 3.13Å; E638-R641 IonicContact OE2-CZ 3.74Å; E638-R641 IonicContact OE2-NE 3.92Å; E638-R641 IonicContact OE2-NH1 2.82Å; E638-R641 PolarHBondContact OE2-NH1 3.34Å; R641-K643 PolarHBondContact O-N 3.45Å
642	V	74.9	Confident	82.4	Confident	51 Å²	51	84.8 Å²	84.8	31%	0.309	42%	0.42	S	S	.	.			trans	-70.4	118.3	-175.5	-178.9	0	0	0	0	111.4	Q395 M650	Q395-V642 HydrophobicContact CG-CG1 4.44Å; V642-M650 HydrophobicContact CG1-CE 3.83Å
643	K	74.6	Confident	82.4	Confident	185 Å²	185	82.4 Å²	82.4	80%	0.804	41%	0.407	S	S	*	.			trans	-87.4	133.8	174.4	-63.1	-178.7	-178.9	179.7	0	110.1	R641	R641-K643 PolarHBondContact O-N 3.45Å
644	T	79.4	Confident	82.7	Confident	31 Å²	31	80.9 Å²	80.9	19%	0.19	39%	0.392	C	S	.	.			trans	-139.2	156.1	175.8	177.6	0	0	0	0	111.3	R646 M650	T644-R646 PolarHBondContact O-N 3.13Å; T644-R646 PolarHBondContact OG1-N 3.43Å; T644-R646 VanDerWaalsContact OG1-N 3.16Å; T644-M650 HydrophobicContact CG2-CB 3.71Å; T644-M650 HydrophobicContact CG2-CE 3.72Å; T644-M650 HydrophobicContact CG2-CG 4.14Å
645	N	79.6	Confident	83.4	Confident	135 Å²	135	80.6 Å²	80.6	72%	0.722	39%	0.392	S	S	*	.	S	Bend	trans	-68.8	-11	169.9	-64.9	-52.3	0	0	0	113.4	E388	E388-N645 PolarHBondContact OE1-ND2 3.46Å
646	R	84.9	Confident	84.1	Confident	162 Å²	162	83.7 Å²	83.7	61%	0.611	41%	0.409	S	S	*	.			trans	-127.9	67.1	-178.5	-63.6	-174.6	179.7	174.3	1.6	112.9	T644 F648 V649 M650	T644-R646 PolarHBondContact O-N 3.13Å; T644-R646 PolarHBondContact OG1-N 3.43Å; T644-R646 VanDerWaalsContact OG1-N 3.16Å; R646-F648 VanDerWaalsContact C-N 3.31Å; R646-F648 PolarHBondContact O-N 3.45Å; R646-V649 HydrophobicContact CB-CB 4.06Å; R646-V649 HydrophobicContact CB-CG2 4.1Å; R646-V649 PolarHBondContact O-N 2.87Å; R646-V649 VanDerWaalsContact O-N 3.1Å; R646-M650 PolarHBondContact O-N 3.29Å; R646-M650 VanDerWaalsContact O-N 3.08Å
647	P	85.5	Confident	84.4	Confident	92 Å²	92	81.2 Å²	81.2	60%	0.597	40%	0.396	S	S	*	.	H	α-helix	trans	-59.1	-35.7	-172.9	23.1	-34.4	0	0	0	114	M650 F651	P647-M650 PolarHBondContact O-N 2.89Å; P647-F651 WeakPolarHBondContact O-CB 3.2Å; P647-F651 PolarHBondContact O-N 2.95Å
648	F	88.9	Confident	84.9	Confident	148 Å²	148	79.8 Å²	79.8	65%	0.649	39%	0.386	S	S	*	.	H	α-helix	trans	-67.8	-37.8	177.5	-176.9	-102.2	0	0	0	113.2	R646 L652	R646-F648 VanDerWaalsContact C-N 3.31Å; R646-F648 PolarHBondContact O-N 3.45Å; F648-L652 HydrophobicContact CD1-CD1 4.19Å; F648-L652 HydrophobicContact CE1-CD1 3.53Å; F648-L652 HydrophobicContact CZ-CD1 3.88Å; F648-L652 PolarHBondContact O-N 3.16Å; F648-L652 VanDerWaalsContact O-N 3.07Å
649	V	88.2	Confident	85.9	Confident	58 Å²	58	80.2 Å²	80.2	35%	0.352	39%	0.39	S	S	.	.	H	α-helix	trans	-69.1	-40.6	176.8	-179.6	0	0	0	0	110.1	L392 R646 L652 L653	L392-V649 HydrophobicContact CD2-CG1 4.4Å; R646-V649 HydrophobicContact CB-CB 4.06Å; R646-V649 HydrophobicContact CB-CG2 4.1Å; R646-V649 PolarHBondContact O-N 2.87Å; R646-V649 VanDerWaalsContact O-N 3.1Å; V649-L652 PolarHBondContact O-N 2.88Å; V649-L653 HydrophobicContact CG1-CD1 4.01Å; V649-L653 HydrophobicContact CG1-CG 4.42Å; V649-L653 WeakPolarHBondContact O-CG 3.15Å; V649-L653 PolarHBondContact O-N 2.84Å
650	M	87.4	Confident	86.7	Confident	6 Å²	6	84 Å²	84	3%	0.03	41%	0.41	C	S	.	.	H	α-helix	trans	-58.8	-51.7	174.3	-172.4	67.1	87.4	0	0	111.8	L392 Q395 V642 T644 R646 P647 L652 L653 Q654	L392-M650 HydrophobicContact CD2-CE 4.12Å; L392-M650 HydrophobicContact CD2-SD 4.28Å; Q395-M650 HydrophobicContact CB-CE 4.24Å; Q395-M650 HydrophobicContact CB-SD 3.33Å; Q395-M650 WeakPolarHBondContact CB-SD 3.41Å; Q395-M650 HydrophobicContact CG-CE 3.82Å; Q395-M650 HydrophobicContact CG-SD 3.5Å; Q395-M650 WeakPolarHBondContact CG-SD 3.43Å; V642-M650 HydrophobicContact CG1-CE 3.83Å; T644-M650 HydrophobicContact CG2-CB 3.71Å; T644-M650 HydrophobicContact CG2-CE 3.72Å; T644-M650 HydrophobicContact CG2-CG 4.14Å; R646-M650 PolarHBondContact O-N 3.29Å; R646-M650 VanDerWaalsContact O-N 3.08Å; P647-M650 PolarHBondContact O-N 2.89Å; M650-L652 VanDerWaalsContact C-N 3.28Å; M650-L652 PolarHBondContact O-N 2.85Å; M650-L653 PolarHBondContact O-N 3.44Å; M650-L653 VanDerWaalsContact O-N 3.13Å; M650-Q654 HydrophobicContact CG-CG 4.31Å; M650-Q654 WeakPolarHBondContact O-CB 3.04Å; M650-Q654 VanDerWaalsContact O-CG 3.3Å; M650-Q654 WeakPolarHBondContact O-CG 3.46Å; M650-Q654 PolarHBondContact O-N 3.43Å; M650-Q654 HydrophobicContact SD-CG 4.41Å
651	F	90	Very high	87.3	Confident	120 Å²	120	78.5 Å²	78.5	53%	0.526	38%	0.381	S	S	.	.	H	α-helix	trans	-55	-43.8	176.6	175.5	-94.5	0	0	0	112	P647 N655	P647-F651 WeakPolarHBondContact O-CB 3.2Å; P647-F651 PolarHBondContact O-N 2.95Å; F651-N655 WeakPolarHBondContact CD2-ND2 3.14Å; F651-N655 VanDerWaalsContact CE2-ND2 3.31Å; F651-N655 WeakPolarHBondContact CE2-ND2 3.26Å; F651-N655 WeakPolarHBondContact CZ-ND2 3.24Å; F651-N655 WeakPolarHBondContact O-CB 3.37Å; F651-N655 PolarHBondContact O-N 3.27Å; F651-N655 VanDerWaalsContact O-N 3.1Å; F651-N655 PolarHBondContact O-ND2 3.2Å
652	L	92	Very high	88.2	Confident	96 Å²	96	75.7 Å²	75.7	50%	0.503	37%	0.37	S	S	.	.	H	α-helix	trans	-62.9	-45.1	176.3	-105.9	167.8	0	0	0	112.6	F648 V649 M650 L656	F648-L652 HydrophobicContact CD1-CD1 4.19Å; F648-L652 HydrophobicContact CE1-CD1 3.53Å; F648-L652 HydrophobicContact CZ-CD1 3.88Å; F648-L652 PolarHBondContact O-N 3.16Å; F648-L652 VanDerWaalsContact O-N 3.07Å; V649-L652 PolarHBondContact O-N 2.88Å; M650-L652 VanDerWaalsContact C-N 3.28Å; M650-L652 PolarHBondContact O-N 2.85Å; L652-L656 WeakPolarHBondContact O-CB 3.37Å; L652-L656 PolarHBondContact O-N 3.07Å
653	L	90.4	Very high	89	Confident	38 Å²	38	76.6 Å²	76.6	20%	0.199	38%	0.376	C	S	.	.	H	α-helix	trans	-68.2	-41.4	-179.5	-71.8	173	0	0	0	112.4	L392 L396 V649 M650 L656 G657	L392-L653 HydrophobicContact CB-CD1 3.84Å; L392-L653 HydrophobicContact CD2-CD1 4.09Å; L392-L653 HydrophobicContact CG-CD1 4.46Å; L396-L653 HydrophobicContact CB-CB 4.33Å; L396-L653 HydrophobicContact CB-CD2 4.47Å; L396-L653 HydrophobicContact CD1-CD2 4.43Å; L396-L653 VanDerWaalsContact CD1-O 3.26Å; L396-L653 WeakPolarHBondContact CD1-O 3.35Å; L396-L653 HydrophobicContact CD2-CD2 4.48Å; V649-L653 HydrophobicContact CG1-CD1 4.01Å; V649-L653 HydrophobicContact CG1-CG 4.42Å; V649-L653 WeakPolarHBondContact O-CG 3.15Å; V649-L653 PolarHBondContact O-N 2.84Å; M650-L653 PolarHBondContact O-N 3.44Å; M650-L653 VanDerWaalsContact O-N 3.13Å; L653-L656 PolarHBondContact O-N 3.24Å; L653-G657 PolarHBondContact O-N 3.21Å
654	Q	91	Very high	89.7	Confident	17 Å²	17	69.8 Å²	69.8	8%	0.079	35%	0.351	C	S	.	.	H	α-helix	trans	-61.7	-48.5	176.5	-71.8	171.3	-20.4	0	0	111.4	Q395 M639 M650 G657 L658	Q395-Q654 HydrophobicContact CB-CG 4.35Å; M639-Q654 HydrophobicContact CE-CB 4.02Å; M639-Q654 HydrophobicContact CE-CG 4.31Å; M639-Q654 HydrophobicContact CG-CB 4.4Å; M639-Q654 HydrophobicContact CG-CG 3.73Å; M639-Q654 PolarHBondContact O-NE2 3.28Å; M639-Q654 HydrophobicContact SD-CB 3.79Å; M639-Q654 HydrophobicContact SD-CG 3.77Å; M650-Q654 HydrophobicContact CG-CG 4.31Å; M650-Q654 WeakPolarHBondContact O-CB 3.04Å; M650-Q654 VanDerWaalsContact O-CG 3.3Å; M650-Q654 WeakPolarHBondContact O-CG 3.46Å; M650-Q654 PolarHBondContact O-N 3.43Å; M650-Q654 HydrophobicContact SD-CG 4.41Å; Q654-G657 PolarHBondContact O-N 3.19Å; Q654-L658 WeakPolarHBondContact O-CG 3.43Å; Q654-L658 PolarHBondContact O-N 3.1Å
655	N	92.7	Very high	90.1	Very high	61 Å²	61	68.4 Å²	68.4	33%	0.326	34%	0.343	S	S	.	.	H	α-helix	trans	-67.6	-35.8	176.9	-77.1	-91.1	0	0	0	112.3	F651 G657 L658 L659	F651-N655 WeakPolarHBondContact CD2-ND2 3.14Å; F651-N655 VanDerWaalsContact CE2-ND2 3.31Å; F651-N655 WeakPolarHBondContact CE2-ND2 3.26Å; F651-N655 WeakPolarHBondContact CZ-ND2 3.24Å; F651-N655 WeakPolarHBondContact O-CB 3.37Å; F651-N655 PolarHBondContact O-N 3.27Å; F651-N655 VanDerWaalsContact O-N 3.1Å; F651-N655 PolarHBondContact O-ND2 3.2Å; N655-G657 VanDerWaalsContact C-N 3.34Å; N655-L658 PolarHBondContact O-N 2.98Å; N655-L659 WeakPolarHBondContact O-CB 3.36Å; N655-L659 VanDerWaalsContact O-CG 3.26Å; N655-L659 WeakPolarHBondContact O-CG 3.48Å; N655-L659 PolarHBondContact O-N 3.2Å
656	L	94.4	Very high	90.6	Very high	81 Å²	81	65.9 Å²	65.9	42%	0.424	33%	0.329	S	S	.	.	H	α-helix	trans	-62.1	-42.9	173.1	179.4	62.3	0	0	0	111	L396 L652 L653 L660	L396-L656 HydrophobicContact CD1-CB 4.2Å; L396-L656 HydrophobicContact CD1-CD2 4.18Å; L396-L656 HydrophobicContact CD1-CG 4.1Å; L652-L656 WeakPolarHBondContact O-CB 3.37Å; L652-L656 PolarHBondContact O-N 3.07Å; L653-L656 PolarHBondContact O-N 3.24Å; L656-L660 HydrophobicContact CD1-CD1 4.01Å; L656-L660 HydrophobicContact CD1-CG 4.09Å; L656-L660 HydrophobicContact CG-CD1 3.87Å; L656-L660 HydrophobicContact CG-CG 4.38Å; L656-L660 VanDerWaalsContact O-CB 3.29Å; L656-L660 WeakPolarHBondContact O-CB 3.25Å; L656-L660 WeakPolarHBondContact O-CG 3.24Å; L656-L660 PolarHBondContact O-N 3.49Å
657	G	91.7	Very high	90.8	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-58.1	-53.9	174	0	0	0	0	0	111.9	G399 L400 L653 Q654 N655 L659 L660 G661	G399-G657 VanDerWaalsContact C-C 3.43Å; G399-G657 CarbonylContact O-C 3.35Å; L400-G657 WeakPolarHBondContact CA-O 3.26Å; L653-G657 PolarHBondContact O-N 3.21Å; Q654-G657 PolarHBondContact O-N 3.19Å; N655-G657 VanDerWaalsContact C-N 3.34Å; G657-L659 PolarHBondContact O-N 3.4Å; G657-L660 PolarHBondContact O-N 2.91Å; G657-G661 PolarHBondContact O-N 3.34Å
658	L	92.9	Very high	90.7	Very high	16 Å²	16	59.3 Å²	59.3	8%	0.084	30%	0.301	C	S	.	.	H	α-helix	trans	-54.9	-49.5	178.4	-72.4	168.7	0	0	0	112.1	G399 V402 M639 Q654 N655 G661 W662	G399-L658 WeakPolarHBondContact O-CA 3.3Å; G399-L658 WeakPolarHBondContact O-CD2 3.35Å; G399-L658 PolarHBondContact O-N 2.93Å; V402-L658 HydrophobicContact CB-CD2 3.7Å; V402-L658 HydrophobicContact CG1-CD2 3.48Å; V402-L658 VanDerWaalsContact CG1-CD2 3.48Å; M639-L658 HydrophobicContact CE-CD1 4.29Å; Q654-L658 WeakPolarHBondContact O-CG 3.43Å; Q654-L658 PolarHBondContact O-N 3.1Å; N655-L658 PolarHBondContact O-N 2.98Å; L658-G661 PolarHBondContact O-N 3.02Å; L658-W662 HydrophobicContact CB-CH2 4.43Å; L658-W662 HydrophobicContact CB-CZ3 4.41Å; L658-W662 HydrophobicContact CD2-CZ2 4.44Å; L658-W662 PolarHBondContact O-N 3.06Å
659	L	94.9	Very high	90.5	Very high	98 Å²	98	53.4 Å²	53.4	51%	0.513	28%	0.279	S	S	.	.	H	α-helix	trans	-65.6	-40.3	179.8	-71.5	171.6	0	0	0	112.2	N655 G657 G661 W662 T663	N655-L659 WeakPolarHBondContact O-CB 3.36Å; N655-L659 VanDerWaalsContact O-CG 3.26Å; N655-L659 WeakPolarHBondContact O-CG 3.48Å; N655-L659 PolarHBondContact O-N 3.2Å; G657-L659 PolarHBondContact O-N 3.4Å; L659-G661 VanDerWaalsContact C-N 3.31Å; L659-W662 HydrophobicContact CD2-CE3 4.23Å; L659-W662 HydrophobicContact CD2-CZ3 4.41Å; L659-T663 WeakPolarHBondContact O-CB 3.46Å; L659-T663 PolarHBondContact O-N 3.41Å; L659-T663 PolarHBondContact O-OG1 3.24Å
660	L	93.3	Very high	90.2	Very high	87 Å²	87	56.3 Å²	56.3	46%	0.455	29%	0.292	S	S	.	.	H	α-helix	trans	-62.9	-39	173.8	-75.2	171	0	0	0	111.2	L400 L656 G657 T663 C664	L400-L660 HydrophobicContact CD1-CB 3.94Å; L656-L660 HydrophobicContact CD1-CD1 4.01Å; L656-L660 HydrophobicContact CD1-CG 4.09Å; L656-L660 HydrophobicContact CG-CD1 3.87Å; L656-L660 HydrophobicContact CG-CG 4.38Å; L656-L660 VanDerWaalsContact O-CB 3.29Å; L656-L660 WeakPolarHBondContact O-CB 3.25Å; L656-L660 WeakPolarHBondContact O-CG 3.24Å; L656-L660 PolarHBondContact O-N 3.49Å; G657-L660 PolarHBondContact O-N 2.91Å; L660-T663 PolarHBondContact O-N 2.77Å; L660-C664 VanDerWaalsContact O-CB 3.28Å; L660-C664 WeakPolarHBondContact O-CB 3.33Å; L660-C664 PolarHBondContact O-N 3.48Å
661	G	91.1	Very high	90	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-65.3	-54.5	178.2	0	0	0	0	0	112.5	G657 L658 L659 T663 C664 L665	G657-G661 PolarHBondContact O-N 3.34Å; L658-G661 PolarHBondContact O-N 3.02Å; L659-G661 VanDerWaalsContact C-N 3.31Å; G661-T663 VanDerWaalsContact C-N 3.28Å; G661-T663 PolarHBondContact O-N 3.4Å; G661-C664 WeakPolarHBondContact O-CB 3.43Å; G661-C664 PolarHBondContact O-N 3.12Å; G661-C664 VanDerWaalsContact O-N 3.15Å; G661-L665 PolarHBondContact O-N 3.16Å
662	W	93.8	Very high	89.1	Confident	107 Å²	107	55.9 Å²	55.9	41%	0.405	29%	0.29	S	S	.	.	H	α-helix	trans	-60.3	-37.4	175.2	-64.5	-33.6	0	0	0	112.5	S406 L658 L659 L666	S406-W662 PolarHBondContact OG-NE1 3.3Å; L658-W662 HydrophobicContact CB-CH2 4.43Å; L658-W662 HydrophobicContact CB-CZ3 4.41Å; L658-W662 HydrophobicContact CD2-CZ2 4.44Å; L658-W662 PolarHBondContact O-N 3.06Å; L659-W662 HydrophobicContact CD2-CE3 4.23Å; L659-W662 HydrophobicContact CD2-CZ3 4.41Å; W662-L666 WeakPolarHBondContact O-CB 3.26Å; W662-L666 PolarHBondContact O-N 3.4Å
663	T	92.2	Very high	87.8	Confident	70 Å²	70	57.9 Å²	57.9	43%	0.429	30%	0.297	S	S	.	.	H	α-helix	trans	-66.7	-40.4	176.3	-57.8	0	0	0	0	111.4	L659 L660 G661 L667	L659-T663 WeakPolarHBondContact O-CB 3.46Å; L659-T663 PolarHBondContact O-N 3.41Å; L659-T663 PolarHBondContact O-OG1 3.24Å; L660-T663 PolarHBondContact O-N 2.77Å; G661-T663 VanDerWaalsContact C-N 3.28Å; G661-T663 PolarHBondContact O-N 3.4Å; T663-L667 HydrophobicContact CG2-CD1 4Å; T663-L667 HydrophobicContact CG2-CG 4.38Å; T663-L667 WeakPolarHBondContact O-CB 3.5Å; T663-L667 WeakPolarHBondContact O-CG 3.5Å; T663-L667 PolarHBondContact O-N 3.3Å
664	C	89.1	Confident	86.6	Confident	42 Å²	42	63.5 Å²	63.5	28%	0.284	32%	0.32	S	S	.	.	H	α-helix	trans	-60.2	-51.4	176.2	-170	0	0	0	0	111	L660 G661 L667 L668	L660-C664 VanDerWaalsContact O-CB 3.28Å; L660-C664 WeakPolarHBondContact O-CB 3.33Å; L660-C664 PolarHBondContact O-N 3.48Å; G661-C664 WeakPolarHBondContact O-CB 3.43Å; G661-C664 PolarHBondContact O-N 3.12Å; G661-C664 VanDerWaalsContact O-N 3.15Å; C664-L667 PolarHBondContact O-N 3Å; C664-L668 WeakPolarHBondContact O-CG 3.37Å; C664-L668 PolarHBondContact O-N 2.57Å
665	L	88.8	Confident	85.3	Confident	2 Å²	2	65.3 Å²	65.3	1%	0.01	33%	0.329	C	S	.	.	H	α-helix	trans	-68.3	-36.6	-179.2	-86.1	-68.4	0	0	0	112.4	T404 D408 A562 G661 L667 L668 A669	T404-L665 HydrophobicContact CG2-CD2 3.69Å; D408-L665 HydrophobicContact CB-CD1 3.81Å; D408-L665 HydrophobicContact CB-CG 4.36Å; A562-L665 HydrophobicContact CB-CD1 3.74Å; G661-L665 PolarHBondContact O-N 3.16Å; L665-L667 VanDerWaalsContact C-N 3.35Å; L665-L668 HydrophobicContact CD1-CD1 4.31Å; L665-L668 PolarHBondContact O-N 3.11Å; L665-A669 WeakPolarHBondContact O-CB 3.38Å; L665-A669 PolarHBondContact O-N 3.09Å
666	L	90.1	Very high	83.2	Confident	82 Å²	82	72 Å²	72	43%	0.429	36%	0.355	S	S	.	.	H	α-helix	trans	-62.8	-41.1	172.5	-179.8	62.5	0	0	0	111.7	L411 W662 L670	L411-L666 HydrophobicContact CD1-CB 4.05Å; L411-L666 HydrophobicContact CD1-CD1 4.49Å; W662-L666 WeakPolarHBondContact O-CB 3.26Å; W662-L666 PolarHBondContact O-N 3.4Å; L666-L670 HydrophobicContact CD1-CD1 3.98Å; L666-L670 HydrophobicContact CD1-CG 4.13Å; L666-L670 HydrophobicContact CG-CD1 3.94Å; L666-L670 HydrophobicContact CG-CG 4.46Å; L666-L670 WeakPolarHBondContact O-CB 3.4Å; L666-L670 VanDerWaalsContact O-CG 3.23Å; L666-L670 WeakPolarHBondContact O-CG 3.38Å; L666-L670 PolarHBondContact O-N 3.19Å
667	L	88.3	Confident	81.3	Confident	86 Å²	86	75.9 Å²	75.9	45%	0.45	37%	0.369	S	S	.	.	H	α-helix	trans	-66.8	-42.2	175.2	-72.2	171.2	0	0	0	111.2	T663 C664 L665 L670 F671	T663-L667 HydrophobicContact CG2-CD1 4Å; T663-L667 HydrophobicContact CG2-CG 4.38Å; T663-L667 WeakPolarHBondContact O-CB 3.5Å; T663-L667 WeakPolarHBondContact O-CG 3.5Å; T663-L667 PolarHBondContact O-N 3.3Å; C664-L667 PolarHBondContact O-N 3Å; L665-L667 VanDerWaalsContact C-N 3.35Å; L667-L670 PolarHBondContact O-N 2.87Å; L667-F671 HydrophobicContact CD2-CD2 4.11Å; L667-F671 HydrophobicContact CD2-CE2 3.79Å; L667-F671 WeakPolarHBondContact O-CB 3.5Å; L667-F671 VanDerWaalsContact O-CD2 3.28Å; L667-F671 WeakPolarHBondContact O-CD2 3.46Å; L667-F671 PolarHBondContact O-N 3.41Å
668	L	84.6	Confident	80.8	Confident	31 Å²	31	79.7 Å²	79.7	16%	0.162	39%	0.388	C	S	.	.	H	α-helix	trans	-58.6	-49.8	174.2	-71.9	169	0	0	0	111.1	V561 A562 C664 L665 L670 F671 E672 L675	V561-L668 HydrophobicContact CB-CD2 4.48Å; V561-L668 HydrophobicContact CG1-CD1 4.11Å; V561-L668 HydrophobicContact CG1-CD2 4.04Å; A562-L668 HydrophobicContact CB-CD1 4.42Å; C664-L668 WeakPolarHBondContact O-CG 3.37Å; C664-L668 PolarHBondContact O-N 2.57Å; L665-L668 HydrophobicContact CD1-CD1 4.31Å; L665-L668 PolarHBondContact O-N 3.11Å; L668-L670 PolarHBondContact O-N 3.21Å; L668-F671 PolarHBondContact O-N 3.02Å; L668-E672 PolarHBondContact O-N 2.98Å; L668-L675 HydrophobicContact CD2-CD1 4.43Å
669	A	82.8	Confident	80.1	Confident	24 Å²	24	83.1 Å²	83.1	20%	0.198	40%	0.404	C	S	.	.	H	α-helix	trans	-61.8	-41.4	178.4	0	0	0	0	0	113.2	L665	L665-A669 WeakPolarHBondContact O-CB 3.38Å; L665-A669 PolarHBondContact O-N 3.09Å
670	L	83.5	Confident	79.3	Confident	118 Å²	118	82.2 Å²	82.2	62%	0.618	40%	0.398	S	S	*	.	H	α-helix	trans	-73.1	-25.1	178.8	-72.2	173.9	0	0	0	113.9	L666 L667 L668	L666-L670 HydrophobicContact CD1-CD1 3.98Å; L666-L670 HydrophobicContact CD1-CG 4.13Å; L666-L670 HydrophobicContact CG-CD1 3.94Å; L666-L670 HydrophobicContact CG-CG 4.46Å; L666-L670 WeakPolarHBondContact O-CB 3.4Å; L666-L670 VanDerWaalsContact O-CG 3.23Å; L666-L670 WeakPolarHBondContact O-CG 3.38Å; L666-L670 PolarHBondContact O-N 3.19Å; L667-L670 PolarHBondContact O-N 2.87Å; L668-L670 PolarHBondContact O-N 3.21Å
671	F	81.6	Confident	78.5	Confident	98 Å²	98	81.9 Å²	81.9	43%	0.43	39%	0.394	S	S	.	.	H	α-helix	trans	-111.1	0.5	-175.4	-70.3	-78	0	0	0	114.4	L667 L668 H673 K674 L675	L667-F671 HydrophobicContact CD2-CD2 4.11Å; L667-F671 HydrophobicContact CD2-CE2 3.79Å; L667-F671 WeakPolarHBondContact O-CB 3.5Å; L667-F671 VanDerWaalsContact O-CD2 3.28Å; L667-F671 WeakPolarHBondContact O-CD2 3.46Å; L667-F671 PolarHBondContact O-N 3.41Å; L668-F671 PolarHBondContact O-N 3.02Å; F671-H673 VanDerWaalsContact C-N 3.31Å; F671-H673 PolarHBondContact O-N 2.83Å; F671-K674 HydrophobicContact CD1-CD 4.06Å; F671-K674 HydrophobicContact CE1-CD 4.42Å; F671-K674 WeakPolarHBondContact O-CA 3.35Å; F671-K674 PolarHBondContact O-N 3.16Å; F671-L675 PolarHBondContact O-N 2.99Å
672	E	71.6	Confident	77.7	Confident	19 Å²	19	87.1 Å²	87.1	9%	0.089	42%	0.419	C	S	.	.	G	3₁₀ helix	trans	-44.9	-53.5	178.3	-166.9	-170.7	158.7	0	0	111.4	T555 A558 L668 K674 L675	T555-E672 PolarHBondContact OG1-OE1 3.07Å; A558-E672 HydrophobicContact CB-CG 4.14Å; L668-E672 PolarHBondContact O-N 2.98Å; E672-K674 PolarHBondContact O-N 2.84Å; E672-L675 PolarHBondContact O-N 3.31Å; E672-L675 VanDerWaalsContact O-N 3.09Å
673	H	64.2	Low	76.6	Confident	139 Å²	139	85.7 Å²	85.7	64%	0.644	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-65.6	-8.5	179.2	-63.6	-62.3	0	0	0	116	F671	F671-H673 VanDerWaalsContact C-N 3.31Å; F671-H673 PolarHBondContact O-N 2.83Å
674	K	66.8	Low	75.5	Confident	156 Å²	156	86.9 Å²	86.9	68%	0.678	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-108	-9.1	176.2	-63.7	-173.7	-171.2	163.7	0	112.9	F671 E672 K676	F671-K674 HydrophobicContact CD1-CD 4.06Å; F671-K674 HydrophobicContact CE1-CD 4.42Å; F671-K674 WeakPolarHBondContact O-CA 3.35Å; F671-K674 PolarHBondContact O-N 3.16Å; E672-K674 PolarHBondContact O-N 2.84Å; K674-K676 VanDerWaalsContact C-N 3.34Å; K674-K676 PolarHBondContact O-N 2.8Å
675	L	62.1	Low	74.5	Confident	55 Å²	55	90.3 Å²	90.3	29%	0.288	43%	0.43	S	S	.	.			trans	-73.9	87.9	172.6	-66.1	175.1	0	0	0	109.6	L668 F671 E672 F677	L668-L675 HydrophobicContact CD2-CD1 4.43Å; F671-L675 PolarHBondContact O-N 2.99Å; E672-L675 PolarHBondContact O-N 3.31Å; E672-L675 VanDerWaalsContact O-N 3.09Å; L675-F677 HydrophobicContact CB-CD2 4.21Å; L675-F677 HydrophobicContact CB-CE2 3.59Å; L675-F677 HydrophobicContact CB-CZ 4.06Å; L675-F677 HydrophobicContact CD1-CE2 4.14Å; L675-F677 HydrophobicContact CD1-CZ 4.16Å; L675-F677 HydrophobicContact CD2-CZ 4.39Å; L675-F677 HydrophobicContact CG-CE2 4.36Å; L675-F677 HydrophobicContact CG-CZ 4.44Å; L675-F677 PolarHBondContact O-N 3.32Å
676	K	50.5	Low	73.3	Confident	200 Å²	200	97.7 Å²	97.7	87%	0.87	47%	0.465	S	S	*	.			trans	-83.6	109	165.9	-66.1	-170.8	176.4	-169.5	0	108.6	K674	K674-K676 VanDerWaalsContact C-N 3.34Å; K674-K676 PolarHBondContact O-N 2.8Å
677	F	53.2	Low	71.7	Confident	164 Å²	164	99.1 Å²	99.1	72%	0.719	47%	0.468	S	S	*	.			trans	-90.6	0	170.5	-65.8	-73.4	0	0	0	110.8	M557 L675	M557-F677 HydrophobicContact CB-CD2 3.59Å; M557-F677 HydrophobicContact CB-CE2 3.4Å; M557-F677 VanDerWaalsContact CB-CE2 3.4Å; M557-F677 HydrophobicContact CB-CG 4.22Å; M557-F677 HydrophobicContact CB-CZ 3.91Å; M557-F677 HydrophobicContact CE-CD1 3.8Å; M557-F677 HydrophobicContact CE-CE1 3.85Å; M557-F677 HydrophobicContact CE-CG 4.2Å; M557-F677 HydrophobicContact CE-CZ 4.31Å; M557-F677 HydrophobicContact CG-CD2 3.92Å; M557-F677 HydrophobicContact CG-CE2 4.21Å; M557-F677 HydrophobicContact CG-CG 4.14Å; L675-F677 HydrophobicContact CB-CD2 4.21Å; L675-F677 HydrophobicContact CB-CE2 3.59Å; L675-F677 HydrophobicContact CB-CZ 4.06Å; L675-F677 HydrophobicContact CD1-CE2 4.14Å; L675-F677 HydrophobicContact CD1-CZ 4.16Å; L675-F677 HydrophobicContact CD2-CZ 4.39Å; L675-F677 HydrophobicContact CG-CE2 4.36Å; L675-F677 HydrophobicContact CG-CZ 4.44Å; L675-F677 PolarHBondContact O-N 3.32Å

Retrieved 677 of 677 residues in 138.6 ms (Link to these results)

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