A0A061IGA0_CRIGR Loading...

Lon protease homolog 2, peroxisomal

ATP-dependent serine protease that mediates the selective degradation of misfolded and unassembled polypeptides in the peroxisomal matrix. Necessary for type 2 peroxisome targeting signal (PTS2)-containing protein processing and facilitates peroxisome matrix protein import. May indirectly regulate peroxisomal fatty acid beta-oxidation through degradation of the self-processed forms of TYSND1.

AlphaFold DB , UniProt , Accession A0A061IGA0, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Lonp2, Length 852 aa.

						>A0A061IGA0_CRIGR|A0A061IGA0|Lonp2
MSSVSPIQIPSRLPLLLTHEGVLLPGSTMRTSVDTARNLQLVRSRLLKGTSLQSTILGIIPNTPDPASDAQDLPPLHRIGTAALAVQVVGSNWPKPHYTLLITGLCRFQIVQVLKEKPYPVAEVEQLDRLEEFPNTCKTKEELGELSEQFYRYAVQLVEMLDMSVPAVAKLRRLLDSLPREALPDILTSIIRTSNKEKLQILDAVSLEDRFKMTIPLLVRQIEGLKLLQKTRKPKQDDDKRVIAIRPIRRITHIPGTLEDEDEEEDNDDIVMLEKKIKTSSMPEQAHKVCVKEIKRLKKMPQSMPEYALTRNYLELMVELPWNKSTTDRLDIRAARILLDNDHYAMEKLKRRVLEYLAVRQLKNNLKGPILCFVGPPGVGKTSVGRSVAKTLGREFHRIALGGVCDQSDIRGHRRTYVGSMPGRIINGLKTVGVNNPVFLLDEVDKLGKSLQGDPAAALLEVLDPEQNHNFTDHYLNVAFDLSQVLFIATANTTATIPPALLDRMEIIQVPGYTQEEKIEIAHRHLIPKQLEQHGLTPQQIQIPQLTTLAIITRYTREAGVRSLDRKFGAICRAVAVKVAEGQHKEAKLDRSDVADGEGCREHVLEDAKPEAISDTADLALPPEMPILIDFHALKDILGPPLYELEVSERLSQPGVAIGLAWTPLGGKIMFVEASRMDGEGQLTLTGQLGDVMKESAHLAISWLRSNAKKYHLTNAFGSFDLLDNTDIHLHFPAGAVTKDGPSAGVTIVTCLASLFSGRLVRSDVAMTGEITLRGLVLPVGGIKDKVLAAHRAGLKHIIIPQRNEKDLEEIPSNIRQDLSFVTASCLDEVLNAAFDGGFTVKTRPGLIDSKL
					

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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	33.1	Very low	54.1	Low	246 Å²	246	108.2 Å²	108.2	100%	1.212	64%	0.638	S	S	*	*				0	125.1	0	-80.4	179.8	159.6	0	0	107
2	S	25.5	Very low	56.7	Low	105 Å²	105	112.7 Å²	112.7	73%	0.734	64%	0.636	S	S	*	*			trans	-57.2	149.6	-177.1	42.9	0	0	0	0	113.5
3	S	26.8	Very low	58.8	Low	104 Å²	104	104.1 Å²	104.1	73%	0.727	59%	0.587	S	S	*	*			trans	30.6	102.7	153.1	58.2	0	0	0	0	116	S5	S3-S5 VanDerWaalsContact C-N 3.29Å; S3-S5 PolarHBondContact O-N 2.85Å
4	V	37.5	Very low	60.9	Low	134 Å²	134	97.6 Å²	97.6	81%	0.812	55%	0.552	S	S	*	*			trans	-62.4	91.1	171.3	-175.7	0	0	0	0	108.5
5	S	38.7	Very low	62.5	Low	88 Å²	88	91.1 Å²	91.1	62%	0.615	52%	0.515	S	S	*	.			trans	-58.8	133.7	161.8	49.6	0	0	0	0	107.7	S3 I7	S3-S5 VanDerWaalsContact C-N 3.29Å; S3-S5 PolarHBondContact O-N 2.85Å; S5-I7 PolarHBondContact O-N 3.07Å
6	P	54.3	Low	64	Low	107 Å²	107	85.4 Å²	85.4	70%	0.695	48%	0.483	S	S	*	.			trans	-60	114.4	179.3	24.1	-31.7	0	0	0	108.7	Q8	P6-Q8 PolarHBondContact O-N 3.27Å; P6-Q8 VanDerWaalsContact O-N 3.15Å
7	I	64.9	Low	65.2	Low	78 Å²	78	80.6 Å²	80.6	40%	0.4	46%	0.455	S	S	.	.			trans	-66.5	114.3	178.4	-61.6	171.6	0	0	0	106.8	S5 L105 Q126	S5-I7 PolarHBondContact O-N 3.07Å; I7-L105 HydrophobicContact CD1-CD2 4.29Å; I7-L105 HydrophobicContact CG2-CD1 4.36Å; I7-Q126 PolarHBondContact O-NE2 2.85Å; I7-Q126 PolarHBondContact O-OE1 3.16Å
8	Q	72.1	Confident	66	Low	174 Å²	174	76.2 Å²	76.2	81%	0.813	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-93	118.8	177	-168.2	173.7	6.9	0	0	109.8	P6	P6-Q8 PolarHBondContact O-N 3.27Å; P6-Q8 VanDerWaalsContact O-N 3.15Å
9	I	79.1	Confident	66.2	Low	19 Å²	19	76.6 Å²	76.6	10%	0.097	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-82.6	143.2	178.2	-47.8	168.1	0	0	0	109.4	L13 I56 A82 C106 F108 Q126	I9-L13 HydrophobicContact CG2-CD1 3.69Å; I9-L13 HydrophobicContact CG2-CD2 4.09Å; I9-L13 HydrophobicContact CG2-CG 4.06Å; I9-I56 HydrophobicContact CG2-CG2 4.46Å; I9-A82 HydrophobicContact CD1-CB 3.79Å; I9-A82 HydrophobicContact CG1-CB 4.29Å; I9-A82 HydrophobicContact CG2-CB 4.29Å; I9-C106 HydrophobicContact CD1-CB 4.32Å; I9-C106 WeakPolarHBondContact CD1-SG 3.18Å; I9-C106 WeakPolarHBondContact CG1-SG 3.24Å; I9-F108 HydrophobicContact CD1-CB 4.49Å; I9-Q126 HydrophobicContact CD1-CB 3.9Å; I9-Q126 HydrophobicContact CD1-CG 3.8Å; I9-Q126 HydrophobicContact CG1-CG 4.42Å
10	P	81.8	Confident	66.2	Low	64 Å²	64	80.8 Å²	80.8	42%	0.416	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-63.2	146.7	168.2	27.1	-35.8	0	0	0	111.8	R12 L13	P10-R12 PolarHBondContact O-N 2.9Å; P10-R12 VanDerWaalsContact O-N 3.14Å; P10-L13 HydrophobicContact CG-CD2 3.71Å
11	S	80.9	Confident	66.5	Low	71 Å²	71	77.7 Å²	77.7	50%	0.497	43%	0.431	S	S	.	.	S	Bend	trans	-65	-16.8	-179.9	55.8	0	0	0	0	114.3	E123 V124	S11-E123 VanDerWaalsContact O-CA 3.31Å; S11-E123 WeakPolarHBondContact O-CA 2.89Å; S11-V124 PolarHBondContact O-N 2.86Å
12	R	85.6	Confident	68.9	Low	162 Å²	162	66.4 Å²	66.4	61%	0.611	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121	122.5	178.3	-61.7	-179.4	-179.3	177.5	-0.3	110	P10 L114 A122	P10-R12 PolarHBondContact O-N 2.9Å; P10-R12 VanDerWaalsContact O-N 3.14Å; R12-L114 HydrophobicContact CG-CD1 4.07Å; R12-A122 WeakPolarHBondContact CA-O 3.24Å
13	L	84.7	Confident	71.8	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.005	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	137.2	178.7	-74.6	-175.8	0	0	0	112.6	I9 P10 I56 A82 F108 V121 A122 V124	I9-L13 HydrophobicContact CG2-CD1 3.69Å; I9-L13 HydrophobicContact CG2-CD2 4.09Å; I9-L13 HydrophobicContact CG2-CG 4.06Å; P10-L13 HydrophobicContact CG-CD2 3.71Å; L13-I56 HydrophobicContact CD1-CG2 4.46Å; L13-I56 HydrophobicContact CD2-CB 4.09Å; L13-I56 HydrophobicContact CD2-CG2 3.75Å; L13-A82 HydrophobicContact CD1-CB 4.14Å; L13-F108 HydrophobicContact CD1-CD1 4.2Å; L13-F108 HydrophobicContact CD1-CE1 4.16Å; L13-V121 WeakPolarHBondContact O-CA 3.45Å; L13-A122 PolarHBondContact N-O 3.25Å; L13-A122 PolarHBondContact O-N 2.82Å; L13-V124 HydrophobicContact CB-CG1 4.36Å; L13-V124 HydrophobicContact CB-CG2 4.2Å; L13-V124 HydrophobicContact CD1-CG2 3.82Å; L13-V124 HydrophobicContact CG-CG2 3.77Å
14	P	87.3	Confident	74.6	Confident	14 Å²	14	56.6 Å²	56.6	9%	0.091	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	136.4	164.7	32.5	-33.8	0	0	0	109.6	L41 L57 G58 Y119	P14-L41 HydrophobicContact CB-CD1 4.16Å; P14-L57 HydrophobicContact CG-CD2 3.68Å; P14-G58 PolarHBondContact O-N 2.77Å; P14-Y119 HydrophobicContact CB-CD2 4.14Å; P14-Y119 HydrophobicContact CB-CE2 3.84Å
15	L	85.9	Confident	76.9	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	127.1	-174.3	-59.3	175.1	0	0	0	111.1	L41 G58 I60 L76 F108 P120 A122	L15-L41 WeakPolarHBondContact O-CD1 3.44Å; L15-G58 CarbonylContact C-O 3.39Å; L15-G58 VanDerWaalsContact CA-O 3.26Å; L15-G58 WeakPolarHBondContact CA-O 3.39Å; L15-I60 HydrophobicContact CB-CD1 4.1Å; L15-I60 HydrophobicContact CD1-CD1 3.53Å; L15-I60 HydrophobicContact CD2-CD1 3.85Å; L15-I60 HydrophobicContact CD2-CG1 4.17Å; L15-I60 HydrophobicContact CG-CD1 4.01Å; L15-L76 HydrophobicContact CD1-CD1 4.25Å; L15-F108 HydrophobicContact CD2-CE2 4.35Å; L15-F108 HydrophobicContact CD2-CZ 4.09Å; L15-P120 HydrophobicContact CB-CB 4.12Å; L15-P120 HydrophobicContact CB-CG 3.99Å; L15-P120 HydrophobicContact CD1-CB 4.24Å; L15-P120 PolarHBondContact N-O 3.27Å; L15-A122 HydrophobicContact CD1-CB 3.52Å; L15-A122 HydrophobicContact CD2-CB 4.33Å; L15-A122 HydrophobicContact CG-CB 4.08Å
16	L	85.8	Confident	78.7	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	115.8	169.5	-173.4	77.6	0	0	0	108.4	T18 V33 N38 G58 I59 I60 L100 I102	L16-T18 HydrophobicContact CD2-CG2 4.2Å; L16-T18 HydrophobicContact CG-CG2 4.33Å; L16-V33 HydrophobicContact CD1-CG2 4.35Å; L16-N38 HydrophobicContact CD1-CB 3.94Å; L16-G58 PolarHBondContact N-O 3.49Å; L16-I59 HydrophobicContact CB-CG1 4.49Å; L16-I59 HydrophobicContact CD2-CD1 4.39Å; L16-I59 HydrophobicContact CD2-CG1 4.45Å; L16-I60 PolarHBondContact O-N 3.39Å; L16-I60 VanDerWaalsContact O-N 3.09Å; L16-L100 HydrophobicContact CD1-CD1 4.38Å; L16-L100 HydrophobicContact CD2-CD1 4.07Å; L16-I102 HydrophobicContact CD2-CD1 3.55Å
17	L	84.9	Confident	80.1	Confident	3 Å²	3	43.9 Å²	43.9	2%	0.016	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	124.5	179.7	-57.6	-179.8	0	0	0	109.4	N38 I60 D65 L73 L76 P120	L17-N38 PolarHBondContact N-OD1 3.48Å; L17-N38 PolarHBondContact O-ND2 3.43Å; L17-I60 HydrophobicContact CD2-CB 4.18Å; L17-I60 HydrophobicContact CD2-CD1 4.16Å; L17-D65 HydrophobicContact CB-CB 4.22Å; L17-D65 HydrophobicContact CD1-CB 4.15Å; L17-L73 HydrophobicContact CD1-CD2 3.87Å; L17-L76 HydrophobicContact CD2-CD2 3.69Å; L17-P120 HydrophobicContact CD1-CG 4.39Å; L17-P120 HydrophobicContact CG-CG 4.38Å
18	T	78.8	Confident	81.1	Confident	2 Å²	2	44.7 Å²	44.7	1%	0.012	24%	0.242	C	C	.	.			trans	-119.5	124.2	-177.2	56.7	0	0	0	0	110.7	L16 T31 I59 I60 N62 T63	L16-T18 HydrophobicContact CD2-CG2 4.2Å; L16-T18 HydrophobicContact CG-CG2 4.33Å; T18-T31 HydrophobicContact CG2-CG2 3.72Å; T18-I59 HydrophobicContact CG2-CG2 3.82Å; T18-I60 PolarHBondContact N-O 3.48Å; T18-I60 VanDerWaalsContact N-O 3.08Å; T18-I60 PolarHBondContact OG1-O 2.87Å; T18-N62 PolarHBondContact O-N 3.45Å; T18-T63 PolarHBondContact O-N 3.33Å
19	H	69.9	Low	81.6	Confident	83 Å²	83	37.7 Å²	37.7	38%	0.384	21%	0.21	S	C	.	.	S	Bend	trans	-80.8	-35.7	175.8	-66	-110.5	0	0	0	111.4	P64 D65	H19-P64 WeakPolarHBondContact CE1-CA 3.49Å; H19-P64 VanDerWaalsContact ND1-CA 3.31Å; H19-P64 WeakPolarHBondContact ND1-CA 3.5Å; H19-D65 PolarHBondContact CE1-N 3.4Å; H19-D65 PolarHBondContact CE1-O 2.92Å; H19-D65 VanDerWaalsContact CE1-O 3.25Å; H19-D65 WeakPolarHBondContact NE2-CB 3.34Å; H19-D65 PolarHBondContact NE2-N 3.49Å; H19-D65 PolarHBondContact NE2-O 2.97Å
20	E	66.5	Low	81.8	Confident	160 Å²	160	45.8 Å²	45.8	75%	0.748	24%	0.239	S	C	*	.	S	Bend	trans	-120.6	126	-174.6	-63	-168.2	167.9	0	0	111
21	G	73	Confident	81.7	Confident	17 Å²	17	43.3 Å²	43.3	18%	0.175	22%	0.223	C	C	.	.			trans	91.7	147.1	176.6	0	0	0	0	0	113.7
22	V	83	Confident	81.6	Confident	8 Å²	8	43.2 Å²	43.2	5%	0.048	22%	0.222	C	C	.	.			trans	-115.5	119.1	173.5	-177.9	0	0	0	0	106.8	L24 P61 N195 K198 L199 L202	V22-L24 HydrophobicContact CG1-CD2 4.37Å; V22-P61 HydrophobicContact CB-CB 4.24Å; V22-P61 HydrophobicContact CG1-CB 4.09Å; V22-P61 HydrophobicContact CG1-CG 4.27Å; V22-P61 HydrophobicContact CG2-CB 3.87Å; V22-N195 HydrophobicContact CG2-CB 4.44Å; V22-K198 HydrophobicContact CB-CB 3.74Å; V22-K198 HydrophobicContact CB-CD 4.4Å; V22-K198 HydrophobicContact CG1-CB 4.16Å; V22-K198 HydrophobicContact CG2-CB 3.88Å; V22-L199 HydrophobicContact CG2-CB 4.5Å; V22-L202 HydrophobicContact CG1-CB 4.35Å; V22-L202 HydrophobicContact CG1-CD2 4.08Å
23	L	85.9	Confident	81.3	Confident	3 Å²	3	35.5 Å²	35.5	2%	0.016	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-81.7	121.7	174.6	-177.5	68.7	0	0	0	109.4	M29 I59 T81 A83	L23-M29 HydrophobicContact CB-CE 3.86Å; L23-M29 HydrophobicContact CB-SD 4.4Å; L23-M29 HydrophobicContact CD1-CB 3.67Å; L23-I59 HydrophobicContact CB-CD1 4.32Å; L23-I59 HydrophobicContact CB-CG2 4.42Å; L23-I59 HydrophobicContact CD2-CD1 3.44Å; L23-I59 VanDerWaalsContact CD2-CD1 3.44Å; L23-I59 HydrophobicContact CD2-CG1 4.25Å; L23-I59 HydrophobicContact CG-CD1 4.49Å; L23-T81 HydrophobicContact CD2-CG2 4.09Å; L23-T81 HydrophobicContact CG-CG2 4.1Å; L23-T81 WeakPolarHBondContact O-CB 3.47Å; L23-T81 PolarHBondContact O-OG1 3.44Å; L23-A83 HydrophobicContact CD2-CB 3.34Å
24	L	86.3	Confident	80.7	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-99.8	152.2	173.7	-63.6	173	0	0	0	110.4	V22 S27 D185 T188 I201 L202	V22-L24 HydrophobicContact CG1-CD2 4.37Å; L24-S27 PolarHBondContact N-OG 2.91Å; L24-S27 WeakPolarHBondContact O-CB 3.48Å; L24-S27 PolarHBondContact O-N 2.95Å; L24-S27 PolarHBondContact O-OG 2.8Å; L24-D185 HydrophobicContact CB-CB 4.32Å; L24-D185 WeakPolarHBondContact CD1-O 3.31Å; L24-T188 HydrophobicContact CD1-CG2 3.61Å; L24-I201 HydrophobicContact CD1-CG2 4.46Å; L24-I201 HydrophobicContact CD2-CG2 4.35Å; L24-L202 HydrophobicContact CD2-CB 4.1Å; L24-L202 HydrophobicContact CD2-CD1 4.33Å
25	P	85.4	Confident	80.2	Confident	13 Å²	13	40.6 Å²	40.6	8%	0.084	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.2	140.6	174.4	-27	36.7	0	0	0	112.5	S27 T81 R107	P25-S27 PolarHBondContact O-N 3.49Å; P25-S27 VanDerWaalsContact O-N 3.16Å; P25-T81 HydrophobicContact CG-CG2 4.39Å; P25-R107 HydrophobicContact CG-CG 3.8Å
26	G	77.8	Confident	79.5	Confident	43 Å²	43	42.6 Å²	42.6	44%	0.443	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.2	-10.2	-178	0	0	0	0	0	115.6	G104	G26-G104 WeakPolarHBondContact CA-O 3.38Å; G26-G104 PolarHBondContact N-O 2.7Å
27	S	83.6	Confident	79	Confident	6 Å²	6	43 Å²	43	4%	0.042	24%	0.238	C	C	.	.			trans	-91.8	157.2	177.6	74.4	0	0	0	0	112.7	L24 P25 T103 G104 S189	L24-S27 PolarHBondContact N-OG 2.91Å; L24-S27 WeakPolarHBondContact O-CB 3.48Å; L24-S27 PolarHBondContact O-N 2.95Å; L24-S27 PolarHBondContact O-OG 2.8Å; P25-S27 PolarHBondContact O-N 3.49Å; P25-S27 VanDerWaalsContact O-N 3.16Å; S27-T103 WeakPolarHBondContact O-CA 3.42Å; S27-G104 PolarHBondContact O-N 3.11Å; S27-S189 VanDerWaalsContact CB-CB 3.4Å; S27-S189 VanDerWaalsContact CB-OG 3.3Å; S27-S189 WeakPolarHBondContact CB-OG 3.47Å
28	T	84.1	Confident	78.7	Confident	95 Å²	95	43.1 Å²	43.1	58%	0.583	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-112.2	135.5	172.9	58.9	0	0	0	0	110.3	I102 T103	T28-I102 CarbonylContact C-O 3.58Å; T28-I102 WeakPolarHBondContact CA-O 3.33Å; T28-T103 HydrophobicContact CG2-CG2 3.87Å; T28-T103 WeakPolarHBondContact CG2-OG1 3.49Å
29	M	82.9	Confident	78.6	Confident	28 Å²	28	43.8 Å²	43.8	14%	0.138	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	141.5	-179.4	-172.2	166.6	76.9	0	0	110	L23 T31 I102	L23-M29 HydrophobicContact CB-CE 3.86Å; L23-M29 HydrophobicContact CB-SD 4.4Å; L23-M29 HydrophobicContact CD1-CB 3.67Å; M29-T31 VanDerWaalsContact CE-OG1 3.29Å; M29-T31 WeakPolarHBondContact CE-OG1 3.04Å; M29-I102 PolarHBondContact N-O 3.03Å; M29-I102 PolarHBondContact O-N 2.91Å
30	R	82.9	Confident	78.9	Confident	188 Å²	188	43.5 Å²	43.5	71%	0.709	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-98.3	128	166.4	-70.3	-177.8	179.4	-179.3	-1.9	108.5	T99 L100 L101	R30-T99 HydrophobicContact CB-CG2 4.46Å; R30-L100 CarbonylContact C-O 3.57Å; R30-L100 VanDerWaalsContact CA-O 3.29Å; R30-L100 WeakPolarHBondContact CA-O 3.23Å; R30-L101 HydrophobicContact CG-CD1 3.57Å
31	T	81	Confident	79.5	Confident	13 Å²	13	35.9 Å²	35.9	8%	0.08	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	125.8	-177.6	-54.1	0	0	0	0	108.9	T18 M29 L100	T18-T31 HydrophobicContact CG2-CG2 3.72Å; M29-T31 VanDerWaalsContact CE-OG1 3.29Å; M29-T31 WeakPolarHBondContact CE-OG1 3.04Å; T31-L100 PolarHBondContact N-O 3.22Å; T31-L100 PolarHBondContact O-N 3.15Å
32	S	78.8	Confident	79.7	Confident	68 Å²	68	35 Å²	35	48%	0.476	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	137.9	169.2	59.4	0	0	0	0	109.6	Y98	S32-Y98 CarbonylContact C-O 3.58Å
33	V	79.3	Confident	79.3	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.006	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	100.1	-178.5	-179.8	0	0	0	0	107.4	L16 N38 L39 V42 H97 Y98 L100	L16-V33 HydrophobicContact CD1-CG2 4.35Å; V33-N38 VanDerWaalsContact CG1-C 3.46Å; V33-N38 HydrophobicContact CG1-CB 3.33Å; V33-L39 HydrophobicContact CG1-CD2 4.13Å; V33-L39 HydrophobicContact CG1-CG 4.37Å; V33-L39 WeakPolarHBondContact O-CD2 3.32Å; V33-V42 HydrophobicContact CG1-CG2 4.18Å; V33-V42 HydrophobicContact CG2-CG2 4.46Å; V33-H97 WeakPolarHBondContact O-CA 3.43Å; V33-Y98 WeakPolarHBondContact CB-O 3.34Å; V33-Y98 PolarHBondContact N-O 3.48Å; V33-Y98 PolarHBondContact O-N 2.84Å; V33-L100 HydrophobicContact CG2-CD1 3.53Å; V33-L100 HydrophobicContact CG2-CG 3.78Å
34	D	72.3	Confident	78.7	Confident	94 Å²	94	41.4 Å²	41.4	50%	0.503	23%	0.226	S	C	.	.			trans	-117.6	-18.4	-172.7	-50.1	-30.4	0	0	0	111.8	H97	D34-H97 WeakPolarHBondContact OD1-CB 3.48Å
35	T	76.4	Confident	78.1	Confident	28 Å²	28	47 Å²	47	17%	0.172	25%	0.247	C	C	.	.	S	Bend	trans	-82.4	142	-177.7	-39.6	0	0	0	0	112.3	R37 N38 L39 D65	T35-R37 VanDerWaalsContact C-N 3.35Å; T35-R37 PolarHBondContact O-N 2.83Å; T35-N38 PolarHBondContact O-N 3.37Å; T35-L39 WeakPolarHBondContact O-CB 3.21Å; T35-L39 VanDerWaalsContact O-CG 3.27Å; T35-L39 WeakPolarHBondContact O-CG 3.43Å; T35-L39 PolarHBondContact O-N 3.32Å; T35-D65 HydrophobicContact CG2-CB 4.09Å; T35-D65 VanDerWaalsContact CG2-OD2 3.22Å; T35-D65 WeakPolarHBondContact CG2-OD2 3.29Å
36	A	71.8	Confident	77.4	Confident	41 Å²	41	46.8 Å²	46.8	34%	0.339	25%	0.245	S	C	.	.	H	α-helix	trans	-52.6	-44.6	-176	0	0	0	0	0	114	L39 Q40	A36-L39 PolarHBondContact O-N 3.05Å; A36-Q40 WeakPolarHBondContact O-CG 3.26Å; A36-Q40 PolarHBondContact O-N 3.17Å
37	R	75	Confident	76.9	Confident	9 Å²	9	48.6 Å²	48.6	3%	0.034	24%	0.244	C	C	.	.	H	α-helix	trans	-63.4	-49.2	178.4	-64.9	177.2	179.2	174.6	-5.9	112.7	T35 L39 Q40 L41 D65 D69 Q71	T35-R37 VanDerWaalsContact C-N 3.35Å; T35-R37 PolarHBondContact O-N 2.83Å; R37-L39 VanDerWaalsContact C-N 3.34Å; R37-L39 PolarHBondContact O-N 2.91Å; R37-Q40 PolarHBondContact O-N 3.23Å; R37-L41 PolarHBondContact O-N 3.21Å; R37-D65 WeakPolarHBondContact CD-OD1 3.43Å; R37-D65 IonicContact NH1-OD1 3.47Å; R37-D65 PolarHBondContact NH1-OD1 3.16Å; R37-D69 WeakPolarHBondContact CG-OD1 3.28Å; R37-D69 IonicContact NE-OD1 3.79Å; R37-D69 PolarHBondContact NH2-O 3.24Å; R37-Q71 PolarHBondContact NH2-O 3.22Å
38	N	78.9	Confident	75.8	Confident	6 Å²	6	56.2 Å²	56.2	3%	0.032	28%	0.277	C	S	.	.	H	α-helix	trans	-66.2	-36.2	177.2	-69.9	-28.1	0	0	0	111.5	L16 L17 V33 T35 L41 V42	L16-N38 HydrophobicContact CD1-CB 3.94Å; L17-N38 PolarHBondContact N-OD1 3.48Å; L17-N38 PolarHBondContact O-ND2 3.43Å; V33-N38 VanDerWaalsContact CG1-C 3.46Å; V33-N38 HydrophobicContact CG1-CB 3.33Å; T35-N38 PolarHBondContact O-N 3.37Å; N38-L41 WeakPolarHBondContact O-CB 3.19Å; N38-L41 PolarHBondContact O-N 3.15Å; N38-V42 WeakPolarHBondContact O-CG2 3.22Å; N38-V42 PolarHBondContact O-N 2.98Å
39	L	76.3	Confident	74.1	Confident	15 Å²	15	55.2 Å²	55.2	8%	0.079	29%	0.285	C	S	.	.	H	α-helix	trans	-62.3	-41.9	172.9	-70.8	174.6	0	0	0	111.2	V33 T35 A36 R37 V42 R43 Y98	V33-L39 HydrophobicContact CG1-CD2 4.13Å; V33-L39 HydrophobicContact CG1-CG 4.37Å; V33-L39 WeakPolarHBondContact O-CD2 3.32Å; T35-L39 WeakPolarHBondContact O-CB 3.21Å; T35-L39 VanDerWaalsContact O-CG 3.27Å; T35-L39 WeakPolarHBondContact O-CG 3.43Å; T35-L39 PolarHBondContact O-N 3.32Å; A36-L39 PolarHBondContact O-N 3.05Å; R37-L39 VanDerWaalsContact C-N 3.34Å; R37-L39 PolarHBondContact O-N 2.91Å; L39-V42 PolarHBondContact O-N 3.3Å; L39-R43 WeakPolarHBondContact O-CB 3.39Å; L39-R43 VanDerWaalsContact O-CG 3.27Å; L39-R43 WeakPolarHBondContact O-CG 3.45Å; L39-R43 PolarHBondContact O-N 3.4Å; L39-Y98 HydrophobicContact CD2-CD2 3.33Å; L39-Y98 HydrophobicContact CD2-CE2 3.61Å; L39-Y98 HydrophobicContact CD2-CG 4.41Å
40	Q	75.3	Confident	72.6	Confident	77 Å²	77	57.5 Å²	57.5	36%	0.36	30%	0.3	S	S	.	.	H	α-helix	trans	-65.7	-37	175	-75.7	-177.7	0.9	0	0	112.4	A36 R37 R43 S44 P118	A36-Q40 WeakPolarHBondContact O-CG 3.26Å; A36-Q40 PolarHBondContact O-N 3.17Å; R37-Q40 PolarHBondContact O-N 3.23Å; Q40-R43 PolarHBondContact O-N 3.07Å; Q40-S44 VanDerWaalsContact O-CB 3.22Å; Q40-S44 WeakPolarHBondContact O-CB 3.41Å; Q40-S44 PolarHBondContact O-N 3.1Å; Q40-S44 PolarHBondContact O-OG 3.41Å; Q40-P118 PolarHBondContact OE1-O 3Å
41	L	79.8	Confident	71.3	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-59.7	-50.3	172.2	-177.4	159	0	0	0	110.6	P14 L15 R37 N38 R43 S44 R45 L57 Y119	P14-L41 HydrophobicContact CB-CD1 4.16Å; L15-L41 WeakPolarHBondContact O-CD1 3.44Å; R37-L41 PolarHBondContact O-N 3.21Å; N38-L41 WeakPolarHBondContact O-CB 3.19Å; N38-L41 PolarHBondContact O-N 3.15Å; L41-R43 PolarHBondContact O-N 2.89Å; L41-S44 PolarHBondContact O-N 3.44Å; L41-S44 PolarHBondContact O-OG 3.46Å; L41-R45 WeakPolarHBondContact O-CB 3.38Å; L41-R45 PolarHBondContact O-N 2.78Å; L41-L57 HydrophobicContact CD2-CD1 4.36Å; L41-L57 HydrophobicContact CD2-CD2 3.97Å; L41-Y119 HydrophobicContact CB-CD1 4.22Å; L41-Y119 HydrophobicContact CB-CD2 4.39Å; L41-Y119 HydrophobicContact CB-CG 3.93Å; L41-Y119 HydrophobicContact CD1-CD2 4.12Å; L41-Y119 HydrophobicContact CD1-CG 4.37Å; L41-Y119 HydrophobicContact CG-CD2 4.22Å; L41-Y119 HydrophobicContact CG-CG 4.27Å
42	V	78.1	Confident	70.2	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	30%	0.303	C	S	.	.	I	π-helix	trans	-60.6	-47.6	178	173.9	0	0	0	0	110.9	V33 N38 L39 S44 L46 L47 V88 Y98 L100	V33-V42 HydrophobicContact CG1-CG2 4.18Å; V33-V42 HydrophobicContact CG2-CG2 4.46Å; N38-V42 WeakPolarHBondContact O-CG2 3.22Å; N38-V42 PolarHBondContact O-N 2.98Å; L39-V42 PolarHBondContact O-N 3.3Å; V42-S44 PolarHBondContact O-N 3.26Å; V42-L46 HydrophobicContact CB-CD1 4.42Å; V42-L46 HydrophobicContact CG1-CB 4.33Å; V42-L46 HydrophobicContact CG1-CD1 4.18Å; V42-L46 HydrophobicContact CG2-CD1 4.14Å; V42-L46 WeakPolarHBondContact O-CA 3.5Å; V42-L46 WeakPolarHBondContact O-CB 3.42Å; V42-L46 PolarHBondContact O-N 3.43Å; V42-L47 PolarHBondContact O-N 2.95Å; V42-L47 VanDerWaalsContact O-N 3.16Å; V42-V88 HydrophobicContact CG1-CG1 4.12Å; V42-Y98 HydrophobicContact CB-CD2 4.03Å; V42-Y98 HydrophobicContact CB-CE2 4.45Å; V42-Y98 HydrophobicContact CG1-CD1 4.32Å; V42-Y98 HydrophobicContact CG1-CD2 3.67Å; V42-Y98 HydrophobicContact CG1-CE2 4.07Å; V42-Y98 HydrophobicContact CG1-CG 3.85Å; V42-Y98 HydrophobicContact CG2-CD2 4.49Å; V42-L100 HydrophobicContact CG1-CD2 4.48Å; V42-L100 HydrophobicContact CG2-CD1 3.84Å; V42-L100 HydrophobicContact CG2-CD2 4.12Å; V42-L100 HydrophobicContact CG2-CG 4.34Å
43	R	74.3	Confident	69	Low	109 Å²	109	58.8 Å²	58.8	41%	0.411	32%	0.316	S	S	.	.	I	π-helix	trans	-61.8	-42.3	179.3	-73.9	173.2	177.3	-177.2	-2.8	112.8	L39 Q40 L41 L47 Y98	L39-R43 WeakPolarHBondContact O-CB 3.39Å; L39-R43 VanDerWaalsContact O-CG 3.27Å; L39-R43 WeakPolarHBondContact O-CG 3.45Å; L39-R43 PolarHBondContact O-N 3.4Å; Q40-R43 PolarHBondContact O-N 3.07Å; L41-R43 PolarHBondContact O-N 2.89Å; R43-L47 HydrophobicContact CG-CD1 4.21Å; R43-Y98 HydrophobicContact CG-CE2 4.28Å
44	S	72.7	Confident	68.1	Low	36 Å²	36	62.5 Å²	62.5	25%	0.252	34%	0.342	S	S	.	.	I	π-helix	trans	-81	-32.2	-175.2	63.9	0	0	0	0	114.2	Q40 L41 V42 Y119	Q40-S44 VanDerWaalsContact O-CB 3.22Å; Q40-S44 WeakPolarHBondContact O-CB 3.41Å; Q40-S44 PolarHBondContact O-N 3.1Å; Q40-S44 PolarHBondContact O-OG 3.41Å; L41-S44 PolarHBondContact O-N 3.44Å; L41-S44 PolarHBondContact O-OG 3.46Å; V42-S44 PolarHBondContact O-N 3.26Å; S44-Y119 WeakPolarHBondContact OG-CE1 3.13Å
45	R	73.3	Confident	68.1	Low	117 Å²	117	58.8 Å²	58.8	44%	0.442	32%	0.323	S	S	.	.	I	π-helix	trans	-109.2	-32.2	-173.7	-70	-66.8	-169.8	163.2	1.8	114.8	L41 T50 Y119	L41-R45 WeakPolarHBondContact O-CB 3.38Å; L41-R45 PolarHBondContact O-N 2.78Å; R45-T50 PolarHBondContact O-OG1 2.82Å; R45-Y119 PolarHBondContact NE-OH 3.14Å
46	L	71.6	Confident	68.4	Low	9 Å²	9	59.2 Å²	59.2	5%	0.047	32%	0.323	C	S	.	.	I	π-helix	trans	-98.8	-30.3	-176.6	-59.8	176.5	0	0	0	112.4	V42 L52 T55 L57 A85 V88 L100	V42-L46 HydrophobicContact CB-CD1 4.42Å; V42-L46 HydrophobicContact CG1-CB 4.33Å; V42-L46 HydrophobicContact CG1-CD1 4.18Å; V42-L46 HydrophobicContact CG2-CD1 4.14Å; V42-L46 WeakPolarHBondContact O-CA 3.5Å; V42-L46 WeakPolarHBondContact O-CB 3.42Å; V42-L46 PolarHBondContact O-N 3.43Å; L46-L52 HydrophobicContact CB-CD2 4.17Å; L46-L52 HydrophobicContact CD2-CD2 4.07Å; L46-T55 HydrophobicContact CD2-CG2 3.96Å; L46-L57 HydrophobicContact CD1-CD1 4.45Å; L46-A85 HydrophobicContact CD1-CB 4.28Å; L46-A85 HydrophobicContact CD2-CB 3.93Å; L46-V88 HydrophobicContact CB-CG2 4.27Å; L46-V88 HydrophobicContact CD1-CG2 3.86Å; L46-L100 HydrophobicContact CD1-CD1 4.41Å; L46-L100 HydrophobicContact CD1-CD2 3.68Å
47	L	67.8	Low	69.2	Low	81 Å²	81	57.2 Å²	57.2	42%	0.424	31%	0.307	S	S	.	.	S	Bend	trans	-95.9	-19.9	-177.8	-60.3	179.5	0	0	0	114.5	V42 R43 G49 Y98 M625	V42-L47 PolarHBondContact O-N 2.95Å; V42-L47 VanDerWaalsContact O-N 3.16Å; R43-L47 HydrophobicContact CG-CD1 4.21Å; L47-G49 VanDerWaalsContact C-N 3.31Å; L47-G49 PolarHBondContact O-N 3.27Å; L47-Y98 HydrophobicContact CD1-CE1 4.23Å; L47-M625 HydrophobicContact CD1-SD 4.12Å
48	K	60	Low	69.7	Low	166 Å²	166	56.8 Å²	56.8	72%	0.722	31%	0.306	S	S	*	.	S	Bend	trans	-84.2	20.7	-177.4	-76.6	-172.1	179	-171.9	0	116
49	G	48.2	Very low	70.1	Confident	73 Å²	73	56.6 Å²	56.6	75%	0.753	30%	0.304	S	S	*	.	S	Bend	trans	99.9	9.3	163.3	0	0	0	0	0	118.2	L47	L47-G49 VanDerWaalsContact C-N 3.31Å; L47-G49 PolarHBondContact O-N 3.27Å
50	T	50.4	Low	70.5	Confident	76 Å²	76	55.9 Å²	55.9	47%	0.466	30%	0.301	S	S	.	.	S	Bend	trans	-82.6	133.6	164.6	32.8	0	0	0	0	110.5	R45 L52	R45-T50 PolarHBondContact O-OG1 2.82Å; T50-L52 PolarHBondContact O-N 2.91Å
51	S	55.3	Low	70.8	Confident	75 Å²	75	52.3 Å²	52.3	52%	0.524	28%	0.284	S	S	.	.			trans	-52.3	123.7	177.9	-178.5	0	0	0	0	110.5	Q53 S54	S51-Q53 PolarHBondContact O-N 2.91Å; S51-S54 PolarHBondContact O-N 2.95Å; S51-S54 PolarHBondContact O-OG 3.22Å
52	L	58.8	Low	70.1	Confident	60 Å²	60	56.9 Å²	56.9	31%	0.314	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-49.8	-32.9	-178.6	-69.5	171.3	0	0	0	112.1	L46 T50 S54 V88	L46-L52 HydrophobicContact CB-CD2 4.17Å; L46-L52 HydrophobicContact CD2-CD2 4.07Å; T50-L52 PolarHBondContact O-N 2.91Å; L52-S54 PolarHBondContact O-N 3.03Å; L52-V88 HydrophobicContact CD2-CG2 3.87Å
53	Q	53.1	Low	69.3	Low	162 Å²	162	57.1 Å²	57.1	76%	0.757	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-71.7	-6.9	-179	-62.6	-176.8	-7.1	0	0	115	S51 L84	S51-Q53 PolarHBondContact O-N 2.91Å; Q53-L84 WeakPolarHBondContact O-CD1 3.48Å
54	S	60.3	Low	68.4	Low	79 Å²	79	55.7 Å²	55.7	55%	0.552	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-113.5	-8.2	-177.7	62.7	0	0	0	0	114.3	S51 L52 I56	S51-S54 PolarHBondContact O-N 2.95Å; S51-S54 PolarHBondContact O-OG 3.22Å; L52-S54 PolarHBondContact O-N 3.03Å; S54-I56 PolarHBondContact O-N 2.83Å
55	T	73.4	Confident	67.5	Low	16 Å²	16	54.3 Å²	54.3	10%	0.098	31%	0.305	C	S	.	.			trans	-91.1	106.6	-174.9	-53	0	0	0	0	110.9	L46 L57	L46-T55 HydrophobicContact CD2-CG2 3.96Å; T55-L57 HydrophobicContact CG2-CD2 3.96Å; T55-L57 HydrophobicContact CG2-CG 4.49Å
56	I	83.2	Confident	66.6	Low	36 Å²	36	49.7 Å²	49.7	19%	0.185	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	128.3	172.7	-55.5	172.4	0	0	0	108.9	I9 L13 S54 A82 L105	I9-I56 HydrophobicContact CG2-CG2 4.46Å; L13-I56 HydrophobicContact CD1-CG2 4.46Å; L13-I56 HydrophobicContact CD2-CB 4.09Å; L13-I56 HydrophobicContact CD2-CG2 3.75Å; S54-I56 PolarHBondContact O-N 2.83Å; I56-A82 HydrophobicContact CG2-CB 4.06Å; I56-L105 HydrophobicContact CG1-CD1 4.45Å
57	L	86.8	Confident	65.6	Low	0 Å²	0	54.5 Å²	54.5	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	144.1	176.7	-57.5	177.6	0	0	0	109.3	P14 L41 L46 T55 A82 A83 A85	P14-L57 HydrophobicContact CG-CD2 3.68Å; L41-L57 HydrophobicContact CD2-CD1 4.36Å; L41-L57 HydrophobicContact CD2-CD2 3.97Å; L46-L57 HydrophobicContact CD1-CD1 4.45Å; T55-L57 HydrophobicContact CG2-CD2 3.96Å; T55-L57 HydrophobicContact CG2-CG 4.49Å; L57-A82 CarbonylContact O-C 3.42Å; L57-A82 WeakPolarHBondContact O-CA 3.16Å; L57-A83 PolarHBondContact N-O 3.3Å; L57-A83 PolarHBondContact O-N 3.08Å; L57-A85 HydrophobicContact CD1-CB 4.27Å
58	G	86.5	Confident	64.6	Low	0 Å²	0	53.6 Å²	53.6	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	117.4	169.3	0	0	0	0	0	110.3	P14 L15 L16	P14-G58 PolarHBondContact O-N 2.77Å; L15-G58 CarbonylContact C-O 3.39Å; L15-G58 VanDerWaalsContact CA-O 3.26Å; L15-G58 WeakPolarHBondContact CA-O 3.39Å; L16-G58 PolarHBondContact N-O 3.49Å
59	I	87.1	Confident	64.1	Low	1 Å²	1	49 Å²	49	1%	0.005	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	127.3	176.2	-58.4	-167	0	0	0	109.7	L16 T18 L23 G80 T81 A83 I102	L16-I59 HydrophobicContact CB-CG1 4.49Å; L16-I59 HydrophobicContact CD2-CD1 4.39Å; L16-I59 HydrophobicContact CD2-CG1 4.45Å; T18-I59 HydrophobicContact CG2-CG2 3.82Å; L23-I59 HydrophobicContact CB-CD1 4.32Å; L23-I59 HydrophobicContact CB-CG2 4.42Å; L23-I59 HydrophobicContact CD2-CD1 3.44Å; L23-I59 VanDerWaalsContact CD2-CD1 3.44Å; L23-I59 HydrophobicContact CD2-CG1 4.25Å; L23-I59 HydrophobicContact CG-CD1 4.49Å; I59-G80 WeakPolarHBondContact O-CA 3.48Å; I59-T81 PolarHBondContact N-O 3.18Å; I59-T81 PolarHBondContact O-N 3.06Å; I59-A83 HydrophobicContact CD1-CB 3.73Å; I59-A83 HydrophobicContact CG1-CB 3.8Å; I59-I102 HydrophobicContact CD1-CB 4.22Å; I59-I102 HydrophobicContact CD1-CD1 3.62Å; I59-I102 HydrophobicContact CD1-CG2 4.05Å
60	I	85.4	Confident	64	Low	0 Å²	0	49.3 Å²	49.3	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	119.3	174.6	-57.2	179	0	0	0	108.6	L15 L16 L17 T18 T63 L76 H77 I110	L15-I60 HydrophobicContact CB-CD1 4.1Å; L15-I60 HydrophobicContact CD1-CD1 3.53Å; L15-I60 HydrophobicContact CD2-CD1 3.85Å; L15-I60 HydrophobicContact CD2-CG1 4.17Å; L15-I60 HydrophobicContact CG-CD1 4.01Å; L16-I60 PolarHBondContact O-N 3.39Å; L16-I60 VanDerWaalsContact O-N 3.09Å; L17-I60 HydrophobicContact CD2-CB 4.18Å; L17-I60 HydrophobicContact CD2-CD1 4.16Å; T18-I60 PolarHBondContact N-O 3.48Å; T18-I60 VanDerWaalsContact N-O 3.08Å; T18-I60 PolarHBondContact OG1-O 2.87Å; I60-T63 HydrophobicContact CG2-CG2 3.78Å; I60-L76 HydrophobicContact CD1-CB 4.44Å; I60-L76 HydrophobicContact CD1-CD1 4.15Å; I60-L76 HydrophobicContact CD1-CD2 4.05Å; I60-L76 HydrophobicContact CD1-CG 4.46Å; I60-H77 HydrophobicContact CG2-CB 3.94Å; I60-I110 HydrophobicContact CD1-CD1 3.51Å; I60-I110 HydrophobicContact CG1-CD1 4.29Å
61	P	80.1	Confident	64.2	Low	3 Å²	3	51.2 Å²	51.2	2%	0.019	31%	0.314	C	S	.	.			trans	-78.4	156.6	178.7	31.2	-34.1	0	0	0	112.7	V22 T63 L202	V22-P61 HydrophobicContact CB-CB 4.24Å; V22-P61 HydrophobicContact CG1-CB 4.09Å; V22-P61 HydrophobicContact CG1-CG 4.27Å; V22-P61 HydrophobicContact CG2-CB 3.87Å; P61-T63 PolarHBondContact O-N 3.45Å; P61-T63 VanDerWaalsContact O-N 3.09Å; P61-L202 HydrophobicContact CG-CD2 3.77Å
62	N	65.3	Low	64.3	Low	95 Å²	95	54.5 Å²	54.5	51%	0.508	33%	0.326	S	S	.	.	S	Bend	trans	54.8	31.7	163.8	-159.5	40.9	0	0	0	114.8	T18 L199	T18-N62 PolarHBondContact O-N 3.45Å; N62-L199 HydrophobicContact CB-CD1 4.13Å
63	T	60.9	Low	64.4	Low	5 Å²	5	53 Å²	53	3%	0.031	32%	0.318	C	S	.	.			trans	-111	114.4	175.4	40.2	0	0	0	0	108	T18 I60 P61 D65 L76	T18-T63 PolarHBondContact O-N 3.33Å; I60-T63 HydrophobicContact CG2-CG2 3.78Å; P61-T63 PolarHBondContact O-N 3.45Å; P61-T63 VanDerWaalsContact O-N 3.09Å; T63-D65 PolarHBondContact O-N 2.95Å; T63-D65 VanDerWaalsContact O-N 3.13Å; T63-L76 HydrophobicContact CG2-CD2 4.16Å
64	P	57.1	Low	65	Low	79 Å²	79	46.8 Å²	46.8	51%	0.513	29%	0.291	S	S	.	.			trans	-75.2	106.2	-179.3	27.9	-31.5	0	0	0	110.3	H19 P66 P74	H19-P64 WeakPolarHBondContact CE1-CA 3.49Å; H19-P64 VanDerWaalsContact ND1-CA 3.31Å; H19-P64 WeakPolarHBondContact ND1-CA 3.5Å; P64-P66 WeakPolarHBondContact O-CD 3.41Å; P64-P74 WeakPolarHBondContact O-CG 3.42Å
65	D	53.5	Low	65.3	Low	8 Å²	8	49 Å²	49	4%	0.043	30%	0.304	C	S	.	.			trans	-63	120.8	169.6	-156.2	10.4	0	0	0	108.9	L17 H19 T35 R37 T63	L17-D65 HydrophobicContact CB-CB 4.22Å; L17-D65 HydrophobicContact CD1-CB 4.15Å; H19-D65 PolarHBondContact CE1-N 3.4Å; H19-D65 PolarHBondContact CE1-O 2.92Å; H19-D65 VanDerWaalsContact CE1-O 3.25Å; H19-D65 WeakPolarHBondContact NE2-CB 3.34Å; H19-D65 PolarHBondContact NE2-N 3.49Å; H19-D65 PolarHBondContact NE2-O 2.97Å; T35-D65 HydrophobicContact CG2-CB 4.09Å; T35-D65 VanDerWaalsContact CG2-OD2 3.22Å; T35-D65 WeakPolarHBondContact CG2-OD2 3.29Å; R37-D65 WeakPolarHBondContact CD-OD1 3.43Å; R37-D65 IonicContact NH1-OD1 3.47Å; R37-D65 PolarHBondContact NH1-OD1 3.16Å; T63-D65 PolarHBondContact O-N 2.95Å; T63-D65 VanDerWaalsContact O-N 3.13Å
66	P	54.5	Low	65.3	Low	20 Å²	20	50.3 Å²	50.3	13%	0.13	31%	0.31	C	S	.	.			trans	-62.8	143.1	179.4	22.4	-32	0	0	0	111.2	P64 S68 Q71	P64-P66 WeakPolarHBondContact O-CD 3.41Å; P66-S68 PolarHBondContact O-N 3.29Å; P66-Q71 HydrophobicContact CB-CB 3.91Å; P66-Q71 HydrophobicContact CG-CB 3.98Å
67	A	49.1	Very low	65.1	Low	110 Å²	110	50.5 Å²	50.5	91%	0.909	31%	0.31	S	S	*	.	S	Bend	trans	-67.5	-3.8	-175.2	0	0	0	0	0	114.8
68	S	47.8	Very low	64.8	Low	61 Å²	61	58.5 Å²	58.5	43%	0.427	34%	0.34	S	S	.	.	S	Bend	trans	-132.1	136.7	-178.4	178	0	0	0	0	111	P66 A70 Q71	P66-S68 PolarHBondContact O-N 3.29Å; S68-A70 PolarHBondContact O-N 2.91Å; S68-Q71 PolarHBondContact O-N 3.48Å
69	D	50.5	Low	64.8	Low	69 Å²	69	59.3 Å²	59.3	37%	0.369	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-11.9	179.2	-74	-32.7	0	0	0	114.1	R37 K117	R37-D69 WeakPolarHBondContact CG-OD1 3.28Å; R37-D69 IonicContact NE-OD1 3.79Å; R37-D69 PolarHBondContact NH2-O 3.24Å; D69-K117 WeakPolarHBondContact O-CE 3.38Å; D69-K117 PolarHBondContact O-NZ 3.06Å
70	A	45.4	Very low	64.8	Low	81 Å²	81	59.3 Å²	59.3	67%	0.669	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-6.4	-176.4	0	0	0	0	0	115.3	S68	S68-A70 PolarHBondContact O-N 2.91Å
71	Q	55	Low	64.9	Low	116 Å²	116	59.3 Å²	59.3	54%	0.542	35%	0.345	S	S	.	.	S	Bend	trans	-101.4	140.8	-178.1	-68.2	179	-7.8	0	0	112.3	R37 P66 S68	R37-Q71 PolarHBondContact NH2-O 3.22Å; P66-Q71 HydrophobicContact CB-CB 3.91Å; P66-Q71 HydrophobicContact CG-CB 3.98Å; S68-Q71 PolarHBondContact O-N 3.48Å
72	D	56.6	Low	65.3	Low	143 Å²	143	59.2 Å²	59.2	77%	0.765	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-62.3	154.3	176.9	-62.8	-32.5	0	0	0	111.9
73	L	61	Low	66.3	Low	30 Å²	30	54.7 Å²	54.7	16%	0.157	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-63.5	133.6	-179.2	-77.5	167.6	0	0	0	111.2	L17 E116 P120	L17-L73 HydrophobicContact CD1-CD2 3.87Å; L73-E116 HydrophobicContact CD1-CB 3.97Å; L73-E116 HydrophobicContact CD1-CG 3.59Å; L73-P120 HydrophobicContact CD1-CB 4.27Å
74	P	64.9	Low	67.6	Low	30 Å²	30	56.4 Å²	56.4	20%	0.195	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-64.7	162.5	170.3	31.2	-37.9	0	0	0	111	P64 L76	P64-P74 WeakPolarHBondContact O-CG 3.42Å; P74-L76 PolarHBondContact O-N 2.99Å
75	P	67	Low	68.7	Low	127 Å²	127	52.6 Å²	52.6	83%	0.825	30%	0.304	S	S	*	.			trans	-57	113.9	177.4	23.1	-33	0	0	0	110.5
76	L	73.6	Confident	69.9	Low	42 Å²	42	55.8 Å²	55.8	22%	0.22	32%	0.323	C	S	.	.			trans	-72.1	143.8	-179	-63.9	176.2	0	0	0	110.6	L15 L17 I60 T63 P74 R78 I110 V113	L15-L76 HydrophobicContact CD1-CD1 4.25Å; L17-L76 HydrophobicContact CD2-CD2 3.69Å; I60-L76 HydrophobicContact CD1-CB 4.44Å; I60-L76 HydrophobicContact CD1-CD1 4.15Å; I60-L76 HydrophobicContact CD1-CD2 4.05Å; I60-L76 HydrophobicContact CD1-CG 4.46Å; T63-L76 HydrophobicContact CG2-CD2 4.16Å; P74-L76 PolarHBondContact O-N 2.99Å; L76-R78 PolarHBondContact O-N 3.47Å; L76-I110 HydrophobicContact CB-CD1 4.33Å; L76-I110 HydrophobicContact CD1-CD1 4.43Å; L76-V113 HydrophobicContact CD1-CG2 3.74Å
77	H	78.5	Confident	71	Confident	40 Å²	40	59.5 Å²	59.5	19%	0.185	34%	0.339	C	S	.	.			trans	-65.7	134.1	171.4	-167.4	-99.4	0	0	0	110.4	I60 I79 I110 L199 D203	I60-H77 HydrophobicContact CG2-CB 3.94Å; H77-I79 VanDerWaalsContact C-N 3.33Å; H77-I79 PolarHBondContact ND1-N 2.79Å; H77-I79 PolarHBondContact ND1-O 2.89Å; H77-I79 PolarHBondContact O-N 3.25Å; H77-I110 WeakPolarHBondContact O-CD1 3.43Å; H77-L199 WeakPolarHBondContact NE2-CD2 3.15Å; H77-D203 IonicContact CE1-OD1 3.91Å; H77-D203 PolarHBondContact CE1-OD1 3.18Å; H77-D203 IonicContact NE2-OD1 3.25Å; H77-D203 PolarHBondContact NE2-OD1 3.39Å; H77-D203 IonicContact NE2-OD2 3.98Å
78	R	81.3	Confident	72.3	Confident	168 Å²	168	55.9 Å²	55.9	63%	0.634	31%	0.305	S	S	*	.	S	Bend	trans	-67.3	-32	-169.5	-172.8	175.1	175.7	-179.5	-0.3	113.5	L76 Q109 I110	L76-R78 PolarHBondContact O-N 3.47Å; R78-Q109 HydrophobicContact CG-CG 3.97Å; R78-Q109 VanDerWaalsContact NE-NE2 3.14Å; R78-I110 PolarHBondContact O-N 3Å
79	I	85.4	Confident	73.5	Confident	18 Å²	18	56.6 Å²	56.6	9%	0.092	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	131.8	-179.8	-61.5	172.5	0	0	0	109.4	H77 F108 L127 L202 V205	H77-I79 VanDerWaalsContact C-N 3.33Å; H77-I79 PolarHBondContact ND1-N 2.79Å; H77-I79 PolarHBondContact ND1-O 2.89Å; H77-I79 PolarHBondContact O-N 3.25Å; I79-F108 WeakPolarHBondContact CA-O 3.45Å; I79-L127 HydrophobicContact CD1-CD1 4.26Å; I79-L127 HydrophobicContact CG1-CD1 4.17Å; I79-L127 HydrophobicContact CG2-CD1 4.29Å; I79-L202 HydrophobicContact CG2-CD1 4.44Å; I79-L202 HydrophobicContact CG2-CG 4.07Å; I79-V205 HydrophobicContact CD1-CG2 4.44Å
80	G	87.2	Confident	74.3	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	174.7	177.4	0	0	0	0	0	112.2	I59 R107 F108	I59-G80 WeakPolarHBondContact O-CA 3.48Å; G80-R107 WeakPolarHBondContact O-CA 3.27Å; G80-F108 PolarHBondContact N-O 3.37Å; G80-F108 WeakPolarHBondContact O-CD1 3.33Å; G80-F108 PolarHBondContact O-N 3.33Å
81	T	88.9	Confident	75.1	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.006	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	122	178.7	-58.6	0	0	0	0	110	L23 P25 I59 C106 L202	L23-T81 HydrophobicContact CD2-CG2 4.09Å; L23-T81 HydrophobicContact CG-CG2 4.1Å; L23-T81 WeakPolarHBondContact O-CB 3.47Å; L23-T81 PolarHBondContact O-OG1 3.44Å; P25-T81 HydrophobicContact CG-CG2 4.39Å; I59-T81 PolarHBondContact N-O 3.18Å; I59-T81 PolarHBondContact O-N 3.06Å; T81-C106 CarbonylContact C-O 3.48Å; T81-C106 WeakPolarHBondContact CA-O 3.22Å; T81-L202 VanDerWaalsContact OG1-CD1 3.23Å; T81-L202 WeakPolarHBondContact OG1-CD1 3.36Å
82	A	88	Confident	75.5	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	131.4	171.4	0	0	0	0	0	108.5	I9 L13 I56 L57 L105 C106 F108	I9-A82 HydrophobicContact CD1-CB 3.79Å; I9-A82 HydrophobicContact CG1-CB 4.29Å; I9-A82 HydrophobicContact CG2-CB 4.29Å; L13-A82 HydrophobicContact CD1-CB 4.14Å; I56-A82 HydrophobicContact CG2-CB 4.06Å; L57-A82 CarbonylContact O-C 3.42Å; L57-A82 WeakPolarHBondContact O-CA 3.16Å; A82-L105 WeakPolarHBondContact O-CB 3.27Å; A82-L105 PolarHBondContact O-N 2.7Å; A82-C106 PolarHBondContact N-O 2.85Å; A82-F108 HydrophobicContact CB-CD1 3.92Å; A82-F108 HydrophobicContact CB-CE1 4.35Å
83	A	87.1	Confident	75.6	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	143.2	-165.3	0	0	0	0	0	111.7	L23 L57 I59 I102 T103	L23-A83 HydrophobicContact CD2-CB 3.34Å; L57-A83 PolarHBondContact N-O 3.3Å; L57-A83 PolarHBondContact O-N 3.08Å; I59-A83 HydrophobicContact CD1-CB 3.73Å; I59-A83 HydrophobicContact CG1-CB 3.8Å; A83-I102 HydrophobicContact CB-CG2 3.38Å; A83-T103 CarbonylContact C-O 3.18Å; A83-T103 WeakPolarHBondContact CA-O 3.44Å
84	L	86.4	Confident	75.4	Confident	41 Å²	41	44.3 Å²	44.3	22%	0.215	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	126.1	177.8	-173.3	72.5	0	0	0	110.6	Q53 V86 I102 T103 L105	Q53-L84 WeakPolarHBondContact O-CD1 3.48Å; L84-V86 PolarHBondContact O-N 3.27Å; L84-I102 VanDerWaalsContact C-CG2 3.5Å; L84-I102 CarbonylContact O-C 3.49Å; L84-I102 WeakPolarHBondContact O-CA 3.39Å; L84-I102 WeakPolarHBondContact O-CG2 3.46Å; L84-T103 PolarHBondContact N-O 3.43Å; L84-T103 PolarHBondContact O-N 3.5Å; L84-L105 HydrophobicContact CB-CD1 4.27Å; L84-L105 HydrophobicContact CB-CD2 4.47Å; L84-L105 HydrophobicContact CB-CG 4.45Å
85	A	81.8	Confident	75.3	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	110.8	174.6	0	0	0	0	0	110.6	L46 L57	L46-A85 HydrophobicContact CD1-CB 4.28Å; L46-A85 HydrophobicContact CD2-CB 3.93Å; L57-A85 HydrophobicContact CD1-CB 4.27Å
86	V	78.4	Confident	75.3	Confident	74 Å²	74	47.3 Å²	47.3	45%	0.448	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	-40.7	-177	-179.7	0	0	0	0	111.6	L84 L101 T103	L84-V86 PolarHBondContact O-N 3.27Å; V86-L101 HydrophobicContact CB-CD2 4.35Å; V86-L101 HydrophobicContact CB-CG 4.43Å; V86-L101 HydrophobicContact CG1-CD2 4.35Å; V86-L101 PolarHBondContact N-O 2.74Å; V86-T103 VanDerWaalsContact CG2-OG1 3.24Å; V86-T103 WeakPolarHBondContact CG2-OG1 3.43Å
87	Q	76.2	Confident	75.3	Confident	99 Å²	99	48.1 Å²	48.1	46%	0.463	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	140.2	-177.2	-170.2	179.7	1.9	0	0	110.6	V89 L101	Q87-V89 HydrophobicContact CG-CG2 4.24Å; Q87-L101 HydrophobicContact CB-CB 4.03Å; Q87-L101 HydrophobicContact CB-CD2 4.37Å; Q87-L101 PolarHBondContact N-O 3.33Å; Q87-L101 PolarHBondContact O-N 3.41Å
88	V	76.9	Confident	75.3	Confident	33 Å²	33	46.5 Å²	46.5	20%	0.2	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	125.3	172.5	-174.9	0	0	0	0	107.9	V42 L46 L52 Y98 L100	V42-V88 HydrophobicContact CG1-CG1 4.12Å; L46-V88 HydrophobicContact CB-CG2 4.27Å; L46-V88 HydrophobicContact CD1-CG2 3.86Å; L52-V88 HydrophobicContact CD2-CG2 3.87Å; V88-Y98 HydrophobicContact CG1-CD1 4.12Å; V88-L100 HydrophobicContact CB-CD2 4.03Å; V88-L100 HydrophobicContact CG1-CD2 3.76Å; V88-L100 HydrophobicContact CG2-CD2 3.51Å
89	V	73.5	Confident	75.2	Confident	76 Å²	76	41 Å²	41	46%	0.461	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	121.3	171.9	-177.6	0	0	0	0	107.5	Q87 Y98 T99	Q87-V89 HydrophobicContact CG-CG2 4.24Å; V89-Y98 CarbonylContact O-C 3.57Å; V89-Y98 WeakPolarHBondContact O-CA 3.5Å; V89-T99 PolarHBondContact N-O 3.46Å; V89-T99 PolarHBondContact O-N 2.94Å
90	G	66.5	Low	75	Confident	21 Å²	21	40.1 Å²	40.1	22%	0.216	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	136.3	178.6	0	0	0	0	0	111.6	Y98	G90-Y98 VanDerWaalsContact CA-CD1 3.41Å
91	S	63.6	Low	74.9	Confident	17 Å²	17	41.8 Å²	41.8	12%	0.119	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	134.4	164.6	175.1	0	0	0	0	109.4	W93 P96 H97	S91-W93 PolarHBondContact OG-N 3.25Å; S91-W93 PolarHBondContact OG-O 3.43Å; S91-P96 WeakPolarHBondContact O-CA 3.48Å; S91-H97 PolarHBondContact N-O 3.43Å; S91-H97 PolarHBondContact O-N 2.95Å; S91-H97 PolarHBondContact O-ND1 2.98Å
92	N	62.6	Low	74.8	Confident	35 Å²	35	41.8 Å²	41.8	19%	0.187	23%	0.229	C	C	.	.			trans	-98.3	10.5	-179.1	-71.8	-8.9	0	0	0	112.7	M625 I627	N92-M625 PolarHBondContact ND2-O 2.75Å; N92-I627 HydrophobicContact CB-CG1 4.41Å
93	W	59.5	Low	74.8	Confident	29 Å²	29	43.4 Å²	43.4	11%	0.11	24%	0.239	C	C	.	.	S	Bend	trans	-130.7	130.7	-175.5	-166.7	-82.8	0	0	0	112.1	S91 A574 V575 K578 I627 A633 D636 I637	S91-W93 PolarHBondContact OG-N 3.25Å; S91-W93 PolarHBondContact OG-O 3.43Å; W93-A574 HydrophobicContact CH2-CB 4.41Å; W93-V575 HydrophobicContact CZ3-CG2 4.44Å; W93-K578 HydrophobicContact CE3-CG 4.33Å; W93-K578 HydrophobicContact CH2-CG 3.76Å; W93-K578 HydrophobicContact CZ3-CB 4.19Å; W93-K578 HydrophobicContact CZ3-CD 4.43Å; W93-K578 HydrophobicContact CZ3-CG 3.47Å; W93-K578 VanDerWaalsContact CZ3-CG 3.47Å; W93-I627 HydrophobicContact CE3-CG2 3.93Å; W93-A633 HydrophobicContact CB-CB 4.36Å; W93-A633 VanDerWaalsContact CD1-CB 3.5Å; W93-A633 HydrophobicContact CD2-CB 4.4Å; W93-A633 HydrophobicContact CG-CB 3.84Å; W93-D636 PolarHBondContact NE1-OD2 3.13Å; W93-I637 HydrophobicContact CH2-CD1 4.1Å; W93-I637 HydrophobicContact CH2-CG1 4.13Å; W93-I637 HydrophobicContact CZ2-CD1 3.89Å; W93-I637 HydrophobicContact CZ2-CG1 3.64Å
94	P	55.3	Low	74.8	Confident	80 Å²	80	43.5 Å²	43.5	52%	0.519	24%	0.24	S	C	.	.	S	Bend	cis	-81.6	-11.2	-4.9	32	-34.8	0	0	0	114.6
95	K	64.4	Low	74.7	Confident	167 Å²	167	43.9 Å²	43.9	73%	0.726	24%	0.242	S	C	*	.	S	Bend	trans	-133	150.7	169.6	-71.6	-177.7	-179.2	178	0	108.8	H97	K95-H97 PolarHBondContact O-N 3.23Å; K95-H97 VanDerWaalsContact O-N 3.14Å; K95-H97 PolarHBondContact O-ND1 3.28Å
96	P	65.8	Low	74.9	Confident	53 Å²	53	44.2 Å²	44.2	34%	0.344	24%	0.244	S	C	.	.			trans	-63.1	115.9	175.6	27.1	-33.6	0	0	0	109.9	S91	S91-P96 WeakPolarHBondContact O-CA 3.48Å
97	H	73.9	Confident	75.3	Confident	59 Å²	59	40.7 Å²	40.7	27%	0.273	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	139.1	172.8	60.9	-73.8	0	0	0	109.7	V33 D34 S91 K95	V33-H97 WeakPolarHBondContact O-CA 3.43Å; D34-H97 WeakPolarHBondContact OD1-CB 3.48Å; S91-H97 PolarHBondContact N-O 3.43Å; S91-H97 PolarHBondContact O-N 2.95Å; S91-H97 PolarHBondContact O-ND1 2.98Å; K95-H97 PolarHBondContact O-N 3.23Å; K95-H97 VanDerWaalsContact O-N 3.14Å; K95-H97 PolarHBondContact O-ND1 3.28Å
98	Y	77.9	Confident	75.9	Confident	6 Å²	6	36 Å²	36	2%	0.024	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	131.8	169.8	-61.7	-71.2	0	0	0	109.3	S32 V33 L39 V42 R43 L47 V88 V89 G90 M625	S32-Y98 CarbonylContact C-O 3.58Å; V33-Y98 WeakPolarHBondContact CB-O 3.34Å; V33-Y98 PolarHBondContact N-O 3.48Å; V33-Y98 PolarHBondContact O-N 2.84Å; L39-Y98 HydrophobicContact CD2-CD2 3.33Å; L39-Y98 HydrophobicContact CD2-CE2 3.61Å; L39-Y98 HydrophobicContact CD2-CG 4.41Å; V42-Y98 HydrophobicContact CB-CD2 4.03Å; V42-Y98 HydrophobicContact CB-CE2 4.45Å; V42-Y98 HydrophobicContact CG1-CD1 4.32Å; V42-Y98 HydrophobicContact CG1-CD2 3.67Å; V42-Y98 HydrophobicContact CG1-CE2 4.07Å; V42-Y98 HydrophobicContact CG1-CG 3.85Å; V42-Y98 HydrophobicContact CG2-CD2 4.49Å; R43-Y98 HydrophobicContact CG-CE2 4.28Å; L47-Y98 HydrophobicContact CD1-CE1 4.23Å; V88-Y98 HydrophobicContact CG1-CD1 4.12Å; V89-Y98 CarbonylContact O-C 3.57Å; V89-Y98 WeakPolarHBondContact O-CA 3.5Å; G90-Y98 VanDerWaalsContact CA-CD1 3.41Å; Y98-M625 HydrophobicContact CE1-SD 3.83Å
99	T	79.6	Confident	76.5	Confident	51 Å²	51	36.5 Å²	36.5	31%	0.313	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	115.2	165.3	-54.7	0	0	0	0	108.2	R30 V89	R30-T99 HydrophobicContact CB-CG2 4.46Å; V89-T99 PolarHBondContact N-O 3.46Å; V89-T99 PolarHBondContact O-N 2.94Å
100	L	82.3	Confident	77.1	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	130.5	175.5	-61.7	178.6	0	0	0	109.8	L16 R30 T31 V33 V42 L46 V88 I102	L16-L100 HydrophobicContact CD1-CD1 4.38Å; L16-L100 HydrophobicContact CD2-CD1 4.07Å; R30-L100 CarbonylContact C-O 3.57Å; R30-L100 VanDerWaalsContact CA-O 3.29Å; R30-L100 WeakPolarHBondContact CA-O 3.23Å; T31-L100 PolarHBondContact N-O 3.22Å; T31-L100 PolarHBondContact O-N 3.15Å; V33-L100 HydrophobicContact CG2-CD1 3.53Å; V33-L100 HydrophobicContact CG2-CG 3.78Å; V42-L100 HydrophobicContact CG1-CD2 4.48Å; V42-L100 HydrophobicContact CG2-CD1 3.84Å; V42-L100 HydrophobicContact CG2-CD2 4.12Å; V42-L100 HydrophobicContact CG2-CG 4.34Å; L46-L100 HydrophobicContact CD1-CD1 4.41Å; L46-L100 HydrophobicContact CD1-CD2 3.68Å; V88-L100 HydrophobicContact CB-CD2 4.03Å; V88-L100 HydrophobicContact CG1-CD2 3.76Å; V88-L100 HydrophobicContact CG2-CD2 3.51Å; L100-I102 HydrophobicContact CB-CD1 3.86Å; L100-I102 HydrophobicContact CB-CG1 3.73Å; L100-I102 HydrophobicContact CD1-CD1 4.02Å
101	L	84.9	Confident	78	Confident	36 Å²	36	37.2 Å²	37.2	19%	0.188	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	113.9	163.8	-179.2	68.4	0	0	0	108.3	R30 V86 Q87	R30-L101 HydrophobicContact CG-CD1 3.57Å; V86-L101 HydrophobicContact CB-CD2 4.35Å; V86-L101 HydrophobicContact CB-CG 4.43Å; V86-L101 HydrophobicContact CG1-CD2 4.35Å; V86-L101 PolarHBondContact N-O 2.74Å; Q87-L101 HydrophobicContact CB-CB 4.03Å; Q87-L101 HydrophobicContact CB-CD2 4.37Å; Q87-L101 PolarHBondContact N-O 3.33Å; Q87-L101 PolarHBondContact O-N 3.41Å
102	I	87.4	Confident	79	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	141.5	-173.1	-36	176.5	0	0	0	109.9	L16 T28 M29 I59 A83 L84 L100	L16-I102 HydrophobicContact CD2-CD1 3.55Å; T28-I102 CarbonylContact C-O 3.58Å; T28-I102 WeakPolarHBondContact CA-O 3.33Å; M29-I102 PolarHBondContact N-O 3.03Å; M29-I102 PolarHBondContact O-N 2.91Å; I59-I102 HydrophobicContact CD1-CB 4.22Å; I59-I102 HydrophobicContact CD1-CD1 3.62Å; I59-I102 HydrophobicContact CD1-CG2 4.05Å; A83-I102 HydrophobicContact CB-CG2 3.38Å; L84-I102 VanDerWaalsContact C-CG2 3.5Å; L84-I102 CarbonylContact O-C 3.49Å; L84-I102 WeakPolarHBondContact O-CA 3.39Å; L84-I102 WeakPolarHBondContact O-CG2 3.46Å; L100-I102 HydrophobicContact CB-CD1 3.86Å; L100-I102 HydrophobicContact CB-CG1 3.73Å; L100-I102 HydrophobicContact CD1-CD1 4.02Å
103	T	86.9	Confident	80	Confident	35 Å²	35	42.7 Å²	42.7	22%	0.215	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	126.1	178.4	-53.5	0	0	0	0	110.1	S27 T28 A83 L84 V86	S27-T103 WeakPolarHBondContact O-CA 3.42Å; T28-T103 HydrophobicContact CG2-CG2 3.87Å; T28-T103 WeakPolarHBondContact CG2-OG1 3.49Å; A83-T103 CarbonylContact C-O 3.18Å; A83-T103 WeakPolarHBondContact CA-O 3.44Å; L84-T103 PolarHBondContact N-O 3.43Å; L84-T103 PolarHBondContact O-N 3.5Å; V86-T103 VanDerWaalsContact CG2-OG1 3.24Å; V86-T103 WeakPolarHBondContact CG2-OG1 3.43Å
104	G	86.8	Confident	81.1	Confident	2 Å²	2	45 Å²	45	2%	0.021	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	133.2	178	0	0	0	0	0	111.7	G26 S27	G26-G104 WeakPolarHBondContact CA-O 3.38Å; G26-G104 PolarHBondContact N-O 2.7Å; S27-G104 PolarHBondContact O-N 3.11Å
105	L	84.9	Confident	82.4	Confident	49 Å²	49	46.6 Å²	46.6	26%	0.257	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	-58.5	179.4	-59	178.7	0	0	0	110.9	I7 I56 A82 L84	I7-L105 HydrophobicContact CD1-CD2 4.29Å; I7-L105 HydrophobicContact CG2-CD1 4.36Å; I56-L105 HydrophobicContact CG1-CD1 4.45Å; A82-L105 WeakPolarHBondContact O-CB 3.27Å; A82-L105 PolarHBondContact O-N 2.7Å; L84-L105 HydrophobicContact CB-CD1 4.27Å; L84-L105 HydrophobicContact CB-CD2 4.47Å; L84-L105 HydrophobicContact CB-CG 4.45Å
106	C	84.9	Confident	82.8	Confident	6 Å²	6	42.7 Å²	42.7	4%	0.041	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	161.7	-171.1	38.2	0	0	0	0	111.9	I9 T81 A82 D128	I9-C106 HydrophobicContact CD1-CB 4.32Å; I9-C106 WeakPolarHBondContact CD1-SG 3.18Å; I9-C106 WeakPolarHBondContact CG1-SG 3.24Å; T81-C106 CarbonylContact C-O 3.48Å; T81-C106 WeakPolarHBondContact CA-O 3.22Å; A82-C106 PolarHBondContact N-O 2.85Å; C106-D128 HydrophobicContact CB-CB 4.4Å
107	R	87.4	Confident	83.2	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	140.4	175.9	-61.9	175.7	168.3	80.8	-7.4	110.9	P25 G80 L127 D128 D185 I201 L202 R210	P25-R107 HydrophobicContact CG-CG 3.8Å; G80-R107 WeakPolarHBondContact O-CA 3.27Å; R107-L127 HydrophobicContact CB-CB 4.4Å; R107-L127 PolarHBondContact O-N 2.9Å; R107-D128 WeakPolarHBondContact CB-OD2 3.33Å; R107-D128 PolarHBondContact N-OD2 2.77Å; R107-D185 IonicContact CZ-OD1 3.82Å; R107-D185 IonicContact CZ-OD2 3.45Å; R107-D185 IonicContact NH1-OD1 3.91Å; R107-D185 IonicContact NH1-OD2 2.71Å; R107-D185 PolarHBondContact NH1-OD2 3.45Å; R107-D185 VanDerWaalsContact NH2-CG 3.34Å; R107-D185 IonicContact NH2-OD1 3.34Å; R107-D185 PolarHBondContact NH2-OD1 2.89Å; R107-D185 IonicContact NH2-OD2 3.96Å; R107-D185 PolarHBondContact NH2-OD2 3.18Å; R107-I201 PolarHBondContact NH2-O 2.99Å; R107-L202 HydrophobicContact CG-CD1 4.06Å; R107-L202 PolarHBondContact NE-O 3.15Å; R107-L202 VanDerWaalsContact NE-O 3.11Å; R107-R210 VanDerWaalsContact CZ-CZ 3.42Å
108	F	88.9	Confident	82.9	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	155.4	170.7	70.2	-95.7	0	0	0	111	I9 L13 L15 I79 G80 A82 I110 V124 E125	I9-F108 HydrophobicContact CD1-CB 4.49Å; L13-F108 HydrophobicContact CD1-CD1 4.2Å; L13-F108 HydrophobicContact CD1-CE1 4.16Å; L15-F108 HydrophobicContact CD2-CE2 4.35Å; L15-F108 HydrophobicContact CD2-CZ 4.09Å; I79-F108 WeakPolarHBondContact CA-O 3.45Å; G80-F108 PolarHBondContact N-O 3.37Å; G80-F108 WeakPolarHBondContact O-CD1 3.33Å; G80-F108 PolarHBondContact O-N 3.33Å; A82-F108 HydrophobicContact CB-CD1 3.92Å; A82-F108 HydrophobicContact CB-CE1 4.35Å; F108-I110 HydrophobicContact CD2-CG1 4.38Å; F108-I110 HydrophobicContact CE2-CG1 3.83Å; F108-V124 HydrophobicContact CB-CB 4.2Å; F108-V124 HydrophobicContact CD2-CB 3.58Å; F108-V124 HydrophobicContact CD2-CG1 3.33Å; F108-V124 HydrophobicContact CE2-CB 4.24Å; F108-V124 HydrophobicContact CE2-CG1 3.46Å; F108-V124 VanDerWaalsContact CE2-CG1 3.46Å; F108-V124 HydrophobicContact CG-CB 4.06Å; F108-V124 HydrophobicContact CG-CG1 4.17Å; F108-V124 HydrophobicContact CZ-CG1 4.37Å; F108-E125 CarbonylContact C-O 3.56Å; F108-E125 WeakPolarHBondContact CA-O 3.4Å; F108-E125 WeakPolarHBondContact CB-O 3.31Å
109	Q	88.7	Confident	83	Confident	44 Å²	44	47 Å²	47	21%	0.206	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	139.6	170	-165.7	-178.8	-46	0	0	109.9	R78 V124 E125 L127	R78-Q109 HydrophobicContact CG-CG 3.97Å; R78-Q109 VanDerWaalsContact NE-NE2 3.14Å; Q109-V124 WeakPolarHBondContact O-CA 3.36Å; Q109-E125 PolarHBondContact N-O 3.16Å; Q109-E125 PolarHBondContact O-N 2.83Å; Q109-L127 HydrophobicContact CB-CD1 4.03Å; Q109-L127 HydrophobicContact CB-CD2 4.04Å; Q109-L127 HydrophobicContact CB-CG 4.09Å
110	I	86.7	Confident	83.1	Confident	24 Å²	24	44.6 Å²	44.6	12%	0.123	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	125	172.3	-59.2	171.8	0	0	0	108.8	I60 L76 H77 R78 F108 V113 A122	I60-I110 HydrophobicContact CD1-CD1 3.51Å; I60-I110 HydrophobicContact CG1-CD1 4.29Å; L76-I110 HydrophobicContact CB-CD1 4.33Å; L76-I110 HydrophobicContact CD1-CD1 4.43Å; H77-I110 WeakPolarHBondContact O-CD1 3.43Å; R78-I110 PolarHBondContact O-N 3Å; F108-I110 HydrophobicContact CD2-CG1 4.38Å; F108-I110 HydrophobicContact CE2-CG1 3.83Å; I110-V113 HydrophobicContact CG2-CG2 4.45Å; I110-A122 HydrophobicContact CG2-CB 4.05Å
111	V	86	Confident	83.3	Confident	89 Å²	89	45.8 Å²	45.8	54%	0.539	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	-52.3	173.8	-179.1	0	0	0	0	109.5	E123 E125	V111-E123 PolarHBondContact N-O 3.21Å; V111-E125 HydrophobicContact CG2-CB 4.03Å
112	Q	84.6	Confident	83.4	Confident	118 Å²	118	44.1 Å²	44.1	55%	0.551	23%	0.225	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-153.7	142.6	-178.9	-174.4	174.8	-3.1	0	0	111.4	A122 E123	Q112-A122 CarbonylContact O-C 3.53Å; Q112-A122 WeakPolarHBondContact O-CA 3.38Å; Q112-A122 WeakPolarHBondContact O-CB 3.38Å; Q112-E123 PolarHBondContact N-O 2.92Å; Q112-E123 PolarHBondContact O-N 2.77Å
113	V	83.5	Confident	83.4	Confident	48 Å²	48	47.3 Å²	47.3	29%	0.291	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	120.6	169.8	-176.3	0	0	0	0	108.7	L76 I110 E116 A122	L76-V113 HydrophobicContact CD1-CG2 3.74Å; I110-V113 HydrophobicContact CG2-CG2 4.45Å; V113-E116 HydrophobicContact CG1-CG 4.31Å; V113-A122 HydrophobicContact CG2-CB 4.43Å
114	L	83.3	Confident	83.5	Confident	77 Å²	77	46.2 Å²	46.2	40%	0.403	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	-36.8	-175.7	-65.1	175	0	0	0	112.5	R12 V121 E123	R12-L114 HydrophobicContact CG-CD1 4.07Å; L114-V121 PolarHBondContact N-O 2.92Å; L114-E123 HydrophobicContact CD1-CB 4.35Å; L114-E123 HydrophobicContact CG-CB 4.44Å
115	K	80.9	Confident	83.4	Confident	115 Å²	115	51 Å²	51	50%	0.5	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	138.5	-175.3	-159.8	-173	-161.5	-156.2	0	110	K117 P120 V121	K115-K117 VanDerWaalsContact CD-O 3.24Å; K115-K117 WeakPolarHBondContact CD-O 3.19Å; K115-K117 WeakPolarHBondContact CE-O 3.22Å; K115-K117 WeakPolarHBondContact CG-O 3.31Å; K115-K117 PolarHBondContact NZ-O 3.07Å; K115-K117 VanDerWaalsContact NZ-O 3.16Å; K115-P120 CarbonylContact O-C 3.5Å; K115-P120 VanDerWaalsContact O-CA 3.23Å; K115-P120 WeakPolarHBondContact O-CA 2.99Å; K115-V121 HydrophobicContact CB-CB 4.33Å; K115-V121 PolarHBondContact N-O 2.8Å; K115-V121 PolarHBondContact O-N 3.19Å
116	E	74.1	Confident	83.4	Confident	85 Å²	85	50.8 Å²	50.8	40%	0.397	25%	0.253	S	S	.	.			trans	-105.1	-36.9	177.7	-56.4	-168.3	162.1	0	0	113.3	L73 V113 Y119	L73-E116 HydrophobicContact CD1-CB 3.97Å; L73-E116 HydrophobicContact CD1-CG 3.59Å; V113-E116 HydrophobicContact CG1-CG 4.31Å; E116-Y119 CarbonylContact O-C 3.56Å
117	K	72.8	Confident	83.1	Confident	126 Å²	126	52.6 Å²	52.6	55%	0.548	26%	0.261	S	S	.	.	S	Bend	trans	-114.2	137.8	-179.2	-64	-177.1	179.7	-179	0	111.2	D69 K115	D69-K117 WeakPolarHBondContact O-CE 3.38Å; D69-K117 PolarHBondContact O-NZ 3.06Å; K115-K117 VanDerWaalsContact CD-O 3.24Å; K115-K117 WeakPolarHBondContact CD-O 3.19Å; K115-K117 WeakPolarHBondContact CE-O 3.22Å; K115-K117 WeakPolarHBondContact CG-O 3.31Å; K115-K117 PolarHBondContact NZ-O 3.07Å; K115-K117 VanDerWaalsContact NZ-O 3.16Å
118	P	68.8	Low	82.1	Confident	57 Å²	57	54 Å²	54	37%	0.37	27%	0.269	S	S	.	.	S	Bend	cis	-76.9	-19.2	5.1	27.7	-32.4	0	0	0	115.1	Q40	Q40-P118 PolarHBondContact OE1-O 3Å
119	Y	80.5	Confident	80.6	Confident	25 Å²	25	63.3 Å²	63.3	10%	0.098	30%	0.304	C	S	.	.	S	Bend	trans	-146.5	155	172.9	53.3	-92.9	0	0	0	109.3	P14 L41 S44 R45 E116 V121	P14-Y119 HydrophobicContact CB-CD2 4.14Å; P14-Y119 HydrophobicContact CB-CE2 3.84Å; L41-Y119 HydrophobicContact CB-CD1 4.22Å; L41-Y119 HydrophobicContact CB-CD2 4.39Å; L41-Y119 HydrophobicContact CB-CG 3.93Å; L41-Y119 HydrophobicContact CD1-CD2 4.12Å; L41-Y119 HydrophobicContact CD1-CG 4.37Å; L41-Y119 HydrophobicContact CG-CD2 4.22Å; L41-Y119 HydrophobicContact CG-CG 4.27Å; S44-Y119 WeakPolarHBondContact OG-CE1 3.13Å; R45-Y119 PolarHBondContact NE-OH 3.14Å; E116-Y119 CarbonylContact O-C 3.56Å; Y119-V121 HydrophobicContact CD2-CG2 3.99Å; Y119-V121 HydrophobicContact CE2-CG2 3.74Å
120	P	81.7	Confident	78.9	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	33%	0.326	C	S	.	.			trans	-67.5	133	-175.7	22.1	-30.2	0	0	0	112.5	L15 L17 L73 K115	L15-P120 HydrophobicContact CB-CB 4.12Å; L15-P120 HydrophobicContact CB-CG 3.99Å; L15-P120 HydrophobicContact CD1-CB 4.24Å; L15-P120 PolarHBondContact N-O 3.27Å; L17-P120 HydrophobicContact CD1-CG 4.39Å; L17-P120 HydrophobicContact CG-CG 4.38Å; L73-P120 HydrophobicContact CD1-CB 4.27Å; K115-P120 CarbonylContact O-C 3.5Å; K115-P120 VanDerWaalsContact O-CA 3.23Å; K115-P120 WeakPolarHBondContact O-CA 2.99Å
121	V	85.9	Confident	76.7	Confident	26 Å²	26	74 Å²	74	16%	0.158	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	126.2	173	-179.1	0	0	0	0	108.2	L13 L114 K115 Y119	L13-V121 WeakPolarHBondContact O-CA 3.45Å; L114-V121 PolarHBondContact N-O 2.92Å; K115-V121 HydrophobicContact CB-CB 4.33Å; K115-V121 PolarHBondContact N-O 2.8Å; K115-V121 PolarHBondContact O-N 3.19Å; Y119-V121 HydrophobicContact CD2-CG2 3.99Å; Y119-V121 HydrophobicContact CE2-CG2 3.74Å
122	A	86.3	Confident	74.5	Confident	0 Å²	0	78.7 Å²	78.7	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	152.3	-179.5	0	0	0	0	0	112.3	R12 L13 L15 I110 Q112 V113 V124	R12-A122 WeakPolarHBondContact CA-O 3.24Å; L13-A122 PolarHBondContact N-O 3.25Å; L13-A122 PolarHBondContact O-N 2.82Å; L15-A122 HydrophobicContact CD1-CB 3.52Å; L15-A122 HydrophobicContact CD2-CB 4.33Å; L15-A122 HydrophobicContact CG-CB 4.08Å; I110-A122 HydrophobicContact CG2-CB 4.05Å; Q112-A122 CarbonylContact O-C 3.53Å; Q112-A122 WeakPolarHBondContact O-CA 3.38Å; Q112-A122 WeakPolarHBondContact O-CB 3.38Å; V113-A122 HydrophobicContact CG2-CB 4.43Å; A122-V124 HydrophobicContact CB-CG1 4.42Å
123	E	88.1	Confident	72.2	Confident	67 Å²	67	81.6 Å²	81.6	31%	0.313	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	128.7	165	-173.7	159.3	-147.2	0	0	109.3	S11 V111 Q112 L114	S11-E123 VanDerWaalsContact O-CA 3.31Å; S11-E123 WeakPolarHBondContact O-CA 2.89Å; V111-E123 PolarHBondContact N-O 3.21Å; Q112-E123 PolarHBondContact N-O 2.92Å; Q112-E123 PolarHBondContact O-N 2.77Å; L114-E123 HydrophobicContact CD1-CB 4.35Å; L114-E123 HydrophobicContact CG-CB 4.44Å
124	V	88.3	Confident	70	Confident	13 Å²	13	84.4 Å²	84.4	8%	0.079	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	144.5	-168.5	-61.4	0	0	0	0	111.6	S11 L13 F108 Q109 A122	S11-V124 PolarHBondContact O-N 2.86Å; L13-V124 HydrophobicContact CB-CG1 4.36Å; L13-V124 HydrophobicContact CB-CG2 4.2Å; L13-V124 HydrophobicContact CD1-CG2 3.82Å; L13-V124 HydrophobicContact CG-CG2 3.77Å; F108-V124 HydrophobicContact CB-CB 4.2Å; F108-V124 HydrophobicContact CD2-CB 3.58Å; F108-V124 HydrophobicContact CD2-CG1 3.33Å; F108-V124 HydrophobicContact CE2-CB 4.24Å; F108-V124 HydrophobicContact CE2-CG1 3.46Å; F108-V124 VanDerWaalsContact CE2-CG1 3.46Å; F108-V124 HydrophobicContact CG-CB 4.06Å; F108-V124 HydrophobicContact CG-CG1 4.17Å; F108-V124 HydrophobicContact CZ-CG1 4.37Å; Q109-V124 WeakPolarHBondContact O-CA 3.36Å; A122-V124 HydrophobicContact CB-CG1 4.42Å
125	E	85.9	Confident	67.8	Low	102 Å²	102	87.8 Å²	87.8	48%	0.477	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	129.2	174.1	-172.9	174.3	-168.4	0	0	110.1	F108 Q109 V111	F108-E125 CarbonylContact C-O 3.56Å; F108-E125 WeakPolarHBondContact CA-O 3.4Å; F108-E125 WeakPolarHBondContact CB-O 3.31Å; Q109-E125 PolarHBondContact N-O 3.16Å; Q109-E125 PolarHBondContact O-N 2.83Å; V111-E125 HydrophobicContact CG2-CB 4.03Å
126	Q	84.4	Confident	65.8	Low	45 Å²	45	86.9 Å²	86.9	21%	0.21	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	124.1	179.7	179	171.8	-2.9	0	0	110.8	I7 I9	I7-Q126 PolarHBondContact O-NE2 2.85Å; I7-Q126 PolarHBondContact O-OE1 3.16Å; I9-Q126 HydrophobicContact CD1-CB 3.9Å; I9-Q126 HydrophobicContact CD1-CG 3.8Å; I9-Q126 HydrophobicContact CG1-CG 4.42Å
127	L	77.4	Confident	64.4	Low	43 Å²	43	88 Å²	88	23%	0.225	44%	0.442	C	S	.	.			trans	-90.6	-26.6	-177.6	-65.5	177.8	0	0	0	113.2	I79 R107 Q109 R129 V205	I79-L127 HydrophobicContact CD1-CD1 4.26Å; I79-L127 HydrophobicContact CG1-CD1 4.17Å; I79-L127 HydrophobicContact CG2-CD1 4.29Å; R107-L127 HydrophobicContact CB-CB 4.4Å; R107-L127 PolarHBondContact O-N 2.9Å; Q109-L127 HydrophobicContact CB-CD1 4.03Å; Q109-L127 HydrophobicContact CB-CD2 4.04Å; Q109-L127 HydrophobicContact CB-CG 4.09Å; L127-R129 VanDerWaalsContact C-N 3.33Å; L127-R129 PolarHBondContact O-N 3.49Å; L127-R129 VanDerWaalsContact O-N 3.07Å; L127-V205 HydrophobicContact CB-CG1 4.48Å; L127-V205 HydrophobicContact CD1-CG2 4.19Å
128	D	66.8	Low	63.3	Low	31 Å²	31	90.6 Å²	90.6	17%	0.166	45%	0.454	C	S	.	.			trans	-84.6	69.6	179.1	-64.4	-46.1	0	0	0	110.7	C106 R107 R210	C106-D128 HydrophobicContact CB-CB 4.4Å; R107-D128 WeakPolarHBondContact CB-OD2 3.33Å; R107-D128 PolarHBondContact N-OD2 2.77Å; D128-R210 IonicContact OD1-CZ 2.99Å; D128-R210 IonicContact OD1-NH2 3.86Å; D128-R210 PolarHBondContact OD1-NH2 3.36Å
129	R	57.3	Low	62.4	Low	194 Å²	194	91.2 Å²	91.2	73%	0.732	46%	0.456	S	S	*	.			trans	-91.1	97.5	162.5	-71.5	-173.1	-174.9	172.1	5.5	108.2	L127 E131	L127-R129 VanDerWaalsContact C-N 3.33Å; L127-R129 PolarHBondContact O-N 3.49Å; L127-R129 VanDerWaalsContact O-N 3.07Å; R129-E131 PolarHBondContact O-N 3.37Å
130	L	52.7	Low	61.4	Low	127 Å²	127	97.3 Å²	97.3	67%	0.665	48%	0.483	S	S	*	.			trans	-82.8	14.8	-178.6	-86.4	161.4	0	0	0	114.3	L207	L130-L207 HydrophobicContact CD2-CD1 4.38Å
131	E	42.5	Very low	60.5	Low	166 Å²	166	104.1 Å²	104.1	78%	0.776	52%	0.515	S	S	*	.	S	Bend	trans	-114.4	133.3	169.6	-68.7	-173.1	167.8	0	0	109.5	R129	R129-E131 PolarHBondContact O-N 3.37Å
132	E	38.6	Very low	59.7	Low	187 Å²	187	108.1 Å²	108.1	87%	0.874	53%	0.532	S	S	*	.			trans	91.6	60	-180	-53.1	-178.8	-179.6	0	0	117.5	P134	E132-P134 WeakPolarHBondContact O-CD 3.4Å
133	F	37.2	Very low	59.1	Low	180 Å²	180	110.8 Å²	110.8	79%	0.789	55%	0.546	S	S	*	.			trans	-91.5	109	140.6	-74.8	-76.7	0	0	0	108.4
134	P	35.6	Very low	58.4	Low	106 Å²	106	109 Å²	109	69%	0.688	55%	0.546	S	S	*	.			trans	-62.2	145.1	173.6	25.4	-31.2	0	0	0	109.9	E132 T136	E132-P134 WeakPolarHBondContact O-CD 3.4Å; P134-T136 PolarHBondContact O-N 3.05Å
135	N	37.9	Very low	57.9	Low	149 Å²	149	114.9 Å²	114.9	80%	0.797	57%	0.572	S	S	*	*			trans	-50.4	91.6	-177.7	-67	-48.2	0	0	0	113.9
136	T	39.9	Very low	57.7	Low	96 Å²	96	111.4 Å²	111.4	59%	0.589	56%	0.557	S	S	*	*			trans	-116.3	108	159.3	45.1	0	0	0	0	109.5	P134 K138	P134-T136 PolarHBondContact O-N 3.05Å; T136-K138 PolarHBondContact O-N 3.09Å; T136-K138 VanDerWaalsContact O-N 3.09Å
137	C	44.5	Very low	57.5	Low	109 Å²	109	110.2 Å²	110.2	74%	0.736	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.3	-14.4	-170.3	-69.2	0	0	0	0	116
138	K	48.4	Very low	57.6	Low	180 Å²	180	115 Å²	115	78%	0.783	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-33	-175.3	-68.1	-173	175.5	-175.4	0	114.1	T136 K140	T136-K138 PolarHBondContact O-N 3.09Å; T136-K138 VanDerWaalsContact O-N 3.09Å; K138-K140 VanDerWaalsContact C-N 3.31Å; K138-K140 PolarHBondContact O-N 2.8Å
139	T	51.3	Low	58.4	Low	69 Å²	69	116.9 Å²	116.9	42%	0.423	58%	0.582	S	S	.	*	H	α-helix	trans	-78	-15.2	-175.1	-14.3	0	0	0	0	113.4	L143	T139-L143 VanDerWaalsContact O-CB 3.31Å; T139-L143 WeakPolarHBondContact O-CB 3.4Å; T139-L143 PolarHBondContact O-N 3Å
140	K	58.3	Low	59.7	Low	153 Å²	153	107.7 Å²	107.7	67%	0.665	55%	0.548	S	S	*	.	H	α-helix	trans	-76.2	-30.1	178.4	-78	-174.6	176.4	177.9	0	113.3	K138 G144	K138-K140 VanDerWaalsContact C-N 3.31Å; K138-K140 PolarHBondContact O-N 2.8Å; K140-G144 PolarHBondContact O-N 2.87Å
141	E	63.3	Low	61	Low	143 Å²	143	106 Å²	106	67%	0.668	53%	0.533	S	S	*	.	H	α-helix	trans	-71	-50.9	-179.3	-70.3	178.5	170.3	0	0	110.5	L143 G144 E145	E141-L143 PolarHBondContact O-N 3.07Å; E141-G144 WeakPolarHBondContact O-CA 3.46Å; E141-G144 PolarHBondContact O-N 2.84Å; E141-G144 VanDerWaalsContact O-N 3.11Å; E141-E145 PolarHBondContact O-N 3.37Å
142	E	68.9	Low	63	Low	111 Å²	111	105.4 Å²	105.4	52%	0.519	52%	0.524	S	S	.	.	H	α-helix	trans	-63.4	-40.4	177.9	-64.8	-179.9	173.7	0	0	112.6	G144 E145 L146	E142-G144 VanDerWaalsContact C-N 3.31Å; E142-G144 PolarHBondContact O-N 3.37Å; E142-E145 PolarHBondContact O-N 3.4Å; E142-L146 WeakPolarHBondContact O-CG 3.45Å; E142-L146 PolarHBondContact O-N 2.89Å
143	L	72.9	Confident	65.1	Low	56 Å²	56	98.8 Å²	98.8	29%	0.293	49%	0.491	S	S	.	.	H	α-helix	trans	-63.8	-39.2	173.8	-169.6	94.5	0	0	0	111.4	T139 E141 S147 L207 E208	T139-L143 VanDerWaalsContact O-CB 3.31Å; T139-L143 WeakPolarHBondContact O-CB 3.4Å; T139-L143 PolarHBondContact O-N 3Å; E141-L143 PolarHBondContact O-N 3.07Å; L143-S147 VanDerWaalsContact O-CB 3.29Å; L143-S147 WeakPolarHBondContact O-CB 3.43Å; L143-S147 PolarHBondContact O-N 3.3Å; L143-S147 PolarHBondContact O-OG 2.94Å; L143-L207 HydrophobicContact CD1-CB 4.01Å; L143-E208 HydrophobicContact CD1-CB 4.25Å
144	G	73.8	Confident	67.1	Low	30 Å²	30	90.3 Å²	90.3	31%	0.309	45%	0.454	S	S	.	.	H	α-helix	trans	-59.6	-50.4	175.8	0	0	0	0	0	111.7	K140 E141 E142 S147 E148	K140-G144 PolarHBondContact O-N 2.87Å; E141-G144 WeakPolarHBondContact O-CA 3.46Å; E141-G144 PolarHBondContact O-N 2.84Å; E141-G144 VanDerWaalsContact O-N 3.11Å; E142-G144 VanDerWaalsContact C-N 3.31Å; E142-G144 PolarHBondContact O-N 3.37Å; G144-S147 PolarHBondContact O-N 3.2Å; G144-S147 PolarHBondContact O-OG 3.1Å; G144-E148 PolarHBondContact O-N 3Å
145	E	79	Confident	69.3	Low	136 Å²	136	87.5 Å²	87.5	64%	0.636	44%	0.435	S	S	*	.	H	α-helix	trans	-60.4	-47	178	-70.4	-178.5	179.7	0	0	112.4	E141 E142 S147 E148 Q149	E141-E145 PolarHBondContact O-N 3.37Å; E142-E145 PolarHBondContact O-N 3.4Å; E145-S147 VanDerWaalsContact C-N 3.32Å; E145-S147 PolarHBondContact O-N 2.76Å; E145-E148 PolarHBondContact O-N 3.47Å; E145-Q149 VanDerWaalsContact O-CB 3.32Å; E145-Q149 WeakPolarHBondContact O-CB 3.42Å; E145-Q149 PolarHBondContact O-N 3.13Å
146	L	81.2	Confident	71.3	Confident	29 Å²	29	83.7 Å²	83.7	15%	0.152	41%	0.413	C	S	.	.	H	α-helix	trans	-62.8	-39.6	177.4	-72.5	173.3	0	0	0	111.9	E142 F150 E208 F211 K212 I215	E142-L146 WeakPolarHBondContact O-CG 3.45Å; E142-L146 PolarHBondContact O-N 2.89Å; L146-F150 VanDerWaalsContact O-CB 3.22Å; L146-F150 WeakPolarHBondContact O-CB 3.3Å; L146-F150 PolarHBondContact O-N 3.46Å; L146-E208 HydrophobicContact CD1-CG 3.94Å; L146-F211 HydrophobicContact CB-CB 4.09Å; L146-K212 HydrophobicContact CD1-CG 3.94Å; L146-K212 HydrophobicContact CD2-CG 4.46Å; L146-I215 HydrophobicContact CD2-CD1 3.92Å
147	S	79.8	Confident	73.2	Confident	20 Å²	20	79.8 Å²	79.8	14%	0.14	39%	0.388	C	S	.	.	H	α-helix	trans	-65.4	-40.1	177.9	79.4	0	0	0	0	112.2	L143 G144 E145 Y151	L143-S147 VanDerWaalsContact O-CB 3.29Å; L143-S147 WeakPolarHBondContact O-CB 3.43Å; L143-S147 PolarHBondContact O-N 3.3Å; L143-S147 PolarHBondContact O-OG 2.94Å; G144-S147 PolarHBondContact O-N 3.2Å; G144-S147 PolarHBondContact O-OG 3.1Å; E145-S147 VanDerWaalsContact C-N 3.32Å; E145-S147 PolarHBondContact O-N 2.76Å; S147-Y151 WeakPolarHBondContact O-CB 3.49Å; S147-Y151 PolarHBondContact O-N 2.94Å
148	E	79.5	Confident	74.6	Confident	142 Å²	142	75 Å²	75	66%	0.664	36%	0.356	S	S	*	.	H	α-helix	trans	-70.9	-43.2	178.4	-172.3	176.6	177.9	0	0	111.2	G144 E145 F150 Y151 R152	G144-E148 PolarHBondContact O-N 3Å; E145-E148 PolarHBondContact O-N 3.47Å; E148-F150 VanDerWaalsContact C-N 3.33Å; E148-F150 PolarHBondContact O-N 3.24Å; E148-Y151 PolarHBondContact O-N 2.93Å; E148-R152 PolarHBondContact O-N 3.32Å
149	Q	83.3	Confident	75.7	Confident	71 Å²	71	73.5 Å²	73.5	33%	0.332	35%	0.352	S	S	.	.	H	α-helix	trans	-59.3	-45.8	175	-177.1	179.1	13.5	0	0	111.4	E145 R152 Y153 I215	E145-Q149 VanDerWaalsContact O-CB 3.32Å; E145-Q149 WeakPolarHBondContact O-CB 3.42Å; E145-Q149 PolarHBondContact O-N 3.13Å; Q149-R152 PolarHBondContact O-N 2.94Å; Q149-Y153 HydrophobicContact CG-CD2 4Å; Q149-Y153 HydrophobicContact CG-CE2 3.54Å; Q149-Y153 WeakPolarHBondContact O-CD2 3.48Å; Q149-Y153 PolarHBondContact O-N 3.25Å; Q149-I215 HydrophobicContact CG-CD1 4.44Å
150	F	84.2	Confident	76.6	Confident	2 Å²	2	73.4 Å²	73.4	1%	0.009	35%	0.347	C	S	.	.	H	α-helix	trans	-60.5	-46.9	176	176.2	-91.9	0	0	0	111.7	L146 E148 R152 Y153 A154 L183 P184 L187 F211 T214 I215 L218	L146-F150 VanDerWaalsContact O-CB 3.22Å; L146-F150 WeakPolarHBondContact O-CB 3.3Å; L146-F150 PolarHBondContact O-N 3.46Å; E148-F150 VanDerWaalsContact C-N 3.33Å; E148-F150 PolarHBondContact O-N 3.24Å; F150-R152 VanDerWaalsContact C-N 3.32Å; F150-R152 PolarHBondContact O-N 2.97Å; F150-Y153 PolarHBondContact O-N 3.24Å; F150-A154 WeakPolarHBondContact O-CB 3.33Å; F150-A154 PolarHBondContact O-N 2.98Å; F150-L183 HydrophobicContact CE1-CB 3.87Å; F150-P184 HydrophobicContact CZ-CB 4.41Å; F150-P184 HydrophobicContact CZ-CG 4.34Å; F150-L187 HydrophobicContact CE1-CD1 3.36Å; F150-L187 HydrophobicContact CE2-CD1 4.38Å; F150-L187 HydrophobicContact CZ-CB 4.13Å; F150-L187 HydrophobicContact CZ-CD1 3.25Å; F150-L187 HydrophobicContact CZ-CG 4.29Å; F150-F211 HydrophobicContact CB-CD1 3.76Å; F150-F211 HydrophobicContact CB-CE1 4.01Å; F150-F211 HydrophobicContact CD1-CD1 4.18Å; F150-F211 AromaticContact CD1-CE1 3.78Å; F150-F211 HydrophobicContact CD1-CE1 3.78Å; F150-F211 HydrophobicContact CD2-CD1 4.05Å; F150-F211 HydrophobicContact CD2-CE1 4.44Å; F150-F211 HydrophobicContact CE1-CE1 4.33Å; F150-F211 AromaticContact CG-CD1 3.74Å; F150-F211 HydrophobicContact CG-CD1 3.74Å; F150-F211 AromaticContact CG-CE1 3.83Å; F150-F211 HydrophobicContact CG-CE1 3.83Å; F150-T214 WeakPolarHBondContact CE2-OG1 3.47Å; F150-I215 HydrophobicContact CB-CD1 4.17Å; F150-I215 HydrophobicContact CB-CG1 3.89Å; F150-I215 HydrophobicContact CD2-CG1 3.9Å; F150-I215 HydrophobicContact CG-CG1 4.41Å; F150-L218 HydrophobicContact CD2-CD1 3.46Å; F150-L218 VanDerWaalsContact CD2-CD1 3.46Å; F150-L218 HydrophobicContact CE2-CD1 3.26Å; F150-L218 HydrophobicContact CE2-CG 4.4Å; F150-L218 HydrophobicContact CG-CD1 4.28Å; F150-L218 HydrophobicContact CZ-CD1 3.96Å
151	Y	81.7	Confident	77.1	Confident	91 Å²	91	68.5 Å²	68.5	36%	0.357	33%	0.328	S	S	.	.	H	α-helix	trans	-60	-42.5	179	-169.3	-95.6	0	0	0	111.7	S147 E148 Y153 A154 V155 L183	S147-Y151 WeakPolarHBondContact O-CB 3.49Å; S147-Y151 PolarHBondContact O-N 2.94Å; E148-Y151 PolarHBondContact O-N 2.93Å; Y151-Y153 PolarHBondContact O-N 3.06Å; Y151-A154 PolarHBondContact O-N 3.37Å; Y151-V155 HydrophobicContact CD1-CG2 4.05Å; Y151-V155 HydrophobicContact CE1-CG2 3.7Å; Y151-V155 WeakPolarHBondContact O-CG2 3.46Å; Y151-V155 PolarHBondContact O-N 2.97Å; Y151-L183 HydrophobicContact CD2-CD1 4.49Å
152	R	82.9	Confident	76.8	Confident	153 Å²	153	67.6 Å²	67.6	58%	0.577	33%	0.327	S	S	*	.	H	α-helix	trans	-58.2	-46	176.1	-171.7	178.9	68.9	-169.5	-0.3	112.1	E148 Q149 F150 Q156	E148-R152 PolarHBondContact O-N 3.32Å; Q149-R152 PolarHBondContact O-N 2.94Å; F150-R152 VanDerWaalsContact C-N 3.32Å; F150-R152 PolarHBondContact O-N 2.97Å; R152-Q156 WeakPolarHBondContact O-CB 3.49Å; R152-Q156 PolarHBondContact O-N 3.24Å; R152-Q156 VanDerWaalsContact O-N 3.1Å
153	Y	83.3	Confident	76	Confident	48 Å²	48	67.6 Å²	67.6	19%	0.188	33%	0.329	C	S	.	.	H	α-helix	trans	-69.6	-35.8	177.4	-69.6	-55.6	0	0	0	112.9	Q149 F150 Y151 Q156 L157 I215 V219 I222	Q149-Y153 HydrophobicContact CG-CD2 4Å; Q149-Y153 HydrophobicContact CG-CE2 3.54Å; Q149-Y153 WeakPolarHBondContact O-CD2 3.48Å; Q149-Y153 PolarHBondContact O-N 3.25Å; F150-Y153 PolarHBondContact O-N 3.24Å; Y151-Y153 PolarHBondContact O-N 3.06Å; Y153-Q156 PolarHBondContact O-N 3.42Å; Y153-L157 WeakPolarHBondContact O-CB 3.23Å; Y153-L157 PolarHBondContact O-N 3.36Å; Y153-I215 HydrophobicContact CD2-CG2 4Å; Y153-I215 HydrophobicContact CE2-CG2 3.93Å; Y153-V219 HydrophobicContact CD1-CG2 4.17Å; Y153-V219 HydrophobicContact CD2-CG2 4.16Å; Y153-V219 HydrophobicContact CE1-CG2 4Å; Y153-V219 HydrophobicContact CE2-CG2 3.97Å; Y153-V219 HydrophobicContact CG-CG2 4.26Å; Y153-I222 HydrophobicContact CD1-CD1 4.12Å
154	A	79.9	Confident	75	Confident	2 Å²	2	69.4 Å²	69.4	2%	0.017	35%	0.346	C	S	.	.	H	α-helix	trans	-62.6	-44.4	176.6	0	0	0	0	0	111.7	F150 Y151 L157 V158 L175 L187	F150-A154 WeakPolarHBondContact O-CB 3.33Å; F150-A154 PolarHBondContact O-N 2.98Å; Y151-A154 PolarHBondContact O-N 3.37Å; A154-L157 PolarHBondContact O-N 2.99Å; A154-V158 WeakPolarHBondContact O-CG2 3.37Å; A154-V158 PolarHBondContact O-N 2.9Å; A154-L175 HydrophobicContact CB-CD2 4.26Å; A154-L187 HydrophobicContact CB-CD1 3.8Å
155	V	80.6	Confident	74.3	Confident	48 Å²	48	71.3 Å²	71.3	29%	0.291	35%	0.352	S	S	.	.	H	α-helix	trans	-62.9	-46.3	175	174.5	0	0	0	0	110.8	Y151 L157 V158 E159	Y151-V155 HydrophobicContact CD1-CG2 4.05Å; Y151-V155 HydrophobicContact CE1-CG2 3.7Å; Y151-V155 WeakPolarHBondContact O-CG2 3.46Å; Y151-V155 PolarHBondContact O-N 2.97Å; V155-L157 VanDerWaalsContact C-N 3.28Å; V155-L157 PolarHBondContact O-N 3.06Å; V155-V158 PolarHBondContact O-N 3.45Å; V155-V158 VanDerWaalsContact O-N 3.09Å; V155-E159 HydrophobicContact CG1-CG 4.42Å; V155-E159 WeakPolarHBondContact O-CG 3.49Å; V155-E159 PolarHBondContact O-N 3.39Å
156	Q	81.3	Confident	73.1	Confident	68 Å²	68	70 Å²	70	32%	0.318	36%	0.355	S	S	.	.	H	α-helix	trans	-58.1	-39.3	177.5	-174.4	178.7	15.2	0	0	112.5	R152 Y153 E159 M160 I222	R152-Q156 WeakPolarHBondContact O-CB 3.49Å; R152-Q156 PolarHBondContact O-N 3.24Å; R152-Q156 VanDerWaalsContact O-N 3.1Å; Y153-Q156 PolarHBondContact O-N 3.42Å; Q156-E159 PolarHBondContact O-N 3.41Å; Q156-M160 WeakPolarHBondContact O-CG 3.2Å; Q156-M160 PolarHBondContact O-N 3.46Å; Q156-I222 HydrophobicContact CB-CD1 4.4Å; Q156-I222 HydrophobicContact CG-CD1 4.38Å
157	L	78.3	Confident	71.9	Confident	14 Å²	14	71.8 Å²	71.8	7%	0.073	37%	0.374	C	S	.	.	H	α-helix	trans	-65.1	-41.1	176.6	-176.2	149.3	0	0	0	111.6	Y153 A154 V155 L161 L218 Q221 I222	Y153-L157 WeakPolarHBondContact O-CB 3.23Å; Y153-L157 PolarHBondContact O-N 3.36Å; A154-L157 PolarHBondContact O-N 2.99Å; V155-L157 VanDerWaalsContact C-N 3.28Å; V155-L157 PolarHBondContact O-N 3.06Å; L157-L161 HydrophobicContact CD2-CD1 3.73Å; L157-L161 WeakPolarHBondContact O-CG 3.18Å; L157-L218 HydrophobicContact CD1-CD2 3.82Å; L157-Q221 HydrophobicContact CD1-CB 4.12Å; L157-I222 HydrophobicContact CB-CD1 4.36Å; L157-I222 HydrophobicContact CB-CG1 4.06Å; L157-I222 HydrophobicContact CD1-CG1 4.33Å; L157-I222 HydrophobicContact CG-CG1 4.49Å
158	V	74.4	Confident	71.1	Confident	10 Å²	10	71.5 Å²	71.5	6%	0.061	37%	0.372	C	S	.	.	H	α-helix	trans	-66.8	-38.5	178.3	174	0	0	0	0	111.6	A154 V155 M160 L161 V168 L171 R172 L175	A154-V158 WeakPolarHBondContact O-CG2 3.37Å; A154-V158 PolarHBondContact O-N 2.9Å; V155-V158 PolarHBondContact O-N 3.45Å; V155-V158 VanDerWaalsContact O-N 3.09Å; V158-M160 VanDerWaalsContact C-N 3.34Å; V158-M160 PolarHBondContact O-N 2.9Å; V158-L161 PolarHBondContact O-N 3.31Å; V158-V168 HydrophobicContact CG1-CG1 4.05Å; V158-L171 HydrophobicContact CG2-CD2 3.82Å; V158-L171 HydrophobicContact CG2-CG 4.06Å; V158-R172 HydrophobicContact CG1-CB 4.38Å; V158-L175 HydrophobicContact CG2-CD1 3.82Å
159	E	72.2	Confident	70.2	Confident	148 Å²	148	66.5 Å²	66.5	69%	0.692	36%	0.355	S	S	*	.	H	α-helix	trans	-66.3	-32.4	179	-73.4	179	169.9	0	0	113.8	V155 Q156 L161	V155-E159 HydrophobicContact CG1-CG 4.42Å; V155-E159 WeakPolarHBondContact O-CG 3.49Å; V155-E159 PolarHBondContact O-N 3.39Å; Q156-E159 PolarHBondContact O-N 3.41Å; E159-L161 PolarHBondContact O-N 3.09Å
160	M	70.3	Confident	69.1	Low	66 Å²	66	70.1 Å²	70.1	33%	0.325	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-5.2	177.3	-67.1	-168.1	-49.6	0	0	113.5	Q156 V158 I222	Q156-M160 WeakPolarHBondContact O-CG 3.2Å; Q156-M160 PolarHBondContact O-N 3.46Å; V158-M160 VanDerWaalsContact C-N 3.34Å; V158-M160 PolarHBondContact O-N 2.9Å; M160-I222 HydrophobicContact CE-CB 3.78Å; M160-I222 HydrophobicContact CE-CG1 3.77Å; M160-I222 HydrophobicContact CE-CG2 3.51Å; M160-I222 HydrophobicContact SD-CG2 4.3Å
161	L	67.8	Low	68.2	Low	51 Å²	51	70.6 Å²	70.6	27%	0.267	37%	0.372	S	S	.	.	S	Bend	trans	-98.3	137.5	178.4	-67.2	170.8	0	0	0	110.4	L157 V158 E159 M163 V168 L225	L157-L161 HydrophobicContact CD2-CD1 3.73Å; L157-L161 WeakPolarHBondContact O-CG 3.18Å; V158-L161 PolarHBondContact O-N 3.31Å; E159-L161 PolarHBondContact O-N 3.09Å; L161-M163 PolarHBondContact O-N 3.38Å; L161-V168 HydrophobicContact CB-CG1 4.15Å; L161-V168 HydrophobicContact CB-CG2 4.09Å; L161-V168 HydrophobicContact CD1-CG2 4.5Å; L161-L225 HydrophobicContact CD2-CD1 3.93Å; L161-L225 HydrophobicContact CD2-CD2 4.33Å; L161-L225 HydrophobicContact CG-CD1 4.48Å
162	D	58.6	Low	67.6	Low	123 Å²	123	72.9 Å²	72.9	66%	0.658	38%	0.38	S	S	*	.			trans	-67.2	127.7	-173.8	-150.9	-8.6	0	0	0	111.7	S164 V165	D162-S164 PolarHBondContact O-N 2.84Å; D162-S164 VanDerWaalsContact O-N 3.13Å; D162-V165 PolarHBondContact O-N 3.25Å
163	M	51.7	Low	66.9	Low	111 Å²	111	74.4 Å²	74.4	55%	0.547	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-7.4	-168.5	-71.8	-64.8	-63.9	0	0	114.2	L161 V165 V168	L161-M163 PolarHBondContact O-N 3.38Å; M163-V165 PolarHBondContact O-N 3.05Å; M163-V168 HydrophobicContact SD-CG1 4.41Å
164	S	51.1	Low	66.2	Low	94 Å²	94	74.8 Å²	74.8	66%	0.657	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-12.6	177.9	57.9	0	0	0	0	113.5	D162 P166	D162-S164 PolarHBondContact O-N 2.84Å; D162-S164 VanDerWaalsContact O-N 3.13Å; S164-P166 WeakPolarHBondContact O-CD 3.35Å
165	V	58.9	Low	65.6	Low	70 Å²	70	75.3 Å²	75.3	42%	0.424	39%	0.393	S	S	.	.			trans	-92.1	116.9	-177.6	-175.2	0	0	0	0	110.9	D162 M163 A167 V168	D162-V165 PolarHBondContact O-N 3.25Å; M163-V165 PolarHBondContact O-N 3.05Å; V165-A167 HydrophobicContact CG1-CB 4.07Å; V165-A167 PolarHBondContact O-N 3.45Å; V165-V168 HydrophobicContact CB-CG2 4Å; V165-V168 HydrophobicContact CG1-CG2 4.39Å; V165-V168 WeakPolarHBondContact O-CB 3.49Å; V165-V168 PolarHBondContact O-N 3.09Å
166	P	54.4	Low	64.9	Low	108 Å²	108	78.3 Å²	78.3	70%	0.701	41%	0.407	S	S	*	.	H	α-helix	trans	-56.4	-26.1	-177.8	-26.2	33.8	0	0	0	115	S164 K170	S164-P166 WeakPolarHBondContact O-CD 3.35Å; P166-K170 PolarHBondContact O-N 3.12Å
167	A	55.2	Low	64.2	Low	68 Å²	68	79.3 Å²	79.3	56%	0.562	42%	0.422	S	S	*	.	H	α-helix	trans	-66.5	-33.7	176.5	0	0	0	0	0	113	V165 K170 L171	V165-A167 HydrophobicContact CG1-CB 4.07Å; V165-A167 PolarHBondContact O-N 3.45Å; A167-K170 PolarHBondContact O-N 3.14Å; A167-L171 PolarHBondContact O-N 3.18Å
168	V	63	Low	63.7	Low	14 Å²	14	81.4 Å²	81.4	9%	0.085	43%	0.433	C	S	.	.	H	α-helix	trans	-72.8	-38.7	-179.8	-178.6	0	0	0	0	110.4	V158 L161 M163 V165 K170 L171 R172	V158-V168 HydrophobicContact CG1-CG1 4.05Å; L161-V168 HydrophobicContact CB-CG1 4.15Å; L161-V168 HydrophobicContact CB-CG2 4.09Å; L161-V168 HydrophobicContact CD1-CG2 4.5Å; M163-V168 HydrophobicContact SD-CG1 4.41Å; V165-V168 HydrophobicContact CB-CG2 4Å; V165-V168 HydrophobicContact CG1-CG2 4.39Å; V165-V168 WeakPolarHBondContact O-CB 3.49Å; V165-V168 PolarHBondContact O-N 3.09Å; V168-K170 VanDerWaalsContact C-N 3.33Å; V168-K170 PolarHBondContact O-N 3.3Å; V168-L171 WeakPolarHBondContact O-CB 3.3Å; V168-L171 PolarHBondContact O-N 2.8Å; V168-R172 PolarHBondContact O-N 3.09Å
169	A	61.2	Low	63.4	Low	37 Å²	37	84.1 Å²	84.1	31%	0.306	45%	0.45	S	S	.	.	H	α-helix	trans	-64.3	-37	173.3	0	0	0	0	0	112.5	R173	A169-R173 WeakPolarHBondContact O-CG 3.44Å; A169-R173 PolarHBondContact O-N 2.86Å
170	K	59.3	Low	63.3	Low	146 Å²	146	84.8 Å²	84.8	64%	0.635	45%	0.447	S	S	*	.	H	α-helix	trans	-67	-40.4	174	-167.9	177.4	-178.8	-178.7	0	111.6	P166 A167 V168 R173 L174	P166-K170 PolarHBondContact O-N 3.12Å; A167-K170 PolarHBondContact O-N 3.14Å; V168-K170 VanDerWaalsContact C-N 3.33Å; V168-K170 PolarHBondContact O-N 3.3Å; K170-R173 PolarHBondContact O-N 3.19Å; K170-L174 HydrophobicContact CG-CD1 4.36Å; K170-L174 VanDerWaalsContact O-CG 3.28Å; K170-L174 WeakPolarHBondContact O-CG 3.33Å; K170-L174 PolarHBondContact O-N 2.78Å
171	L	66.7	Low	63.4	Low	13 Å²	13	86 Å²	86	7%	0.068	45%	0.452	C	S	.	.	H	α-helix	trans	-61.3	-44.7	176.6	-179.3	55.6	0	0	0	112.5	V158 A167 V168 R173 L174 L175 L187 I190	V158-L171 HydrophobicContact CG2-CD2 3.82Å; V158-L171 HydrophobicContact CG2-CG 4.06Å; A167-L171 PolarHBondContact O-N 3.18Å; V168-L171 WeakPolarHBondContact O-CB 3.3Å; V168-L171 PolarHBondContact O-N 2.8Å; L171-R173 PolarHBondContact O-N 2.91Å; L171-L174 WeakPolarHBondContact O-CB 3.23Å; L171-L174 PolarHBondContact O-N 2.77Å; L171-L175 WeakPolarHBondContact O-CG 3.16Å; L171-L175 PolarHBondContact O-N 2.8Å; L171-L187 HydrophobicContact CD1-CD2 3.76Å; L171-I190 HydrophobicContact CD1-CD1 3.46Å; L171-I190 VanDerWaalsContact CD1-CD1 3.46Å; L171-I190 HydrophobicContact CD2-CG2 4.26Å
172	R	68.4	Low	63.5	Low	138 Å²	138	85.1 Å²	85.1	52%	0.521	45%	0.452	S	S	.	.	H	α-helix	trans	-60.8	-45.1	175.7	-172.2	173.3	178.1	171.2	1.6	112.3	V158 V168 L174 L175 D176	V158-R172 HydrophobicContact CG1-CB 4.38Å; V168-R172 PolarHBondContact O-N 3.09Å; R172-L174 VanDerWaalsContact C-N 3.27Å; R172-L174 PolarHBondContact O-N 2.82Å; R172-L175 WeakPolarHBondContact O-CB 3.37Å; R172-L175 PolarHBondContact O-N 2.87Å; R172-D176 PolarHBondContact O-N 3.35Å; R172-D176 VanDerWaalsContact O-N 3.1Å
173	R	67.9	Low	64.4	Low	185 Å²	185	79.5 Å²	79.5	70%	0.698	42%	0.422	S	S	*	.	H	α-helix	trans	-61.3	-34.4	175	-70.6	177.4	-174.9	172.6	2.3	112.9	A169 K170 L171 S177	A169-R173 WeakPolarHBondContact O-CG 3.44Å; A169-R173 PolarHBondContact O-N 2.86Å; K170-R173 PolarHBondContact O-N 3.19Å; L171-R173 PolarHBondContact O-N 2.91Å; R173-S177 WeakPolarHBondContact O-CB 3.44Å; R173-S177 PolarHBondContact O-N 2.91Å; R173-S177 PolarHBondContact O-OG 3.13Å
174	L	68.3	Low	65.8	Low	56 Å²	56	74.2 Å²	74.2	29%	0.293	40%	0.396	S	S	.	.	H	α-helix	trans	-70.6	-39.3	176.4	-71.7	170.7	0	0	0	111.7	K170 L171 R172 D176 S177 L178	K170-L174 HydrophobicContact CG-CD1 4.36Å; K170-L174 VanDerWaalsContact O-CG 3.28Å; K170-L174 WeakPolarHBondContact O-CG 3.33Å; K170-L174 PolarHBondContact O-N 2.78Å; L171-L174 WeakPolarHBondContact O-CB 3.23Å; L171-L174 PolarHBondContact O-N 2.77Å; R172-L174 VanDerWaalsContact C-N 3.27Å; R172-L174 PolarHBondContact O-N 2.82Å; L174-D176 VanDerWaalsContact C-N 3.31Å; L174-D176 PolarHBondContact O-N 2.81Å; L174-S177 PolarHBondContact O-N 2.6Å; L174-L178 HydrophobicContact CB-CD1 4.08Å; L174-L178 HydrophobicContact CD2-CD1 3.91Å; L174-L178 WeakPolarHBondContact O-CB 3.28Å; L174-L178 PolarHBondContact O-N 2.99Å
175	L	67.9	Low	67.2	Low	13 Å²	13	70 Å²	70	7%	0.068	37%	0.365	C	S	.	.	H	α-helix	trans	-60.9	-39.2	173.4	-71.3	169.8	0	0	0	112.4	A154 V158 L171 R172 L183 L187	A154-L175 HydrophobicContact CB-CD2 4.26Å; V158-L175 HydrophobicContact CG2-CD1 3.82Å; L171-L175 WeakPolarHBondContact O-CG 3.16Å; L171-L175 PolarHBondContact O-N 2.8Å; R172-L175 WeakPolarHBondContact O-CB 3.37Å; R172-L175 PolarHBondContact O-N 2.87Å; L175-L183 HydrophobicContact CD2-CD2 4.32Å; L175-L187 HydrophobicContact CD2-CD1 3.93Å; L175-L187 HydrophobicContact CD2-CD2 4.23Å; L175-L187 HydrophobicContact CD2-CG 4.41Å
176	D	67	Low	68.2	Low	111 Å²	111	67.4 Å²	67.4	59%	0.594	35%	0.349	S	S	*	.	H	α-helix	trans	-78.5	-18.3	-177.3	-64.8	-28.9	0	0	0	113.6	R172 L174	R172-D176 PolarHBondContact O-N 3.35Å; R172-D176 VanDerWaalsContact O-N 3.1Å; L174-D176 VanDerWaalsContact C-N 3.31Å; L174-D176 PolarHBondContact O-N 2.81Å
177	S	65.2	Low	69.4	Low	89 Å²	89	62.6 Å²	62.6	62%	0.622	32%	0.318	S	S	*	.	H	α-helix	trans	-114.1	-13.4	-169	59.7	0	0	0	0	116.1	R173 L174	R173-S177 WeakPolarHBondContact O-CB 3.44Å; R173-S177 PolarHBondContact O-N 2.91Å; R173-S177 PolarHBondContact O-OG 3.13Å; L174-S177 PolarHBondContact O-N 2.6Å
178	L	67.4	Low	70.6	Confident	59 Å²	59	59.6 Å²	59.6	31%	0.309	29%	0.292	S	S	.	.	S	Bend	trans	-102.1	152.6	-173.9	-76.7	164.4	0	0	0	113.2	L174 L183 I186	L174-L178 HydrophobicContact CB-CD1 4.08Å; L174-L178 HydrophobicContact CD2-CD1 3.91Å; L174-L178 WeakPolarHBondContact O-CB 3.28Å; L174-L178 PolarHBondContact O-N 2.99Å; L178-L183 HydrophobicContact CB-CD2 4.02Å; L178-I186 HydrophobicContact CD1-CD1 3.57Å
179	P	69.9	Low	71.2	Confident	66 Å²	66	60.6 Å²	60.6	43%	0.429	30%	0.3	S	S	.	.			trans	-62.9	142.1	173.7	27.2	-33.9	0	0	0	111	E181 A182	P179-E181 VanDerWaalsContact CB-OE2 3.26Å; P179-E181 WeakPolarHBondContact CB-OE2 3.46Å; P179-E181 PolarHBondContact O-N 3.03Å; P179-E181 VanDerWaalsContact O-N 3.11Å; P179-A182 HydrophobicContact CG-CB 4.28Å; P179-A182 PolarHBondContact O-N 3.11Å; P179-A182 VanDerWaalsContact O-N 3.15Å
180	R	68.7	Low	71.9	Confident	162 Å²	162	62.8 Å²	62.8	61%	0.611	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-61.4	-26.1	-171.9	-65.9	-177.6	-177.6	-167.2	0.8	112.3
181	E	72.1	Confident	72.7	Confident	92 Å²	92	56.6 Å²	56.6	43%	0.43	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-71.5	-27.3	-177.3	-56.7	75.3	-162.3	0	0	112.8	P179 L207	P179-E181 VanDerWaalsContact CB-OE2 3.26Å; P179-E181 WeakPolarHBondContact CB-OE2 3.46Å; P179-E181 PolarHBondContact O-N 3.03Å; P179-E181 VanDerWaalsContact O-N 3.11Å; E181-L207 HydrophobicContact CB-CD1 4.27Å; E181-L207 HydrophobicContact CB-CD2 4.18Å; E181-L207 HydrophobicContact CG-CD1 4.04Å
182	A	70.9	Confident	72.8	Confident	32 Å²	32	66.1 Å²	66.1	26%	0.264	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-93.2	-11.1	-179.2	0	0	0	0	0	113.4	P179 D185 I186	P179-A182 HydrophobicContact CG-CB 4.28Å; P179-A182 PolarHBondContact O-N 3.11Å; P179-A182 VanDerWaalsContact O-N 3.15Å; A182-D185 PolarHBondContact O-N 2.66Å; A182-I186 HydrophobicContact CB-CD1 4.3Å; A182-I186 WeakPolarHBondContact O-CG1 3.44Å; A182-I186 PolarHBondContact O-N 3.44Å
183	L	77	Confident	73.2	Confident	6 Å²	6	60.4 Å²	60.4	3%	0.031	30%	0.295	C	S	.	.	H	α-helix	trans	-64.3	-39.4	-175.4	-63.6	179.2	0	0	0	114.4	F150 Y151 L175 L178 D185 I186 L187	F150-L183 HydrophobicContact CE1-CB 3.87Å; Y151-L183 HydrophobicContact CD2-CD1 4.49Å; L175-L183 HydrophobicContact CD2-CD2 4.32Å; L178-L183 HydrophobicContact CB-CD2 4.02Å; L183-D185 VanDerWaalsContact C-N 3.32Å; L183-D185 PolarHBondContact O-N 2.87Å; L183-I186 PolarHBondContact O-N 3.49Å; L183-L187 HydrophobicContact CB-CD1 4.47Å; L183-L187 VanDerWaalsContact O-CB 3.32Å; L183-L187 WeakPolarHBondContact O-CB 3.39Å; L183-L187 WeakPolarHBondContact O-CG 3.46Å; L183-L187 PolarHBondContact O-N 2.85Å
184	P	81.5	Confident	73.9	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-57.4	-44.3	178.2	-28.1	37.9	0	0	0	112.9	F150 T188 R210 F211 T214	F150-P184 HydrophobicContact CZ-CB 4.41Å; F150-P184 HydrophobicContact CZ-CG 4.34Å; P184-T188 VanDerWaalsContact O-CB 3.27Å; P184-T188 WeakPolarHBondContact O-CB 3.39Å; P184-T188 PolarHBondContact O-N 2.95Å; P184-T188 VanDerWaalsContact O-N 3.08Å; P184-T188 PolarHBondContact O-OG1 3.3Å; P184-R210 HydrophobicContact CB-CB 4.24Å; P184-F211 HydrophobicContact CG-CD1 3.63Å; P184-F211 HydrophobicContact CG-CD2 4.4Å; P184-F211 HydrophobicContact CG-CE1 3.32Å; P184-F211 HydrophobicContact CG-CE2 4.12Å; P184-F211 HydrophobicContact CG-CG 4.17Å; P184-F211 HydrophobicContact CG-CZ 3.58Å; P184-T214 HydrophobicContact CB-CG2 3.98Å
185	D	81.3	Confident	74.4	Confident	4 Å²	4	54.7 Å²	54.7	2%	0.021	28%	0.282	C	S	.	.	H	α-helix	trans	-70	-43.3	-176.9	-68	-30.1	0	0	0	111.2	L24 R107 A182 L183 S189 R210	L24-D185 HydrophobicContact CB-CB 4.32Å; L24-D185 WeakPolarHBondContact CD1-O 3.31Å; R107-D185 IonicContact CZ-OD1 3.82Å; R107-D185 IonicContact CZ-OD2 3.45Å; R107-D185 IonicContact NH1-OD1 3.91Å; R107-D185 IonicContact NH1-OD2 2.71Å; R107-D185 PolarHBondContact NH1-OD2 3.45Å; R107-D185 VanDerWaalsContact NH2-CG 3.34Å; R107-D185 IonicContact NH2-OD1 3.34Å; R107-D185 PolarHBondContact NH2-OD1 2.89Å; R107-D185 IonicContact NH2-OD2 3.96Å; R107-D185 PolarHBondContact NH2-OD2 3.18Å; A182-D185 PolarHBondContact O-N 2.66Å; L183-D185 VanDerWaalsContact C-N 3.32Å; L183-D185 PolarHBondContact O-N 2.87Å; D185-S189 PolarHBondContact O-N 3.37Å; D185-R210 IonicContact OD2-NH1 2.91Å; D185-R210 PolarHBondContact OD2-NH1 3.44Å
186	I	79.7	Confident	75.1	Confident	17 Å²	17	61.9 Å²	61.9	9%	0.087	31%	0.313	C	S	.	.	H	α-helix	trans	-69.3	-45.9	179.8	-64.9	170.1	0	0	0	111.1	L178 A182 L183 T188 S189 I190	L178-I186 HydrophobicContact CD1-CD1 3.57Å; A182-I186 HydrophobicContact CB-CD1 4.3Å; A182-I186 WeakPolarHBondContact O-CG1 3.44Å; A182-I186 PolarHBondContact O-N 3.44Å; L183-I186 PolarHBondContact O-N 3.49Å; I186-T188 VanDerWaalsContact C-N 3.34Å; I186-T188 PolarHBondContact O-N 3.07Å; I186-S189 WeakPolarHBondContact O-CB 3.5Å; I186-S189 PolarHBondContact O-N 3.01Å; I186-S189 VanDerWaalsContact O-N 3.15Å; I186-S189 PolarHBondContact O-OG 2.84Å; I186-I190 HydrophobicContact CG2-CD1 4.11Å; I186-I190 WeakPolarHBondContact O-CG1 3.49Å; I186-I190 PolarHBondContact O-N 3.02Å
187	L	78.3	Confident	75.9	Confident	7 Å²	7	58.1 Å²	58.1	4%	0.037	29%	0.292	C	S	.	.	H	α-helix	trans	-65.5	-39.1	179.9	-77.2	167.7	0	0	0	111.9	F150 A154 L171 L175 L183 S189 I190 I191	F150-L187 HydrophobicContact CE1-CD1 3.36Å; F150-L187 HydrophobicContact CE2-CD1 4.38Å; F150-L187 HydrophobicContact CZ-CB 4.13Å; F150-L187 HydrophobicContact CZ-CD1 3.25Å; F150-L187 HydrophobicContact CZ-CG 4.29Å; A154-L187 HydrophobicContact CB-CD1 3.8Å; L171-L187 HydrophobicContact CD1-CD2 3.76Å; L175-L187 HydrophobicContact CD2-CD1 3.93Å; L175-L187 HydrophobicContact CD2-CD2 4.23Å; L175-L187 HydrophobicContact CD2-CG 4.41Å; L183-L187 HydrophobicContact CB-CD1 4.47Å; L183-L187 VanDerWaalsContact O-CB 3.32Å; L183-L187 WeakPolarHBondContact O-CB 3.39Å; L183-L187 WeakPolarHBondContact O-CG 3.46Å; L183-L187 PolarHBondContact O-N 2.85Å; L187-S189 PolarHBondContact O-N 2.99Å; L187-I190 PolarHBondContact O-N 2.85Å; L187-I191 HydrophobicContact CB-CD1 4.27Å; L187-I191 VanDerWaalsContact O-CD1 3.31Å; L187-I191 WeakPolarHBondContact O-CD1 3.46Å; L187-I191 WeakPolarHBondContact O-CG1 3.28Å; L187-I191 PolarHBondContact O-N 3.45Å
188	T	80.8	Confident	76.7	Confident	4 Å²	4	55.4 Å²	55.4	3%	0.025	27%	0.269	C	S	.	.	H	α-helix	trans	-58.6	-35.3	174.2	-60.2	0	0	0	0	112.1	L24 P184 I186 I190 K198 I201 T214	L24-T188 HydrophobicContact CD1-CG2 3.61Å; P184-T188 VanDerWaalsContact O-CB 3.27Å; P184-T188 WeakPolarHBondContact O-CB 3.39Å; P184-T188 PolarHBondContact O-N 2.95Å; P184-T188 VanDerWaalsContact O-N 3.08Å; P184-T188 PolarHBondContact O-OG1 3.3Å; I186-T188 VanDerWaalsContact C-N 3.34Å; I186-T188 PolarHBondContact O-N 3.07Å; T188-I190 VanDerWaalsContact C-N 3.29Å; T188-I190 PolarHBondContact O-N 3.25Å; T188-K198 HydrophobicContact CG2-CG 4.21Å; T188-I201 HydrophobicContact CG2-CD1 3.36Å; T188-T214 WeakPolarHBondContact OG1-CG2 3.26Å
189	S	76.7	Confident	77.5	Confident	36 Å²	36	54 Å²	54	25%	0.252	26%	0.262	S	S	.	.	H	α-helix	trans	-67.5	-30.2	177.2	79.6	0	0	0	0	113.1	S27 D185 I186 L187	S27-S189 VanDerWaalsContact CB-CB 3.4Å; S27-S189 VanDerWaalsContact CB-OG 3.3Å; S27-S189 WeakPolarHBondContact CB-OG 3.47Å; D185-S189 PolarHBondContact O-N 3.37Å; I186-S189 WeakPolarHBondContact O-CB 3.5Å; I186-S189 PolarHBondContact O-N 3.01Å; I186-S189 VanDerWaalsContact O-N 3.15Å; I186-S189 PolarHBondContact O-OG 2.84Å; L187-S189 PolarHBondContact O-N 2.99Å
190	I	75.8	Confident	78.2	Confident	82 Å²	82	56.2 Å²	56.2	42%	0.421	27%	0.266	S	S	.	.	H	α-helix	trans	-86.5	-33.6	-175.8	-63.7	173	0	0	0	111.4	L171 I186 L187 T188	L171-I190 HydrophobicContact CD1-CD1 3.46Å; L171-I190 VanDerWaalsContact CD1-CD1 3.46Å; L171-I190 HydrophobicContact CD2-CG2 4.26Å; I186-I190 HydrophobicContact CG2-CD1 4.11Å; I186-I190 WeakPolarHBondContact O-CG1 3.49Å; I186-I190 PolarHBondContact O-N 3.02Å; L187-I190 PolarHBondContact O-N 2.85Å; T188-I190 VanDerWaalsContact C-N 3.29Å; T188-I190 PolarHBondContact O-N 3.25Å
191	I	75.9	Confident	79	Confident	16 Å²	16	48.6 Å²	48.6	8%	0.082	24%	0.238	C	C	.	.	S	Bend	trans	-75.5	146.5	-179.5	-64	160.9	0	0	0	110.7	L187 T193 L218 Q221	L187-I191 HydrophobicContact CB-CD1 4.27Å; L187-I191 VanDerWaalsContact O-CD1 3.31Å; L187-I191 WeakPolarHBondContact O-CD1 3.46Å; L187-I191 WeakPolarHBondContact O-CG1 3.28Å; L187-I191 PolarHBondContact O-N 3.45Å; I191-T193 HydrophobicContact CB-CG2 4.46Å; I191-T193 HydrophobicContact CG2-CG2 3.96Å; I191-T193 PolarHBondContact O-N 3.48Å; I191-L218 HydrophobicContact CD1-CD2 3.32Å; I191-L218 HydrophobicContact CD1-CG 3.88Å; I191-L218 HydrophobicContact CG1-CD2 4.42Å; I191-Q221 HydrophobicContact CG2-CB 4.23Å; I191-Q221 HydrophobicContact CG2-CG 3.37Å
192	R	68.9	Low	79.6	Confident	213 Å²	213	44.2 Å²	44.2	80%	0.804	22%	0.217	S	C	*	.			trans	-73.8	82	176	-69.6	-174.3	177.3	-176.8	-1	111.9	Q221	R192-Q221 PolarHBondContact O-NE2 2.87Å
193	T	76.5	Confident	80.2	Confident	18 Å²	18	45.6 Å²	45.6	11%	0.11	22%	0.22	C	C	.	.			trans	-108.7	157.3	176.1	50.4	0	0	0	0	111.7	I191 K198 L217	I191-T193 HydrophobicContact CB-CG2 4.46Å; I191-T193 HydrophobicContact CG2-CG2 3.96Å; I191-T193 PolarHBondContact O-N 3.48Å; T193-K198 WeakPolarHBondContact OG1-CE 3.48Å; T193-K198 VanDerWaalsContact OG1-CG 3.29Å; T193-K198 WeakPolarHBondContact OG1-CG 3.35Å; T193-L217 HydrophobicContact CG2-CB 4.25Å; T193-L217 HydrophobicContact CG2-CD1 3.99Å; T193-L217 HydrophobicContact CG2-CD2 4.39Å; T193-L217 HydrophobicContact CG2-CG 4.45Å
194	S	82.4	Confident	80.5	Confident	53 Å²	53	45.9 Å²	45.9	37%	0.371	22%	0.223	S	C	.	.			trans	-73.2	152.3	175.7	68.7	0	0	0	0	111	K196 E197 K198	S194-K196 PolarHBondContact O-N 2.95Å; S194-E197 PolarHBondContact N-OE2 3.37Å; S194-E197 PolarHBondContact O-N 3.09Å; S194-E197 VanDerWaalsContact O-N 3.09Å; S194-E197 VanDerWaalsContact OG-CG 3.26Å; S194-E197 WeakPolarHBondContact OG-CG 3.49Å; S194-E197 PolarHBondContact OG-N 2.86Å; S194-E197 PolarHBondContact OG-OE2 3.45Å; S194-E197 VanDerWaalsContact OG-OE2 3.11Å; S194-K198 PolarHBondContact O-N 2.72Å; S194-K198 VanDerWaalsContact O-N 3.08Å
195	N	79.5	Confident	80.3	Confident	68 Å²	68	49.1 Å²	49.1	36%	0.364	24%	0.243	S	C	.	.	H	α-helix	trans	-59.2	-30.2	178.4	-70.8	-17.6	0	0	0	112.5	V22 K198 L199	V22-N195 HydrophobicContact CG2-CB 4.44Å; N195-K198 PolarHBondContact O-N 3.05Å; N195-L199 WeakPolarHBondContact O-CB 3.35Å; N195-L199 PolarHBondContact O-N 3.04Å
196	K	81.9	Confident	80.3	Confident	164 Å²	164	51 Å²	51	71%	0.713	26%	0.256	S	S	*	.	H	α-helix	trans	-64.5	-43.4	175.2	-66.3	-174.6	178.9	-177.3	0	112.1	S194 L199 Q200	S194-K196 PolarHBondContact O-N 2.95Å; K196-L199 PolarHBondContact O-N 3.04Å; K196-Q200 WeakPolarHBondContact O-CG 3.43Å; K196-Q200 PolarHBondContact O-N 3.44Å; K196-Q200 VanDerWaalsContact O-N 3.08Å
197	E	82.8	Confident	80.2	Confident	33 Å²	33	51.6 Å²	51.6	15%	0.154	26%	0.26	C	S	.	.	H	α-helix	trans	-68.7	-38.8	177.6	-68.7	161.7	165.6	0	0	111.6	S194 L199 Q200 I201 L217 R220	S194-E197 PolarHBondContact N-OE2 3.37Å; S194-E197 PolarHBondContact O-N 3.09Å; S194-E197 VanDerWaalsContact O-N 3.09Å; S194-E197 VanDerWaalsContact OG-CG 3.26Å; S194-E197 WeakPolarHBondContact OG-CG 3.49Å; S194-E197 PolarHBondContact OG-N 2.86Å; S194-E197 PolarHBondContact OG-OE2 3.45Å; S194-E197 VanDerWaalsContact OG-OE2 3.11Å; E197-L199 VanDerWaalsContact C-N 3.29Å; E197-L199 PolarHBondContact O-N 3.14Å; E197-Q200 PolarHBondContact O-N 2.82Å; E197-I201 WeakPolarHBondContact O-CG1 3.43Å; E197-I201 PolarHBondContact O-N 2.96Å; E197-I201 VanDerWaalsContact O-N 3.16Å; E197-L217 HydrophobicContact CB-CD1 4.38Å; E197-L217 HydrophobicContact CB-CD2 4.47Å; E197-L217 HydrophobicContact CG-CD2 4.22Å; E197-R220 IonicContact OE1-CZ 3.3Å; E197-R220 VanDerWaalsContact OE1-CZ 3.22Å; E197-R220 IonicContact OE1-NH1 3.02Å; E197-R220 PolarHBondContact OE1-NH1 3.31Å; E197-R220 IonicContact OE1-NH2 2.89Å; E197-R220 PolarHBondContact OE1-NH2 3.08Å; E197-R220 IonicContact OE2-CZ 2.74Å; E197-R220 IonicContact OE2-NH1 3.5Å; E197-R220 IonicContact OE2-NH2 2.72Å; E197-R220 PolarHBondContact OE2-NH2 2.95Å
198	K	83.3	Confident	80.3	Confident	32 Å²	32	53.2 Å²	53.2	14%	0.139	27%	0.267	C	S	.	.	H	α-helix	trans	-63.6	-36.9	174.6	-66.2	-173.5	176.1	-174.7	0	112.2	V22 T188 T193 S194 N195 I201 L202	V22-K198 HydrophobicContact CB-CB 3.74Å; V22-K198 HydrophobicContact CB-CD 4.4Å; V22-K198 HydrophobicContact CG1-CB 4.16Å; V22-K198 HydrophobicContact CG2-CB 3.88Å; T188-K198 HydrophobicContact CG2-CG 4.21Å; T193-K198 WeakPolarHBondContact OG1-CE 3.48Å; T193-K198 VanDerWaalsContact OG1-CG 3.29Å; T193-K198 WeakPolarHBondContact OG1-CG 3.35Å; S194-K198 PolarHBondContact O-N 2.72Å; S194-K198 VanDerWaalsContact O-N 3.08Å; N195-K198 PolarHBondContact O-N 3.05Å; K198-I201 PolarHBondContact O-N 2.96Å; K198-L202 PolarHBondContact O-N 3.38Å
199	L	84.8	Confident	80.3	Confident	29 Å²	29	56.5 Å²	56.5	15%	0.152	28%	0.284	C	S	.	.	H	α-helix	trans	-67.2	-41	176.6	-174.5	146.2	0	0	0	111.4	V22 N62 H77 N195 K196 E197 I201 L202 D203	V22-L199 HydrophobicContact CG2-CB 4.5Å; N62-L199 HydrophobicContact CB-CD1 4.13Å; H77-L199 WeakPolarHBondContact NE2-CD2 3.15Å; N195-L199 WeakPolarHBondContact O-CB 3.35Å; N195-L199 PolarHBondContact O-N 3.04Å; K196-L199 PolarHBondContact O-N 3.04Å; E197-L199 VanDerWaalsContact C-N 3.29Å; E197-L199 PolarHBondContact O-N 3.14Å; L199-I201 VanDerWaalsContact C-N 3.25Å; L199-I201 PolarHBondContact O-N 2.94Å; L199-L202 WeakPolarHBondContact O-CB 3.47Å; L199-L202 PolarHBondContact O-N 3.36Å; L199-L202 VanDerWaalsContact O-N 3.07Å; L199-D203 WeakPolarHBondContact CD2-OD2 3.31Å; L199-D203 PolarHBondContact O-N 2.98Å
200	Q	84.4	Confident	80.7	Confident	112 Å²	112	55.6 Å²	55.6	52%	0.523	28%	0.276	S	S	.	.	H	α-helix	trans	-59.3	-35.4	172.5	-71	172.7	-22	0	0	112.9	K196 E197 D203 A204	K196-Q200 WeakPolarHBondContact O-CG 3.43Å; K196-Q200 PolarHBondContact O-N 3.44Å; K196-Q200 VanDerWaalsContact O-N 3.08Å; E197-Q200 PolarHBondContact O-N 2.82Å; Q200-D203 PolarHBondContact O-N 2.96Å; Q200-A204 PolarHBondContact O-N 3.22Å
201	I	84.8	Confident	81	Confident	2 Å²	2	52 Å²	52	1%	0.01	26%	0.257	C	S	.	.	H	α-helix	trans	-75.2	-30.8	176.5	-67.7	164.4	0	0	0	111.6	L24 R107 T188 E197 K198 L199 D203 A204 M213 T214 L217	L24-I201 HydrophobicContact CD1-CG2 4.46Å; L24-I201 HydrophobicContact CD2-CG2 4.35Å; R107-I201 PolarHBondContact NH2-O 2.99Å; T188-I201 HydrophobicContact CG2-CD1 3.36Å; E197-I201 WeakPolarHBondContact O-CG1 3.43Å; E197-I201 PolarHBondContact O-N 2.96Å; E197-I201 VanDerWaalsContact O-N 3.16Å; K198-I201 PolarHBondContact O-N 2.96Å; L199-I201 VanDerWaalsContact C-N 3.25Å; L199-I201 PolarHBondContact O-N 2.94Å; I201-D203 VanDerWaalsContact C-N 3.34Å; I201-A204 PolarHBondContact O-N 3.43Å; I201-M213 HydrophobicContact CG1-CB 4.17Å; I201-T214 HydrophobicContact CD1-CG2 3.78Å; I201-T214 HydrophobicContact CG1-CG2 4.29Å; I201-T214 HydrophobicContact CG2-CG2 4.45Å; I201-L217 HydrophobicContact CD1-CD1 3.57Å
202	L	84.5	Confident	81.5	Confident	0 Å²	0	56 Å²	56	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-65.9	-40.1	171.5	-176.1	64.3	0	0	0	111	V22 L24 P61 I79 T81 R107 K198 L199 A204	V22-L202 HydrophobicContact CG1-CB 4.35Å; V22-L202 HydrophobicContact CG1-CD2 4.08Å; L24-L202 HydrophobicContact CD2-CB 4.1Å; L24-L202 HydrophobicContact CD2-CD1 4.33Å; P61-L202 HydrophobicContact CG-CD2 3.77Å; I79-L202 HydrophobicContact CG2-CD1 4.44Å; I79-L202 HydrophobicContact CG2-CG 4.07Å; T81-L202 VanDerWaalsContact OG1-CD1 3.23Å; T81-L202 WeakPolarHBondContact OG1-CD1 3.36Å; R107-L202 HydrophobicContact CG-CD1 4.06Å; R107-L202 PolarHBondContact NE-O 3.15Å; R107-L202 VanDerWaalsContact NE-O 3.11Å; K198-L202 PolarHBondContact O-N 3.38Å; L199-L202 WeakPolarHBondContact O-CB 3.47Å; L199-L202 PolarHBondContact O-N 3.36Å; L199-L202 VanDerWaalsContact O-N 3.07Å; L202-A204 VanDerWaalsContact C-N 3.29Å; L202-A204 PolarHBondContact O-N 3.07Å
203	D	84	Confident	82.1	Confident	62 Å²	62	50.5 Å²	50.5	33%	0.332	26%	0.258	S	S	.	.	H	α-helix	trans	-67.9	-25	177	-71.1	-28.3	0	0	0	113.8	H77 L199 Q200 I201 V205	H77-D203 IonicContact CE1-OD1 3.91Å; H77-D203 PolarHBondContact CE1-OD1 3.18Å; H77-D203 IonicContact NE2-OD1 3.25Å; H77-D203 PolarHBondContact NE2-OD1 3.39Å; H77-D203 IonicContact NE2-OD2 3.98Å; L199-D203 WeakPolarHBondContact CD2-OD2 3.31Å; L199-D203 PolarHBondContact O-N 2.98Å; Q200-D203 PolarHBondContact O-N 2.96Å; I201-D203 VanDerWaalsContact C-N 3.34Å; D203-V205 PolarHBondContact O-N 3.35Å
204	A	83.5	Confident	82.5	Confident	11 Å²	11	49.8 Å²	49.8	9%	0.091	25%	0.254	C	S	.	.			trans	-71.2	94.6	177.9	0	0	0	0	0	111.5	Q200 I201 L202 D209 R210	Q200-A204 PolarHBondContact O-N 3.22Å; I201-A204 PolarHBondContact O-N 3.43Å; L202-A204 VanDerWaalsContact C-N 3.29Å; L202-A204 PolarHBondContact O-N 3.07Å; A204-D209 HydrophobicContact CB-CB 4.09Å; A204-R210 HydrophobicContact CB-CG 3.97Å; A204-R210 WeakPolarHBondContact O-CG 3.46Å; A204-R210 PolarHBondContact O-NE 3.49Å
205	V	76.6	Confident	82.6	Confident	68 Å²	68	47.9 Å²	47.9	41%	0.412	24%	0.239	S	C	.	.			trans	-71.6	-40.1	179.6	-175.9	0	0	0	0	111.4	I79 L127 D203 R210	I79-V205 HydrophobicContact CD1-CG2 4.44Å; L127-V205 HydrophobicContact CB-CG1 4.48Å; L127-V205 HydrophobicContact CD1-CG2 4.19Å; D203-V205 PolarHBondContact O-N 3.35Å; V205-R210 PolarHBondContact O-NH2 3.05Å
206	S	81.1	Confident	82.9	Confident	43 Å²	43	48.2 Å²	48.2	30%	0.301	25%	0.245	S	C	.	.	S	Bend	trans	-78.4	145	-177.6	90.5	0	0	0	0	112.5	E208 D209 R210	S206-E208 VanDerWaalsContact C-N 3.3Å; S206-E208 PolarHBondContact O-N 2.64Å; S206-D209 PolarHBondContact O-N 2.9Å; S206-D209 VanDerWaalsContact OG-CB 3.3Å; S206-D209 WeakPolarHBondContact OG-CB 3.3Å; S206-D209 PolarHBondContact OG-N 3.31Å; S206-D209 VanDerWaalsContact OG-N 3.13Å; S206-D209 PolarHBondContact OG-OD2 2.82Å; S206-R210 VanDerWaalsContact O-CG 3.32Å; S206-R210 WeakPolarHBondContact O-CG 3.49Å; S206-R210 PolarHBondContact O-N 3.3Å
207	L	77.7	Confident	83	Confident	31 Å²	31	41.3 Å²	41.3	16%	0.162	22%	0.216	C	C	.	.	H	α-helix	trans	-64.1	-36.1	178.2	-71.4	175.5	0	0	0	112.3	L130 L143 E181 R210 F211	L130-L207 HydrophobicContact CD2-CD1 4.38Å; L143-L207 HydrophobicContact CD1-CB 4.01Å; E181-L207 HydrophobicContact CB-CD1 4.27Å; E181-L207 HydrophobicContact CB-CD2 4.18Å; E181-L207 HydrophobicContact CG-CD1 4.04Å; L207-R210 WeakPolarHBondContact O-CB 3.35Å; L207-R210 PolarHBondContact O-N 3.31Å; L207-F211 WeakPolarHBondContact O-CD2 3.38Å; L207-F211 PolarHBondContact O-N 3Å; L207-F211 VanDerWaalsContact O-N 3.1Å
208	E	80.3	Confident	83	Confident	41 Å²	41	39.8 Å²	39.8	19%	0.192	21%	0.209	C	C	.	.	H	α-helix	trans	-63.4	-45.7	179.3	-167.7	-173.1	155.7	0	0	111.4	L143 L146 S206 R210 F211 K212	L143-E208 HydrophobicContact CD1-CB 4.25Å; L146-E208 HydrophobicContact CD1-CG 3.94Å; S206-E208 VanDerWaalsContact C-N 3.3Å; S206-E208 PolarHBondContact O-N 2.64Å; E208-R210 VanDerWaalsContact C-N 3.3Å; E208-R210 PolarHBondContact O-N 2.84Å; E208-F211 PolarHBondContact O-N 3.42Å; E208-K212 HydrophobicContact CG-CD 4.46Å; E208-K212 WeakPolarHBondContact O-CG 2.63Å; E208-K212 PolarHBondContact O-N 3.25Å; E208-K212 WeakPolarHBondContact OE1-CE 3.49Å; E208-K212 IonicContact OE1-NZ 3.69Å; E208-K212 PolarHBondContact OE1-NZ 3.47Å
209	D	81.7	Confident	83.1	Confident	73 Å²	73	40.1 Å²	40.1	39%	0.39	21%	0.214	S	C	.	.	H	α-helix	trans	-64.6	-36.7	177.4	-64.3	-38.4	0	0	0	111.4	A204 S206 F211 K212 M213	A204-D209 HydrophobicContact CB-CB 4.09Å; S206-D209 PolarHBondContact O-N 2.9Å; S206-D209 VanDerWaalsContact OG-CB 3.3Å; S206-D209 WeakPolarHBondContact OG-CB 3.3Å; S206-D209 PolarHBondContact OG-N 3.31Å; S206-D209 VanDerWaalsContact OG-N 3.13Å; S206-D209 PolarHBondContact OG-OD2 2.82Å; D209-F211 PolarHBondContact O-N 3.4Å; D209-K212 PolarHBondContact O-N 2.99Å; D209-M213 WeakPolarHBondContact O-CB 3.38Å; D209-M213 WeakPolarHBondContact O-CG 3.3Å; D209-M213 PolarHBondContact O-N 3.36Å
210	R	84.1	Confident	83	Confident	17 Å²	17	43.8 Å²	43.8	6%	0.064	23%	0.225	C	C	.	.	H	α-helix	trans	-60.5	-45.9	174.6	-67.6	174.8	-156.6	-177.8	6.5	111.4	R107 D128 P184 D185 A204 V205 S206 L207 E208 T214	R107-R210 VanDerWaalsContact CZ-CZ 3.42Å; D128-R210 IonicContact OD1-CZ 2.99Å; D128-R210 IonicContact OD1-NH2 3.86Å; D128-R210 PolarHBondContact OD1-NH2 3.36Å; P184-R210 HydrophobicContact CB-CB 4.24Å; D185-R210 IonicContact OD2-NH1 2.91Å; D185-R210 PolarHBondContact OD2-NH1 3.44Å; A204-R210 HydrophobicContact CB-CG 3.97Å; A204-R210 WeakPolarHBondContact O-CG 3.46Å; A204-R210 PolarHBondContact O-NE 3.49Å; V205-R210 PolarHBondContact O-NH2 3.05Å; S206-R210 VanDerWaalsContact O-CG 3.32Å; S206-R210 WeakPolarHBondContact O-CG 3.49Å; S206-R210 PolarHBondContact O-N 3.3Å; L207-R210 WeakPolarHBondContact O-CB 3.35Å; L207-R210 PolarHBondContact O-N 3.31Å; E208-R210 VanDerWaalsContact C-N 3.3Å; E208-R210 PolarHBondContact O-N 2.84Å; R210-T214 WeakPolarHBondContact O-CB 3.42Å; R210-T214 WeakPolarHBondContact O-CG2 3.31Å; R210-T214 PolarHBondContact O-N 2.88Å; R210-T214 VanDerWaalsContact O-N 3.08Å; R210-T214 PolarHBondContact O-OG1 3.41Å
211	F	82.6	Confident	82.9	Confident	7 Å²	7	40.3 Å²	40.3	3%	0.031	21%	0.209	C	C	.	.	H	α-helix	trans	-66.2	-45	177.1	-77.5	-68.8	0	0	0	112.1	L146 F150 P184 L207 E208 D209 M213 T214 I215	L146-F211 HydrophobicContact CB-CB 4.09Å; F150-F211 HydrophobicContact CB-CD1 3.76Å; F150-F211 HydrophobicContact CB-CE1 4.01Å; F150-F211 HydrophobicContact CD1-CD1 4.18Å; F150-F211 AromaticContact CD1-CE1 3.78Å; F150-F211 HydrophobicContact CD1-CE1 3.78Å; F150-F211 HydrophobicContact CD2-CD1 4.05Å; F150-F211 HydrophobicContact CD2-CE1 4.44Å; F150-F211 HydrophobicContact CE1-CE1 4.33Å; F150-F211 AromaticContact CG-CD1 3.74Å; F150-F211 HydrophobicContact CG-CD1 3.74Å; F150-F211 AromaticContact CG-CE1 3.83Å; F150-F211 HydrophobicContact CG-CE1 3.83Å; P184-F211 HydrophobicContact CG-CD1 3.63Å; P184-F211 HydrophobicContact CG-CD2 4.4Å; P184-F211 HydrophobicContact CG-CE1 3.32Å; P184-F211 HydrophobicContact CG-CE2 4.12Å; P184-F211 HydrophobicContact CG-CG 4.17Å; P184-F211 HydrophobicContact CG-CZ 3.58Å; L207-F211 WeakPolarHBondContact O-CD2 3.38Å; L207-F211 PolarHBondContact O-N 3Å; L207-F211 VanDerWaalsContact O-N 3.1Å; E208-F211 PolarHBondContact O-N 3.42Å; D209-F211 PolarHBondContact O-N 3.4Å; F211-M213 VanDerWaalsContact C-N 3.27Å; F211-M213 PolarHBondContact O-N 3.48Å; F211-T214 PolarHBondContact O-N 3.3Å; F211-T214 PolarHBondContact O-OG1 2.99Å; F211-I215 WeakPolarHBondContact O-CD1 3.44Å; F211-I215 VanDerWaalsContact O-CG1 3.26Å; F211-I215 WeakPolarHBondContact O-CG1 3.35Å; F211-I215 PolarHBondContact O-N 3.07Å; F211-I215 VanDerWaalsContact O-N 3.08Å
212	K	85.4	Confident	82.6	Confident	100 Å²	100	40.6 Å²	40.6	44%	0.435	21%	0.21	S	C	.	.	H	α-helix	trans	-59.1	-37.2	178.3	-74.1	179.2	-177.3	170.8	0	112.8	L146 E208 D209 P216	L146-K212 HydrophobicContact CD1-CG 3.94Å; L146-K212 HydrophobicContact CD2-CG 4.46Å; E208-K212 HydrophobicContact CG-CD 4.46Å; E208-K212 WeakPolarHBondContact O-CG 2.63Å; E208-K212 PolarHBondContact O-N 3.25Å; E208-K212 WeakPolarHBondContact OE1-CE 3.49Å; E208-K212 IonicContact OE1-NZ 3.69Å; E208-K212 PolarHBondContact OE1-NZ 3.47Å; D209-K212 PolarHBondContact O-N 2.99Å; K212-P216 WeakPolarHBondContact O-CD 3.39Å; K212-P216 WeakPolarHBondContact O-CG 3.46Å
213	M	82.8	Confident	82.5	Confident	97 Å²	97	45.8 Å²	45.8	48%	0.478	24%	0.235	S	C	.	.	H	α-helix	trans	-78.9	-31.5	179.2	-66.9	-64	165.8	0	0	113.2	I201 D209 F211 L217	I201-M213 HydrophobicContact CG1-CB 4.17Å; D209-M213 WeakPolarHBondContact O-CB 3.38Å; D209-M213 WeakPolarHBondContact O-CG 3.3Å; D209-M213 PolarHBondContact O-N 3.36Å; F211-M213 VanDerWaalsContact C-N 3.27Å; F211-M213 PolarHBondContact O-N 3.48Å; M213-L217 WeakPolarHBondContact O-CG 3.37Å
214	T	84.1	Confident	82.2	Confident	2 Å²	2	44 Å²	44	1%	0.012	23%	0.231	C	C	.	.	H	α-helix	trans	-85.2	-31.7	-175.1	52.2	0	0	0	0	114.1	F150 P184 T188 I201 R210 F211 L217 L218	F150-T214 WeakPolarHBondContact CE2-OG1 3.47Å; P184-T214 HydrophobicContact CB-CG2 3.98Å; T188-T214 WeakPolarHBondContact OG1-CG2 3.26Å; I201-T214 HydrophobicContact CD1-CG2 3.78Å; I201-T214 HydrophobicContact CG1-CG2 4.29Å; I201-T214 HydrophobicContact CG2-CG2 4.45Å; R210-T214 WeakPolarHBondContact O-CB 3.42Å; R210-T214 WeakPolarHBondContact O-CG2 3.31Å; R210-T214 PolarHBondContact O-N 2.88Å; R210-T214 VanDerWaalsContact O-N 3.08Å; R210-T214 PolarHBondContact O-OG1 3.41Å; F211-T214 PolarHBondContact O-N 3.3Å; F211-T214 PolarHBondContact O-OG1 2.99Å; T214-L217 PolarHBondContact O-N 3.09Å; T214-L218 PolarHBondContact O-N 3.43Å
215	I	85.6	Confident	81.5	Confident	14 Å²	14	45.9 Å²	45.9	7%	0.072	24%	0.239	C	C	.	.	H	α-helix	trans	-57.6	-49.2	178.9	-69.5	166	0	0	0	112.3	L146 Q149 F150 Y153 F211 L217 L218 V219	L146-I215 HydrophobicContact CD2-CD1 3.92Å; Q149-I215 HydrophobicContact CG-CD1 4.44Å; F150-I215 HydrophobicContact CB-CD1 4.17Å; F150-I215 HydrophobicContact CB-CG1 3.89Å; F150-I215 HydrophobicContact CD2-CG1 3.9Å; F150-I215 HydrophobicContact CG-CG1 4.41Å; Y153-I215 HydrophobicContact CD2-CG2 4Å; Y153-I215 HydrophobicContact CE2-CG2 3.93Å; F211-I215 WeakPolarHBondContact O-CD1 3.44Å; F211-I215 VanDerWaalsContact O-CG1 3.26Å; F211-I215 WeakPolarHBondContact O-CG1 3.35Å; F211-I215 PolarHBondContact O-N 3.07Å; F211-I215 VanDerWaalsContact O-N 3.08Å; I215-L217 VanDerWaalsContact C-N 3.27Å; I215-L217 PolarHBondContact O-N 2.84Å; I215-L218 WeakPolarHBondContact O-CB 3.48Å; I215-L218 PolarHBondContact O-N 3.4Å; I215-V219 WeakPolarHBondContact O-CG2 3.38Å; I215-V219 PolarHBondContact O-N 2.95Å
216	P	86	Confident	81.4	Confident	75 Å²	75	47.5 Å²	47.5	49%	0.487	24%	0.241	S	C	.	.	H	α-helix	trans	-61.1	-34.5	177.9	-24.1	34.4	0	0	0	113.2	K212 V219 R220	K212-P216 WeakPolarHBondContact O-CD 3.39Å; K212-P216 WeakPolarHBondContact O-CG 3.46Å; P216-V219 PolarHBondContact O-N 3.06Å; P216-R220 WeakPolarHBondContact O-CB 3.23Å; P216-R220 PolarHBondContact O-N 3.13Å
217	L	83.2	Confident	81.1	Confident	19 Å²	19	50.6 Å²	50.6	10%	0.099	25%	0.253	C	S	.	.	H	α-helix	trans	-68	-39.6	178.5	-61	176	0	0	0	111.5	T193 E197 I201 M213 T214 I215 Q221	T193-L217 HydrophobicContact CG2-CB 4.25Å; T193-L217 HydrophobicContact CG2-CD1 3.99Å; T193-L217 HydrophobicContact CG2-CD2 4.39Å; T193-L217 HydrophobicContact CG2-CG 4.45Å; E197-L217 HydrophobicContact CB-CD1 4.38Å; E197-L217 HydrophobicContact CB-CD2 4.47Å; E197-L217 HydrophobicContact CG-CD2 4.22Å; I201-L217 HydrophobicContact CD1-CD1 3.57Å; M213-L217 WeakPolarHBondContact O-CG 3.37Å; T214-L217 PolarHBondContact O-N 3.09Å; I215-L217 VanDerWaalsContact C-N 3.27Å; I215-L217 PolarHBondContact O-N 2.84Å; L217-Q221 WeakPolarHBondContact O-CG 3.18Å; L217-Q221 PolarHBondContact O-N 3.45Å
218	L	82.1	Confident	80.3	Confident	1 Å²	1	54 Å²	54	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-61.4	-48.7	172.7	-83.8	169	0	0	0	111.5	F150 L157 I191 T214 I215 R220 Q221 I222	F150-L218 HydrophobicContact CD2-CD1 3.46Å; F150-L218 VanDerWaalsContact CD2-CD1 3.46Å; F150-L218 HydrophobicContact CE2-CD1 3.26Å; F150-L218 HydrophobicContact CE2-CG 4.4Å; F150-L218 HydrophobicContact CG-CD1 4.28Å; F150-L218 HydrophobicContact CZ-CD1 3.96Å; L157-L218 HydrophobicContact CD1-CD2 3.82Å; I191-L218 HydrophobicContact CD1-CD2 3.32Å; I191-L218 HydrophobicContact CD1-CG 3.88Å; I191-L218 HydrophobicContact CG1-CD2 4.42Å; T214-L218 PolarHBondContact O-N 3.43Å; I215-L218 WeakPolarHBondContact O-CB 3.48Å; I215-L218 PolarHBondContact O-N 3.4Å; L218-R220 PolarHBondContact O-N 3.2Å; L218-Q221 PolarHBondContact O-N 3.32Å; L218-Q221 VanDerWaalsContact O-N 3.11Å; L218-I222 WeakPolarHBondContact O-CG1 3.35Å; L218-I222 PolarHBondContact O-N 3.33Å
219	V	85.3	Confident	79.3	Confident	39 Å²	39	60.1 Å²	60.1	24%	0.236	30%	0.3	C	S	.	.	H	α-helix	trans	-59.6	-46.2	179.5	174.5	0	0	0	0	111	Y153 I215 P216 Q221 I222 E223	Y153-V219 HydrophobicContact CD1-CG2 4.17Å; Y153-V219 HydrophobicContact CD2-CG2 4.16Å; Y153-V219 HydrophobicContact CE1-CG2 4Å; Y153-V219 HydrophobicContact CE2-CG2 3.97Å; Y153-V219 HydrophobicContact CG-CG2 4.26Å; I215-V219 WeakPolarHBondContact O-CG2 3.38Å; I215-V219 PolarHBondContact O-N 2.95Å; P216-V219 PolarHBondContact O-N 3.06Å; V219-Q221 PolarHBondContact O-N 2.99Å; V219-I222 WeakPolarHBondContact O-CB 3.48Å; V219-I222 PolarHBondContact O-N 3.03Å; V219-E223 WeakPolarHBondContact O-CG 3.39Å; V219-E223 PolarHBondContact O-N 3.4Å
220	R	84.4	Confident	78	Confident	106 Å²	106	64.9 Å²	64.9	40%	0.4	32%	0.317	S	S	.	.	H	α-helix	trans	-57.2	-33.7	176.9	-173.9	178.1	69.3	-179.6	-2.5	112.8	E197 P216 L218 G224	E197-R220 IonicContact OE1-CZ 3.3Å; E197-R220 VanDerWaalsContact OE1-CZ 3.22Å; E197-R220 IonicContact OE1-NH1 3.02Å; E197-R220 PolarHBondContact OE1-NH1 3.31Å; E197-R220 IonicContact OE1-NH2 2.89Å; E197-R220 PolarHBondContact OE1-NH2 3.08Å; E197-R220 IonicContact OE2-CZ 2.74Å; E197-R220 IonicContact OE2-NH1 3.5Å; E197-R220 IonicContact OE2-NH2 2.72Å; E197-R220 PolarHBondContact OE2-NH2 2.95Å; P216-R220 WeakPolarHBondContact O-CB 3.23Å; P216-R220 PolarHBondContact O-N 3.13Å; L218-R220 PolarHBondContact O-N 3.2Å; R220-G224 PolarHBondContact O-N 3.41Å
221	Q	80.3	Confident	76.3	Confident	39 Å²	39	69.1 Å²	69.1	18%	0.182	35%	0.345	C	S	.	.	H	α-helix	trans	-80.6	-36.7	-177.3	-65.9	-82.1	-24.6	0	0	111.9	L157 I191 R192 L217 L218 V219 E223 G224 L225	L157-Q221 HydrophobicContact CD1-CB 4.12Å; I191-Q221 HydrophobicContact CG2-CB 4.23Å; I191-Q221 HydrophobicContact CG2-CG 3.37Å; R192-Q221 PolarHBondContact O-NE2 2.87Å; L217-Q221 WeakPolarHBondContact O-CG 3.18Å; L217-Q221 PolarHBondContact O-N 3.45Å; L218-Q221 PolarHBondContact O-N 3.32Å; L218-Q221 VanDerWaalsContact O-N 3.11Å; V219-Q221 PolarHBondContact O-N 2.99Å; Q221-E223 PolarHBondContact O-N 3.36Å; Q221-G224 PolarHBondContact O-N 3.39Å; Q221-L225 WeakPolarHBondContact O-CB 3.21Å; Q221-L225 WeakPolarHBondContact O-CG 3.41Å; Q221-L225 PolarHBondContact O-N 3.15Å
222	I	80.3	Confident	74.1	Confident	7 Å²	7	80.5 Å²	80.5	4%	0.036	39%	0.387	C	S	.	.	H	α-helix	trans	-56.8	-43.9	169.1	-70.4	171.3	0	0	0	109.5	Y153 Q156 L157 M160 L218 V219 K226	Y153-I222 HydrophobicContact CD1-CD1 4.12Å; Q156-I222 HydrophobicContact CB-CD1 4.4Å; Q156-I222 HydrophobicContact CG-CD1 4.38Å; L157-I222 HydrophobicContact CB-CD1 4.36Å; L157-I222 HydrophobicContact CB-CG1 4.06Å; L157-I222 HydrophobicContact CD1-CG1 4.33Å; L157-I222 HydrophobicContact CG-CG1 4.49Å; M160-I222 HydrophobicContact CE-CB 3.78Å; M160-I222 HydrophobicContact CE-CG1 3.77Å; M160-I222 HydrophobicContact CE-CG2 3.51Å; M160-I222 HydrophobicContact SD-CG2 4.3Å; L218-I222 WeakPolarHBondContact O-CG1 3.35Å; L218-I222 PolarHBondContact O-N 3.33Å; V219-I222 WeakPolarHBondContact O-CB 3.48Å; V219-I222 PolarHBondContact O-N 3.03Å; I222-K226 VanDerWaalsContact O-CG 3.29Å; I222-K226 WeakPolarHBondContact O-CG 3.24Å; I222-K226 PolarHBondContact O-N 3.2Å
223	E	81.9	Confident	71.6	Confident	109 Å²	109	85.3 Å²	85.3	51%	0.509	41%	0.409	S	S	.	.	H	α-helix	trans	-69.2	-42.9	175.6	-69	176.2	177.7	0	0	112.8	V219 Q221 L225 K226 L227	V219-E223 WeakPolarHBondContact O-CG 3.39Å; V219-E223 PolarHBondContact O-N 3.4Å; Q221-E223 PolarHBondContact O-N 3.36Å; E223-L225 PolarHBondContact O-N 2.95Å; E223-K226 WeakPolarHBondContact O-CB 3.44Å; E223-K226 PolarHBondContact O-N 3.17Å; E223-L227 WeakPolarHBondContact O-CG 3.47Å; E223-L227 PolarHBondContact O-N 2.98Å
224	G	76.6	Confident	69.6	Low	24 Å²	24	86.8 Å²	86.8	25%	0.247	43%	0.425	C	S	.	.	H	α-helix	trans	-61.5	-40.8	177.6	0	0	0	0	0	113.4	R220 Q221 K226 L227 L228	R220-G224 PolarHBondContact O-N 3.41Å; Q221-G224 PolarHBondContact O-N 3.39Å; G224-K226 VanDerWaalsContact C-N 3.33Å; G224-K226 PolarHBondContact O-N 3.11Å; G224-L227 PolarHBondContact O-N 3.41Å; G224-L227 VanDerWaalsContact O-N 3.14Å; G224-L228 WeakPolarHBondContact O-CB 3.42Å; G224-L228 WeakPolarHBondContact O-CG 3.2Å; G224-L228 PolarHBondContact O-N 3.05Å
225	L	70.6	Confident	66.9	Low	52 Å²	52	96.1 Å²	96.1	27%	0.272	47%	0.466	S	S	.	.	H	α-helix	trans	-63.4	-39.1	174.3	-74.8	171.1	0	0	0	111.8	L161 Q221 E223 L227 L228 Q229	L161-L225 HydrophobicContact CD2-CD1 3.93Å; L161-L225 HydrophobicContact CD2-CD2 4.33Å; L161-L225 HydrophobicContact CG-CD1 4.48Å; Q221-L225 WeakPolarHBondContact O-CB 3.21Å; Q221-L225 WeakPolarHBondContact O-CG 3.41Å; Q221-L225 PolarHBondContact O-N 3.15Å; E223-L225 PolarHBondContact O-N 2.95Å; L225-L227 VanDerWaalsContact C-N 3.25Å; L225-L227 PolarHBondContact O-N 3.37Å; L225-L228 PolarHBondContact O-N 2.9Å; L225-Q229 PolarHBondContact O-N 2.95Å
226	K	73.9	Confident	64.3	Low	101 Å²	101	104.3 Å²	104.3	44%	0.439	50%	0.504	S	S	.	.	H	α-helix	trans	-63.3	-31.2	173.4	-69	169.5	-177.4	177.1	0	112.4	I222 E223 G224	I222-K226 VanDerWaalsContact O-CG 3.29Å; I222-K226 WeakPolarHBondContact O-CG 3.24Å; I222-K226 PolarHBondContact O-N 3.2Å; E223-K226 WeakPolarHBondContact O-CB 3.44Å; E223-K226 PolarHBondContact O-N 3.17Å; G224-K226 VanDerWaalsContact C-N 3.33Å; G224-K226 PolarHBondContact O-N 3.11Å
227	L	74.8	Confident	61.8	Low	108 Å²	108	108.1 Å²	108.1	57%	0.565	52%	0.52	S	S	*	.	H	α-helix	trans	-79.8	-39.3	175.4	-67.6	171.9	0	0	0	112.4	E223 G224 L225 Q229 K230 T231	E223-L227 WeakPolarHBondContact O-CG 3.47Å; E223-L227 PolarHBondContact O-N 2.98Å; G224-L227 PolarHBondContact O-N 3.41Å; G224-L227 VanDerWaalsContact O-N 3.14Å; L225-L227 VanDerWaalsContact C-N 3.25Å; L225-L227 PolarHBondContact O-N 3.37Å; L227-Q229 VanDerWaalsContact C-N 3.31Å; L227-Q229 PolarHBondContact O-N 3.44Å; L227-K230 WeakPolarHBondContact O-CA 3.32Å; L227-K230 VanDerWaalsContact O-CB 3.22Å; L227-K230 WeakPolarHBondContact O-CB 3.35Å; L227-K230 PolarHBondContact O-N 2.93Å; L227-T231 PolarHBondContact O-OG1 3.41Å; L227-T231 VanDerWaalsContact O-OG1 3.06Å
228	L	60.4	Low	59.2	Low	104 Å²	104	114.5 Å²	114.5	55%	0.545	55%	0.554	S	S	.	*	H	α-helix	trans	-66.1	-29.4	-179.4	-83.8	165.3	0	0	0	113.6	G224 L225 K230 T231	G224-L228 WeakPolarHBondContact O-CB 3.42Å; G224-L228 WeakPolarHBondContact O-CG 3.2Å; G224-L228 PolarHBondContact O-N 3.05Å; L225-L228 PolarHBondContact O-N 2.9Å; L228-K230 PolarHBondContact O-N 3.43Å; L228-K230 VanDerWaalsContact O-N 3.16Å; L228-T231 PolarHBondContact O-N 3.18Å
229	Q	58.3	Low	56.9	Low	169 Å²	169	122 Å²	122	79%	0.79	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	-21.1	167.3	-75.2	-176.5	-8.7	0	0	112.4	L225 L227	L225-Q229 PolarHBondContact O-N 2.95Å; L227-Q229 VanDerWaalsContact C-N 3.31Å; L227-Q229 PolarHBondContact O-N 3.44Å
230	K	54.8	Low	54.3	Low	172 Å²	172	127.6 Å²	127.6	75%	0.748	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	-9.6	-177.3	-57.8	-179.3	176.4	-179.9	0	114.9	L227 L228	L227-K230 WeakPolarHBondContact O-CA 3.32Å; L227-K230 VanDerWaalsContact O-CB 3.22Å; L227-K230 WeakPolarHBondContact O-CB 3.35Å; L227-K230 PolarHBondContact O-N 2.93Å; L228-K230 PolarHBondContact O-N 3.43Å; L228-K230 VanDerWaalsContact O-N 3.16Å
231	T	48.7	Very low	51.8	Low	106 Å²	106	132.6 Å²	132.6	65%	0.65	63%	0.634	S	S	*	*			trans	-135.8	47.2	-164.8	22.3	0	0	0	0	116.1	L227 L228 K233	L227-T231 PolarHBondContact O-OG1 3.41Å; L227-T231 VanDerWaalsContact O-OG1 3.06Å; L228-T231 PolarHBondContact O-N 3.18Å; T231-K233 PolarHBondContact O-N 2.96Å
232	R	36.5	Very low	49.3	Very low	246 Å²	246	136.3 Å²	136.3	93%	0.928	66%	0.659	S	S	*	*			trans	-81.5	101.8	167.2	-84.4	-177.9	171.2	176	-1.8	112
233	K	32.8	Very low	46.7	Very low	202 Å²	202	143.1 Å²	143.1	88%	0.878	69%	0.694	S	S	*	*			trans	-167.8	132.6	152.7	-102.6	179.3	-170.5	-177.8	0	110.7	T231	T231-K233 PolarHBondContact O-N 2.96Å
234	P	40.1	Very low	44.1	Very low	128 Å²	128	141.5 Å²	141.5	83%	0.831	70%	0.699	S	S	*	*			trans	-110.8	157.6	-176.2	38.4	-29	0	0	0	114.2
235	K	27.3	Very low	41.9	Very low	198 Å²	198	147.8 Å²	147.8	86%	0.861	73%	0.726	S	S	*	*			trans	-152.2	124.7	158.8	-109.4	-175	-178.9	-174.8	0	114.2
236	Q	31	Very low	39.9	Very low	185 Å²	185	156 Å²	156	86%	0.864	75%	0.753	S	S	*	*			trans	21.5	138.9	145.4	-85.3	173.5	-34.3	0	0	125.6
237	D	34.7	Very low	38.4	Very low	156 Å²	156	156.1 Å²	156.1	83%	0.834	76%	0.764	S	S	*	*			trans	-60.1	164.2	164.9	-75.5	-39.1	0	0	0	115.6
238	D	28.6	Very low	36.1	Very low	152 Å²	152	158.3 Å²	158.3	81%	0.813	78%	0.775	S	S	*	*			trans	-151.9	133.9	143.7	-114.1	-7.1	0	0	0	110.7
239	D	33.2	Very low	34.4	Very low	160 Å²	160	163 Å²	163	86%	0.856	79%	0.785	S	S	*	*			trans	-119.2	146.1	173.9	-140.7	1.5	0	0	0	108.7
240	K	31.4	Very low	32.9	Very low	155 Å²	155	164.5 Å²	164.5	67%	0.674	78%	0.784	S	S	*	*			trans	-146.1	135.2	-177.6	-104.2	179	-174.3	157.5	0	114.1
241	R	30.8	Very low	31.6	Very low	212 Å²	212	163.6 Å²	163.6	80%	0.8	79%	0.786	S	S	*	*			trans	92.7	147.9	135.3	-75.9	175.1	176.9	-179.2	-0.2	119.3
242	V	28	Very low	30.5	Very low	116 Å²	116	164.7 Å²	164.7	70%	0.703	79%	0.792	S	S	*	*			cis	171.2	165.3	-21.2	144.1	0	0	0	0	107.4
243	I	26.8	Very low	30.1	Very low	151 Å²	151	162.1 Å²	162.1	77%	0.774	79%	0.79	S	S	*	*			trans	83.8	144.7	157.9	-40.5	-174.2	0	0	0	118.5
244	A	26.8	Very low	30	Very low	74 Å²	74	160.2 Å²	160.2	61%	0.612	79%	0.788	S	S	*	*			cis	177.9	174.7	-32.5	0	0	0	0	0	109.4
245	I	30.3	Very low	29.7	Very low	156 Å²	156	160 Å²	160	80%	0.8	79%	0.786	S	S	*	*			trans	76.2	145.2	149.5	-61.3	151.4	0	0	0	117
246	R	28.6	Very low	29.8	Very low	225 Å²	225	154.2 Å²	154.2	85%	0.849	78%	0.783	S	S	*	*			cis	-177.1	-174	-29.3	-130.5	-175.3	-167.1	-176.8	5.3	105.7
247	P	42.1	Very low	29.7	Very low	103 Å²	103	152 Å²	152	67%	0.669	78%	0.783	S	S	*	*			trans	-117	-170.9	-131.9	37.4	-16.6	0	0	0	115.3
248	I	26.1	Very low	29.6	Very low	154 Å²	154	153.1 Å²	153.1	79%	0.79	79%	0.787	S	S	*	*			trans	174.4	128.9	130.8	-84.9	152	0	0	0	113.5
249	R	26.2	Very low	29.6	Very low	202 Å²	202	154.9 Å²	154.9	76%	0.762	79%	0.791	S	S	*	*			trans	16.3	164	143.8	-61.5	179.6	169.6	-179.4	-2.5	122
250	R	26.7	Very low	29.8	Very low	202 Å²	202	155 Å²	155	76%	0.762	79%	0.792	S	S	*	*			cis	-176.2	170.7	-10	-108	-175.7	-175.8	177.9	-0.2	106.6
251	I	26.8	Very low	29.9	Very low	153 Å²	153	156 Å²	156	79%	0.785	80%	0.798	S	S	*	*			trans	137	97.4	145.6	-71.7	163.2	0	0	0	109.5
252	T	26.6	Very low	30.3	Very low	128 Å²	128	152.6 Å²	152.6	79%	0.785	80%	0.796	S	S	*	*				70.3	122.4	91.2	53.4	0	0	0	0	116.6
253	H	27.8	Very low	31	Very low	192 Å²	192	156 Å²	156	89%	0.889	81%	0.805	S	S	*	*			trans	-89.2	153.8	-178.8	-71.3	-89.1	0	0	0	113.1
254	I	29.5	Very low	31.7	Very low	163 Å²	163	158.3 Å²	158.3	84%	0.836	81%	0.812	S	S	*	*			trans	-124.1	135.4	164.9	-57.4	170.7	0	0	0	106.9
255	P	34.8	Very low	32.9	Very low	123 Å²	123	162.1 Å²	162.1	80%	0.799	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-98.9	138.1	165.6	25.1	-10.1	0	0	0	111.6
256	G	29.4	Very low	34	Very low	76 Å²	76	157.4 Å²	157.4	78%	0.784	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-90	146	172.2	0	0	0	0	0	112.3
257	T	28.5	Very low	35.4	Very low	140 Å²	140	153 Å²	153	86%	0.859	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-76	147.3	170.9	36.6	0	0	0	0	111.6
258	L	31.6	Very low	36.5	Very low	178 Å²	178	153.8 Å²	153.8	93%	0.932	79%	0.785	S	S	*	*			trans	-120.1	135	166.6	-79.4	162.6	0	0	0	108
259	E	30.5	Very low	38.7	Very low	190 Å²	190	148.5 Å²	148.5	89%	0.888	76%	0.759	S	S	*	*			trans	-90.3	154.3	-179	-70.4	174.5	150.8	0	0	111.2
260	D	35.9	Very low	41.2	Very low	163 Å²	163	140 Å²	140	87%	0.872	73%	0.728	S	S	*	*			trans	-80	127.2	178.9	-58.8	-59.6	0	0	0	111.6
261	E	34	Very low	43.9	Very low	175 Å²	175	133.9 Å²	133.9	82%	0.818	71%	0.713	S	S	*	*			trans	-147	103.9	160.4	-72.3	-171	163.5	0	0	107
262	D	39.3	Very low	46.6	Very low	141 Å²	141	130.8 Å²	130.8	75%	0.754	70%	0.696	S	S	*	*			trans	-174.4	88.9	165.3	-83.3	-33.5	0	0	0	110.3
263	E	41.9	Very low	49.4	Very low	188 Å²	188	125.1 Å²	125.1	88%	0.879	66%	0.661	S	S	*	*	S	Bend	trans	-131.8	2.6	170.2	-77.5	-164.5	168.3	0	0	114.6
264	E	42	Very low	52.2	Low	198 Å²	198	118.7 Å²	118.7	93%	0.925	63%	0.631	S	S	*	*	S	Bend	trans	-108.3	-7	-176.4	-69.8	-167.4	168.3	0	0	116.1
265	E	51.7	Low	54.9	Low	155 Å²	155	117.4 Å²	117.4	72%	0.724	62%	0.62	S	S	*	*	S	Bend	trans	-86.2	-10.2	-178.2	-65.7	-165.7	156.1	0	0	114.9
266	D	54.6	Low	57.3	Low	57 Å²	57	116.8 Å²	116.8	31%	0.305	61%	0.605	S	S	.	*	H	α-helix	trans	-85.3	-17.4	-156.4	-72.3	-54.5	0	0	0	117.8
267	N	57.9	Low	60	Low	131 Å²	131	113.4 Å²	113.4	70%	0.701	57%	0.569	S	S	*	*	H	α-helix	trans	-79.2	-25.9	-177.1	-110.4	-44.3	0	0	0	113.3	D269	N267-D269 VanDerWaalsContact C-N 3.31Å
268	D	65.3	Low	62.6	Low	120 Å²	120	113.6 Å²	113.6	64%	0.642	56%	0.558	S	S	*	*	H	α-helix	trans	-71.9	-27.8	178.4	-82	-18.4	0	0	0	112.2	I270 V271 M272	D268-I270 PolarHBondContact O-N 3.38Å; D268-V271 PolarHBondContact O-N 2.78Å; D268-M272 HydrophobicContact CB-CE 4.3Å; D268-M272 WeakPolarHBondContact O-CG 3.3Å; D268-M272 PolarHBondContact O-N 3.49Å
269	D	71	Confident	65.2	Low	44 Å²	44	110.5 Å²	110.5	24%	0.235	55%	0.546	C	S	.	.	H	α-helix	trans	-61.5	-40.6	-178.6	-82.1	-14.3	0	0	0	113.9	N267 V271 M272 L273 R311	N267-D269 VanDerWaalsContact C-N 3.31Å; D269-V271 VanDerWaalsContact C-N 3.33Å; D269-V271 PolarHBondContact O-N 2.85Å; D269-M272 PolarHBondContact O-N 3.14Å; D269-M272 VanDerWaalsContact OD1-CE 3.28Å; D269-M272 WeakPolarHBondContact OD1-CE 3.37Å; D269-L273 WeakPolarHBondContact O-CG 3.12Å; D269-L273 PolarHBondContact O-N 3.4Å; D269-R311 IonicContact OD2-CZ 3.58Å; D269-R311 IonicContact OD2-NH1 3.69Å; D269-R311 IonicContact OD2-NH2 2.7Å; D269-R311 PolarHBondContact OD2-NH2 2.87Å
270	I	80.2	Confident	67.2	Low	22 Å²	22	102.7 Å²	102.7	11%	0.113	51%	0.512	C	S	.	.	H	α-helix	trans	-67	-39.1	-179.5	-57.1	175.7	0	0	0	110.5	D268 L273 E274 K298 Y307	D268-I270 PolarHBondContact O-N 3.38Å; I270-L273 PolarHBondContact O-N 3.36Å; I270-E274 PolarHBondContact O-N 3.15Å; I270-E274 VanDerWaalsContact O-N 3.11Å; I270-K298 HydrophobicContact CG2-CG 4.11Å; I270-Y307 WeakPolarHBondContact CD1-OH 3.49Å
271	V	83.4	Confident	69.4	Low	75 Å²	75	98.9 Å²	98.9	46%	0.455	50%	0.499	S	S	.	.	H	α-helix	trans	-68.9	-38.7	177.7	180	0	0	0	0	110.2	D268 D269 E274 K275	D268-V271 PolarHBondContact O-N 2.78Å; D269-V271 VanDerWaalsContact C-N 3.33Å; D269-V271 PolarHBondContact O-N 2.85Å; V271-E274 PolarHBondContact O-N 3.43Å; V271-K275 PolarHBondContact O-N 3.34Å; V271-K275 VanDerWaalsContact O-N 3.15Å
272	M	82.9	Confident	71.8	Confident	87 Å²	87	91.5 Å²	91.5	43%	0.429	46%	0.464	S	S	.	.	H	α-helix	trans	-61.9	-44.7	173.2	-75.3	-163.8	-87.3	0	0	112.1	D268 D269 E274 K275 K276	D268-M272 HydrophobicContact CB-CE 4.3Å; D268-M272 WeakPolarHBondContact O-CG 3.3Å; D268-M272 PolarHBondContact O-N 3.49Å; D269-M272 PolarHBondContact O-N 3.14Å; D269-M272 VanDerWaalsContact OD1-CE 3.28Å; D269-M272 WeakPolarHBondContact OD1-CE 3.37Å; M272-E274 VanDerWaalsContact C-N 3.34Å; M272-E274 PolarHBondContact O-N 3.39Å; M272-K275 PolarHBondContact O-N 2.97Å; M272-K276 WeakPolarHBondContact O-CG 3.38Å; M272-K276 PolarHBondContact O-N 3.43Å
273	L	84.4	Confident	74.2	Confident	9 Å²	9	87.7 Å²	87.7	5%	0.047	45%	0.447	C	S	.	.	H	α-helix	trans	-60.6	-41.6	176.5	-75.8	168.2	0	0	0	112.2	D269 I270 K275 K276 I277 R311 E315	D269-L273 WeakPolarHBondContact O-CG 3.12Å; D269-L273 PolarHBondContact O-N 3.4Å; I270-L273 PolarHBondContact O-N 3.36Å; L273-K275 PolarHBondContact O-N 3.16Å; L273-K276 PolarHBondContact O-N 3.27Å; L273-I277 VanDerWaalsContact O-CG1 3.29Å; L273-I277 WeakPolarHBondContact O-CG1 3.44Å; L273-I277 PolarHBondContact O-N 3.43Å; L273-R311 HydrophobicContact CD1-CG 4.47Å; L273-E315 HydrophobicContact CD2-CG 3.73Å
274	E	86.4	Confident	76.3	Confident	57 Å²	57	85.2 Å²	85.2	27%	0.266	44%	0.436	S	S	.	.	H	α-helix	trans	-63.6	-40.7	177.5	-167.8	179.5	155.1	0	0	112.3	I270 V271 M272 I277 K278 I294 K298	I270-E274 PolarHBondContact O-N 3.15Å; I270-E274 VanDerWaalsContact O-N 3.11Å; V271-E274 PolarHBondContact O-N 3.43Å; M272-E274 VanDerWaalsContact C-N 3.34Å; M272-E274 PolarHBondContact O-N 3.39Å; E274-I277 PolarHBondContact O-N 3.1Å; E274-K278 PolarHBondContact O-N 3.31Å; E274-K278 IonicContact OE1-NZ 2.89Å; E274-K278 PolarHBondContact OE1-NZ 3.29Å; E274-I294 HydrophobicContact CB-CD1 3.83Å; E274-I294 HydrophobicContact CG-CD1 4.28Å; E274-K298 IonicContact OE2-NZ 2.7Å; E274-K298 PolarHBondContact OE2-NZ 3.45Å
275	K	86.8	Confident	78.5	Confident	136 Å²	136	82.2 Å²	82.2	59%	0.591	42%	0.422	S	S	*	.	H	α-helix	trans	-63.4	-42.8	173.8	-72.1	176.4	-177.8	172.5	0	111.4	V271 M272 L273 I277 K278 T279	V271-K275 PolarHBondContact O-N 3.34Å; V271-K275 VanDerWaalsContact O-N 3.15Å; M272-K275 PolarHBondContact O-N 2.97Å; L273-K275 PolarHBondContact O-N 3.16Å; K275-I277 PolarHBondContact O-N 2.96Å; K275-K278 PolarHBondContact O-N 3.27Å; K275-T279 PolarHBondContact O-N 2.8Å; K275-T279 VanDerWaalsContact O-N 3.08Å; K275-T279 PolarHBondContact O-OG1 3.18Å
276	K	85.8	Confident	80.3	Confident	110 Å²	110	74.9 Å²	74.9	48%	0.478	39%	0.387	S	S	.	.	H	α-helix	trans	-63.4	-40.2	178.5	-70.8	176	-179.1	176.2	0	112.2	M272 L273 K278 T279 S280 V318	M272-K276 WeakPolarHBondContact O-CG 3.38Å; M272-K276 PolarHBondContact O-N 3.43Å; L273-K276 PolarHBondContact O-N 3.27Å; K276-K278 VanDerWaalsContact C-N 3.34Å; K276-K278 PolarHBondContact O-N 3.46Å; K276-T279 PolarHBondContact O-N 2.94Å; K276-S280 PolarHBondContact O-N 2.91Å; K276-S280 PolarHBondContact O-OG 3.45Å; K276-S280 VanDerWaalsContact O-OG 3.06Å; K276-V318 HydrophobicContact CB-CG1 3.59Å; K276-V318 HydrophobicContact CB-CG2 4.34Å; K276-V318 HydrophobicContact CD-CG1 4.09Å; K276-V318 HydrophobicContact CG-CG1 4.34Å
277	I	86.4	Confident	81.9	Confident	6 Å²	6	75.5 Å²	75.5	3%	0.031	39%	0.388	C	S	.	.	H	α-helix	trans	-62.9	-37.7	176.3	-66.6	163.1	0	0	0	112.1	L273 E274 K275 T279 S280 C290 I294 L314 V318	L273-I277 VanDerWaalsContact O-CG1 3.29Å; L273-I277 WeakPolarHBondContact O-CG1 3.44Å; L273-I277 PolarHBondContact O-N 3.43Å; E274-I277 PolarHBondContact O-N 3.1Å; K275-I277 PolarHBondContact O-N 2.96Å; I277-T279 VanDerWaalsContact C-N 3.32Å; I277-S280 WeakPolarHBondContact CA-OG 3.37Å; I277-S280 PolarHBondContact O-OG 3.33Å; I277-S280 VanDerWaalsContact O-OG 3.1Å; I277-C290 HydrophobicContact CD1-CB 4.31Å; I277-C290 HydrophobicContact CG2-CB 4.01Å; I277-I294 HydrophobicContact CD1-CD1 3.72Å; I277-L314 HydrophobicContact CD1-CD2 4.22Å; I277-V318 HydrophobicContact CB-CG2 4.49Å; I277-V318 HydrophobicContact CG1-CG2 3.48Å; I277-V318 VanDerWaalsContact CG1-CG2 3.48Å
278	K	83.2	Confident	83.5	Confident	144 Å²	144	75.3 Å²	75.3	63%	0.626	38%	0.381	S	S	*	.	H	α-helix	trans	-71.5	-30.4	176.5	-69.8	173.9	-172.7	163.3	0	112.3	E274 K275 K276	E274-K278 PolarHBondContact O-N 3.31Å; E274-K278 IonicContact OE1-NZ 2.89Å; E274-K278 PolarHBondContact OE1-NZ 3.29Å; K275-K278 PolarHBondContact O-N 3.27Å; K276-K278 VanDerWaalsContact C-N 3.34Å; K276-K278 PolarHBondContact O-N 3.46Å
279	T	84.6	Confident	84.7	Confident	113 Å²	113	71.9 Å²	71.9	69%	0.693	36%	0.364	S	S	*	.	H	α-helix	trans	-79.3	-35.3	-179.6	-51.6	0	0	0	0	111.5	K275 K276 I277 S281	K275-T279 PolarHBondContact O-N 2.8Å; K275-T279 VanDerWaalsContact O-N 3.08Å; K275-T279 PolarHBondContact O-OG1 3.18Å; K276-T279 PolarHBondContact O-N 2.94Å; I277-T279 VanDerWaalsContact C-N 3.32Å; T279-S281 PolarHBondContact O-N 3.16Å
280	S	74.5	Confident	85.6	Confident	25 Å²	25	69.8 Å²	69.8	18%	0.175	35%	0.353	C	S	.	.	S	Bend	trans	-70.7	115.2	177	51.9	0	0	0	0	109.7	K276 I277 M282	K276-S280 PolarHBondContact O-N 2.91Å; K276-S280 PolarHBondContact O-OG 3.45Å; K276-S280 VanDerWaalsContact O-OG 3.06Å; I277-S280 WeakPolarHBondContact CA-OG 3.37Å; I277-S280 PolarHBondContact O-OG 3.33Å; I277-S280 VanDerWaalsContact O-OG 3.1Å; S280-M282 PolarHBondContact O-N 2.93Å; S280-M282 WeakPolarHBondContact OG-CE 3.43Å
281	S	80.4	Confident	86.1	Confident	84 Å²	84	71 Å²	71	59%	0.587	36%	0.362	S	S	*	.			trans	-72	63.6	177	-50.9	0	0	0	0	111.2	T279 N323	T279-S281 PolarHBondContact O-N 3.16Å; S281-N323 PolarHBondContact O-ND2 2.95Å
282	M	86.1	Confident	86.5	Confident	20 Å²	20	74.8 Å²	74.8	10%	0.099	37%	0.372	C	S	.	.			trans	-75	154.6	-179.7	-53.8	-161.6	-174.5	0	0	111.6	S280 A286 H287 M317 V318 W322	S280-M282 PolarHBondContact O-N 2.93Å; S280-M282 WeakPolarHBondContact OG-CE 3.43Å; M282-A286 HydrophobicContact CB-CB 4.13Å; M282-A286 HydrophobicContact SD-CB 4.3Å; M282-H287 HydrophobicContact CB-CB 4.46Å; M282-M317 HydrophobicContact CE-CB 4.15Å; M282-M317 WeakPolarHBondContact CE-O 3.37Å; M282-M317 HydrophobicContact SD-CE 4.41Å; M282-V318 HydrophobicContact CE-CB 4.44Å; M282-V318 HydrophobicContact CE-CG2 4.05Å; M282-W322 HydrophobicContact CB-CD2 4.42Å; M282-W322 HydrophobicContact CB-CG 4.27Å; M282-W322 HydrophobicContact CG-CD2 4.43Å; M282-W322 HydrophobicContact CG-CG 4.09Å; M282-W322 HydrophobicContact SD-CZ2 4.32Å
283	P	87.9	Confident	86.8	Confident	60 Å²	60	71.6 Å²	71.6	39%	0.39	36%	0.356	S	S	.	.			trans	-57.4	151.9	168.8	-21.6	32.1	0	0	0	111.8	Q285 A286 H287 W322	P283-Q285 PolarHBondContact O-N 3.39Å; P283-Q285 VanDerWaalsContact O-N 3.13Å; P283-A286 PolarHBondContact O-N 3.39Å; P283-H287 PolarHBondContact O-N 3.46Å; P283-W322 HydrophobicContact CG-CD2 4.41Å; P283-W322 HydrophobicContact CG-CE3 3.62Å; P283-W322 HydrophobicContact CG-CZ3 4.04Å
284	E	87.9	Confident	87.1	Confident	137 Å²	137	71.7 Å²	71.7	64%	0.64	36%	0.357	S	S	*	.	H	α-helix	trans	-56.5	-36.4	-176	-164.2	-170.6	159.5	0	0	112.8	K288	E284-K288 HydrophobicContact CG-CD 4.5Å; E284-K288 WeakPolarHBondContact O-CB 3.43Å; E284-K288 VanDerWaalsContact O-CG 3.3Å; E284-K288 WeakPolarHBondContact O-CG 3.3Å; E284-K288 PolarHBondContact O-N 3.42Å; E284-K288 VanDerWaalsContact O-N 3.09Å; E284-K288 WeakPolarHBondContact OE1-CE 3.29Å; E284-K288 IonicContact OE1-NZ 3.95Å; E284-K288 PolarHBondContact OE1-NZ 3.24Å
285	Q	87.7	Confident	87.4	Confident	135 Å²	135	75.5 Å²	75.5	63%	0.631	37%	0.372	S	S	*	.	H	α-helix	trans	-64.4	-48.9	176.4	-65.9	-171.1	-6.7	0	0	112.1	P283 K288 V289	P283-Q285 PolarHBondContact O-N 3.39Å; P283-Q285 VanDerWaalsContact O-N 3.13Å; Q285-K288 PolarHBondContact O-N 2.59Å; Q285-V289 WeakPolarHBondContact O-CG2 3.29Å; Q285-V289 PolarHBondContact O-N 2.91Å
286	A	88.3	Confident	87.5	Confident	0 Å²	0	74 Å²	74	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-62.6	-45.4	178.5	0	0	0	0	0	111.5	M282 P283 K288 V289 C290 M317 W322 V478	M282-A286 HydrophobicContact CB-CB 4.13Å; M282-A286 HydrophobicContact SD-CB 4.3Å; P283-A286 PolarHBondContact O-N 3.39Å; A286-K288 PolarHBondContact O-N 3.42Å; A286-V289 PolarHBondContact O-N 3.4Å; A286-V289 VanDerWaalsContact O-N 3.15Å; A286-C290 PolarHBondContact O-N 2.98Å; A286-C290 PolarHBondContact O-SG 2.74Å; A286-M317 HydrophobicContact CB-CE 3.71Å; A286-W322 HydrophobicContact CB-CH2 3.7Å; A286-W322 HydrophobicContact CB-CZ2 3.94Å; A286-W322 HydrophobicContact CB-CZ3 4.08Å; A286-V478 HydrophobicContact CB-CG1 4.07Å
287	H	89.7	Confident	87.6	Confident	71 Å²	71	68.9 Å²	68.9	33%	0.329	34%	0.341	S	S	.	.	H	α-helix	trans	-61.3	-42.4	179.4	-176.5	-90.5	0	0	0	112.2	M282 P283 V289 C290 V291	M282-H287 HydrophobicContact CB-CB 4.46Å; P283-H287 PolarHBondContact O-N 3.46Å; H287-V289 VanDerWaalsContact C-N 3.31Å; H287-V289 PolarHBondContact O-N 3.5Å; H287-C290 PolarHBondContact O-N 3.44Å; H287-V291 WeakPolarHBondContact O-CG2 2.95Å; H287-V291 PolarHBondContact O-N 2.93Å
288	K	91.1	Very high	87.7	Confident	126 Å²	126	74.1 Å²	74.1	55%	0.548	36%	0.363	S	S	.	.	H	α-helix	trans	-59.4	-40.3	175.4	-77.8	173.5	-176.7	168.2	0	112.2	E284 Q285 A286 K292	E284-K288 HydrophobicContact CG-CD 4.5Å; E284-K288 WeakPolarHBondContact O-CB 3.43Å; E284-K288 VanDerWaalsContact O-CG 3.3Å; E284-K288 WeakPolarHBondContact O-CG 3.3Å; E284-K288 PolarHBondContact O-N 3.42Å; E284-K288 VanDerWaalsContact O-N 3.09Å; E284-K288 WeakPolarHBondContact OE1-CE 3.29Å; E284-K288 IonicContact OE1-NZ 3.95Å; E284-K288 PolarHBondContact OE1-NZ 3.24Å; Q285-K288 PolarHBondContact O-N 2.59Å; A286-K288 PolarHBondContact O-N 3.42Å; K288-K292 PolarHBondContact O-N 3.18Å
289	V	90.6	Very high	87.9	Confident	48 Å²	48	76.1 Å²	76.1	29%	0.291	37%	0.372	S	S	.	.	H	α-helix	trans	-66.4	-47.7	177	176.1	0	0	0	0	110.7	Q285 A286 H287 V291 K292 E293 Y313 V478	Q285-V289 WeakPolarHBondContact O-CG2 3.29Å; Q285-V289 PolarHBondContact O-N 2.91Å; A286-V289 PolarHBondContact O-N 3.4Å; A286-V289 VanDerWaalsContact O-N 3.15Å; H287-V289 VanDerWaalsContact C-N 3.31Å; H287-V289 PolarHBondContact O-N 3.5Å; V289-V291 VanDerWaalsContact C-N 3.35Å; V289-V291 PolarHBondContact O-N 2.66Å; V289-K292 WeakPolarHBondContact O-CB 3.48Å; V289-K292 PolarHBondContact O-N 3.27Å; V289-K292 VanDerWaalsContact O-N 3.11Å; V289-E293 HydrophobicContact CG1-CG 4.28Å; V289-E293 WeakPolarHBondContact O-CG 3.12Å; V289-E293 PolarHBondContact O-N 2.88Å; V289-Y313 HydrophobicContact CG1-CE1 4.26Å; V289-V478 HydrophobicContact CG2-CG2 4.19Å
290	C	89.8	Confident	88	Confident	0 Å²	0	72 Å²	72	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-58.5	-43	177.6	-68.8	0	0	0	0	112.8	I277 A286 H287 K292 E293 I294 L314	I277-C290 HydrophobicContact CD1-CB 4.31Å; I277-C290 HydrophobicContact CG2-CB 4.01Å; A286-C290 PolarHBondContact O-N 2.98Å; A286-C290 PolarHBondContact O-SG 2.74Å; H287-C290 PolarHBondContact O-N 3.44Å; C290-K292 VanDerWaalsContact C-N 3.29Å; C290-K292 PolarHBondContact O-N 2.96Å; C290-E293 PolarHBondContact O-N 3.25Å; C290-I294 WeakPolarHBondContact O-CG2 3.49Å; C290-I294 PolarHBondContact O-N 2.71Å; C290-L314 HydrophobicContact CB-CD2 4.11Å
291	V	91	Very high	88.5	Confident	48 Å²	48	74.2 Å²	74.2	29%	0.291	36%	0.359	S	S	.	.	H	α-helix	trans	-64.5	-33.8	177.7	172.3	0	0	0	0	112	H287 V289 I294 K295	H287-V291 WeakPolarHBondContact O-CG2 2.95Å; H287-V291 PolarHBondContact O-N 2.93Å; V289-V291 VanDerWaalsContact C-N 3.35Å; V289-V291 PolarHBondContact O-N 2.66Å; V291-I294 WeakPolarHBondContact O-CG2 3.47Å; V291-K295 VanDerWaalsContact O-CG 3.3Å; V291-K295 WeakPolarHBondContact O-CG 3.41Å; V291-K295 PolarHBondContact O-N 3.3Å
292	K	91.4	Very high	88.5	Confident	155 Å²	155	75.7 Å²	75.7	67%	0.674	36%	0.356	S	S	*	.	H	α-helix	trans	-70.6	-45.2	175.4	-172.9	-178.4	177.2	-175.2	0	111.3	K288 V289 C290 K295 R296	K288-K292 PolarHBondContact O-N 3.18Å; V289-K292 WeakPolarHBondContact O-CB 3.48Å; V289-K292 PolarHBondContact O-N 3.27Å; V289-K292 VanDerWaalsContact O-N 3.11Å; C290-K292 VanDerWaalsContact C-N 3.29Å; C290-K292 PolarHBondContact O-N 2.96Å; K292-K295 PolarHBondContact O-N 2.87Å; K292-R296 PolarHBondContact O-N 2.87Å; K292-R296 VanDerWaalsContact O-N 3.17Å
293	E	89.6	Confident	88.3	Confident	19 Å²	19	80.1 Å²	80.1	9%	0.089	39%	0.389	C	S	.	.	H	α-helix	trans	-69.7	-38	-178	-67.8	-66.4	111.6	0	0	112.2	V289 C290 K295 R296 L297 T310 Y313 L314 R415	V289-E293 HydrophobicContact CG1-CG 4.28Å; V289-E293 WeakPolarHBondContact O-CG 3.12Å; V289-E293 PolarHBondContact O-N 2.88Å; C290-E293 PolarHBondContact O-N 3.25Å; E293-K295 PolarHBondContact O-N 2.84Å; E293-R296 CarbonylContact O-C 3.57Å; E293-R296 WeakPolarHBondContact O-CA 3.38Å; E293-R296 WeakPolarHBondContact O-CB 3.46Å; E293-R296 PolarHBondContact O-N 3.5Å; E293-R296 VanDerWaalsContact O-N 3.09Å; E293-L297 PolarHBondContact O-N 3.4Å; E293-T310 HydrophobicContact CB-CG2 4.22Å; E293-Y313 HydrophobicContact CG-CD1 4.42Å; E293-Y313 HydrophobicContact CG-CE1 4.16Å; E293-L314 HydrophobicContact CB-CD2 3.94Å; E293-L314 HydrophobicContact CB-CG 4.35Å; E293-R415 IonicContact OE2-CZ 3.4Å; E293-R415 IonicContact OE2-NH1 2.85Å; E293-R415 PolarHBondContact OE2-NH1 3.15Å; E293-R415 IonicContact OE2-NH2 2.85Å; E293-R415 PolarHBondContact OE2-NH2 3.13Å
294	I	90.9	Very high	88.2	Confident	12 Å²	12	81.9 Å²	81.9	6%	0.062	39%	0.394	C	S	.	.	H	α-helix	trans	-67.6	-34.8	176.6	-161.5	160.5	0	0	0	112.5	E274 I277 C290 V291 R296 L297 K298 L314	E274-I294 HydrophobicContact CB-CD1 3.83Å; E274-I294 HydrophobicContact CG-CD1 4.28Å; I277-I294 HydrophobicContact CD1-CD1 3.72Å; C290-I294 WeakPolarHBondContact O-CG2 3.49Å; C290-I294 PolarHBondContact O-N 2.71Å; V291-I294 WeakPolarHBondContact O-CG2 3.47Å; I294-R296 VanDerWaalsContact C-N 3.26Å; I294-R296 PolarHBondContact O-N 3.32Å; I294-L297 PolarHBondContact O-N 3Å; I294-K298 WeakPolarHBondContact O-CG 3.03Å; I294-K298 PolarHBondContact O-N 3.14Å; I294-K298 VanDerWaalsContact O-N 3.09Å; I294-L314 HydrophobicContact CB-CD1 3.97Å; I294-L314 HydrophobicContact CG1-CD1 4.26Å
295	K	90.9	Very high	87.8	Confident	136 Å²	136	79.3 Å²	79.3	59%	0.591	39%	0.389	S	S	*	.	H	α-helix	trans	-65.2	-32.2	171.6	-75.3	177.2	-177	-178.9	0	111.9	V291 K292 E293	V291-K295 VanDerWaalsContact O-CG 3.3Å; V291-K295 WeakPolarHBondContact O-CG 3.41Å; V291-K295 PolarHBondContact O-N 3.3Å; K292-K295 PolarHBondContact O-N 2.87Å; E293-K295 PolarHBondContact O-N 2.84Å
296	R	88.9	Confident	87.6	Confident	105 Å²	105	77.2 Å²	77.2	40%	0.396	38%	0.379	S	S	.	.	H	α-helix	trans	-72	-45.7	175	-166.6	-172.8	169.2	-171.4	-12.8	110.3	K292 E293 I294 K298 K299 M300 E306	K292-R296 PolarHBondContact O-N 2.87Å; K292-R296 VanDerWaalsContact O-N 3.17Å; E293-R296 CarbonylContact O-C 3.57Å; E293-R296 WeakPolarHBondContact O-CA 3.38Å; E293-R296 WeakPolarHBondContact O-CB 3.46Å; E293-R296 PolarHBondContact O-N 3.5Å; E293-R296 VanDerWaalsContact O-N 3.09Å; I294-R296 VanDerWaalsContact C-N 3.26Å; I294-R296 PolarHBondContact O-N 3.32Å; R296-K298 PolarHBondContact O-N 3.12Å; R296-K299 PolarHBondContact O-N 3.16Å; R296-M300 HydrophobicContact CG-CE 3.57Å; R296-M300 VanDerWaalsContact CZ-CE 3.49Å; R296-M300 WeakPolarHBondContact O-CG 3.4Å; R296-M300 PolarHBondContact O-N 3.01Å; R296-E306 IonicContact CZ-OE2 3.27Å; R296-E306 IonicContact NH2-OE1 3.79Å; R296-E306 IonicContact NH2-OE2 2.66Å; R296-E306 PolarHBondContact NH2-OE2 2.72Å
297	L	89.2	Confident	87.6	Confident	2 Å²	2	78 Å²	78	1%	0.01	38%	0.382	C	S	.	.	H	α-helix	trans	-57.5	-44.6	178.4	-170	72.9	0	0	0	112.2	E293 I294 K299 M300 Y307 T310 R311 L314	E293-L297 PolarHBondContact O-N 3.4Å; I294-L297 PolarHBondContact O-N 3Å; L297-K299 PolarHBondContact O-N 2.95Å; L297-K299 VanDerWaalsContact O-N 3.14Å; L297-M300 PolarHBondContact O-N 3.29Å; L297-M300 VanDerWaalsContact O-N 3.12Å; L297-Y307 HydrophobicContact CD1-CD1 4.3Å; L297-Y307 HydrophobicContact CD1-CD2 3.5Å; L297-Y307 HydrophobicContact CD1-CE1 4.32Å; L297-Y307 HydrophobicContact CD1-CE2 3.55Å; L297-Y307 HydrophobicContact CD1-CG 3.88Å; L297-Y307 WeakPolarHBondContact CD1-O 3.35Å; L297-Y307 HydrophobicContact CG-CD2 4.19Å; L297-Y307 HydrophobicContact CG-CE2 3.78Å; L297-T310 HydrophobicContact CB-CG2 4.3Å; L297-T310 HydrophobicContact CD1-CG2 4.16Å; L297-R311 HydrophobicContact CD1-CB 4.41Å; L297-R311 HydrophobicContact CD2-CB 4.47Å; L297-L314 HydrophobicContact CD2-CD1 4.05Å
298	K	88.1	Confident	87.4	Confident	117 Å²	117	77 Å²	77	51%	0.509	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-21.9	176.6	-72.8	-176.5	-176.9	-175.5	0	114.3	I270 E274 I294 R296	I270-K298 HydrophobicContact CG2-CG 4.11Å; E274-K298 IonicContact OE2-NZ 2.7Å; E274-K298 PolarHBondContact OE2-NZ 3.45Å; I294-K298 WeakPolarHBondContact O-CG 3.03Å; I294-K298 PolarHBondContact O-N 3.14Å; I294-K298 VanDerWaalsContact O-N 3.09Å; R296-K298 PolarHBondContact O-N 3.12Å
299	K	87.8	Confident	87.1	Confident	186 Å²	186	72.3 Å²	72.3	81%	0.809	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-14.3	179.5	-67.8	-177.4	179.5	-171.4	0	113	R296 L297	R296-K299 PolarHBondContact O-N 3.16Å; L297-K299 PolarHBondContact O-N 2.95Å; L297-K299 VanDerWaalsContact O-N 3.14Å
300	M	86.4	Confident	87	Confident	26 Å²	26	70.2 Å²	70.2	13%	0.128	36%	0.355	C	S	.	.	S	Bend	trans	-86.9	139.2	-177.2	-75.3	-173	-172.8	0	0	111.2	R296 L297 E306 Y307	R296-M300 HydrophobicContact CG-CE 3.57Å; R296-M300 VanDerWaalsContact CZ-CE 3.49Å; R296-M300 WeakPolarHBondContact O-CG 3.4Å; R296-M300 PolarHBondContact O-N 3.01Å; L297-M300 PolarHBondContact O-N 3.29Å; L297-M300 VanDerWaalsContact O-N 3.12Å; M300-E306 HydrophobicContact CE-CB 4.12Å; M300-E306 WeakPolarHBondContact CE-OE2 3.25Å; M300-E306 HydrophobicContact SD-CB 3.98Å; M300-Y307 HydrophobicContact CB-CD2 4.04Å
301	P	85.3	Confident	87	Confident	72 Å²	72	73.1 Å²	73.1	47%	0.468	37%	0.365	S	S	.	.			trans	-70.6	142.5	167.9	28.5	-31	0	0	0	111	S303 M304	P301-S303 VanDerWaalsContact C-N 3.25Å; P301-S303 PolarHBondContact O-N 3.13Å; P301-M304 HydrophobicContact CG-CG 4.06Å; P301-M304 HydrophobicContact CG-SD 4.14Å; P301-M304 PolarHBondContact O-N 2.74Å
302	Q	80.9	Confident	86.9	Confident	114 Å²	114	74.6 Å²	74.6	53%	0.533	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-26.2	-177.3	-73.8	170.6	-27.6	0	0	113.7	M304 Y307	Q302-M304 PolarHBondContact O-N 3.02Å; Q302-Y307 HydrophobicContact CB-CD1 4.48Å; Q302-Y307 HydrophobicContact CG-CD1 4.19Å; Q302-Y307 HydrophobicContact CG-CD2 4.29Å; Q302-Y307 HydrophobicContact CG-CE1 3.82Å; Q302-Y307 HydrophobicContact CG-CE2 3.91Å; Q302-Y307 HydrophobicContact CG-CG 4.43Å
303	S	81.5	Confident	86.8	Confident	113 Å²	113	67.4 Å²	67.4	79%	0.79	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-12.9	176.6	59.3	0	0	0	0	113.8	P301	P301-S303 VanDerWaalsContact C-N 3.25Å; P301-S303 PolarHBondContact O-N 3.13Å
304	M	85	Confident	86.9	Confident	97 Å²	97	66.5 Å²	66.5	48%	0.478	34%	0.336	S	S	.	.	S	Bend	trans	-80.1	134.9	176.3	-85.8	-172	165.2	0	0	112	P301 Q302 E306 Y307	P301-M304 HydrophobicContact CG-CG 4.06Å; P301-M304 HydrophobicContact CG-SD 4.14Å; P301-M304 PolarHBondContact O-N 2.74Å; Q302-M304 PolarHBondContact O-N 3.02Å; M304-E306 PolarHBondContact O-N 3.5Å; M304-E306 VanDerWaalsContact O-N 3.14Å; M304-Y307 VanDerWaalsContact O-CB 3.23Å; M304-Y307 WeakPolarHBondContact O-CB 3.4Å; M304-Y307 PolarHBondContact O-N 3.16Å
305	P	80.8	Confident	86.8	Confident	84 Å²	84	68.5 Å²	68.5	55%	0.545	35%	0.345	S	S	.	.	H	α-helix	trans	-62.7	-23.6	176.6	24.9	-33.6	0	0	0	113.3	Y307 L309 V418	P305-Y307 PolarHBondContact O-N 2.88Å; P305-L309 PolarHBondContact O-N 3Å; P305-V418 HydrophobicContact CB-CG2 4.16Å
306	E	83.2	Confident	86.8	Confident	91 Å²	91	62.3 Å²	62.3	43%	0.425	32%	0.319	S	S	.	.	H	α-helix	trans	-65.8	-25.8	173.7	-67.4	-163.9	169.2	0	0	113.2	R296 M300 M304 L309 T310	R296-E306 IonicContact CZ-OE2 3.27Å; R296-E306 IonicContact NH2-OE1 3.79Å; R296-E306 IonicContact NH2-OE2 2.66Å; R296-E306 PolarHBondContact NH2-OE2 2.72Å; M300-E306 HydrophobicContact CE-CB 4.12Å; M300-E306 WeakPolarHBondContact CE-OE2 3.25Å; M300-E306 HydrophobicContact SD-CB 3.98Å; M304-E306 PolarHBondContact O-N 3.5Å; M304-E306 VanDerWaalsContact O-N 3.14Å; E306-L309 PolarHBondContact O-N 2.89Å; E306-T310 WeakPolarHBondContact O-CB 3.24Å; E306-T310 PolarHBondContact O-N 2.89Å; E306-T310 PolarHBondContact O-OG1 3.01Å
307	Y	87	Confident	86.9	Confident	16 Å²	16	57.3 Å²	57.3	6%	0.063	30%	0.3	C	S	.	.	H	α-helix	trans	-64	-53.7	-179.7	-176.3	-86.2	0	0	0	110.3	I270 L297 M300 Q302 M304 P305 L309 T310 R311	I270-Y307 WeakPolarHBondContact CD1-OH 3.49Å; L297-Y307 HydrophobicContact CD1-CD1 4.3Å; L297-Y307 HydrophobicContact CD1-CD2 3.5Å; L297-Y307 HydrophobicContact CD1-CE1 4.32Å; L297-Y307 HydrophobicContact CD1-CE2 3.55Å; L297-Y307 HydrophobicContact CD1-CG 3.88Å; L297-Y307 WeakPolarHBondContact CD1-O 3.35Å; L297-Y307 HydrophobicContact CG-CD2 4.19Å; L297-Y307 HydrophobicContact CG-CE2 3.78Å; M300-Y307 HydrophobicContact CB-CD2 4.04Å; Q302-Y307 HydrophobicContact CB-CD1 4.48Å; Q302-Y307 HydrophobicContact CG-CD1 4.19Å; Q302-Y307 HydrophobicContact CG-CD2 4.29Å; Q302-Y307 HydrophobicContact CG-CE1 3.82Å; Q302-Y307 HydrophobicContact CG-CE2 3.91Å; Q302-Y307 HydrophobicContact CG-CG 4.43Å; M304-Y307 VanDerWaalsContact O-CB 3.23Å; M304-Y307 WeakPolarHBondContact O-CB 3.4Å; M304-Y307 PolarHBondContact O-N 3.16Å; P305-Y307 PolarHBondContact O-N 2.88Å; Y307-L309 VanDerWaalsContact C-N 3.33Å; Y307-L309 PolarHBondContact O-N 3.32Å; Y307-T310 PolarHBondContact O-N 2.95Å; Y307-R311 WeakPolarHBondContact O-CB 3.46Å; Y307-R311 PolarHBondContact O-N 2.98Å
308	A	85.3	Confident	86.9	Confident	50 Å²	50	58.5 Å²	58.5	41%	0.413	31%	0.307	S	S	.	.	H	α-helix	trans	-58.8	-42.7	177.1	0	0	0	0	0	112	T310 R311 N312	A308-T310 VanDerWaalsContact C-N 3.35Å; A308-T310 PolarHBondContact O-N 2.78Å; A308-R311 PolarHBondContact O-N 3.24Å; A308-N312 WeakPolarHBondContact O-CB 3.23Å; A308-N312 PolarHBondContact O-N 3.33Å; A308-N312 PolarHBondContact O-ND2 3.08Å; A308-N312 PolarHBondContact O-OD1 3.45Å
309	L	86.6	Confident	87	Confident	28 Å²	28	57.5 Å²	57.5	15%	0.147	30%	0.304	C	S	.	.	H	α-helix	trans	-62	-40.8	176.9	-74	174.3	0	0	0	112.9	P305 E306 Y307 Y313	P305-L309 PolarHBondContact O-N 3Å; E306-L309 PolarHBondContact O-N 2.89Å; Y307-L309 VanDerWaalsContact C-N 3.33Å; Y307-L309 PolarHBondContact O-N 3.32Å; L309-Y313 WeakPolarHBondContact O-CB 3.38Å; L309-Y313 PolarHBondContact O-N 3.37Å
310	T	88.2	Confident	87.1	Confident	4 Å²	4	48.9 Å²	48.9	3%	0.025	27%	0.267	C	S	.	.	H	α-helix	trans	-74.3	-37.2	-179.2	-54.1	0	0	0	0	111.4	E293 L297 E306 Y307 A308 Y313 L314	E293-T310 HydrophobicContact CB-CG2 4.22Å; L297-T310 HydrophobicContact CB-CG2 4.3Å; L297-T310 HydrophobicContact CD1-CG2 4.16Å; E306-T310 WeakPolarHBondContact O-CB 3.24Å; E306-T310 PolarHBondContact O-N 2.89Å; E306-T310 PolarHBondContact O-OG1 3.01Å; Y307-T310 PolarHBondContact O-N 2.95Å; A308-T310 VanDerWaalsContact C-N 3.35Å; A308-T310 PolarHBondContact O-N 2.78Å; T310-Y313 PolarHBondContact O-N 3.01Å; T310-L314 HydrophobicContact CG2-CD1 4.44Å; T310-L314 WeakPolarHBondContact O-CG 3.47Å; T310-L314 PolarHBondContact O-N 3.18Å
311	R	88.4	Confident	87.3	Confident	60 Å²	60	48 Å²	48	23%	0.226	26%	0.263	C	S	.	.	H	α-helix	trans	-59.2	-54.5	171.7	179	179.3	174	161.4	6.7	110.8	D269 L273 L297 Y307 A308 Y313 L314 E315	D269-R311 IonicContact OD2-CZ 3.58Å; D269-R311 IonicContact OD2-NH1 3.69Å; D269-R311 IonicContact OD2-NH2 2.7Å; D269-R311 PolarHBondContact OD2-NH2 2.87Å; L273-R311 HydrophobicContact CD1-CG 4.47Å; L297-R311 HydrophobicContact CD1-CB 4.41Å; L297-R311 HydrophobicContact CD2-CB 4.47Å; Y307-R311 WeakPolarHBondContact O-CB 3.46Å; Y307-R311 PolarHBondContact O-N 2.98Å; A308-R311 PolarHBondContact O-N 3.24Å; R311-Y313 PolarHBondContact O-N 3.28Å; R311-L314 PolarHBondContact O-N 3.44Å; R311-E315 WeakPolarHBondContact CG-OE1 3.42Å; R311-E315 IonicContact CZ-OE1 2.81Å; R311-E315 IonicContact NE-OE1 2.93Å; R311-E315 PolarHBondContact NE-OE1 3.22Å; R311-E315 IonicContact NH2-OE1 3.93Å; R311-E315 PolarHBondContact O-N 3.42Å
312	N	88.8	Confident	87.4	Confident	80 Å²	80	45.8 Å²	45.8	43%	0.428	25%	0.246	S	C	.	.	H	α-helix	trans	-58.6	-36.6	178.8	-66.9	-7.3	0	0	0	112.2	A308 L316	A308-N312 WeakPolarHBondContact O-CB 3.23Å; A308-N312 PolarHBondContact O-N 3.33Å; A308-N312 PolarHBondContact O-ND2 3.08Å; A308-N312 PolarHBondContact O-OD1 3.45Å; N312-L316 WeakPolarHBondContact O-CB 3.47Å; N312-L316 PolarHBondContact O-N 2.91Å
313	Y	90.8	Very high	87.7	Confident	3 Å²	3	45.9 Å²	45.9	1%	0.012	25%	0.249	C	C	.	.	H	α-helix	trans	-65.4	-45.4	174.7	175.6	-96.9	0	0	0	112.4	V289 E293 L309 T310 R311 L316 M317 Y475 L476	V289-Y313 HydrophobicContact CG1-CE1 4.26Å; E293-Y313 HydrophobicContact CG-CD1 4.42Å; E293-Y313 HydrophobicContact CG-CE1 4.16Å; L309-Y313 WeakPolarHBondContact O-CB 3.38Å; L309-Y313 PolarHBondContact O-N 3.37Å; T310-Y313 PolarHBondContact O-N 3.01Å; R311-Y313 PolarHBondContact O-N 3.28Å; Y313-L316 PolarHBondContact O-N 2.79Å; Y313-M317 HydrophobicContact CD1-CG 4.25Å; Y313-M317 HydrophobicContact CE1-CG 3.82Å; Y313-M317 HydrophobicContact CE2-CG 4.32Å; Y313-M317 HydrophobicContact CE2-SD 4.44Å; Y313-M317 VanDerWaalsContact O-CG 3.3Å; Y313-M317 WeakPolarHBondContact O-CG 3.32Å; Y313-M317 PolarHBondContact O-N 3.18Å; Y313-Y475 HydrophobicContact CD2-CD1 4.34Å; Y313-Y475 AromaticContact CD2-CE1 3.95Å; Y313-Y475 HydrophobicContact CD2-CE1 3.95Å; Y313-L476 PolarHBondContact OH-O 3.46Å
314	L	90.5	Very high	87.9	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-65.7	-40.2	177.8	-74.3	172	0	0	0	111.7	I277 C290 E293 I294 L297 T310 R311 M317 V318	I277-L314 HydrophobicContact CD1-CD2 4.22Å; C290-L314 HydrophobicContact CB-CD2 4.11Å; E293-L314 HydrophobicContact CB-CD2 3.94Å; E293-L314 HydrophobicContact CB-CG 4.35Å; I294-L314 HydrophobicContact CB-CD1 3.97Å; I294-L314 HydrophobicContact CG1-CD1 4.26Å; L297-L314 HydrophobicContact CD2-CD1 4.05Å; T310-L314 HydrophobicContact CG2-CD1 4.44Å; T310-L314 WeakPolarHBondContact O-CG 3.47Å; T310-L314 PolarHBondContact O-N 3.18Å; R311-L314 PolarHBondContact O-N 3.44Å; L314-M317 PolarHBondContact O-N 3.47Å; L314-V318 VanDerWaalsContact O-CG2 3.31Å; L314-V318 WeakPolarHBondContact O-CG2 3.37Å; L314-V318 PolarHBondContact O-N 3Å
315	E	89.7	Confident	88	Confident	54 Å²	54	46.1 Å²	46.1	25%	0.252	24%	0.243	S	C	.	.	H	α-helix	trans	-58.7	-48.8	172.5	-75.6	171.4	-172.6	0	0	111.1	L273 R311 M317 V318 E319	L273-E315 HydrophobicContact CD2-CG 3.73Å; R311-E315 WeakPolarHBondContact CG-OE1 3.42Å; R311-E315 IonicContact CZ-OE1 2.81Å; R311-E315 IonicContact NE-OE1 2.93Å; R311-E315 PolarHBondContact NE-OE1 3.22Å; R311-E315 IonicContact NH2-OE1 3.93Å; R311-E315 PolarHBondContact O-N 3.42Å; E315-M317 PolarHBondContact O-N 3.44Å; E315-V318 PolarHBondContact O-N 3.24Å; E315-E319 WeakPolarHBondContact O-CG 3.46Å; E315-E319 PolarHBondContact O-N 2.89Å
316	L	90.6	Very high	88.4	Confident	7 Å²	7	43.4 Å²	43.4	4%	0.037	23%	0.225	C	C	.	.	H	α-helix	trans	-57.1	-48.3	175.8	-179.8	68.7	0	0	0	111.8	N312 Y313 V318 E319 L320 P422 I426 K430 Y475 L476	N312-L316 WeakPolarHBondContact O-CB 3.47Å; N312-L316 PolarHBondContact O-N 2.91Å; Y313-L316 PolarHBondContact O-N 2.79Å; L316-V318 VanDerWaalsContact C-N 3.25Å; L316-V318 PolarHBondContact O-N 3.08Å; L316-E319 PolarHBondContact O-N 3.03Å; L316-L320 HydrophobicContact CD1-CG 4.47Å; L316-L320 HydrophobicContact CG-CD1 4.32Å; L316-L320 VanDerWaalsContact O-CG 3.3Å; L316-L320 WeakPolarHBondContact O-CG 3.5Å; L316-L320 PolarHBondContact O-N 3.45Å; L316-L320 VanDerWaalsContact O-N 3.07Å; L316-P422 HydrophobicContact CD2-CB 4.01Å; L316-P422 HydrophobicContact CD2-CG 3.97Å; L316-I426 HydrophobicContact CD1-CG2 4.37Å; L316-I426 HydrophobicContact CD2-CG2 4.35Å; L316-K430 HydrophobicContact CD1-CB 4.39Å; L316-K430 HydrophobicContact CD1-CD 3.75Å; L316-K430 HydrophobicContact CD1-CG 4.2Å; L316-Y475 HydrophobicContact CD2-CD1 3.76Å; L316-Y475 HydrophobicContact CD2-CE1 3.67Å; L316-L476 HydrophobicContact CD2-CD1 4.33Å
317	M	90.2	Very high	88.5	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-58.3	-40.1	179.9	-72.9	-68.9	-71.4	0	0	111.9	M282 A286 Y313 L314 E315 W322 L476 V478	M282-M317 HydrophobicContact CE-CB 4.15Å; M282-M317 WeakPolarHBondContact CE-O 3.37Å; M282-M317 HydrophobicContact SD-CE 4.41Å; A286-M317 HydrophobicContact CB-CE 3.71Å; Y313-M317 HydrophobicContact CD1-CG 4.25Å; Y313-M317 HydrophobicContact CE1-CG 3.82Å; Y313-M317 HydrophobicContact CE2-CG 4.32Å; Y313-M317 HydrophobicContact CE2-SD 4.44Å; Y313-M317 VanDerWaalsContact O-CG 3.3Å; Y313-M317 WeakPolarHBondContact O-CG 3.32Å; Y313-M317 PolarHBondContact O-N 3.18Å; L314-M317 PolarHBondContact O-N 3.47Å; E315-M317 PolarHBondContact O-N 3.44Å; M317-W322 HydrophobicContact CE-CH2 4.03Å; M317-W322 HydrophobicContact CE-CZ2 3.63Å; M317-W322 PolarHBondContact O-NE1 2.98Å; M317-W322 HydrophobicContact SD-CH2 4.46Å; M317-W322 HydrophobicContact SD-CZ2 3.96Å; M317-L476 HydrophobicContact SD-CD1 3.4Å; M317-L476 WeakPolarHBondContact SD-CD1 3.49Å; M317-L476 HydrophobicContact SD-CG 3.93Å; M317-V478 HydrophobicContact CE-CG2 4.42Å
318	V	90.2	Very high	88.2	Confident	26 Å²	26	46.8 Å²	46.8	16%	0.158	25%	0.252	C	S	.	.	H	α-helix	trans	-69.4	-40	179.4	165.9	0	0	0	0	112.2	K276 I277 M282 L314 E315 L316 L320	K276-V318 HydrophobicContact CB-CG1 3.59Å; K276-V318 HydrophobicContact CB-CG2 4.34Å; K276-V318 HydrophobicContact CD-CG1 4.09Å; K276-V318 HydrophobicContact CG-CG1 4.34Å; I277-V318 HydrophobicContact CB-CG2 4.49Å; I277-V318 HydrophobicContact CG1-CG2 3.48Å; I277-V318 VanDerWaalsContact CG1-CG2 3.48Å; M282-V318 HydrophobicContact CE-CB 4.44Å; M282-V318 HydrophobicContact CE-CG2 4.05Å; L314-V318 VanDerWaalsContact O-CG2 3.31Å; L314-V318 WeakPolarHBondContact O-CG2 3.37Å; L314-V318 PolarHBondContact O-N 3Å; E315-V318 PolarHBondContact O-N 3.24Å; L316-V318 VanDerWaalsContact C-N 3.25Å; L316-V318 PolarHBondContact O-N 3.08Å; V318-L320 VanDerWaalsContact C-N 3.33Å
319	E	89.8	Confident	87.9	Confident	97 Å²	97	53.3 Å²	53.3	45%	0.453	27%	0.266	S	S	.	.	H	α-helix	trans	-75.7	-21.9	-178.1	-72.5	179.4	-173.7	0	0	113.2	E315 L316 K430	E315-E319 WeakPolarHBondContact O-CG 3.46Å; E315-E319 PolarHBondContact O-N 2.89Å; L316-E319 PolarHBondContact O-N 3.03Å; E319-K430 HydrophobicContact CB-CG 4.39Å; E319-K430 WeakPolarHBondContact OE2-CE 3.12Å; E319-K430 IonicContact OE2-NZ 3.8Å; E319-K430 PolarHBondContact OE2-NZ 3.45Å
320	L	90.5	Very high	87.5	Confident	5 Å²	5	54.3 Å²	54.3	3%	0.026	27%	0.271	C	S	.	.	S	Bend	trans	-63.9	133.8	179.1	-76.5	170.9	0	0	0	112	L316 V318 W322 I426 L429 K430 L476 F480	L316-L320 HydrophobicContact CD1-CG 4.47Å; L316-L320 HydrophobicContact CG-CD1 4.32Å; L316-L320 VanDerWaalsContact O-CG 3.3Å; L316-L320 WeakPolarHBondContact O-CG 3.5Å; L316-L320 PolarHBondContact O-N 3.45Å; L316-L320 VanDerWaalsContact O-N 3.07Å; V318-L320 VanDerWaalsContact C-N 3.33Å; L320-W322 HydrophobicContact CB-CZ2 4.45Å; L320-W322 HydrophobicContact CD1-CZ2 4.36Å; L320-W322 PolarHBondContact O-N 3.35Å; L320-W322 PolarHBondContact O-NE1 3.41Å; L320-I426 HydrophobicContact CD1-CG2 4.07Å; L320-I426 HydrophobicContact CD2-CG2 3.82Å; L320-L429 HydrophobicContact CD2-CB 4.2Å; L320-K430 HydrophobicContact CD2-CB 4.43Å; L320-L476 HydrophobicContact CD1-CD1 3.58Å; L320-L476 HydrophobicContact CD1-CD2 4.39Å; L320-F480 HydrophobicContact CB-CE2 4.21Å
321	P	90.3	Very high	87.4	Confident	8 Å²	8	58.4 Å²	58.4	5%	0.052	29%	0.293	C	S	.	.			trans	-81.1	87.5	-177.8	32.4	-34.7	0	0	0	110.4	K324 G433 V434 N435	P321-K324 HydrophobicContact CB-CB 4.31Å; P321-G433 VanDerWaalsContact CB-C 3.46Å; P321-G433 WeakPolarHBondContact CB-O 3.42Å; P321-V434 WeakPolarHBondContact CG-O 3.48Å; P321-N435 WeakPolarHBondContact O-CB 3.44Å
322	W	87.6	Confident	87.3	Confident	25 Å²	25	57.9 Å²	57.9	10%	0.095	29%	0.294	C	S	.	.	S	Bend	trans	-69.1	-49.1	179.3	-60	92.8	0	0	0	112.5	M282 P283 A286 M317 L320 N435 L476 V478 F480	M282-W322 HydrophobicContact CB-CD2 4.42Å; M282-W322 HydrophobicContact CB-CG 4.27Å; M282-W322 HydrophobicContact CG-CD2 4.43Å; M282-W322 HydrophobicContact CG-CG 4.09Å; M282-W322 HydrophobicContact SD-CZ2 4.32Å; P283-W322 HydrophobicContact CG-CD2 4.41Å; P283-W322 HydrophobicContact CG-CE3 3.62Å; P283-W322 HydrophobicContact CG-CZ3 4.04Å; A286-W322 HydrophobicContact CB-CH2 3.7Å; A286-W322 HydrophobicContact CB-CZ2 3.94Å; A286-W322 HydrophobicContact CB-CZ3 4.08Å; M317-W322 HydrophobicContact CE-CH2 4.03Å; M317-W322 HydrophobicContact CE-CZ2 3.63Å; M317-W322 PolarHBondContact O-NE1 2.98Å; M317-W322 HydrophobicContact SD-CH2 4.46Å; M317-W322 HydrophobicContact SD-CZ2 3.96Å; L320-W322 HydrophobicContact CB-CZ2 4.45Å; L320-W322 HydrophobicContact CD1-CZ2 4.36Å; L320-W322 PolarHBondContact O-N 3.35Å; L320-W322 PolarHBondContact O-NE1 3.41Å; W322-N435 PolarHBondContact O-ND2 3.32Å; W322-L476 HydrophobicContact CH2-CD2 4.27Å; W322-V478 HydrophobicContact CH2-CG1 4.3Å; W322-F480 HydrophobicContact CD2-CE2 4.1Å; W322-F480 AromaticContact CE3-CD2 3.9Å; W322-F480 HydrophobicContact CE3-CD2 3.9Å; W322-F480 AromaticContact CE3-CE2 3.76Å; W322-F480 HydrophobicContact CE3-CE2 3.76Å; W322-F480 AromaticContact CH2-CD2 3.89Å; W322-F480 HydrophobicContact CH2-CD2 3.89Å; W322-F480 HydrophobicContact CH2-CE2 4.3Å; W322-F480 AromaticContact CZ3-CD2 3.54Å; W322-F480 HydrophobicContact CZ3-CD2 3.54Å; W322-F480 AromaticContact CZ3-CE2 3.89Å; W322-F480 HydrophobicContact CZ3-CE2 3.89Å
323	N	86.3	Confident	87.4	Confident	115 Å²	115	63.9 Å²	63.9	62%	0.615	31%	0.311	S	S	*	.	S	Bend	trans	-122.6	2.4	-175.7	-79.4	-17.8	0	0	0	114.4	S281 S325	S281-N323 PolarHBondContact O-ND2 2.95Å; N323-S325 PolarHBondContact O-N 3.49Å
324	K	86.4	Confident	87.3	Confident	140 Å²	140	66 Å²	66	61%	0.609	33%	0.329	S	S	*	.			trans	-85.5	114.1	-178.2	-171.7	177	168	-165.2	0	109.9	P321 G433 V434 N435	P321-K324 HydrophobicContact CB-CB 4.31Å; K324-G433 WeakPolarHBondContact CD-O 3.46Å; K324-V434 HydrophobicContact CG-CG1 4.35Å; K324-V434 CarbonylContact O-C 3.5Å; K324-V434 VanDerWaalsContact O-CA 3.28Å; K324-V434 WeakPolarHBondContact O-CA 3.3Å; K324-N435 PolarHBondContact O-N 3.47Å; K324-N435 PolarHBondContact O-OD1 2.98Å
325	S	87.3	Confident	87.1	Confident	75 Å²	75	66.3 Å²	66.3	52%	0.524	33%	0.331	S	S	.	.			trans	-123.9	152.2	-179.2	60.5	0	0	0	0	112.4	N323 N435	N323-S325 PolarHBondContact O-N 3.49Å; S325-N435 WeakPolarHBondContact CA-OD1 3.32Å; S325-N435 WeakPolarHBondContact CB-OD1 3.36Å
326	T	88.6	Confident	87.1	Confident	28 Å²	28	70.4 Å²	70.4	17%	0.172	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-83.9	153.6	168.7	51.8	0	0	0	0	111.2	E395 V434 N436	T326-E395 HydrophobicContact CG2-CG 4.3Å; T326-V434 HydrophobicContact CG2-CB 4.38Å; T326-V434 HydrophobicContact CG2-CG1 3.97Å; T326-V434 HydrophobicContact CG2-CG2 4.15Å; T326-N436 PolarHBondContact N-ND2 3.27Å; T326-N436 PolarHBondContact N-OD1 3.1Å; T326-N436 PolarHBondContact O-ND2 2.85Å; T326-N436 VanDerWaalsContact OG1-CG 3.3Å; T326-N436 PolarHBondContact OG1-ND2 3.45Å; T326-N436 VanDerWaalsContact OG1-ND2 3.12Å; T326-N436 PolarHBondContact OG1-OD1 3.2Å
327	T	84.8	Confident	87.2	Confident	123 Å²	123	75 Å²	75	76%	0.755	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-87	122.7	176.1	48	0	0	0	0	110.7
328	D	81.4	Confident	87.1	Confident	55 Å²	55	77 Å²	77	29%	0.294	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-73.2	131.5	-178	-71.8	-6	0	0	0	111.6	L330 R360 L392 R394	D328-L330 HydrophobicContact CB-CD2 4.33Å; D328-L330 HydrophobicContact CB-CG 4.22Å; D328-R360 IonicContact OD2-CZ 3.16Å; D328-R360 IonicContact OD2-NE 2.8Å; D328-R360 IonicContact OD2-NH2 3.09Å; D328-L392 WeakPolarHBondContact CA-O 3.33Å; D328-R394 VanDerWaalsContact CG-NH2 3.29Å; D328-R394 IonicContact OD1-CZ 3.49Å; D328-R394 VanDerWaalsContact OD1-CZ 3.3Å; D328-R394 IonicContact OD1-NE 2.84Å; D328-R394 PolarHBondContact OD1-NE 3.09Å; D328-R394 IonicContact OD1-NH2 3.81Å; D328-R394 PolarHBondContact OD1-NH2 2.85Å; D328-R394 IonicContact OD2-CZ 3.75Å; D328-R394 IonicContact OD2-NE 2.64Å; D328-R394 PolarHBondContact OD2-NE 3.43Å; D328-R394 IonicContact OD2-NH2 3.02Å; D328-R394 PolarHBondContact OD2-NH2 3.16Å
329	R	79.9	Confident	87	Confident	187 Å²	187	75.9 Å²	75.9	71%	0.706	37%	0.372	S	S	*	.			trans	-97.5	105.2	170.4	-65.4	-176.6	-178.1	-179.1	0.7	109.7	L392	R329-L392 PolarHBondContact N-O 3.19Å
330	L	76.9	Confident	86.9	Confident	49 Å²	49	74.9 Å²	74.9	26%	0.257	37%	0.369	S	S	.	.			trans	-103.4	37.4	-173.5	-60.1	172.6	0	0	0	113.3	D328 R360 Q361 L392	D328-L330 HydrophobicContact CB-CD2 4.33Å; D328-L330 HydrophobicContact CB-CG 4.22Å; L330-R360 HydrophobicContact CD2-CG 4.35Å; L330-Q361 HydrophobicContact CB-CG 4.46Å; L330-L392 HydrophobicContact CD2-CD2 4.22Å
331	D	85.9	Confident	86.8	Confident	90 Å²	90	80 Å²	80	48%	0.481	40%	0.396	S	S	.	.			trans	-90.1	110.2	174.8	-176.5	4.4	0	0	0	111.5	R333 A334 A335	D331-R333 VanDerWaalsContact C-N 3.33Å; D331-R333 PolarHBondContact O-N 3.43Å; D331-R333 PolarHBondContact OD1-N 3.13Å; D331-A334 HydrophobicContact CB-CB 4.01Å; D331-A334 WeakPolarHBondContact OD2-CB 3.11Å; D331-A335 VanDerWaalsContact O-CB 3.23Å; D331-A335 WeakPolarHBondContact O-CB 3.4Å; D331-A335 PolarHBondContact O-N 3.2Å
332	I	87.4	Confident	86.6	Confident	49 Å²	49	82 Å²	82	25%	0.251	41%	0.407	S	S	.	.	H	α-helix	trans	-65.4	-35.1	-179.8	-54.8	172.6	0	0	0	111.4	R336 L354 A358	I332-R336 PolarHBondContact O-N 2.89Å; I332-L354 HydrophobicContact CG2-CD2 4.01Å; I332-A358 HydrophobicContact CD1-CB 3.88Å
333	R	89.4	Confident	86.6	Confident	205 Å²	205	81.8 Å²	81.8	77%	0.774	41%	0.407	S	S	*	.	H	α-helix	trans	-71.2	-48.8	-178	-67.7	-176.4	-177.3	178.4	1.7	110.5	D331 A335 R336 I337	D331-R333 VanDerWaalsContact C-N 3.33Å; D331-R333 PolarHBondContact O-N 3.43Å; D331-R333 PolarHBondContact OD1-N 3.13Å; R333-A335 VanDerWaalsContact C-N 3.3Å; R333-A335 PolarHBondContact O-N 3.44Å; R333-R336 PolarHBondContact O-N 2.9Å; R333-I337 WeakPolarHBondContact O-CG1 3.47Å; R333-I337 PolarHBondContact O-N 2.99Å; R333-I337 VanDerWaalsContact O-N 3.16Å
334	A	88.5	Confident	86.5	Confident	49 Å²	49	79.8 Å²	79.8	41%	0.405	39%	0.391	S	S	.	.	H	α-helix	trans	-59.9	-42.1	173.8	0	0	0	0	0	111.5	D331 R336 I337 L338	D331-A334 HydrophobicContact CB-CB 4.01Å; D331-A334 WeakPolarHBondContact OD2-CB 3.11Å; A334-R336 VanDerWaalsContact C-N 3.35Å; A334-R336 PolarHBondContact O-N 2.98Å; A334-I337 PolarHBondContact O-N 2.91Å; A334-L338 WeakPolarHBondContact O-CB 3.16Å; A334-L338 PolarHBondContact O-N 3.23Å
335	A	87.9	Confident	86.2	Confident	5 Å²	5	74.1 Å²	74.1	4%	0.041	37%	0.371	C	S	.	.	H	α-helix	trans	-61	-40.8	177.1	0	0	0	0	0	112.5	D331 R333 L338 L339 L354 L357 T391	D331-A335 VanDerWaalsContact O-CB 3.23Å; D331-A335 WeakPolarHBondContact O-CB 3.4Å; D331-A335 PolarHBondContact O-N 3.2Å; R333-A335 VanDerWaalsContact C-N 3.3Å; R333-A335 PolarHBondContact O-N 3.44Å; A335-L338 PolarHBondContact O-N 2.74Å; A335-L339 WeakPolarHBondContact O-CB 3.45Å; A335-L339 VanDerWaalsContact O-CG 3.24Å; A335-L339 WeakPolarHBondContact O-CG 3.5Å; A335-L339 PolarHBondContact O-N 3.48Å; A335-L354 HydrophobicContact CB-CD2 4.1Å; A335-L357 HydrophobicContact CB-CD1 3.73Å; A335-T391 HydrophobicContact CB-CG2 4.14Å
336	R	90	Very high	86	Confident	141 Å²	141	71.7 Å²	71.7	53%	0.532	35%	0.351	S	S	.	.	H	α-helix	trans	-61.1	-50.8	175.9	-179.2	175.1	-67.7	-178.8	-1.3	111.5	I332 R333 A334 L338 L339 D340 L354	I332-R336 PolarHBondContact O-N 2.89Å; R333-R336 PolarHBondContact O-N 2.9Å; A334-R336 VanDerWaalsContact C-N 3.35Å; A334-R336 PolarHBondContact O-N 2.98Å; R336-L338 VanDerWaalsContact C-N 3.29Å; R336-L338 PolarHBondContact O-N 3.42Å; R336-L339 PolarHBondContact O-N 3.27Å; R336-D340 WeakPolarHBondContact CG-OD2 3.47Å; R336-D340 WeakPolarHBondContact O-CB 3.49Å; R336-D340 PolarHBondContact O-N 2.78Å; R336-L354 HydrophobicContact CB-CD1 4.13Å; R336-L354 HydrophobicContact CB-CD2 4.19Å; R336-L354 HydrophobicContact CG-CD1 4.23Å
337	I	90.9	Very high	85.7	Confident	104 Å²	104	78 Å²	78	53%	0.533	38%	0.379	S	S	.	.	H	α-helix	trans	-59.7	-43.3	-179.7	-64.9	166.7	0	0	0	110.6	R333 A334 D340 N341	R333-I337 WeakPolarHBondContact O-CG1 3.47Å; R333-I337 PolarHBondContact O-N 2.99Å; R333-I337 VanDerWaalsContact O-N 3.16Å; A334-I337 PolarHBondContact O-N 2.91Å; I337-D340 PolarHBondContact O-N 3.16Å; I337-N341 WeakPolarHBondContact O-CB 3.32Å; I337-N341 PolarHBondContact O-N 3.48Å; I337-N341 PolarHBondContact O-ND2 2.73Å
338	L	89	Confident	85.6	Confident	41 Å²	41	78.5 Å²	78.5	22%	0.215	37%	0.371	C	S	.	.	H	α-helix	trans	-66.3	-46.4	-179.5	-160.8	163.7	0	0	0	111.3	A334 A335 R336 D340 N341 D342 S387 K390 T391	A334-L338 WeakPolarHBondContact O-CB 3.16Å; A334-L338 PolarHBondContact O-N 3.23Å; A335-L338 PolarHBondContact O-N 2.74Å; R336-L338 VanDerWaalsContact C-N 3.29Å; R336-L338 PolarHBondContact O-N 3.42Å; L338-D340 VanDerWaalsContact C-N 3.29Å; L338-D340 PolarHBondContact O-N 3.26Å; L338-N341 PolarHBondContact O-N 3.11Å; L338-D342 WeakPolarHBondContact CD2-OD2 3.43Å; L338-D342 WeakPolarHBondContact O-CB 3.29Å; L338-D342 PolarHBondContact O-N 2.99Å; L338-S387 WeakPolarHBondContact CD2-OG 3.4Å; L338-K390 HydrophobicContact CD1-CG 4.32Å; L338-K390 HydrophobicContact CD2-CD 4.34Å; L338-T391 HydrophobicContact CB-CG2 3.95Å; L338-T391 HydrophobicContact CD1-CG2 4.03Å; L338-T391 HydrophobicContact CD2-CG2 3.81Å; L338-T391 HydrophobicContact CG-CG2 4.14Å
339	L	87.9	Confident	85.9	Confident	3 Å²	3	76.1 Å²	76.1	2%	0.016	36%	0.358	C	S	.	.	H	α-helix	trans	-62.5	-35.5	176.3	-72	168.7	0	0	0	112.5	A335 R336 H343 K350 V353 L354 T391	A335-L339 WeakPolarHBondContact O-CB 3.45Å; A335-L339 VanDerWaalsContact O-CG 3.24Å; A335-L339 WeakPolarHBondContact O-CG 3.5Å; A335-L339 PolarHBondContact O-N 3.48Å; R336-L339 PolarHBondContact O-N 3.27Å; L339-H343 PolarHBondContact O-N 3.45Å; L339-K350 HydrophobicContact CB-CG 4.46Å; L339-K350 VanDerWaalsContact O-CE 3.31Å; L339-K350 WeakPolarHBondContact O-CE 3.4Å; L339-V353 HydrophobicContact CD1-CB 4.43Å; L339-V353 HydrophobicContact CD1-CG1 3.88Å; L339-L354 HydrophobicContact CD1-CD2 4.28Å; L339-L354 HydrophobicContact CD1-CG 4.44Å; L339-T391 HydrophobicContact CD2-CG2 4.48Å; L339-T391 HydrophobicContact CG-CG2 4.18Å
340	D	88.3	Confident	86.3	Confident	75 Å²	75	68.2 Å²	68.2	40%	0.401	33%	0.329	S	S	.	.	H	α-helix	trans	-73.1	-32.9	176.9	-72.5	-29.5	0	0	0	113	R336 I337 L338 K350	R336-D340 WeakPolarHBondContact CG-OD2 3.47Å; R336-D340 WeakPolarHBondContact O-CB 3.49Å; R336-D340 PolarHBondContact O-N 2.78Å; I337-D340 PolarHBondContact O-N 3.16Å; L338-D340 VanDerWaalsContact C-N 3.29Å; L338-D340 PolarHBondContact O-N 3.26Å; D340-K350 VanDerWaalsContact OD1-CD 3.32Å; D340-K350 WeakPolarHBondContact OD1-CD 3.46Å; D340-K350 WeakPolarHBondContact OD1-CE 3.36Å; D340-K350 IonicContact OD1-NZ 2.78Å; D340-K350 PolarHBondContact OD1-NZ 2.97Å
341	N	88.5	Confident	86.9	Confident	112 Å²	112	74.3 Å²	74.3	60%	0.599	35%	0.348	S	S	*	.	H	α-helix	trans	-76.3	-35.4	175.7	-73.1	-17.7	0	0	0	113.1	I337 L338 H525	I337-N341 WeakPolarHBondContact O-CB 3.32Å; I337-N341 PolarHBondContact O-N 3.48Å; I337-N341 PolarHBondContact O-ND2 2.73Å; L338-N341 PolarHBondContact O-N 3.11Å; N341-H525 PolarHBondContact O-CE1 3.45Å
342	D	86.3	Confident	87	Confident	52 Å²	52	73.2 Å²	73.2	28%	0.278	34%	0.337	S	S	.	.	H	α-helix	trans	-80.9	-28.6	-178.3	-79.2	-4.6	0	0	0	112.4	L338 S387	L338-D342 WeakPolarHBondContact CD2-OD2 3.43Å; L338-D342 WeakPolarHBondContact O-CB 3.29Å; L338-D342 PolarHBondContact O-N 2.99Å; D342-S387 WeakPolarHBondContact OD2-CB 3.26Å; D342-S387 PolarHBondContact OD2-OG 2.94Å
343	H	86.3	Confident	86.9	Confident	19 Å²	19	71 Å²	71	9%	0.088	33%	0.326	C	S	.	.			trans	-137.4	123.8	-172.2	-67	99.8	0	0	0	112.3	L339 M346 K350 S383	L339-H343 PolarHBondContact O-N 3.45Å; H343-M346 HydrophobicContact CB-CE 3.64Å; H343-K350 VanDerWaalsContact O-CE 3.26Å; H343-K350 WeakPolarHBondContact O-CE 3.45Å; H343-K350 PolarHBondContact O-NZ 3.11Å; H343-S383 PolarHBondContact CE1-O 2.92Å; H343-S383 WeakPolarHBondContact NE2-CB 3.35Å; H343-S383 PolarHBondContact NE2-OG 3.24Å
344	Y	85.6	Confident	86.9	Confident	74 Å²	74	62 Å²	62	29%	0.29	29%	0.293	S	S	.	.	S	Bend	trans	-80.8	145.9	167.3	-167.6	-103.3	0	0	0	111.4	E517 E520 I521	Y344-E517 HydrophobicContact CD1-CB 4.43Å; Y344-E517 HydrophobicContact CD1-CG 4.48Å; Y344-E517 HydrophobicContact CE1-CB 4.26Å; Y344-E517 HydrophobicContact CE1-CG 4.01Å; Y344-E520 HydrophobicContact CD1-CB 3.95Å; Y344-E520 HydrophobicContact CD2-CB 4.44Å; Y344-E520 HydrophobicContact CE1-CB 3.74Å; Y344-E520 HydrophobicContact CE1-CG 4.19Å; Y344-E520 HydrophobicContact CE2-CB 4.25Å; Y344-E520 HydrophobicContact CE2-CG 4.43Å; Y344-E520 HydrophobicContact CG-CB 4.29Å; Y344-I521 HydrophobicContact CD1-CG1 4.11Å; Y344-I521 HydrophobicContact CG-CG1 4.38Å
345	A	79.7	Confident	86.9	Confident	21 Å²	21	62.8 Å²	62.8	17%	0.174	29%	0.288	C	S	.	.	S	Bend	trans	62.3	-155.2	-175.6	0	0	0	0	0	114.3	K350 E517	A345-K350 WeakPolarHBondContact O-CE 3.31Å; A345-K350 PolarHBondContact O-NZ 3.17Å; A345-E517 HydrophobicContact CB-CG 4.49Å
346	M	81.9	Confident	86.7	Confident	23 Å²	23	64.2 Å²	64.2	11%	0.113	29%	0.293	C	S	.	.			trans	64.3	41.2	178.5	-56.4	177.9	-78.8	0	0	115.5	H343 K348 L349 K350 V384 V510 Y513	H343-M346 HydrophobicContact CB-CE 3.64Å; M346-K348 VanDerWaalsContact C-N 3.34Å; M346-K348 PolarHBondContact O-N 3.33Å; M346-L349 HydrophobicContact CB-CB 4.29Å; M346-L349 PolarHBondContact O-N 3.38Å; M346-L349 VanDerWaalsContact O-N 3.1Å; M346-K350 WeakPolarHBondContact O-CG 3.24Å; M346-K350 PolarHBondContact O-N 2.9Å; M346-V384 HydrophobicContact CE-CG2 4.12Å; M346-V384 HydrophobicContact SD-CG2 4.22Å; M346-V510 HydrophobicContact CG-CG1 4.13Å; M346-V510 HydrophobicContact SD-CG1 3.78Å; M346-Y513 HydrophobicContact CG-CE1 4.4Å
347	E	82.8	Confident	86.3	Confident	162 Å²	162	57.9 Å²	57.9	76%	0.757	27%	0.269	S	S	*	.	H	α-helix	trans	-56	-43	-177.8	-63.7	-177.8	177.6	0	0	113.8	L349 K350 R351	E347-L349 VanDerWaalsContact C-N 3.3Å; E347-L349 PolarHBondContact O-N 2.96Å; E347-K350 PolarHBondContact O-N 3.47Å; E347-R351 VanDerWaalsContact O-CB 3.24Å; E347-R351 WeakPolarHBondContact O-CB 3.38Å; E347-R351 PolarHBondContact O-N 3.39Å
348	K	83.9	Confident	86.1	Confident	133 Å²	133	54.4 Å²	54.4	58%	0.578	26%	0.256	S	S	*	.	H	α-helix	trans	-57.8	-43.8	177.9	-67.4	-169.2	179.9	-170.1	0	111.5	M346 R352	M346-K348 VanDerWaalsContact C-N 3.34Å; M346-K348 PolarHBondContact O-N 3.33Å; K348-R352 WeakPolarHBondContact O-CB 3.47Å; K348-R352 PolarHBondContact O-N 3.28Å; K348-R352 VanDerWaalsContact O-N 3.14Å
349	L	87.3	Confident	85.9	Confident	5 Å²	5	55.8 Å²	55.8	3%	0.026	27%	0.267	C	S	.	.	H	α-helix	trans	-68.8	-48.7	178.9	-177.2	150	0	0	0	110.9	M346 E347 R351 R352 V353 F373 V384 I508 V510	M346-L349 HydrophobicContact CB-CB 4.29Å; M346-L349 PolarHBondContact O-N 3.38Å; M346-L349 VanDerWaalsContact O-N 3.1Å; E347-L349 VanDerWaalsContact C-N 3.3Å; E347-L349 PolarHBondContact O-N 2.96Å; L349-R351 VanDerWaalsContact C-N 3.33Å; L349-R351 PolarHBondContact O-N 3.28Å; L349-R352 PolarHBondContact O-N 3.25Å; L349-R352 VanDerWaalsContact O-N 3.09Å; L349-V353 HydrophobicContact CD2-CG2 3.86Å; L349-V353 HydrophobicContact CG-CG2 4.49Å; L349-V353 WeakPolarHBondContact O-CG2 3.32Å; L349-V353 PolarHBondContact O-N 2.91Å; L349-F373 HydrophobicContact CD1-CD1 3.7Å; L349-F373 HydrophobicContact CD1-CD2 4.38Å; L349-F373 HydrophobicContact CD1-CE1 3.75Å; L349-F373 HydrophobicContact CD1-CE2 4.42Å; L349-F373 HydrophobicContact CD1-CG 4.04Å; L349-F373 HydrophobicContact CD1-CZ 4.12Å; L349-F373 HydrophobicContact CG-CD1 4.48Å; L349-F373 HydrophobicContact CG-CE1 4.1Å; L349-F373 HydrophobicContact CG-CZ 4.47Å; L349-V384 HydrophobicContact CD1-CG1 4.05Å; L349-V384 HydrophobicContact CD2-CG1 3.35Å; L349-V384 HydrophobicContact CD2-CG2 4.46Å; L349-V384 HydrophobicContact CG-CG1 4.33Å; L349-I508 HydrophobicContact CB-CG2 4.08Å; L349-I508 HydrophobicContact CD1-CG2 4.28Å; L349-I508 HydrophobicContact CG-CG2 4.25Å; L349-V510 HydrophobicContact CD1-CG2 3.51Å
350	K	88.3	Confident	85.5	Confident	21 Å²	21	56.6 Å²	56.6	9%	0.091	27%	0.269	C	S	.	.	H	α-helix	trans	-59.9	-45.2	-179	-70.8	177.2	176.5	177.6	0	111.4	L339 D340 H343 A345 M346 E347 R352 V353 L354	L339-K350 HydrophobicContact CB-CG 4.46Å; L339-K350 VanDerWaalsContact O-CE 3.31Å; L339-K350 WeakPolarHBondContact O-CE 3.4Å; D340-K350 VanDerWaalsContact OD1-CD 3.32Å; D340-K350 WeakPolarHBondContact OD1-CD 3.46Å; D340-K350 WeakPolarHBondContact OD1-CE 3.36Å; D340-K350 IonicContact OD1-NZ 2.78Å; D340-K350 PolarHBondContact OD1-NZ 2.97Å; H343-K350 VanDerWaalsContact O-CE 3.26Å; H343-K350 WeakPolarHBondContact O-CE 3.45Å; H343-K350 PolarHBondContact O-NZ 3.11Å; A345-K350 WeakPolarHBondContact O-CE 3.31Å; A345-K350 PolarHBondContact O-NZ 3.17Å; M346-K350 WeakPolarHBondContact O-CG 3.24Å; M346-K350 PolarHBondContact O-N 2.9Å; E347-K350 PolarHBondContact O-N 3.47Å; K350-R352 VanDerWaalsContact C-N 3.29Å; K350-R352 PolarHBondContact O-N 3.23Å; K350-V353 PolarHBondContact O-N 3.03Å; K350-L354 VanDerWaalsContact O-CG 3.27Å; K350-L354 WeakPolarHBondContact O-CG 3.49Å; K350-L354 PolarHBondContact O-N 3.44Å
351	R	89.1	Confident	85.2	Confident	176 Å²	176	58 Å²	58	66%	0.664	27%	0.274	S	S	*	.	H	α-helix	trans	-55.6	-46.5	174	179.4	177.9	172.1	165.6	2.9	110.8	E347 L349 L354 E355	E347-R351 VanDerWaalsContact O-CB 3.24Å; E347-R351 WeakPolarHBondContact O-CB 3.38Å; E347-R351 PolarHBondContact O-N 3.39Å; L349-R351 VanDerWaalsContact C-N 3.33Å; L349-R351 PolarHBondContact O-N 3.28Å; R351-L354 PolarHBondContact O-N 2.96Å; R351-E355 WeakPolarHBondContact CG-OE1 3.21Å; R351-E355 IonicContact CZ-OE1 2.73Å; R351-E355 IonicContact NE-OE1 3.91Å; R351-E355 PolarHBondContact NE-OE1 2.79Å; R351-E355 IonicContact NH2-OE1 3.48Å; R351-E355 WeakPolarHBondContact O-CG 3.35Å; R351-E355 PolarHBondContact O-N 3.42Å
352	R	87.5	Confident	85	Confident	68 Å²	68	60.1 Å²	60.1	26%	0.257	28%	0.284	S	S	.	.	H	α-helix	trans	-68.1	-39.2	-178.3	-171.6	55.5	-175	158.8	1.2	113.4	K348 L349 K350 L354 E355 Y356 E506 I508	K348-R352 WeakPolarHBondContact O-CB 3.47Å; K348-R352 PolarHBondContact O-N 3.28Å; K348-R352 VanDerWaalsContact O-N 3.14Å; L349-R352 PolarHBondContact O-N 3.25Å; L349-R352 VanDerWaalsContact O-N 3.09Å; K350-R352 VanDerWaalsContact C-N 3.29Å; K350-R352 PolarHBondContact O-N 3.23Å; R352-L354 VanDerWaalsContact C-N 3.32Å; R352-L354 PolarHBondContact O-N 3.3Å; R352-E355 VanDerWaalsContact CD-OE2 3.26Å; R352-E355 WeakPolarHBondContact CD-OE2 3.18Å; R352-E355 IonicContact CZ-OE2 2.79Å; R352-E355 IonicContact NE-OE2 3.27Å; R352-E355 IonicContact NH1-OE2 3.72Å; R352-E355 PolarHBondContact NH1-OE2 2.69Å; R352-E355 WeakPolarHBondContact O-CB 3.26Å; R352-E355 PolarHBondContact O-N 3.39Å; R352-Y356 PolarHBondContact O-N 2.74Å; R352-E506 IonicContact CZ-OE1 3.85Å; R352-E506 IonicContact CZ-OE2 2.77Å; R352-E506 VanDerWaalsContact NE-CD 3.35Å; R352-E506 IonicContact NE-OE1 3.89Å; R352-E506 PolarHBondContact NE-OE1 3.04Å; R352-E506 IonicContact NE-OE2 2.71Å; R352-E506 PolarHBondContact NE-OE2 2.85Å; R352-E506 VanDerWaalsContact NH2-CD 3.29Å; R352-E506 IonicContact NH2-OE1 2.74Å; R352-E506 PolarHBondContact NH2-OE1 3.3Å; R352-E506 VanDerWaalsContact NH2-OE1 3.09Å; R352-E506 IonicContact NH2-OE2 3.03Å; R352-E506 PolarHBondContact NH2-OE2 3.37Å; R352-I508 HydrophobicContact CB-CD1 4.14Å; R352-I508 HydrophobicContact CG-CD1 3.63Å; R352-I508 HydrophobicContact CG-CG1 4.22Å
353	V	85.8	Confident	84.7	Confident	1 Å²	1	63.6 Å²	63.6	1%	0.006	30%	0.297	C	S	.	.	H	α-helix	trans	-60.7	-43.4	172.5	170.4	0	0	0	0	110.6	L339 L349 K350 Y356 L357 V388	L339-V353 HydrophobicContact CD1-CB 4.43Å; L339-V353 HydrophobicContact CD1-CG1 3.88Å; L349-V353 HydrophobicContact CD2-CG2 3.86Å; L349-V353 HydrophobicContact CG-CG2 4.49Å; L349-V353 WeakPolarHBondContact O-CG2 3.32Å; L349-V353 PolarHBondContact O-N 2.91Å; K350-V353 PolarHBondContact O-N 3.03Å; V353-Y356 WeakPolarHBondContact O-CB 3.38Å; V353-Y356 PolarHBondContact O-N 3.19Å; V353-L357 HydrophobicContact CG1-CD1 4.34Å; V353-L357 WeakPolarHBondContact O-CG 3.44Å; V353-L357 PolarHBondContact O-N 2.95Å; V353-V388 HydrophobicContact CG1-CG2 3.81Å; V353-V388 HydrophobicContact CG2-CG2 4.08Å
354	L	88.8	Confident	83.7	Confident	17 Å²	17	68.9 Å²	68.9	9%	0.089	33%	0.326	C	S	.	.	H	α-helix	trans	-65.3	-38.8	176.6	-67.8	171.6	0	0	0	112.2	I332 A335 R336 L339 K350 R351 R352 Y356 L357 A358	I332-L354 HydrophobicContact CG2-CD2 4.01Å; A335-L354 HydrophobicContact CB-CD2 4.1Å; R336-L354 HydrophobicContact CB-CD1 4.13Å; R336-L354 HydrophobicContact CB-CD2 4.19Å; R336-L354 HydrophobicContact CG-CD1 4.23Å; L339-L354 HydrophobicContact CD1-CD2 4.28Å; L339-L354 HydrophobicContact CD1-CG 4.44Å; K350-L354 VanDerWaalsContact O-CG 3.27Å; K350-L354 WeakPolarHBondContact O-CG 3.49Å; K350-L354 PolarHBondContact O-N 3.44Å; R351-L354 PolarHBondContact O-N 2.96Å; R352-L354 VanDerWaalsContact C-N 3.32Å; R352-L354 PolarHBondContact O-N 3.3Å; L354-Y356 VanDerWaalsContact C-N 3.35Å; L354-L357 HydrophobicContact CD2-CD1 4.45Å; L354-L357 PolarHBondContact O-N 2.91Å; L354-A358 WeakPolarHBondContact O-CB 3.43Å; L354-A358 PolarHBondContact O-N 3.25Å
355	E	88.3	Confident	82.8	Confident	66 Å²	66	70.6 Å²	70.6	31%	0.308	34%	0.34	S	S	.	.	H	α-helix	trans	-60.8	-44.3	172.7	-72.9	169.1	-170.9	0	0	111.1	R351 R352 L357 A358 V359	R351-E355 WeakPolarHBondContact CG-OE1 3.21Å; R351-E355 IonicContact CZ-OE1 2.73Å; R351-E355 IonicContact NE-OE1 3.91Å; R351-E355 PolarHBondContact NE-OE1 2.79Å; R351-E355 IonicContact NH2-OE1 3.48Å; R351-E355 WeakPolarHBondContact O-CG 3.35Å; R351-E355 PolarHBondContact O-N 3.42Å; R352-E355 VanDerWaalsContact CD-OE2 3.26Å; R352-E355 WeakPolarHBondContact CD-OE2 3.18Å; R352-E355 IonicContact CZ-OE2 2.79Å; R352-E355 IonicContact NE-OE2 3.27Å; R352-E355 IonicContact NH1-OE2 3.72Å; R352-E355 PolarHBondContact NH1-OE2 2.69Å; R352-E355 WeakPolarHBondContact O-CB 3.26Å; R352-E355 PolarHBondContact O-N 3.39Å; E355-L357 PolarHBondContact O-N 3.49Å; E355-A358 PolarHBondContact O-N 3.3Å; E355-V359 WeakPolarHBondContact O-CG2 3.37Å; E355-V359 PolarHBondContact O-N 2.84Å
356	Y	83.8	Confident	82	Confident	34 Å²	34	72.1 Å²	72.1	13%	0.133	35%	0.345	C	S	.	.	H	α-helix	trans	-59.1	-46.4	175.2	177.9	-92.4	0	0	0	112	R352 V353 L354 A358 V359 R360 L366 L371 L486	R352-Y356 PolarHBondContact O-N 2.74Å; V353-Y356 WeakPolarHBondContact O-CB 3.38Å; V353-Y356 PolarHBondContact O-N 3.19Å; L354-Y356 VanDerWaalsContact C-N 3.35Å; Y356-A358 VanDerWaalsContact C-N 3.34Å; Y356-A358 PolarHBondContact O-N 3.08Å; Y356-V359 PolarHBondContact O-N 3.24Å; Y356-R360 WeakPolarHBondContact O-CB 3.36Å; Y356-R360 PolarHBondContact O-N 3.24Å; Y356-L366 HydrophobicContact CE2-CD1 4.15Å; Y356-L371 HydrophobicContact CD2-CD1 4.45Å; Y356-L371 HydrophobicContact CG-CD1 4.32Å; Y356-L486 HydrophobicContact CE1-CD1 4.16Å; Y356-L486 HydrophobicContact CE1-CD2 4.14Å; Y356-L486 WeakPolarHBondContact OH-CD1 3.47Å
357	L	82.8	Confident	81.1	Confident	8 Å²	8	78.4 Å²	78.4	4%	0.042	37%	0.371	C	S	.	.	H	α-helix	trans	-61.8	-40.7	176.3	-68.5	175.2	0	0	0	112.3	A335 V353 L354 E355 R360 Q361 L392	A335-L357 HydrophobicContact CB-CD1 3.73Å; V353-L357 HydrophobicContact CG1-CD1 4.34Å; V353-L357 WeakPolarHBondContact O-CG 3.44Å; V353-L357 PolarHBondContact O-N 2.95Å; L354-L357 HydrophobicContact CD2-CD1 4.45Å; L354-L357 PolarHBondContact O-N 2.91Å; E355-L357 PolarHBondContact O-N 3.49Å; L357-R360 WeakPolarHBondContact O-CB 3.27Å; L357-R360 PolarHBondContact O-N 2.75Å; L357-Q361 PolarHBondContact O-N 2.65Å; L357-L392 HydrophobicContact CD2-CD1 4.43Å; L357-L392 HydrophobicContact CD2-CD2 3.29Å; L357-L392 HydrophobicContact CD2-CG 3.85Å
358	A	86.6	Confident	80.2	Confident	31 Å²	31	71.9 Å²	71.9	26%	0.256	35%	0.347	S	S	.	.	H	α-helix	trans	-64.4	-44.1	178.4	0	0	0	0	0	111.9	I332 L354 E355 Y356 R360 Q361 L362	I332-A358 HydrophobicContact CD1-CB 3.88Å; L354-A358 WeakPolarHBondContact O-CB 3.43Å; L354-A358 PolarHBondContact O-N 3.25Å; E355-A358 PolarHBondContact O-N 3.3Å; Y356-A358 VanDerWaalsContact C-N 3.34Å; Y356-A358 PolarHBondContact O-N 3.08Å; A358-R360 VanDerWaalsContact C-N 3.27Å; A358-R360 PolarHBondContact O-N 3.08Å; A358-Q361 WeakPolarHBondContact O-CB 3.39Å; A358-Q361 PolarHBondContact O-N 3.08Å; A358-L362 WeakPolarHBondContact O-CG 3.36Å; A358-L362 PolarHBondContact O-N 3.46Å
359	V	84.9	Confident	79.6	Confident	71 Å²	71	68.9 Å²	68.9	43%	0.43	34%	0.342	S	S	.	.	H	α-helix	trans	-65.3	-35.9	176.5	-175.9	0	0	0	0	110.7	E355 Y356 Q361 L362 K363 L366	E355-V359 WeakPolarHBondContact O-CG2 3.37Å; E355-V359 PolarHBondContact O-N 2.84Å; Y356-V359 PolarHBondContact O-N 3.24Å; V359-Q361 VanDerWaalsContact C-N 3.35Å; V359-L362 PolarHBondContact O-N 3.26Å; V359-K363 PolarHBondContact O-N 3.15Å; V359-L366 HydrophobicContact CB-CD1 4.45Å; V359-L366 HydrophobicContact CG1-CD1 4.34Å; V359-L366 HydrophobicContact CG1-CD2 3.65Å; V359-L366 HydrophobicContact CG1-CG 4.35Å
360	R	80	Confident	79.5	Confident	20 Å²	20	69.5 Å²	69.5	8%	0.075	35%	0.345	C	S	.	.	H	α-helix	trans	-65.4	-38.1	176.5	-167.8	178.7	-171.9	148.1	26.7	112.7	D328 L330 Y356 L357 A358 L362 K363 L366 R394	D328-R360 IonicContact OD2-CZ 3.16Å; D328-R360 IonicContact OD2-NE 2.8Å; D328-R360 IonicContact OD2-NH2 3.09Å; L330-R360 HydrophobicContact CD2-CG 4.35Å; Y356-R360 WeakPolarHBondContact O-CB 3.36Å; Y356-R360 PolarHBondContact O-N 3.24Å; L357-R360 WeakPolarHBondContact O-CB 3.27Å; L357-R360 PolarHBondContact O-N 2.75Å; A358-R360 VanDerWaalsContact C-N 3.27Å; A358-R360 PolarHBondContact O-N 3.08Å; R360-L362 PolarHBondContact O-N 2.62Å; R360-K363 CarbonylContact O-C 3.59Å; R360-K363 VanDerWaalsContact O-C 3.23Å; R360-K363 PolarHBondContact O-N 3.27Å; R360-K363 VanDerWaalsContact O-O 3.06Å; R360-L366 VanDerWaalsContact CA-CD1 3.49Å; R360-L366 HydrophobicContact CB-CD1 3.61Å; R360-L366 HydrophobicContact CG-CD1 4.08Å; R360-R394 VanDerWaalsContact NH2-NH1 3.19Å
361	Q	81.9	Confident	79.6	Confident	105 Å²	105	68.7 Å²	68.7	49%	0.491	34%	0.341	S	S	.	.	H	α-helix	trans	-62.8	-32.8	174.2	-169.3	179.9	10.7	0	0	112	L330 L357 A358 V359	L330-Q361 HydrophobicContact CB-CG 4.46Å; L357-Q361 PolarHBondContact O-N 2.65Å; A358-Q361 WeakPolarHBondContact O-CB 3.39Å; A358-Q361 PolarHBondContact O-N 3.08Å; V359-Q361 VanDerWaalsContact C-N 3.35Å
362	L	84.5	Confident	79.7	Confident	155 Å²	155	60.3 Å²	60.3	81%	0.812	31%	0.31	S	S	*	.	H	α-helix	trans	-80.2	-31.6	176.4	-64.7	173.7	0	0	0	112.9	A358 V359 R360	A358-L362 WeakPolarHBondContact O-CG 3.36Å; A358-L362 PolarHBondContact O-N 3.46Å; V359-L362 PolarHBondContact O-N 3.26Å; R360-L362 PolarHBondContact O-N 2.62Å
363	K	78.6	Confident	80	Confident	126 Å²	126	57 Å²	57	55%	0.548	30%	0.297	S	S	.	.			trans	-137.9	111	-177.5	-168.3	-179.9	-176.8	-179.2	0	111.4	V359 R360 N365	V359-K363 PolarHBondContact O-N 3.15Å; R360-K363 CarbonylContact O-C 3.59Å; R360-K363 VanDerWaalsContact O-C 3.23Å; R360-K363 PolarHBondContact O-N 3.27Å; R360-K363 VanDerWaalsContact O-O 3.06Å; K363-N365 VanDerWaalsContact C-N 3.27Å; K363-N365 WeakPolarHBondContact CD-O 3.03Å; K363-N365 WeakPolarHBondContact CE-O 3.46Å; K363-N365 PolarHBondContact O-N 3.37Å
364	N	65.8	Low	80.2	Confident	130 Å²	130	57.6 Å²	57.6	70%	0.695	30%	0.301	S	S	*	.	S	Bend	trans	-61.2	-31	-179.6	-70.5	-7.7	0	0	0	113.7
365	N	65.8	Low	80.1	Confident	110 Å²	110	57.2 Å²	57.2	59%	0.588	30%	0.301	S	S	*	.	S	Bend	trans	-109.2	90.6	176.9	-80	-11	0	0	0	111	K363 K367	K363-N365 VanDerWaalsContact C-N 3.27Å; K363-N365 WeakPolarHBondContact CD-O 3.03Å; K363-N365 WeakPolarHBondContact CE-O 3.46Å; K363-N365 PolarHBondContact O-N 3.37Å; N365-K367 PolarHBondContact O-N 3.21Å
366	L	62.8	Low	79.9	Confident	53 Å²	53	54.7 Å²	54.7	28%	0.277	29%	0.29	S	S	.	.			trans	-85.7	105.9	173.1	-95.5	167.3	0	0	0	110.4	Y356 V359 R360 G368	Y356-L366 HydrophobicContact CE2-CD1 4.15Å; V359-L366 HydrophobicContact CB-CD1 4.45Å; V359-L366 HydrophobicContact CG1-CD1 4.34Å; V359-L366 HydrophobicContact CG1-CD2 3.65Å; V359-L366 HydrophobicContact CG1-CG 4.35Å; R360-L366 VanDerWaalsContact CA-CD1 3.49Å; R360-L366 HydrophobicContact CB-CD1 3.61Å; R360-L366 HydrophobicContact CG-CD1 4.08Å; L366-G368 PolarHBondContact O-N 3.31Å
367	K	64.8	Low	80	Confident	154 Å²	154	55.5 Å²	55.5	67%	0.67	30%	0.3	S	S	*	.			trans	-82.5	70.4	155.9	-65	-170.7	175.6	-166	0	107.8	N365 P465	N365-K367 PolarHBondContact O-N 3.21Å; K367-P465 HydrophobicContact CB-CB 4.26Å; K367-P465 HydrophobicContact CD-CB 4.47Å; K367-P465 HydrophobicContact CG-CB 4.17Å
368	G	63.4	Low	80.2	Confident	25 Å²	25	56.4 Å²	56.4	26%	0.258	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-103.3	158.3	-177.1	0	0	0	0	0	112.2	L366	L366-G368 PolarHBondContact O-N 3.31Å
369	P	71.8	Confident	80.2	Confident	70 Å²	70	55 Å²	55	46%	0.455	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-63.4	151.5	172.9	29.2	-34.7	0	0	0	110.9	E506	P369-E506 HydrophobicContact CB-CB 4.14Å; P369-E506 HydrophobicContact CG-CB 4.16Å
370	I	85	Confident	80.2	Confident	18 Å²	18	52.7 Å²	52.7	9%	0.092	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	133	-178.1	-66.8	140.7	0	0	0	109.7	C372 L463 F487 A489 R504 M505 E506	I370-C372 PolarHBondContact O-N 2.91Å; I370-L463 HydrophobicContact CD1-CB 3.52Å; I370-L463 HydrophobicContact CD1-CD1 4.12Å; I370-L463 HydrophobicContact CD1-CD2 3.68Å; I370-L463 HydrophobicContact CD1-CG 3.94Å; I370-L463 HydrophobicContact CG1-CD2 4.3Å; I370-F487 HydrophobicContact CG2-CB 4.24Å; I370-A489 HydrophobicContact CG2-CB 4.5Å; I370-R504 PolarHBondContact N-O 3.26Å; I370-M505 HydrophobicContact CB-CG 4.31Å; I370-M505 HydrophobicContact CG2-CG 4.47Å; I370-M505 CarbonylContact O-C 3.54Å; I370-M505 WeakPolarHBondContact O-CA 3.47Å; I370-E506 PolarHBondContact O-N 3.22Å
371	L	89.6	Confident	80.7	Confident	4 Å²	4	52.3 Å²	52.3	2%	0.021	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	120.4	177.8	-58.3	177.5	0	0	0	109.8	Y356 F373 A489 I508	Y356-L371 HydrophobicContact CD2-CD1 4.45Å; Y356-L371 HydrophobicContact CG-CD1 4.32Å; L371-F373 HydrophobicContact CB-CE1 4.28Å; L371-A489 PolarHBondContact O-N 3.19Å; L371-I508 HydrophobicContact CD2-CD1 3.98Å
372	C	91.9	Very high	81	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	111.7	176.1	-174.5	0	0	0	0	110.7	I370 A489 M505 E506 I508	I370-C372 PolarHBondContact O-N 2.91Å; C372-A489 CarbonylContact C-O 3.55Å; C372-A489 WeakPolarHBondContact CA-O 3.04Å; C372-A489 HydrophobicContact CB-CB 4.14Å; C372-M505 HydrophobicContact CB-CB 3.95Å; C372-M505 HydrophobicContact CB-CG 4.23Å; C372-M505 HydrophobicContact CB-SD 4Å; C372-E506 PolarHBondContact N-O 2.84Å; C372-I508 PolarHBondContact O-N 2.96Å
373	F	92.8	Very high	81.2	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	114.8	177.2	-54.7	-32.5	0	0	0	110.5	L349 L371 K381 V384 I488 A489 T490 A491 I508 V510	L349-F373 HydrophobicContact CD1-CD1 3.7Å; L349-F373 HydrophobicContact CD1-CD2 4.38Å; L349-F373 HydrophobicContact CD1-CE1 3.75Å; L349-F373 HydrophobicContact CD1-CE2 4.42Å; L349-F373 HydrophobicContact CD1-CG 4.04Å; L349-F373 HydrophobicContact CD1-CZ 4.12Å; L349-F373 HydrophobicContact CG-CD1 4.48Å; L349-F373 HydrophobicContact CG-CE1 4.1Å; L349-F373 HydrophobicContact CG-CZ 4.47Å; L371-F373 HydrophobicContact CB-CE1 4.28Å; F373-K381 HydrophobicContact CB-CB 4.41Å; F373-K381 HydrophobicContact CB-CD 4.25Å; F373-K381 HydrophobicContact CB-CG 4.42Å; F373-V384 HydrophobicContact CE2-CB 4.45Å; F373-V384 HydrophobicContact CE2-CG1 3.79Å; F373-V384 HydrophobicContact CZ-CG1 4.12Å; F373-I488 HydrophobicContact CD2-CG2 3.87Å; F373-I488 HydrophobicContact CE2-CG2 3.48Å; F373-I488 VanDerWaalsContact CE2-CG2 3.48Å; F373-I488 HydrophobicContact CZ-CG2 3.97Å; F373-A489 PolarHBondContact N-O 2.69Å; F373-T490 HydrophobicContact CB-CG2 4.29Å; F373-T490 HydrophobicContact CD2-CG2 4.24Å; F373-T490 WeakPolarHBondContact O-CA 3.45Å; F373-A491 PolarHBondContact O-N 3.33Å; F373-I508 HydrophobicContact CD1-CB 4.09Å; F373-I508 HydrophobicContact CD1-CD1 4.11Å; F373-I508 HydrophobicContact CD1-CG2 4.43Å; F373-I508 HydrophobicContact CE1-CD1 3.78Å; F373-V510 HydrophobicContact CB-CG2 4.45Å
374	V	90.1	Very high	81.7	Confident	13 Å²	13	38.3 Å²	38.3	8%	0.079	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	132.6	-179.4	-173.8	0	0	0	0	110.3	A491 T494 I507 I508 Q509 V510	V374-A491 WeakPolarHBondContact CA-O 3.29Å; V374-A491 HydrophobicContact CG2-CB 4.26Å; V374-T494 HydrophobicContact CB-CG2 4.49Å; V374-T494 HydrophobicContact CG1-CG2 4.02Å; V374-T494 HydrophobicContact CG2-CG2 4.08Å; V374-I507 HydrophobicContact CB-CG2 4.31Å; V374-I507 HydrophobicContact CG2-CG2 3.76Å; V374-I508 PolarHBondContact N-O 2.75Å; V374-Q509 CarbonylContact O-C 3.58Å; V374-Q509 WeakPolarHBondContact O-CA 3.26Å; V374-V510 PolarHBondContact O-N 3.06Å
375	G	87.3	Confident	82.8	Confident	8 Å²	8	32.1 Å²	32.1	8%	0.082	20%	0.196	C	C	.	.			trans	174.9	177.7	176.1	0	0	0	0	0	113.3	K381 A491 N492 V510	G375-K381 PolarHBondContact O-NZ 3.14Å; G375-A491 PolarHBondContact N-O 3.03Å; G375-N492 VanDerWaalsContact O-CA 3.24Å; G375-N492 WeakPolarHBondContact O-CA 3.3Å; G375-N492 PolarHBondContact O-OD1 3.1Å; G375-V510 VanDerWaalsContact CA-O 3.31Å; G375-V510 WeakPolarHBondContact CA-O 3.49Å
376	P	83.6	Confident	84	Confident	13 Å²	13	34.4 Å²	34.4	8%	0.084	20%	0.196	C	C	.	.			trans	-64	162.2	178.3	23.2	-27.6	0	0	0	112.2	V379 K381 V510 A559	P376-V379 HydrophobicContact CG-CG1 3.75Å; P376-V379 VanDerWaalsContact O-CG2 3.29Å; P376-V379 WeakPolarHBondContact O-CG2 3.48Å; P376-K381 PolarHBondContact O-NZ 3.37Å; P376-V510 WeakPolarHBondContact CD-O 2.96Å; P376-A559 HydrophobicContact CB-CB 3.98Å; P376-A559 HydrophobicContact CG-CB 3.75Å
377	P	86.5	Confident	85.3	Confident	52 Å²	52	32 Å²	32	34%	0.338	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	145.3	177.3	27.1	-34.4	0	0	0	111.4	L665	P377-L665 HydrophobicContact CG-CD2 4.3Å
378	G	85.9	Confident	86.4	Confident	26 Å²	26	24.8 Å²	24.8	27%	0.268	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.1	13.2	175.8	0	0	0	0	0	115.8	G380 G560 V561	G378-G380 VanDerWaalsContact C-N 3.3Å; G378-G560 WeakPolarHBondContact O-CA 3.44Å; G378-V561 WeakPolarHBondContact O-CG2 3.43Å; G378-V561 PolarHBondContact O-N 2.86Å
379	V	86.6	Confident	87.7	Confident	1 Å²	1	23.6 Å²	23.6	1%	0.006	14%	0.141	C	C	.	.	S	Bend	trans	-88.5	14.8	172.3	-57.1	0	0	0	0	113.9	P376 K381 V510 Y513	P376-V379 HydrophobicContact CG-CG1 3.75Å; P376-V379 VanDerWaalsContact O-CG2 3.29Å; P376-V379 WeakPolarHBondContact O-CG2 3.48Å; V379-K381 HydrophobicContact CG2-CD 4.12Å; V379-K381 HydrophobicContact CG2-CG 3.55Å; V379-K381 PolarHBondContact O-N 3.02Å; V379-V510 HydrophobicContact CB-CG1 4.09Å; V379-V510 HydrophobicContact CG2-CB 4.19Å; V379-V510 HydrophobicContact CG2-CG1 3.7Å; V379-Y513 HydrophobicContact CB-CE2 4.15Å; V379-Y513 HydrophobicContact CG1-CE2 4.37Å; V379-Y513 PolarHBondContact O-OH 3.33Å
380	G	86.6	Confident	88.6	Confident	23 Å²	23	26.6 Å²	26.6	24%	0.237	15%	0.147	C	C	.	.	S	Bend	trans	77	13.4	174.9	0	0	0	0	0	116.8	G378 T382 S383 V384	G378-G380 VanDerWaalsContact C-N 3.3Å; G380-T382 VanDerWaalsContact C-N 3.29Å; G380-T382 PolarHBondContact O-N 3.35Å; G380-S383 WeakPolarHBondContact CA-OG 3.49Å; G380-S383 WeakPolarHBondContact O-CA 3.35Å; G380-S383 PolarHBondContact O-N 3.02Å; G380-S383 PolarHBondContact O-OG 2.88Å; G380-V384 PolarHBondContact O-N 3.17Å
381	K	89	Confident	88.7	Confident	12 Å²	12	26.4 Å²	26.4	5%	0.052	15%	0.146	C	C	.	.	H	α-helix	trans	-48.1	-47.2	178.6	-54.8	-171.9	-70	-103.5	0	113.4	F373 G375 P376 V379 S383 V384 G385 T490 A491 N492	F373-K381 HydrophobicContact CB-CB 4.41Å; F373-K381 HydrophobicContact CB-CD 4.25Å; F373-K381 HydrophobicContact CB-CG 4.42Å; G375-K381 PolarHBondContact O-NZ 3.14Å; P376-K381 PolarHBondContact O-NZ 3.37Å; V379-K381 HydrophobicContact CG2-CD 4.12Å; V379-K381 HydrophobicContact CG2-CG 3.55Å; V379-K381 PolarHBondContact O-N 3.02Å; K381-S383 PolarHBondContact O-N 3.03Å; K381-V384 PolarHBondContact O-N 2.63Å; K381-G385 PolarHBondContact O-N 2.89Å; K381-T490 HydrophobicContact CB-CG2 4Å; K381-A491 VanDerWaalsContact CE-O 3.31Å; K381-A491 WeakPolarHBondContact CE-O 3.4Å; K381-A491 PolarHBondContact NZ-O 3.28Å; K381-N492 PolarHBondContact NZ-OD1 3.49Å
382	T	88.9	Confident	88.5	Confident	41 Å²	41	26.2 Å²	26.2	25%	0.252	15%	0.145	S	C	.	.	H	α-helix	trans	-64.7	-38.4	177.6	-40.1	0	0	0	0	112.6	G380 V384 G385 R386 L440	G380-T382 VanDerWaalsContact C-N 3.29Å; G380-T382 PolarHBondContact O-N 3.35Å; T382-V384 VanDerWaalsContact C-N 3.35Å; T382-G385 PolarHBondContact O-N 2.9Å; T382-R386 PolarHBondContact O-N 2.84Å; T382-L440 HydrophobicContact CG2-CD2 3.47Å; T382-L440 VanDerWaalsContact CG2-CD2 3.47Å
383	S	88.9	Confident	88.3	Confident	50 Å²	50	27.7 Å²	27.7	35%	0.35	16%	0.161	S	C	.	.	H	α-helix	trans	-70.2	-33.2	178.9	61.8	0	0	0	0	112.4	H343 G380 K381 R386 S387	H343-S383 PolarHBondContact CE1-O 2.92Å; H343-S383 WeakPolarHBondContact NE2-CB 3.35Å; H343-S383 PolarHBondContact NE2-OG 3.24Å; G380-S383 WeakPolarHBondContact CA-OG 3.49Å; G380-S383 WeakPolarHBondContact O-CA 3.35Å; G380-S383 PolarHBondContact O-N 3.02Å; G380-S383 PolarHBondContact O-OG 2.88Å; K381-S383 PolarHBondContact O-N 3.03Å; S383-R386 WeakPolarHBondContact O-CB 3.46Å; S383-R386 PolarHBondContact O-N 3.41Å; S383-S387 PolarHBondContact O-N 2.84Å
384	V	88.1	Confident	88.2	Confident	2 Å²	2	28.3 Å²	28.3	1%	0.012	16%	0.163	C	C	.	.	H	α-helix	trans	-62.7	-47.4	173.4	169.6	0	0	0	0	110.3	M346 L349 F373 G380 K381 T382 R386 S387 V388	M346-V384 HydrophobicContact CE-CG2 4.12Å; M346-V384 HydrophobicContact SD-CG2 4.22Å; L349-V384 HydrophobicContact CD1-CG1 4.05Å; L349-V384 HydrophobicContact CD2-CG1 3.35Å; L349-V384 HydrophobicContact CD2-CG2 4.46Å; L349-V384 HydrophobicContact CG-CG1 4.33Å; F373-V384 HydrophobicContact CE2-CB 4.45Å; F373-V384 HydrophobicContact CE2-CG1 3.79Å; F373-V384 HydrophobicContact CZ-CG1 4.12Å; G380-V384 PolarHBondContact O-N 3.17Å; K381-V384 PolarHBondContact O-N 2.63Å; T382-V384 VanDerWaalsContact C-N 3.35Å; V384-R386 PolarHBondContact O-N 3.35Å; V384-S387 PolarHBondContact O-N 2.96Å; V384-V388 HydrophobicContact CG1-CG2 4.38Å; V384-V388 WeakPolarHBondContact O-CG2 3.47Å; V384-V388 PolarHBondContact O-N 3.3Å
385	G	89.1	Confident	88.3	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-55.9	-37.7	176	0	0	0	0	0	113.2	K381 T382 V388 A389	K381-G385 PolarHBondContact O-N 2.89Å; T382-G385 PolarHBondContact O-N 2.9Å; G385-V388 PolarHBondContact O-N 3.47Å; G385-A389 PolarHBondContact O-N 2.92Å; G385-A389 VanDerWaalsContact O-N 3.14Å
386	R	91.2	Very high	88.7	Confident	157 Å²	157	34.2 Å²	34.2	59%	0.592	19%	0.187	S	C	*	.	H	α-helix	trans	-67	-42.3	174.2	-175.2	-177.7	-65.4	172	-4.2	112.6	T382 S383 V384 V388 A389 K390 F396	T382-R386 PolarHBondContact O-N 2.84Å; S383-R386 WeakPolarHBondContact O-CB 3.46Å; S383-R386 PolarHBondContact O-N 3.41Å; V384-R386 PolarHBondContact O-N 3.35Å; R386-V388 VanDerWaalsContact C-N 3.33Å; R386-A389 PolarHBondContact O-N 3.29Å; R386-K390 PolarHBondContact O-N 3.43Å; R386-F396 HydrophobicContact CB-CD1 4.4Å; R386-F396 HydrophobicContact CB-CD2 4.36Å; R386-F396 HydrophobicContact CB-CE1 4.31Å; R386-F396 HydrophobicContact CB-CE2 4.26Å; R386-F396 HydrophobicContact CB-CG 4.41Å; R386-F396 HydrophobicContact CB-CZ 4.24Å; R386-F396 HydrophobicContact CG-CD1 4.35Å; R386-F396 HydrophobicContact CG-CG 4.43Å
387	S	90.2	Very high	89.2	Confident	3 Å²	3	35.7 Å²	35.7	2%	0.021	19%	0.193	C	C	.	.	H	α-helix	trans	-65.2	-38.4	177.2	-169.3	0	0	0	0	111.2	L338 D342 S383 V384 A389 K390 T391	L338-S387 WeakPolarHBondContact CD2-OG 3.4Å; D342-S387 WeakPolarHBondContact OD2-CB 3.26Å; D342-S387 PolarHBondContact OD2-OG 2.94Å; S383-S387 PolarHBondContact O-N 2.84Å; V384-S387 PolarHBondContact O-N 2.96Å; S387-A389 VanDerWaalsContact C-N 3.33Å; S387-A389 PolarHBondContact O-N 3.01Å; S387-K390 PolarHBondContact O-N 3.03Å; S387-K390 VanDerWaalsContact O-N 3.16Å; S387-T391 WeakPolarHBondContact O-CG2 3.39Å; S387-T391 PolarHBondContact O-N 3.23Å; S387-T391 PolarHBondContact O-OG1 3.11Å
388	V	88.6	Confident	89.6	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.012	20%	0.202	C	C	.	.	H	α-helix	trans	-60	-40.4	173	176	0	0	0	0	112.2	V353 V384 G385 R386 T391 L392 I488	V353-V388 HydrophobicContact CG1-CG2 3.81Å; V353-V388 HydrophobicContact CG2-CG2 4.08Å; V384-V388 HydrophobicContact CG1-CG2 4.38Å; V384-V388 WeakPolarHBondContact O-CG2 3.47Å; V384-V388 PolarHBondContact O-N 3.3Å; G385-V388 PolarHBondContact O-N 3.47Å; R386-V388 VanDerWaalsContact C-N 3.33Å; V388-T391 WeakPolarHBondContact CA-OG1 3.33Å; V388-T391 PolarHBondContact O-OG1 3.19Å; V388-L392 HydrophobicContact CG1-CD1 4.05Å; V388-L392 WeakPolarHBondContact O-CB 3.5Å; V388-L392 WeakPolarHBondContact O-CG 3.09Å; V388-L392 PolarHBondContact O-N 3.21Å; V388-L392 VanDerWaalsContact O-N 3.14Å; V388-I488 HydrophobicContact CB-CD1 4.31Å; V388-I488 HydrophobicContact CG1-CD1 4.07Å
389	A	90.5	Very high	89.9	Confident	1 Å²	1	39 Å²	39	1%	0.008	19%	0.191	C	C	.	.	H	α-helix	trans	-66.5	-42.3	174.9	0	0	0	0	0	111.9	G385 R386 S387 T391 L392 G393 R394 F396 V438	G385-A389 PolarHBondContact O-N 2.92Å; G385-A389 VanDerWaalsContact O-N 3.14Å; R386-A389 PolarHBondContact O-N 3.29Å; S387-A389 VanDerWaalsContact C-N 3.33Å; S387-A389 PolarHBondContact O-N 3.01Å; A389-T391 PolarHBondContact O-N 2.82Å; A389-L392 PolarHBondContact O-N 2.64Å; A389-G393 PolarHBondContact O-N 2.86Å; A389-R394 PolarHBondContact O-N 3.08Å; A389-F396 HydrophobicContact CB-CB 3.7Å; A389-F396 HydrophobicContact CB-CD2 3.92Å; A389-F396 HydrophobicContact CB-CG 4.26Å; A389-V438 HydrophobicContact CB-CB 3.89Å; A389-V438 HydrophobicContact CB-CG1 4.37Å; A389-V438 HydrophobicContact CB-CG2 3.8Å
390	K	89.8	Confident	90.2	Very high	133 Å²	133	41.3 Å²	41.3	58%	0.578	21%	0.211	S	C	*	.	H	α-helix	trans	-64.2	-38.7	177.4	-171.4	179.7	174.4	-169.8	0	112.6	L338 R386 S387 G393	L338-K390 HydrophobicContact CD1-CG 4.32Å; L338-K390 HydrophobicContact CD2-CD 4.34Å; R386-K390 PolarHBondContact O-N 3.43Å; S387-K390 PolarHBondContact O-N 3.03Å; S387-K390 VanDerWaalsContact O-N 3.16Å; K390-G393 PolarHBondContact O-N 3.23Å
391	T	87.7	Confident	90.3	Very high	13 Å²	13	40.3 Å²	40.3	8%	0.08	20%	0.199	C	C	.	.	H	α-helix	trans	-66.7	-40.5	174.9	52.8	0	0	0	0	111.8	A335 L338 L339 S387 V388 A389 G393	A335-T391 HydrophobicContact CB-CG2 4.14Å; L338-T391 HydrophobicContact CB-CG2 3.95Å; L338-T391 HydrophobicContact CD1-CG2 4.03Å; L338-T391 HydrophobicContact CD2-CG2 3.81Å; L338-T391 HydrophobicContact CG-CG2 4.14Å; L339-T391 HydrophobicContact CD2-CG2 4.48Å; L339-T391 HydrophobicContact CG-CG2 4.18Å; S387-T391 WeakPolarHBondContact O-CG2 3.39Å; S387-T391 PolarHBondContact O-N 3.23Å; S387-T391 PolarHBondContact O-OG1 3.11Å; V388-T391 WeakPolarHBondContact CA-OG1 3.33Å; V388-T391 PolarHBondContact O-OG1 3.19Å; A389-T391 PolarHBondContact O-N 2.82Å; T391-G393 VanDerWaalsContact C-N 3.25Å; T391-G393 PolarHBondContact O-N 3Å
392	L	85.5	Confident	90	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-70.5	-19.8	175.8	-76.8	168.8	0	0	0	113.4	D328 R329 L330 L357 V388 A389 R394 V438 L486	D328-L392 WeakPolarHBondContact CA-O 3.33Å; R329-L392 PolarHBondContact N-O 3.19Å; L330-L392 HydrophobicContact CD2-CD2 4.22Å; L357-L392 HydrophobicContact CD2-CD1 4.43Å; L357-L392 HydrophobicContact CD2-CD2 3.29Å; L357-L392 HydrophobicContact CD2-CG 3.85Å; V388-L392 HydrophobicContact CG1-CD1 4.05Å; V388-L392 WeakPolarHBondContact O-CB 3.5Å; V388-L392 WeakPolarHBondContact O-CG 3.09Å; V388-L392 PolarHBondContact O-N 3.21Å; V388-L392 VanDerWaalsContact O-N 3.14Å; A389-L392 PolarHBondContact O-N 2.64Å; L392-R394 VanDerWaalsContact C-N 3.29Å; L392-R394 HydrophobicContact CB-CB 4.32Å; L392-R394 HydrophobicContact CB-CG 4.06Å; L392-V438 HydrophobicContact CD1-CG2 4.35Å; L392-L486 HydrophobicContact CD1-CD2 3.66Å
393	G	87.3	Confident	89.8	Confident	32 Å²	32	42 Å²	42	33%	0.33	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.5	23.3	-171.6	0	0	0	0	0	113.2	A389 K390 T391	A389-G393 PolarHBondContact O-N 2.86Å; K390-G393 PolarHBondContact O-N 3.23Å; T391-G393 VanDerWaalsContact C-N 3.25Å; T391-G393 PolarHBondContact O-N 3Å
394	R	90.6	Very high	89.7	Confident	12 Å²	12	39.7 Å²	39.7	5%	0.045	21%	0.213	C	C	.	.			trans	-101.6	151.9	-179.8	-71.7	178.1	172.4	-132.8	-16.3	111	D328 R360 A389 L392 N436 V438 Q484	D328-R394 VanDerWaalsContact CG-NH2 3.29Å; D328-R394 IonicContact OD1-CZ 3.49Å; D328-R394 VanDerWaalsContact OD1-CZ 3.3Å; D328-R394 IonicContact OD1-NE 2.84Å; D328-R394 PolarHBondContact OD1-NE 3.09Å; D328-R394 IonicContact OD1-NH2 3.81Å; D328-R394 PolarHBondContact OD1-NH2 2.85Å; D328-R394 IonicContact OD2-CZ 3.75Å; D328-R394 IonicContact OD2-NE 2.64Å; D328-R394 PolarHBondContact OD2-NE 3.43Å; D328-R394 IonicContact OD2-NH2 3.02Å; D328-R394 PolarHBondContact OD2-NH2 3.16Å; R360-R394 VanDerWaalsContact NH2-NH1 3.19Å; A389-R394 PolarHBondContact O-N 3.08Å; L392-R394 VanDerWaalsContact C-N 3.29Å; L392-R394 HydrophobicContact CB-CB 4.32Å; L392-R394 HydrophobicContact CB-CG 4.06Å; R394-N436 VanDerWaalsContact CD-O 3.3Å; R394-N436 WeakPolarHBondContact CD-O 3.41Å; R394-N436 PolarHBondContact NH1-O 2.96Å; R394-N436 VanDerWaalsContact NH1-O 3.13Å; R394-V438 HydrophobicContact CB-CG2 3.88Å; R394-Q484 PolarHBondContact NH1-O 3.2Å
395	E	93.3	Very high	89.6	Confident	100 Å²	100	42.4 Å²	42.4	47%	0.467	23%	0.231	S	C	.	.			trans	-65.5	143	171.9	-68.2	-58.5	149.9	0	0	111.5	T326 V432 V434 P437 V438	T326-E395 HydrophobicContact CG2-CG 4.3Å; E395-V432 HydrophobicContact CB-CG1 3.33Å; E395-V432 HydrophobicContact CG-CG1 3.95Å; E395-V434 HydrophobicContact CB-CG2 3.93Å; E395-V434 HydrophobicContact CG-CG2 3.88Å; E395-P437 WeakPolarHBondContact O-CA 3.26Å; E395-V438 PolarHBondContact O-N 3.45Å
396	F	94.6	Very high	89.6	Confident	46 Å²	46	43.8 Å²	43.8	20%	0.202	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	129.4	-176.7	175.9	-97.2	0	0	0	110.9	R386 A389 R398 L440	R386-F396 HydrophobicContact CB-CD1 4.4Å; R386-F396 HydrophobicContact CB-CD2 4.36Å; R386-F396 HydrophobicContact CB-CE1 4.31Å; R386-F396 HydrophobicContact CB-CE2 4.26Å; R386-F396 HydrophobicContact CB-CG 4.41Å; R386-F396 HydrophobicContact CB-CZ 4.24Å; R386-F396 HydrophobicContact CG-CD1 4.35Å; R386-F396 HydrophobicContact CG-CG 4.43Å; A389-F396 HydrophobicContact CB-CB 3.7Å; A389-F396 HydrophobicContact CB-CD2 3.92Å; A389-F396 HydrophobicContact CB-CG 4.26Å; F396-R398 HydrophobicContact CE1-CB 4.13Å; F396-R398 HydrophobicContact CZ-CB 4.25Å; F396-L440 HydrophobicContact CE2-CB 3.77Å; F396-L440 HydrophobicContact CE2-CD2 4.24Å; F396-L440 HydrophobicContact CZ-CB 3.88Å; F396-L440 HydrophobicContact CZ-CD2 3.82Å; F396-L440 HydrophobicContact CZ-CG 4.48Å
397	H	95.3	Very high	89.4	Confident	44 Å²	44	38.3 Å²	38.3	20%	0.204	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	139	172.7	-176.2	87.5	0	0	0	111.7	G428 V432 V438 F439 L440	H397-G428 WeakPolarHBondContact NE2-CA 3.44Å; H397-V432 HydrophobicContact CB-CG2 3.4Å; H397-V438 PolarHBondContact N-O 2.75Å; H397-F439 HydrophobicContact CB-CD1 3.78Å; H397-F439 HydrophobicContact CB-CE1 3.74Å; H397-F439 AromaticContact CD2-CD1 3.85Å; H397-F439 AromaticContact CD2-CE1 3.6Å; H397-F439 AromaticContact CG-CE1 3.93Å; H397-F439 WeakPolarHBondContact O-CA 3.46Å; H397-L440 PolarHBondContact O-N 2.98Å
398	R	93.9	Very high	89.3	Confident	139 Å²	139	39.4 Å²	39.4	53%	0.525	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	126.6	-175.6	-179.6	-176.5	68.3	159.3	-1.7	110.1	F396 L440 D442	F396-R398 HydrophobicContact CE1-CB 4.13Å; F396-R398 HydrophobicContact CZ-CB 4.25Å; R398-L440 HydrophobicContact CG-CD2 4.21Å; R398-D442 HydrophobicContact CG-CB 4.25Å; R398-D442 IonicContact NH1-OD2 3.51Å
399	I	93.3	Very high	89.3	Confident	8 Å²	8	41.9 Å²	41.9	4%	0.041	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	114.4	175.6	-55.5	178.6	0	0	0	107.7	L401 R424 I425 F439 L440 L441 D442	I399-L401 HydrophobicContact CG2-CD2 4.18Å; I399-R424 HydrophobicContact CG2-CB 4.21Å; I399-I425 HydrophobicContact CD1-CD1 3.76Å; I399-F439 HydrophobicContact CD1-CD1 4.21Å; I399-F439 HydrophobicContact CD1-CD2 4.44Å; I399-F439 HydrophobicContact CD1-CG 4.22Å; I399-L440 PolarHBondContact N-O 3.33Å; I399-L441 HydrophobicContact CB-CD2 4.14Å; I399-L441 HydrophobicContact CD1-CD2 4.28Å; I399-D442 PolarHBondContact O-N 3.01Å
400	A	91.4	Very high	89.3	Confident	50 Å²	50	42 Å²	42	41%	0.413	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	122	173.1	0	0	0	0	0	109.4	R424	A400-R424 PolarHBondContact O-NH1 2.9Å
401	L	88.5	Confident	89.2	Confident	1 Å²	1	38 Å²	38	1%	0.005	22%	0.222	C	C	.	.			trans	-101.1	-4.8	175.8	-65.8	175.5	0	0	0	112.7	I399 G403 V404 L441 D442 V444 L447 L459	I399-L401 HydrophobicContact CG2-CD2 4.18Å; L401-G403 PolarHBondContact O-N 2.88Å; L401-V404 HydrophobicContact CD2-CG2 4.44Å; L401-V404 WeakPolarHBondContact O-CB 3.48Å; L401-V404 WeakPolarHBondContact O-CG2 3.3Å; L401-V404 PolarHBondContact O-N 3.19Å; L401-V404 VanDerWaalsContact O-N 3.12Å; L401-L441 HydrophobicContact CD1-CB 3.84Å; L401-L441 HydrophobicContact CD1-CD1 4.37Å; L401-L441 HydrophobicContact CD1-CD2 4.21Å; L401-L441 HydrophobicContact CD1-CG 4.36Å; L401-D442 WeakPolarHBondContact CB-O 3.47Å; L401-D442 PolarHBondContact N-O 2.93Å; L401-V444 HydrophobicContact CD1-CG2 4.1Å; L401-L447 HydrophobicContact CB-CD2 4Å; L401-L459 HydrophobicContact CD1-CD1 3.75Å; L401-L459 HydrophobicContact CD1-CD2 4.14Å; L401-L459 HydrophobicContact CD2-CD2 4.37Å
402	G	84.2	Confident	89.3	Confident	30 Å²	30	37.4 Å²	37.4	31%	0.309	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	120.7	176.6	0	0	0	0	0	112.1	V404	G402-V404 VanDerWaalsContact C-N 3.33Å
403	G	83.4	Confident	89.6	Confident	60 Å²	60	41.3 Å²	41.3	62%	0.619	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.8	7.8	179.7	0	0	0	0	0	114.9	L401 C405 K446	L401-G403 PolarHBondContact O-N 2.88Å; G403-C405 PolarHBondContact O-N 2.86Å; G403-K446 PolarHBondContact N-O 3.2Å
404	V	88.2	Confident	89.6	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.006	25%	0.253	C	S	.	.			trans	-72.8	124.8	171.1	175.5	0	0	0	0	108.9	L401 G402 D409 L447 G448 P455	L401-V404 HydrophobicContact CD2-CG2 4.44Å; L401-V404 WeakPolarHBondContact O-CB 3.48Å; L401-V404 WeakPolarHBondContact O-CG2 3.3Å; L401-V404 PolarHBondContact O-N 3.19Å; L401-V404 VanDerWaalsContact O-N 3.12Å; G402-V404 VanDerWaalsContact C-N 3.33Å; V404-D409 HydrophobicContact CG1-CB 3.8Å; V404-L447 HydrophobicContact CB-CD2 4.15Å; V404-G448 PolarHBondContact O-N 3.4Å; V404-P455 HydrophobicContact CG1-CB 4.03Å
405	C	85.5	Confident	89.4	Confident	59 Å²	59	51.3 Å²	51.3	40%	0.399	27%	0.265	S	S	.	.			trans	-119.8	-17.3	-176.2	-66.8	0	0	0	0	113.3	G403 S450	G403-C405 PolarHBondContact O-N 2.86Å; C405-S450 WeakPolarHBondContact O-CB 3.32Å; C405-S450 PolarHBondContact O-OG 3.43Å
406	D	87.8	Confident	88.7	Confident	29 Å²	29	51.2 Å²	51.2	16%	0.155	27%	0.271	C	S	.	.			trans	-117.7	146	-175.9	-172.1	18.4	0	0	0	111.2	S408 D409	D406-S408 VanDerWaalsContact C-N 3.26Å; D406-S408 PolarHBondContact O-N 3.46Å; D406-S408 PolarHBondContact OD1-N 3.29Å; D406-S408 WeakPolarHBondContact OD2-CB 3.34Å; D406-S408 PolarHBondContact OD2-OG 3.45Å; D406-D409 PolarHBondContact O-N 2.95Å
407	Q	88.1	Confident	87.7	Confident	42 Å²	42	57.3 Å²	57.3	20%	0.196	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-30.4	174.2	162.8	162.5	30.8	0	0	112.2	D409 I410 R411 A458	Q407-D409 PolarHBondContact O-N 3.26Å; Q407-I410 PolarHBondContact O-N 3.16Å; Q407-R411 HydrophobicContact CG-CG 4.47Å; Q407-R411 PolarHBondContact O-N 3.06Å; Q407-A458 HydrophobicContact CB-CB 4.46Å; Q407-A458 HydrophobicContact CG-CB 3.9Å
408	S	88.2	Confident	86.6	Confident	26 Å²	26	60.5 Å²	60.5	18%	0.182	32%	0.316	C	S	.	.	H	α-helix	trans	-62.4	-24.5	179.3	-43.3	0	0	0	0	113	D406 I410 G412 H413	D406-S408 VanDerWaalsContact C-N 3.26Å; D406-S408 PolarHBondContact O-N 3.46Å; D406-S408 PolarHBondContact OD1-N 3.29Å; D406-S408 WeakPolarHBondContact OD2-CB 3.34Å; D406-S408 PolarHBondContact OD2-OG 3.45Å; S408-I410 PolarHBondContact O-N 3.05Å; S408-G412 CarbonylContact O-C 3.53Å; S408-G412 WeakPolarHBondContact O-CA 3.45Å; S408-G412 PolarHBondContact O-N 3.36Å; S408-H413 WeakPolarHBondContact CB-CE1 3.44Å; S408-H413 WeakPolarHBondContact CB-ND1 3.39Å
409	D	87.6	Confident	85.9	Confident	54 Å²	54	56.8 Å²	56.8	29%	0.289	32%	0.321	S	S	.	.	H	α-helix	trans	-64.1	-31.1	174.9	-91.1	-16.5	0	0	0	112	V404 D406 Q407 R424	V404-D409 HydrophobicContact CG1-CB 3.8Å; D406-D409 PolarHBondContact O-N 2.95Å; Q407-D409 PolarHBondContact O-N 3.26Å; D409-R424 WeakPolarHBondContact O-CB 3.44Å; D409-R424 VanDerWaalsContact O-CG 3.3Å; D409-R424 WeakPolarHBondContact O-CG 3.42Å; D409-R424 PolarHBondContact O-N 2.86Å; D409-R424 IonicContact OD1-NH2 3.64Å; D409-R424 IonicContact OD2-CZ 3.62Å; D409-R424 IonicContact OD2-NH2 3.7Å; D409-R424 PolarHBondContact OD2-NH2 2.92Å
410	I	90.4	Very high	85.6	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.01	32%	0.322	C	S	.	.	H	α-helix	trans	-92.8	-45.2	-178.4	-63.3	157.6	0	0	0	110.9	Q407 S408 G423 I425 P455 A458 L459 V462	Q407-I410 PolarHBondContact O-N 3.16Å; S408-I410 PolarHBondContact O-N 3.05Å; I410-G423 WeakPolarHBondContact O-CA 3.46Å; I410-I425 HydrophobicContact CG2-CG1 4.16Å; I410-P455 HydrophobicContact CD1-CB 3.93Å; I410-P455 VanDerWaalsContact CD1-O 3.31Å; I410-P455 WeakPolarHBondContact CD1-O 3.22Å; I410-A458 HydrophobicContact CB-CB 4.01Å; I410-A458 HydrophobicContact CD1-CB 3.96Å; I410-A458 HydrophobicContact CG2-CB 4.02Å; I410-L459 HydrophobicContact CD1-CD1 4.33Å; I410-L459 HydrophobicContact CD1-CD2 3.63Å; I410-L459 HydrophobicContact CD1-CG 3.56Å; I410-L459 HydrophobicContact CG1-CD2 4.15Å; I410-L459 HydrophobicContact CG2-CD2 4.32Å; I410-V462 HydrophobicContact CG2-CG2 4.15Å
411	R	88.4	Confident	85.4	Confident	49 Å²	49	60 Å²	60	19%	0.185	33%	0.33	C	S	.	.	H	α-helix	trans	-95	-2.2	-177.1	-67.9	-167.6	-177.7	168.8	-0.7	114.9	Q407 A458 E461 F471 D473 H474	Q407-R411 HydrophobicContact CG-CG 4.47Å; Q407-R411 PolarHBondContact O-N 3.06Å; R411-A458 HydrophobicContact CG-CB 4.19Å; R411-E461 IonicContact CZ-OE2 3.99Å; R411-E461 IonicContact NE-OE2 2.99Å; R411-E461 PolarHBondContact NE-OE2 3.27Å; R411-E461 VanDerWaalsContact NH2-CD 3.34Å; R411-E461 IonicContact NH2-OE1 3.85Å; R411-E461 IonicContact NH2-OE2 2.71Å; R411-E461 PolarHBondContact NH2-OE2 2.92Å; R411-F471 HydrophobicContact CG-CE2 4.31Å; R411-F471 HydrophobicContact CG-CZ 4.4Å; R411-D473 CarbonylContact O-C 3.56Å; R411-H474 PolarHBondContact O-N 3.42Å
412	G	90.2	Very high	85.6	Confident	1 Å²	1	60.7 Å²	60.7	1%	0.01	33%	0.334	C	S	.	.			trans	73.4	177.6	-174.3	0	0	0	0	0	113.9	S408 M421 G423	S408-G412 CarbonylContact O-C 3.53Å; S408-G412 WeakPolarHBondContact O-CA 3.45Å; S408-G412 PolarHBondContact O-N 3.36Å; G412-M421 WeakPolarHBondContact CA-O 3.42Å; G412-G423 VanDerWaalsContact CA-N 3.25Å; G412-G423 VanDerWaalsContact N-CA 3.29Å
413	H	90.6	Very high	85.9	Confident	82 Å²	82	59.3 Å²	59.3	38%	0.38	32%	0.32	S	S	.	.			trans	-98.2	152.4	174.2	-62.4	-75.2	0	0	0	111.3	S408 M421 H474 Y475	S408-H413 WeakPolarHBondContact CB-CE1 3.44Å; S408-H413 WeakPolarHBondContact CB-ND1 3.39Å; H413-M421 PolarHBondContact N-O 3.2Å; H413-H474 CarbonylContact O-C 3.59Å; H413-Y475 WeakPolarHBondContact O-CA 3.33Å; H413-Y475 VanDerWaalsContact O-CB 3.32Å; H413-Y475 WeakPolarHBondContact O-CB 3.49Å; H413-Y475 PolarHBondContact O-N 3.06Å
414	R	87.7	Confident	86.4	Confident	178 Å²	178	60.7 Å²	60.7	67%	0.672	31%	0.307	S	S	*	.			trans	-61.9	146.4	169.2	-62.2	-178.3	-177.3	-174.9	0.7	110	T416 S420 H474	R414-T416 HydrophobicContact CB-CG2 4.33Å; R414-T416 PolarHBondContact O-N 3.07Å; R414-S420 WeakPolarHBondContact O-CB 3.41Å; R414-S420 PolarHBondContact O-OG 3.49Å; R414-H474 HydrophobicContact CG-CB 4.2Å
415	R	86	Confident	86.6	Confident	76 Å²	76	60.8 Å²	60.8	29%	0.287	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	40	179.8	-68.7	174.2	57.3	-165.4	-5.2	114.7	E293 Y475	E293-R415 IonicContact OE2-CZ 3.4Å; E293-R415 IonicContact OE2-NH1 2.85Å; E293-R415 PolarHBondContact OE2-NH1 3.15Å; E293-R415 IonicContact OE2-NH2 2.85Å; E293-R415 PolarHBondContact OE2-NH2 3.13Å; R415-Y475 WeakPolarHBondContact CD-O 2.93Å; R415-Y475 HydrophobicContact CG-CD2 3.74Å; R415-Y475 HydrophobicContact CG-CE2 3.81Å; R415-Y475 HydrophobicContact CG-CG 4.14Å; R415-Y475 WeakPolarHBondContact CG-O 3.19Å
416	T	80.1	Confident	86.9	Confident	98 Å²	98	58 Å²	58	60%	0.601	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-19.1	-175.8	52.5	0	0	0	0	114.2	R414	R414-T416 HydrophobicContact CB-CG2 4.33Å; R414-T416 PolarHBondContact O-N 3.07Å
417	Y	73.3	Confident	87.1	Confident	175 Å²	175	58.9 Å²	58.9	69%	0.686	29%	0.293	S	S	*	.	S	Bend	trans	-126.4	154.8	-175.7	-61.9	-74.1	0	0	0	111.4	G419 S420	Y417-G419 PolarHBondContact O-N 3.36Å; Y417-G419 VanDerWaalsContact O-N 3.13Å; Y417-S420 PolarHBondContact N-OG 2.92Å; Y417-S420 WeakPolarHBondContact O-CB 3.18Å; Y417-S420 PolarHBondContact O-N 3.48Å; Y417-S420 PolarHBondContact O-OG 3.42Å
418	V	71.8	Confident	87.3	Confident	111 Å²	111	56.9 Å²	56.9	67%	0.673	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-24.1	-179.5	-178	0	0	0	0	112.3	P305	P305-V418 HydrophobicContact CB-CG2 4.16Å
419	G	78.9	Confident	87.5	Confident	61 Å²	61	55.7 Å²	55.7	63%	0.629	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	13.6	176	0	0	0	0	0	115.6	Y417 M421	Y417-G419 PolarHBondContact O-N 3.36Å; Y417-G419 VanDerWaalsContact O-N 3.13Å; G419-M421 PolarHBondContact O-N 3.17Å
420	S	86.3	Confident	87.7	Confident	8 Å²	8	57 Å²	57	6%	0.056	28%	0.278	C	S	.	.			trans	-66	122.9	179.4	-66.5	0	0	0	0	110.9	R414 Y417 Y475	R414-S420 WeakPolarHBondContact O-CB 3.41Å; R414-S420 PolarHBondContact O-OG 3.49Å; Y417-S420 PolarHBondContact N-OG 2.92Å; Y417-S420 WeakPolarHBondContact O-CB 3.18Å; Y417-S420 PolarHBondContact O-N 3.48Å; Y417-S420 PolarHBondContact O-OG 3.42Å; S420-Y475 WeakPolarHBondContact O-CE2 3.43Å
421	M	88.7	Confident	87.8	Confident	116 Å²	116	62 Å²	62	57%	0.571	31%	0.309	S	S	*	.			trans	-115.7	145.9	179.7	-64.9	-67.3	-85.1	0	0	110.7	G412 H413 G419	G412-M421 WeakPolarHBondContact CA-O 3.42Å; H413-M421 PolarHBondContact N-O 3.2Å; G419-M421 PolarHBondContact O-N 3.17Å
422	P	91.7	Very high	88	Confident	16 Å²	16	60.9 Å²	60.9	10%	0.104	31%	0.307	C	S	.	.			trans	-68.6	158	169.4	29.7	-34.7	0	0	0	111.2	L316 I426 N427 Y475	L316-P422 HydrophobicContact CD2-CB 4.01Å; L316-P422 HydrophobicContact CD2-CG 3.97Å; P422-I426 HydrophobicContact CB-CB 4.3Å; P422-I426 HydrophobicContact CB-CG2 4.13Å; P422-N427 WeakPolarHBondContact CG-OD1 3.47Å; P422-N427 PolarHBondContact O-ND2 3.37Å; P422-N427 VanDerWaalsContact O-ND2 3.15Å; P422-Y475 HydrophobicContact CB-CD1 3.89Å; P422-Y475 HydrophobicContact CB-CG 4.09Å; P422-Y475 HydrophobicContact CG-CD1 4.37Å
423	G	91.7	Very high	88	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.01	32%	0.315	C	S	.	.			trans	-64.3	160.6	-179.3	0	0	0	0	0	113.2	I410 G412 I425 I426 N427 D473	I410-G423 WeakPolarHBondContact O-CA 3.46Å; G412-G423 VanDerWaalsContact CA-N 3.25Å; G412-G423 VanDerWaalsContact N-CA 3.29Å; G423-I425 PolarHBondContact O-N 3.08Å; G423-I425 VanDerWaalsContact O-N 3.17Å; G423-I426 PolarHBondContact O-N 3.37Å; G423-N427 PolarHBondContact O-N 2.77Å; G423-D473 WeakPolarHBondContact CA-OD2 3.36Å; G423-D473 PolarHBondContact N-OD2 2.96Å
424	R	92.1	Very high	88.1	Confident	90 Å²	90	58.2 Å²	58.2	34%	0.34	30%	0.3	S	S	.	.	H	α-helix	trans	-57.9	-29.9	179.1	-73.1	179.4	-168.2	-161.7	6.9	113.2	I399 A400 D409 G428	I399-R424 HydrophobicContact CG2-CB 4.21Å; A400-R424 PolarHBondContact O-NH1 2.9Å; D409-R424 WeakPolarHBondContact O-CB 3.44Å; D409-R424 VanDerWaalsContact O-CG 3.3Å; D409-R424 WeakPolarHBondContact O-CG 3.42Å; D409-R424 PolarHBondContact O-N 2.86Å; D409-R424 IonicContact OD1-NH2 3.64Å; D409-R424 IonicContact OD2-CZ 3.62Å; D409-R424 IonicContact OD2-NH2 3.7Å; D409-R424 PolarHBondContact OD2-NH2 2.92Å; R424-G428 PolarHBondContact O-N 2.82Å
425	I	92.5	Very high	88.2	Confident	3 Å²	3	51 Å²	51	2%	0.015	28%	0.275	C	S	.	.	H	α-helix	trans	-66.5	-50.8	177.5	-57.6	-63.4	0	0	0	110.7	I399 I410 G423 G428 L429 F439 V462 L482	I399-I425 HydrophobicContact CD1-CD1 3.76Å; I410-I425 HydrophobicContact CG2-CG1 4.16Å; G423-I425 PolarHBondContact O-N 3.08Å; G423-I425 VanDerWaalsContact O-N 3.17Å; I425-G428 PolarHBondContact O-N 3.15Å; I425-L429 PolarHBondContact O-N 3.23Å; I425-F439 HydrophobicContact CG2-CE2 4.22Å; I425-V462 HydrophobicContact CD1-CG1 4.19Å; I425-V462 HydrophobicContact CG1-CG1 4.45Å; I425-V462 HydrophobicContact CG1-CG2 4.33Å; I425-L482 HydrophobicContact CG2-CD1 3.94Å; I425-L482 HydrophobicContact CG2-CD2 4.03Å
426	I	92.6	Very high	88.4	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-65.9	-42	179.8	-61.7	-57.6	0	0	0	110.8	L316 L320 P422 G423 G428 L429 K430 F471 D473 F480	L316-I426 HydrophobicContact CD1-CG2 4.37Å; L316-I426 HydrophobicContact CD2-CG2 4.35Å; L320-I426 HydrophobicContact CD1-CG2 4.07Å; L320-I426 HydrophobicContact CD2-CG2 3.82Å; P422-I426 HydrophobicContact CB-CB 4.3Å; P422-I426 HydrophobicContact CB-CG2 4.13Å; G423-I426 PolarHBondContact O-N 3.37Å; I426-G428 VanDerWaalsContact C-N 3.3Å; I426-G428 PolarHBondContact O-N 2.93Å; I426-L429 HydrophobicContact CD1-CD1 4.35Å; I426-L429 PolarHBondContact O-N 3.3Å; I426-K430 WeakPolarHBondContact O-CB 3.3Å; I426-K430 PolarHBondContact O-N 3.03Å; I426-F471 HydrophobicContact CD1-CE1 4.25Å; I426-F471 HydrophobicContact CG1-CE1 4.4Å; I426-D473 HydrophobicContact CD1-CB 4.43Å; I426-D473 HydrophobicContact CG1-CB 3.8Å; I426-F480 HydrophobicContact CD1-CB 4.4Å; I426-F480 HydrophobicContact CD1-CG 4.42Å
427	N	92.4	Very high	89	Confident	48 Å²	48	43 Å²	43	26%	0.257	23%	0.234	S	C	.	.	H	α-helix	trans	-62.3	-37.2	173.2	-83.9	-30.4	0	0	0	112.6	P422 G423 K430 T431	P422-N427 WeakPolarHBondContact CG-OD1 3.47Å; P422-N427 PolarHBondContact O-ND2 3.37Å; P422-N427 VanDerWaalsContact O-ND2 3.15Å; G423-N427 PolarHBondContact O-N 2.77Å; N427-K430 WeakPolarHBondContact O-CB 3.39Å; N427-K430 PolarHBondContact O-N 2.6Å; N427-T431 WeakPolarHBondContact O-CB 3.31Å; N427-T431 PolarHBondContact O-N 3Å; N427-T431 PolarHBondContact O-OG1 3.13Å
428	G	91.8	Very high	89.9	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.7	-45.1	173.2	0	0	0	0	0	112	H397 R424 I425 I426 T431 V432	H397-G428 WeakPolarHBondContact NE2-CA 3.44Å; R424-G428 PolarHBondContact O-N 2.82Å; I425-G428 PolarHBondContact O-N 3.15Å; I426-G428 VanDerWaalsContact C-N 3.3Å; I426-G428 PolarHBondContact O-N 2.93Å; G428-T431 PolarHBondContact O-N 3.26Å; G428-V432 WeakPolarHBondContact O-CB 3.44Å; G428-V432 VanDerWaalsContact O-CG2 3.23Å; G428-V432 WeakPolarHBondContact O-CG2 3.33Å; G428-V432 PolarHBondContact O-N 2.67Å
429	L	91.9	Very high	91	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-64.3	-41.6	176.4	-71.9	170.9	0	0	0	112.4	L320 I425 I426 T431 V432 G433 P437 F439 F480 L482 V485	L320-L429 HydrophobicContact CD2-CB 4.2Å; I425-L429 PolarHBondContact O-N 3.23Å; I426-L429 HydrophobicContact CD1-CD1 4.35Å; I426-L429 PolarHBondContact O-N 3.3Å; L429-T431 VanDerWaalsContact C-N 3.33Å; L429-T431 PolarHBondContact O-N 2.8Å; L429-V432 PolarHBondContact O-N 3.4Å; L429-G433 PolarHBondContact O-N 3.44Å; L429-P437 HydrophobicContact CD2-CG 3.91Å; L429-F439 HydrophobicContact CD2-CE2 4.04Å; L429-F439 HydrophobicContact CD2-CZ 3.82Å; L429-F439 HydrophobicContact CG-CE2 4.11Å; L429-F439 HydrophobicContact CG-CZ 3.85Å; L429-F480 HydrophobicContact CD1-CD1 3.79Å; L429-F480 HydrophobicContact CD1-CE1 3.4Å; L429-F480 HydrophobicContact CD1-CZ 3.95Å; L429-L482 HydrophobicContact CD1-CD2 3.68Å; L429-V485 HydrophobicContact CD2-CG2 4.47Å
430	K	92.4	Very high	91.8	Very high	83 Å²	83	26.5 Å²	26.5	36%	0.361	14%	0.139	S	C	.	.	H	α-helix	trans	-56	-48.1	173.2	-175.6	-165	-173.8	-177.8	0	111.2	L316 E319 L320 I426 N427 V432	L316-K430 HydrophobicContact CD1-CB 4.39Å; L316-K430 HydrophobicContact CD1-CD 3.75Å; L316-K430 HydrophobicContact CD1-CG 4.2Å; E319-K430 HydrophobicContact CB-CG 4.39Å; E319-K430 WeakPolarHBondContact OE2-CE 3.12Å; E319-K430 IonicContact OE2-NZ 3.8Å; E319-K430 PolarHBondContact OE2-NZ 3.45Å; L320-K430 HydrophobicContact CD2-CB 4.43Å; I426-K430 WeakPolarHBondContact O-CB 3.3Å; I426-K430 PolarHBondContact O-N 3.03Å; N427-K430 WeakPolarHBondContact O-CB 3.39Å; N427-K430 PolarHBondContact O-N 2.6Å; K430-V432 VanDerWaalsContact C-N 3.33Å; K430-V432 PolarHBondContact O-N 3.28Å
431	T	92.1	Very high	92.1	Very high	105 Å²	105	26.1 Å²	26.1	64%	0.644	14%	0.137	S	C	*	.	H	α-helix	trans	-65.7	-36.6	-177.9	-53.4	0	0	0	0	112.2	N427 G428 L429	N427-T431 WeakPolarHBondContact O-CB 3.31Å; N427-T431 PolarHBondContact O-N 3Å; N427-T431 PolarHBondContact O-OG1 3.13Å; G428-T431 PolarHBondContact O-N 3.26Å; L429-T431 VanDerWaalsContact C-N 3.33Å; L429-T431 PolarHBondContact O-N 2.8Å
432	V	92.5	Very high	92.3	Very high	26 Å²	26	21.6 Å²	21.6	16%	0.158	12%	0.115	C	C	.	.	H	α-helix	trans	-84.2	-34.1	-176.6	173.9	0	0	0	0	112.2	E395 H397 G428 L429 K430 V434 P437	E395-V432 HydrophobicContact CB-CG1 3.33Å; E395-V432 HydrophobicContact CG-CG1 3.95Å; H397-V432 HydrophobicContact CB-CG2 3.4Å; G428-V432 WeakPolarHBondContact O-CB 3.44Å; G428-V432 VanDerWaalsContact O-CG2 3.23Å; G428-V432 WeakPolarHBondContact O-CG2 3.33Å; G428-V432 PolarHBondContact O-N 2.67Å; L429-V432 PolarHBondContact O-N 3.4Å; K430-V432 VanDerWaalsContact C-N 3.33Å; K430-V432 PolarHBondContact O-N 3.28Å; V432-V434 VanDerWaalsContact C-N 3.26Å; V432-V434 HydrophobicContact CG1-CG2 3.51Å; V432-V434 PolarHBondContact O-N 3.01Å; V432-P437 HydrophobicContact CG1-CB 3.7Å; V432-P437 HydrophobicContact CG1-CG 4.32Å
433	G	90.7	Very high	92.2	Very high	17 Å²	17	23.7 Å²	23.7	18%	0.175	12%	0.123	C	C	.	.			trans	69	19	176.5	0	0	0	0	0	114.9	P321 K324 L429	P321-G433 VanDerWaalsContact CB-C 3.46Å; P321-G433 WeakPolarHBondContact CB-O 3.42Å; K324-G433 WeakPolarHBondContact CD-O 3.46Å; L429-G433 PolarHBondContact O-N 3.44Å
434	V	92.3	Very high	92.2	Very high	10 Å²	10	23.7 Å²	23.7	6%	0.061	12%	0.123	C	C	.	.			trans	-135.6	154.5	169.2	-60.6	0	0	0	0	111.4	P321 K324 T326 E395 V432 P437	P321-V434 WeakPolarHBondContact CG-O 3.48Å; K324-V434 HydrophobicContact CG-CG1 4.35Å; K324-V434 CarbonylContact O-C 3.5Å; K324-V434 VanDerWaalsContact O-CA 3.28Å; K324-V434 WeakPolarHBondContact O-CA 3.3Å; T326-V434 HydrophobicContact CG2-CB 4.38Å; T326-V434 HydrophobicContact CG2-CG1 3.97Å; T326-V434 HydrophobicContact CG2-CG2 4.15Å; E395-V434 HydrophobicContact CB-CG2 3.93Å; E395-V434 HydrophobicContact CG-CG2 3.88Å; V432-V434 VanDerWaalsContact C-N 3.26Å; V432-V434 HydrophobicContact CG1-CG2 3.51Å; V432-V434 PolarHBondContact O-N 3.01Å; V434-P437 HydrophobicContact CG2-CB 4.31Å; V434-P437 WeakPolarHBondContact O-CD 3.33Å
435	N	89.9	Confident	92	Very high	26 Å²	26	20 Å²	20	14%	0.139	11%	0.111	C	C	.	.	S	Bend	trans	-87.7	-12.9	-176.8	67.7	3.2	0	0	0	114.8	P321 W322 K324 S325 P437 V485	P321-N435 WeakPolarHBondContact O-CB 3.44Å; W322-N435 PolarHBondContact O-ND2 3.32Å; K324-N435 PolarHBondContact O-N 3.47Å; K324-N435 PolarHBondContact O-OD1 2.98Å; S325-N435 WeakPolarHBondContact CA-OD1 3.32Å; S325-N435 WeakPolarHBondContact CB-OD1 3.36Å; N435-P437 WeakPolarHBondContact O-CD 3.32Å; N435-V485 WeakPolarHBondContact O-CG2 3.22Å
436	N	90.8	Very high	91.7	Very high	7 Å²	7	24.5 Å²	24.5	4%	0.037	13%	0.13	C	C	.	.	S	Bend	trans	-115	39.6	-179.1	70.7	-25.7	0	0	0	115	T326 R394 Q484	T326-N436 PolarHBondContact N-ND2 3.27Å; T326-N436 PolarHBondContact N-OD1 3.1Å; T326-N436 PolarHBondContact O-ND2 2.85Å; T326-N436 VanDerWaalsContact OG1-CG 3.3Å; T326-N436 PolarHBondContact OG1-ND2 3.45Å; T326-N436 VanDerWaalsContact OG1-ND2 3.12Å; T326-N436 PolarHBondContact OG1-OD1 3.2Å; R394-N436 VanDerWaalsContact CD-O 3.3Å; R394-N436 WeakPolarHBondContact CD-O 3.41Å; R394-N436 PolarHBondContact NH1-O 2.96Å; R394-N436 VanDerWaalsContact NH1-O 3.13Å; N436-Q484 HydrophobicContact CB-CB 3.99Å
437	P	93.4	Very high	91.4	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.137	C	C	.	.			trans	-73.1	168.7	-179.1	34.6	-37.4	0	0	0	112.6	E395 L429 V432 V434 N435 F439 V485 L486	E395-P437 WeakPolarHBondContact O-CA 3.26Å; L429-P437 HydrophobicContact CD2-CG 3.91Å; V432-P437 HydrophobicContact CG1-CB 3.7Å; V432-P437 HydrophobicContact CG1-CG 4.32Å; V434-P437 HydrophobicContact CG2-CB 4.31Å; V434-P437 WeakPolarHBondContact O-CD 3.33Å; N435-P437 WeakPolarHBondContact O-CD 3.32Å; P437-F439 HydrophobicContact CG-CE1 4.14Å; P437-F439 HydrophobicContact CG-CE2 4.41Å; P437-F439 HydrophobicContact CG-CZ 4.05Å; P437-V485 HydrophobicContact CG-CG1 4.39Å; P437-L486 PolarHBondContact O-N 3.18Å
438	V	92.3	Very high	90.7	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	113.2	166.6	-177	0	0	0	0	108.5	A389 L392 R394 E395 H397 L486 I488	A389-V438 HydrophobicContact CB-CB 3.89Å; A389-V438 HydrophobicContact CB-CG1 4.37Å; A389-V438 HydrophobicContact CB-CG2 3.8Å; L392-V438 HydrophobicContact CD1-CG2 4.35Å; R394-V438 HydrophobicContact CB-CG2 3.88Å; E395-V438 PolarHBondContact O-N 3.45Å; H397-V438 PolarHBondContact N-O 2.75Å; V438-L486 CarbonylContact C-O 3.47Å; V438-L486 WeakPolarHBondContact CA-O 3.39Å; V438-L486 HydrophobicContact CG1-CD2 4.4Å; V438-L486 HydrophobicContact CG1-CG 4.43Å; V438-L486 HydrophobicContact CG2-CB 4.23Å; V438-L486 HydrophobicContact CG2-CD2 4.15Å; V438-I488 HydrophobicContact CG1-CD1 3.69Å; V438-I488 HydrophobicContact CG1-CG1 4.19Å
439	F	93.9	Very high	89.9	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	119.8	172.5	-77.2	-31.7	0	0	0	111.4	H397 I399 I425 L429 P437 V485 L486 F487 I488	H397-F439 HydrophobicContact CB-CD1 3.78Å; H397-F439 HydrophobicContact CB-CE1 3.74Å; H397-F439 AromaticContact CD2-CD1 3.85Å; H397-F439 AromaticContact CD2-CE1 3.6Å; H397-F439 AromaticContact CG-CE1 3.93Å; H397-F439 WeakPolarHBondContact O-CA 3.46Å; I399-F439 HydrophobicContact CD1-CD1 4.21Å; I399-F439 HydrophobicContact CD1-CD2 4.44Å; I399-F439 HydrophobicContact CD1-CG 4.22Å; I425-F439 HydrophobicContact CG2-CE2 4.22Å; L429-F439 HydrophobicContact CD2-CE2 4.04Å; L429-F439 HydrophobicContact CD2-CZ 3.82Å; L429-F439 HydrophobicContact CG-CE2 4.11Å; L429-F439 HydrophobicContact CG-CZ 3.85Å; P437-F439 HydrophobicContact CG-CE1 4.14Å; P437-F439 HydrophobicContact CG-CE2 4.41Å; P437-F439 HydrophobicContact CG-CZ 4.05Å; F439-V485 HydrophobicContact CB-CG1 4.31Å; F439-V485 HydrophobicContact CD2-CG1 3.38Å; F439-V485 HydrophobicContact CE2-CG1 3.89Å; F439-V485 HydrophobicContact CG-CG1 4.03Å; F439-L486 PolarHBondContact N-O 2.85Å; F439-F487 HydrophobicContact CB-CD1 3.96Å; F439-F487 HydrophobicContact CB-CE1 4.15Å; F439-F487 HydrophobicContact CD2-CD1 4.38Å; F439-F487 AromaticContact CD2-CE1 3.73Å; F439-F487 HydrophobicContact CD2-CE1 3.73Å; F439-F487 HydrophobicContact CD2-CZ 4.28Å; F439-F487 HydrophobicContact CG-CE1 4.45Å; F439-F487 WeakPolarHBondContact O-CA 3.41Å; F439-I488 PolarHBondContact O-N 3.31Å
440	L	94.8	Very high	89.2	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	111	170.4	-172.6	75.5	0	0	0	110	T382 F396 H397 R398 I399 D442 I488 T490	T382-L440 HydrophobicContact CG2-CD2 3.47Å; T382-L440 VanDerWaalsContact CG2-CD2 3.47Å; F396-L440 HydrophobicContact CE2-CB 3.77Å; F396-L440 HydrophobicContact CE2-CD2 4.24Å; F396-L440 HydrophobicContact CZ-CB 3.88Å; F396-L440 HydrophobicContact CZ-CD2 3.82Å; F396-L440 HydrophobicContact CZ-CG 4.48Å; H397-L440 PolarHBondContact O-N 2.98Å; R398-L440 HydrophobicContact CG-CD2 4.21Å; I399-L440 PolarHBondContact N-O 3.33Å; L440-D442 PolarHBondContact O-N 3.17Å; L440-I488 CarbonylContact C-O 3.57Å; L440-I488 VanDerWaalsContact CA-O 3.32Å; L440-I488 WeakPolarHBondContact CA-O 3.45Å; L440-I488 HydrophobicContact CD1-CB 3.85Å; L440-I488 HydrophobicContact CD1-CG2 3.61Å; L440-T490 HydrophobicContact CD1-CG2 3.66Å; L440-T490 HydrophobicContact CG-CG2 4.33Å
441	L	93.3	Very high	88.1	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	100.9	172	-56.9	-176.7	0	0	0	109	I399 L401 V444 L463 F487 I488 A489 T490	I399-L441 HydrophobicContact CB-CD2 4.14Å; I399-L441 HydrophobicContact CD1-CD2 4.28Å; L401-L441 HydrophobicContact CD1-CB 3.84Å; L401-L441 HydrophobicContact CD1-CD1 4.37Å; L401-L441 HydrophobicContact CD1-CD2 4.21Å; L401-L441 HydrophobicContact CD1-CG 4.36Å; L441-V444 HydrophobicContact CB-CG2 4.04Å; L441-L463 HydrophobicContact CD1-CD1 4.35Å; L441-L463 HydrophobicContact CD1-CD2 3.95Å; L441-F487 HydrophobicContact CD1-CD1 4.3Å; L441-F487 HydrophobicContact CG-CD1 4.48Å; L441-I488 PolarHBondContact N-O 3.19Å; L441-A489 CarbonylContact O-C 3.57Å; L441-A489 WeakPolarHBondContact O-CA 3.08Å; L441-T490 PolarHBondContact O-N 2.93Å
442	D	92.8	Very high	87	Confident	21 Å²	21	42 Å²	42	11%	0.112	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	136.9	-175.5	-151.8	-7.4	0	0	0	111.1	R398 I399 L401 L440 T490	R398-D442 HydrophobicContact CG-CB 4.25Å; R398-D442 IonicContact NH1-OD2 3.51Å; I399-D442 PolarHBondContact O-N 3.01Å; L401-D442 WeakPolarHBondContact CB-O 3.47Å; L401-D442 PolarHBondContact N-O 2.93Å; L440-D442 PolarHBondContact O-N 3.17Å; D442-T490 WeakPolarHBondContact CA-OG1 3.13Å; D442-T490 PolarHBondContact OD1-OG1 2.72Å
443	E	90.9	Very high	86.2	Confident	59 Å²	59	41.8 Å²	41.8	28%	0.276	22%	0.221	S	C	.	.			trans	57.5	48	177.5	-49.8	-166.2	144	0	0	115.6	D445 K446 T490	E443-D445 WeakPolarHBondContact CA-OD1 3.49Å; E443-D445 PolarHBondContact O-N 3.36Å; E443-D445 VanDerWaalsContact O-N 3.17Å; E443-K446 HydrophobicContact CB-CB 4.48Å; E443-K446 HydrophobicContact CB-CD 4.26Å; E443-K446 HydrophobicContact CB-CG 4.41Å; E443-K446 PolarHBondContact O-N 3.26Å; E443-K446 VanDerWaalsContact O-N 3.09Å; E443-K446 IonicContact OE1-NZ 3.14Å; E443-K446 PolarHBondContact OE1-NZ 2.9Å; E443-K446 WeakPolarHBondContact OE2-CD 3.28Å; E443-K446 WeakPolarHBondContact OE2-CE 3.27Å; E443-K446 IonicContact OE2-NZ 2.84Å; E443-K446 PolarHBondContact OE2-NZ 3.35Å; E443-T490 PolarHBondContact N-O 2.81Å
444	V	90.4	Very high	85.8	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.006	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-61.1	-23.8	176.9	-168.7	0	0	0	0	112.4	L401 L441 K446 L447 A489 T490 L501 M505	L401-V444 HydrophobicContact CD1-CG2 4.1Å; L441-V444 HydrophobicContact CB-CG2 4.04Å; V444-K446 PolarHBondContact O-N 2.99Å; V444-L447 HydrophobicContact CG1-CD1 3.87Å; V444-L447 WeakPolarHBondContact O-CD1 3.47Å; V444-L447 WeakPolarHBondContact O-CG 3.36Å; V444-A489 HydrophobicContact CG2-CB 3.9Å; V444-T490 PolarHBondContact N-O 3.11Å; V444-T490 VanDerWaalsContact N-O 3.09Å; V444-L501 HydrophobicContact CG1-CD1 4.4Å; V444-M505 HydrophobicContact CG1-CE 4.48Å
445	D	88.8	Confident	85.6	Confident	14 Å²	14	43.2 Å²	43.2	8%	0.075	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-70.7	-10.9	177.5	62.3	-41.6	0	0	0	114	E443 A491 N492 T493 T496 I497	E443-D445 WeakPolarHBondContact CA-OD1 3.49Å; E443-D445 PolarHBondContact O-N 3.36Å; E443-D445 VanDerWaalsContact O-N 3.17Å; D445-A491 HydrophobicContact CB-CB 3.86Å; D445-N492 VanDerWaalsContact CG-N 3.32Å; D445-N492 WeakPolarHBondContact OD2-CA 3.5Å; D445-N492 VanDerWaalsContact OD2-CB 3.25Å; D445-N492 WeakPolarHBondContact OD2-CB 3.41Å; D445-N492 PolarHBondContact OD2-N 3.17Å; D445-N492 PolarHBondContact OD2-ND2 2.9Å; D445-T493 HydrophobicContact CB-CG2 4.35Å; D445-T493 PolarHBondContact OD2-N 3.38Å; D445-T496 VanDerWaalsContact CB-OG1 3.31Å; D445-T496 WeakPolarHBondContact CB-OG1 3.36Å; D445-T496 WeakPolarHBondContact O-CB 3.39Å; D445-T496 PolarHBondContact O-OG1 3.47Å; D445-I497 HydrophobicContact CB-CG1 4.12Å
446	K	86.1	Confident	85.4	Confident	96 Å²	96	42.1 Å²	42.1	42%	0.417	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-110.4	24.2	-178.5	-62	-172.4	-164.7	164.2	0	113.6	G403 E443 V444 G448	G403-K446 PolarHBondContact N-O 3.2Å; E443-K446 HydrophobicContact CB-CB 4.48Å; E443-K446 HydrophobicContact CB-CD 4.26Å; E443-K446 HydrophobicContact CB-CG 4.41Å; E443-K446 PolarHBondContact O-N 3.26Å; E443-K446 VanDerWaalsContact O-N 3.09Å; E443-K446 IonicContact OE1-NZ 3.14Å; E443-K446 PolarHBondContact OE1-NZ 2.9Å; E443-K446 WeakPolarHBondContact OE2-CD 3.28Å; E443-K446 WeakPolarHBondContact OE2-CE 3.27Å; E443-K446 IonicContact OE2-NZ 2.84Å; E443-K446 PolarHBondContact OE2-NZ 3.35Å; V444-K446 PolarHBondContact O-N 2.99Å; K446-G448 PolarHBondContact O-N 3.29Å
447	L	85.3	Confident	85.2	Confident	31 Å²	31	44 Å²	44	16%	0.162	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-68.3	127.1	171.8	-70.9	169.8	0	0	0	110.1	L401 V404 V444 P455 L459 L501	L401-L447 HydrophobicContact CB-CD2 4Å; V404-L447 HydrophobicContact CB-CD2 4.15Å; V444-L447 HydrophobicContact CG1-CD1 3.87Å; V444-L447 WeakPolarHBondContact O-CD1 3.47Å; V444-L447 WeakPolarHBondContact O-CG 3.36Å; L447-P455 HydrophobicContact CD2-CB 4.38Å; L447-P455 HydrophobicContact CD2-CG 4.33Å; L447-L459 HydrophobicContact CD1-CD1 3.58Å; L447-L459 HydrophobicContact CD2-CD1 4.31Å; L447-L501 HydrophobicContact CD1-CD1 4.4Å
448	G	78	Confident	84.9	Confident	21 Å²	21	44 Å²	44	22%	0.216	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-89	148.1	175.1	0	0	0	0	0	111.2	V404 K446 P455	V404-G448 PolarHBondContact O-N 3.4Å; K446-G448 PolarHBondContact O-N 3.29Å; G448-P455 WeakPolarHBondContact O-CD 3.49Å; G448-P455 VanDerWaalsContact O-CG 3.29Å; G448-P455 WeakPolarHBondContact O-CG 3.14Å
449	K	75.6	Confident	84.8	Confident	164 Å²	164	44 Å²	44	71%	0.713	24%	0.235	S	C	*	.	P	Polyproline II helix	trans	-97.9	123.8	167.2	-69.4	-175.4	175.2	-175.6	0	108.7
450	S	77.2	Confident	84.5	Confident	44 Å²	44	45.9 Å²	45.9	31%	0.308	25%	0.245	S	C	.	.	B	Isolated β-bridge	trans	-113.7	170.9	172.6	75.9	0	0	0	0	111.2	C405 Q452	C405-S450 WeakPolarHBondContact O-CB 3.32Å; C405-S450 PolarHBondContact O-OG 3.43Å; S450-Q452 PolarHBondContact O-N 2.9Å; S450-Q452 PolarHBondContact OG-N 2.92Å
451	L	69.3	Low	84.1	Confident	189 Å²	189	47.1 Å²	47.1	99%	0.99	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-20.4	172.7	-75.3	152.1	0	0	0	112.8
452	Q	68.7	Low	83.9	Confident	155 Å²	155	47 Å²	47	72%	0.724	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-12.7	-173.7	-75.5	171.8	-30.9	0	0	113.5	S450	S450-Q452 PolarHBondContact O-N 2.9Å; S450-Q452 PolarHBondContact OG-N 2.92Å
453	G	75.3	Confident	83.6	Confident	21 Å²	21	46.4 Å²	46.4	22%	0.216	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	156	169.6	176	0	0	0	0	0	112.2	P455	G453-P455 WeakPolarHBondContact O-CD 3.41Å
454	D	82.5	Confident	83.2	Confident	58 Å²	58	44 Å²	44	31%	0.31	24%	0.236	S	C	.	.			trans	-98.9	109.5	172.9	-167.1	-10.5	0	0	0	109.5	A456 A457	D454-A456 PolarHBondContact O-N 2.95Å; D454-A456 WeakPolarHBondContact OD1-CB 3.44Å; D454-A456 PolarHBondContact OD1-N 3.49Å; D454-A457 HydrophobicContact CB-CB 4.35Å; D454-A457 WeakPolarHBondContact O-CB 3.19Å; D454-A457 PolarHBondContact O-N 3.35Å
455	P	87.3	Confident	82.8	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-61.4	-24.3	176.5	25.8	-33.9	0	0	0	112	V404 I410 L447 G448 G453 A457 A458 L459	V404-P455 HydrophobicContact CG1-CB 4.03Å; I410-P455 HydrophobicContact CD1-CB 3.93Å; I410-P455 VanDerWaalsContact CD1-O 3.31Å; I410-P455 WeakPolarHBondContact CD1-O 3.22Å; L447-P455 HydrophobicContact CD2-CB 4.38Å; L447-P455 HydrophobicContact CD2-CG 4.33Å; G448-P455 WeakPolarHBondContact O-CD 3.49Å; G448-P455 VanDerWaalsContact O-CG 3.29Å; G448-P455 WeakPolarHBondContact O-CG 3.14Å; G453-P455 WeakPolarHBondContact O-CD 3.41Å; P455-A457 VanDerWaalsContact C-N 3.29Å; P455-A457 PolarHBondContact O-N 3.21Å; P455-A458 PolarHBondContact O-N 3.32Å; P455-L459 PolarHBondContact O-N 2.96Å
456	A	86.7	Confident	82.4	Confident	2 Å²	2	51.9 Å²	51.9	2%	0.017	28%	0.276	C	S	.	.	H	α-helix	trans	-63.7	-35.3	175.4	0	0	0	0	0	112.1	D454 A458 L459 L460 P498 L501	D454-A456 PolarHBondContact O-N 2.95Å; D454-A456 WeakPolarHBondContact OD1-CB 3.44Å; D454-A456 PolarHBondContact OD1-N 3.49Å; A456-A458 VanDerWaalsContact C-N 3.34Å; A456-L459 PolarHBondContact O-N 2.89Å; A456-L460 VanDerWaalsContact O-CG 3.31Å; A456-L460 WeakPolarHBondContact O-CG 3.18Å; A456-L460 PolarHBondContact O-N 2.86Å; A456-P498 HydrophobicContact CB-CB 4.26Å; A456-P498 HydrophobicContact CB-CG 3.8Å; A456-L501 HydrophobicContact CB-CD1 4Å
457	A	86.3	Confident	82.4	Confident	46 Å²	46	51.8 Å²	51.8	38%	0.38	28%	0.277	S	S	.	.	H	α-helix	trans	-66.4	-37.4	176.7	0	0	0	0	0	111.9	D454 P455 L460 E461	D454-A457 HydrophobicContact CB-CB 4.35Å; D454-A457 WeakPolarHBondContact O-CB 3.19Å; D454-A457 PolarHBondContact O-N 3.35Å; P455-A457 VanDerWaalsContact C-N 3.29Å; P455-A457 PolarHBondContact O-N 3.21Å; A457-L460 PolarHBondContact O-N 3.39Å; A457-E461 PolarHBondContact O-N 3.09Å
458	A	87.9	Confident	82.5	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-66.8	-39.9	174.3	0	0	0	0	0	112.1	Q407 I410 R411 P455 A456 L460 E461 V462	Q407-A458 HydrophobicContact CB-CB 4.46Å; Q407-A458 HydrophobicContact CG-CB 3.9Å; I410-A458 HydrophobicContact CB-CB 4.01Å; I410-A458 HydrophobicContact CD1-CB 3.96Å; I410-A458 HydrophobicContact CG2-CB 4.02Å; R411-A458 HydrophobicContact CG-CB 4.19Å; P455-A458 PolarHBondContact O-N 3.32Å; A456-A458 VanDerWaalsContact C-N 3.34Å; A458-L460 VanDerWaalsContact C-N 3.33Å; A458-E461 PolarHBondContact O-N 2.97Å; A458-V462 WeakPolarHBondContact O-CG2 3.36Å; A458-V462 PolarHBondContact O-N 3.49Å
459	L	88.9	Confident	82.9	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-65.2	-37.1	173.4	-68.3	175.2	0	0	0	112	L401 I410 L447 P455 A456 E461 V462 L463 L501	L401-L459 HydrophobicContact CD1-CD1 3.75Å; L401-L459 HydrophobicContact CD1-CD2 4.14Å; L401-L459 HydrophobicContact CD2-CD2 4.37Å; I410-L459 HydrophobicContact CD1-CD1 4.33Å; I410-L459 HydrophobicContact CD1-CD2 3.63Å; I410-L459 HydrophobicContact CD1-CG 3.56Å; I410-L459 HydrophobicContact CG1-CD2 4.15Å; I410-L459 HydrophobicContact CG2-CD2 4.32Å; L447-L459 HydrophobicContact CD1-CD1 3.58Å; L447-L459 HydrophobicContact CD2-CD1 4.31Å; P455-L459 PolarHBondContact O-N 2.96Å; A456-L459 PolarHBondContact O-N 2.89Å; L459-E461 VanDerWaalsContact C-N 3.31Å; L459-E461 PolarHBondContact O-N 3.42Å; L459-V462 PolarHBondContact O-N 3.07Å; L459-L463 HydrophobicContact CB-CD1 4.27Å; L459-L463 WeakPolarHBondContact O-CB 3.48Å; L459-L463 WeakPolarHBondContact O-CG 3.43Å; L459-L463 PolarHBondContact O-N 3.03Å; L459-L501 HydrophobicContact CB-CD2 4.25Å
460	L	88.1	Confident	83.5	Confident	38 Å²	38	51.6 Å²	51.6	20%	0.199	28%	0.275	C	S	.	.	H	α-helix	trans	-59.1	-42.6	178.6	-77.3	167.6	0	0	0	111.9	A456 A457 A458 V462 L463 D464 A500 L501	A456-L460 VanDerWaalsContact O-CG 3.31Å; A456-L460 WeakPolarHBondContact O-CG 3.18Å; A456-L460 PolarHBondContact O-N 2.86Å; A457-L460 PolarHBondContact O-N 3.39Å; A458-L460 VanDerWaalsContact C-N 3.33Å; L460-V462 PolarHBondContact O-N 3.2Å; L460-L463 PolarHBondContact O-N 3.45Å; L460-D464 WeakPolarHBondContact O-CB 3.31Å; L460-D464 PolarHBondContact O-N 2.98Å; L460-A500 HydrophobicContact CD1-CB 3.81Å; L460-A500 HydrophobicContact CD2-CB 4.35Å; L460-A500 WeakPolarHBondContact CD2-O 3.42Å; L460-L501 HydrophobicContact CD2-CD2 3.55Å; L460-L501 HydrophobicContact CD2-CG 4.07Å; L460-L501 HydrophobicContact CG-CD2 3.78Å; L460-L501 HydrophobicContact CG-CG 4.24Å
461	E	87.3	Confident	84.2	Confident	26 Å²	26	49.5 Å²	49.5	12%	0.121	26%	0.26	C	S	.	.	H	α-helix	trans	-63.2	-41.2	175.9	-177.8	-169.4	-156.5	0	0	112.4	R411 A457 A458 L459 L463 Q467 F471	R411-E461 IonicContact CZ-OE2 3.99Å; R411-E461 IonicContact NE-OE2 2.99Å; R411-E461 PolarHBondContact NE-OE2 3.27Å; R411-E461 VanDerWaalsContact NH2-CD 3.34Å; R411-E461 IonicContact NH2-OE1 3.85Å; R411-E461 IonicContact NH2-OE2 2.71Å; R411-E461 PolarHBondContact NH2-OE2 2.92Å; A457-E461 PolarHBondContact O-N 3.09Å; A458-E461 PolarHBondContact O-N 2.97Å; L459-E461 VanDerWaalsContact C-N 3.31Å; L459-E461 PolarHBondContact O-N 3.42Å; E461-L463 VanDerWaalsContact C-N 3.33Å; E461-Q467 HydrophobicContact CG-CB 4.31Å; E461-F471 HydrophobicContact CG-CD2 4.32Å
462	V	88.7	Confident	85.1	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-66.7	-38.2	178.3	173	0	0	0	0	111.5	I410 I425 A458 L459 L460 F471 L482 F487	I410-V462 HydrophobicContact CG2-CG2 4.15Å; I425-V462 HydrophobicContact CD1-CG1 4.19Å; I425-V462 HydrophobicContact CG1-CG1 4.45Å; I425-V462 HydrophobicContact CG1-CG2 4.33Å; A458-V462 WeakPolarHBondContact O-CG2 3.36Å; A458-V462 PolarHBondContact O-N 3.49Å; L459-V462 PolarHBondContact O-N 3.07Å; L460-V462 PolarHBondContact O-N 3.2Å; V462-F471 HydrophobicContact CG2-CD2 3.73Å; V462-F471 HydrophobicContact CG2-CE2 3.37Å; V462-F471 HydrophobicContact CG2-CZ 3.98Å; V462-L482 HydrophobicContact CG1-CD1 4.03Å; V462-F487 HydrophobicContact CG1-CE1 3.64Å; V462-F487 HydrophobicContact CG1-CE2 4.26Å; V462-F487 HydrophobicContact CG1-CZ 3.45Å; V462-F487 VanDerWaalsContact CG1-CZ 3.45Å
463	L	85.9	Confident	86.2	Confident	8 Å²	8	35.7 Å²	35.7	4%	0.042	19%	0.194	C	C	.	.	H	α-helix	trans	-87.9	-19.5	-172.8	-71.1	-178.8	0	0	0	113.2	I370 L441 L459 L460 E461 P465 F487 L501 M505	I370-L463 HydrophobicContact CD1-CB 3.52Å; I370-L463 HydrophobicContact CD1-CD1 4.12Å; I370-L463 HydrophobicContact CD1-CD2 3.68Å; I370-L463 HydrophobicContact CD1-CG 3.94Å; I370-L463 HydrophobicContact CG1-CD2 4.3Å; L441-L463 HydrophobicContact CD1-CD1 4.35Å; L441-L463 HydrophobicContact CD1-CD2 3.95Å; L459-L463 HydrophobicContact CB-CD1 4.27Å; L459-L463 WeakPolarHBondContact O-CB 3.48Å; L459-L463 WeakPolarHBondContact O-CG 3.43Å; L459-L463 PolarHBondContact O-N 3.03Å; L460-L463 PolarHBondContact O-N 3.45Å; E461-L463 VanDerWaalsContact C-N 3.33Å; L463-P465 VanDerWaalsContact O-CD 3.29Å; L463-P465 WeakPolarHBondContact O-CD 3.14Å; L463-F487 HydrophobicContact CD2-CB 3.7Å; L463-F487 HydrophobicContact CD2-CD1 3.86Å; L463-F487 HydrophobicContact CD2-CD2 4.04Å; L463-F487 HydrophobicContact CD2-CG 3.59Å; L463-L501 HydrophobicContact CD1-CD2 3.81Å; L463-M505 HydrophobicContact CD1-CE 3.89Å
464	D	83.8	Confident	86.9	Confident	8 Å²	8	37.6 Å²	37.6	4%	0.043	20%	0.198	C	C	.	.			trans	-72.7	117.4	-179.8	-167.5	-7.6	0	0	0	111.3	L460 E466 Q467 N468 R504	L460-D464 WeakPolarHBondContact O-CB 3.31Å; L460-D464 PolarHBondContact O-N 2.98Å; D464-E466 PolarHBondContact O-N 3.22Å; D464-E466 PolarHBondContact OD1-N 3.45Å; D464-E466 VanDerWaalsContact OD1-N 3.15Å; D464-Q467 HydrophobicContact CB-CB 4.11Å; D464-Q467 HydrophobicContact CB-CG 4.16Å; D464-Q467 PolarHBondContact O-N 3.5Å; D464-N468 VanDerWaalsContact O-CB 3.29Å; D464-N468 WeakPolarHBondContact O-CB 3.36Å; D464-N468 PolarHBondContact O-N 3.26Å; D464-R504 IonicContact OD1-CZ 3.84Å; D464-R504 IonicContact OD1-NH1 3.66Å; D464-R504 PolarHBondContact OD1-NH1 2.9Å; D464-R504 IonicContact OD1-NH2 3.28Å; D464-R504 IonicContact OD2-CZ 2.79Å; D464-R504 VanDerWaalsContact OD2-CZ 3.27Å; D464-R504 IonicContact OD2-NH1 2.74Å; D464-R504 PolarHBondContact OD2-NH1 2.87Å; D464-R504 IonicContact OD2-NH2 3.23Å; D464-R504 PolarHBondContact OD2-NH2 3.47Å
465	P	80.4	Confident	87.3	Confident	42 Å²	42	35.3 Å²	35.3	27%	0.273	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-14.8	177.3	-21.6	33.6	0	0	0	114.7	K367 L463 N468	K367-P465 HydrophobicContact CB-CB 4.26Å; K367-P465 HydrophobicContact CD-CB 4.47Å; K367-P465 HydrophobicContact CG-CB 4.17Å; L463-P465 VanDerWaalsContact O-CD 3.29Å; L463-P465 WeakPolarHBondContact O-CD 3.14Å; P465-N468 PolarHBondContact O-OD1 3.07Å
466	E	82.1	Confident	87.4	Confident	138 Å²	138	35.4 Å²	35.4	65%	0.645	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-22.3	175.1	-62.1	-167.6	160.2	0	0	113.3	D464 H469	D464-E466 PolarHBondContact O-N 3.22Å; D464-E466 PolarHBondContact OD1-N 3.45Å; D464-E466 VanDerWaalsContact OD1-N 3.15Å; E466-H469 PolarHBondContact O-CD2 3.49Å; E466-H469 PolarHBondContact O-NE2 3.1Å
467	Q	84.7	Confident	87.5	Confident	95 Å²	95	41.8 Å²	41.8	44%	0.444	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-24.7	-175.8	-58.2	-176.7	-1.2	0	0	112.8	E461 D464 H469 N470	E461-Q467 HydrophobicContact CG-CB 4.31Å; D464-Q467 HydrophobicContact CB-CB 4.11Å; D464-Q467 HydrophobicContact CB-CG 4.16Å; D464-Q467 PolarHBondContact O-N 3.5Å; Q467-H469 PolarHBondContact O-N 3.21Å; Q467-N470 CarbonylContact O-C 3.55Å; Q467-N470 PolarHBondContact O-N 2.88Å
468	N	86.9	Confident	87.7	Confident	17 Å²	17	40.1 Å²	40.1	9%	0.091	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-59.8	-23.4	-173.8	67.6	0.3	0	0	0	114.7	D464 P465 N470 L482	D464-N468 VanDerWaalsContact O-CB 3.29Å; D464-N468 WeakPolarHBondContact O-CB 3.36Å; D464-N468 PolarHBondContact O-N 3.26Å; P465-N468 PolarHBondContact O-OD1 3.07Å; N468-N470 VanDerWaalsContact C-N 3.26Å; N468-N470 PolarHBondContact O-N 3.39Å; N468-L482 HydrophobicContact CB-CB 4.21Å; N468-L482 WeakPolarHBondContact O-CB 3.33Å; N468-L482 PolarHBondContact O-N 3.05Å
469	H	87.1	Confident	87.8	Confident	108 Å²	108	41.2 Å²	41.2	50%	0.5	21%	0.213	S	C	.	.	G	3₁₀ helix	trans	-72	-19.2	177.5	74.6	79.3	0	0	0	113.5	E466 Q467 D481	E466-H469 PolarHBondContact O-CD2 3.49Å; E466-H469 PolarHBondContact O-NE2 3.1Å; Q467-H469 PolarHBondContact O-N 3.21Å; H469-D481 WeakPolarHBondContact CA-OD1 3.5Å
470	N	88.8	Confident	87.8	Confident	86 Å²	86	41.4 Å²	41.4	46%	0.46	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-127.9	38.7	-177.6	-166.4	53.2	0	0	0	110.6	Q467 N468 T472 A479	Q467-N470 CarbonylContact O-C 3.55Å; Q467-N470 PolarHBondContact O-N 2.88Å; N468-N470 VanDerWaalsContact C-N 3.26Å; N468-N470 PolarHBondContact O-N 3.39Å; N470-T472 PolarHBondContact O-N 3.33Å; N470-A479 WeakPolarHBondContact OD1-CB 3.38Å
471	F	90.9	Very high	87.9	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	129	179.8	172.7	-105.9	0	0	0	110.1	R411 I426 E461 V462 D473 A479 F480 L482	R411-F471 HydrophobicContact CG-CE2 4.31Å; R411-F471 HydrophobicContact CG-CZ 4.4Å; I426-F471 HydrophobicContact CD1-CE1 4.25Å; I426-F471 HydrophobicContact CG1-CE1 4.4Å; E461-F471 HydrophobicContact CG-CD2 4.32Å; V462-F471 HydrophobicContact CG2-CD2 3.73Å; V462-F471 HydrophobicContact CG2-CE2 3.37Å; V462-F471 HydrophobicContact CG2-CZ 3.98Å; F471-D473 HydrophobicContact CE1-CB 4.05Å; F471-A479 WeakPolarHBondContact O-CA 3.17Å; F471-F480 PolarHBondContact N-O 2.93Å; F471-F480 PolarHBondContact O-N 3.07Å; F471-L482 HydrophobicContact CB-CD1 3.69Å; F471-L482 HydrophobicContact CB-CG 4.11Å; F471-L482 HydrophobicContact CD1-CD1 3.66Å; F471-L482 HydrophobicContact CD1-CG 4.37Å; F471-L482 HydrophobicContact CD2-CD1 4.28Å; F471-L482 HydrophobicContact CE1-CD1 4.36Å; F471-L482 HydrophobicContact CG-CD1 3.6Å; F471-L482 HydrophobicContact CG-CG 4.42Å
472	T	89.1	Confident	88	Confident	53 Å²	53	42.1 Å²	42.1	33%	0.325	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	112.1	-179.5	56	0	0	0	0	111.1	N470 A479	N470-T472 PolarHBondContact O-N 3.33Å; T472-A479 HydrophobicContact CG2-CB 4.5Å
473	D	90.9	Very high	87.9	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.005	24%	0.236	C	C	.	.			trans	-82.9	138.7	170.8	-179.2	-76.5	0	0	0	109.8	R411 G423 I426 F471 Y475 L476 N477	R411-D473 CarbonylContact O-C 3.56Å; G423-D473 WeakPolarHBondContact CA-OD2 3.36Å; G423-D473 PolarHBondContact N-OD2 2.96Å; I426-D473 HydrophobicContact CD1-CB 4.43Å; I426-D473 HydrophobicContact CG1-CB 3.8Å; F471-D473 HydrophobicContact CE1-CB 4.05Å; D473-Y475 VanDerWaalsContact C-N 3.26Å; D473-Y475 PolarHBondContact O-N 3.18Å; D473-Y475 VanDerWaalsContact OD1-CA 3.31Å; D473-Y475 WeakPolarHBondContact OD1-CA 3.42Å; D473-Y475 WeakPolarHBondContact OD1-CB 3.36Å; D473-Y475 PolarHBondContact OD1-N 3.3Å; D473-L476 HydrophobicContact CB-CB 3.94Å; D473-L476 PolarHBondContact O-N 2.94Å; D473-L476 PolarHBondContact OD1-N 3.44Å; D473-L476 VanDerWaalsContact OD1-N 3.08Å; D473-N477 WeakPolarHBondContact O-CA 3.42Å; D473-N477 PolarHBondContact O-N 3.22Å
474	H	91.1	Very high	87.8	Confident	61 Å²	61	47.5 Å²	47.5	28%	0.282	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-26.8	-178.2	-68.4	-36.2	0	0	0	113.4	R411 H413 R414	R411-H474 PolarHBondContact O-N 3.42Å; H413-H474 CarbonylContact O-C 3.59Å; R414-H474 HydrophobicContact CG-CB 4.2Å
475	Y	91	Very high	88.1	Confident	11 Å²	11	47.6 Å²	47.6	4%	0.043	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-46.5	174.5	-171.3	-92.9	0	0	0	110.7	Y313 L316 H413 R415 S420 P422 D473	Y313-Y475 HydrophobicContact CD2-CD1 4.34Å; Y313-Y475 AromaticContact CD2-CE1 3.95Å; Y313-Y475 HydrophobicContact CD2-CE1 3.95Å; L316-Y475 HydrophobicContact CD2-CD1 3.76Å; L316-Y475 HydrophobicContact CD2-CE1 3.67Å; H413-Y475 WeakPolarHBondContact O-CA 3.33Å; H413-Y475 VanDerWaalsContact O-CB 3.32Å; H413-Y475 WeakPolarHBondContact O-CB 3.49Å; H413-Y475 PolarHBondContact O-N 3.06Å; R415-Y475 WeakPolarHBondContact CD-O 2.93Å; R415-Y475 HydrophobicContact CG-CD2 3.74Å; R415-Y475 HydrophobicContact CG-CE2 3.81Å; R415-Y475 HydrophobicContact CG-CG 4.14Å; R415-Y475 WeakPolarHBondContact CG-O 3.19Å; S420-Y475 WeakPolarHBondContact O-CE2 3.43Å; P422-Y475 HydrophobicContact CB-CD1 3.89Å; P422-Y475 HydrophobicContact CB-CG 4.09Å; P422-Y475 HydrophobicContact CG-CD1 4.37Å; D473-Y475 VanDerWaalsContact C-N 3.26Å; D473-Y475 PolarHBondContact O-N 3.18Å; D473-Y475 VanDerWaalsContact OD1-CA 3.31Å; D473-Y475 WeakPolarHBondContact OD1-CA 3.42Å; D473-Y475 WeakPolarHBondContact OD1-CB 3.36Å; D473-Y475 PolarHBondContact OD1-N 3.3Å
476	L	88.6	Confident	88.5	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.005	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-43.2	-178	-156.3	80	0	0	0	112	Y313 L316 M317 L320 W322 D473 V478 F480	Y313-L476 PolarHBondContact OH-O 3.46Å; L316-L476 HydrophobicContact CD2-CD1 4.33Å; M317-L476 HydrophobicContact SD-CD1 3.4Å; M317-L476 WeakPolarHBondContact SD-CD1 3.49Å; M317-L476 HydrophobicContact SD-CG 3.93Å; L320-L476 HydrophobicContact CD1-CD1 3.58Å; L320-L476 HydrophobicContact CD1-CD2 4.39Å; W322-L476 HydrophobicContact CH2-CD2 4.27Å; D473-L476 HydrophobicContact CB-CB 3.94Å; D473-L476 PolarHBondContact O-N 2.94Å; D473-L476 PolarHBondContact OD1-N 3.44Å; D473-L476 VanDerWaalsContact OD1-N 3.08Å; L476-V478 HydrophobicContact CD2-CB 4.09Å; L476-V478 HydrophobicContact CG-CB 4.22Å; L476-V478 PolarHBondContact O-N 3.13Å; L476-V478 VanDerWaalsContact O-N 3.16Å; L476-F480 HydrophobicContact CD2-CB 4.44Å
477	N	88.3	Confident	88.9	Confident	136 Å²	136	40.2 Å²	40.2	73%	0.727	21%	0.213	S	C	*	.			trans	50.9	27.8	-172.8	-158.4	34	0	0	0	114.1	D473	D473-N477 WeakPolarHBondContact O-CA 3.42Å; D473-N477 PolarHBondContact O-N 3.22Å
478	V	90.4	Very high	89.2	Confident	11 Å²	11	35.7 Å²	35.7	7%	0.067	19%	0.191	C	C	.	.	S	Bend	trans	-130.6	146.5	174.9	177.8	0	0	0	0	106.8	A286 V289 M317 W322 L476	A286-V478 HydrophobicContact CB-CG1 4.07Å; V289-V478 HydrophobicContact CG2-CG2 4.19Å; M317-V478 HydrophobicContact CE-CG2 4.42Å; W322-V478 HydrophobicContact CH2-CG1 4.3Å; L476-V478 HydrophobicContact CD2-CB 4.09Å; L476-V478 HydrophobicContact CG-CB 4.22Å; L476-V478 PolarHBondContact O-N 3.13Å; L476-V478 VanDerWaalsContact O-N 3.16Å
479	A	89.9	Confident	89.5	Confident	24 Å²	24	34.9 Å²	34.9	20%	0.198	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	131.6	175.5	0	0	0	0	0	111.2	N470 F471 T472	N470-A479 WeakPolarHBondContact OD1-CB 3.38Å; F471-A479 WeakPolarHBondContact O-CA 3.17Å; T472-A479 HydrophobicContact CG2-CB 4.5Å
480	F	90.3	Very high	89.8	Confident	5 Å²	5	29.8 Å²	29.8	2%	0.022	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	135.3	173.2	-160.9	-82.8	0	0	0	109.9	L320 W322 I426 L429 F471 L476 L482	L320-F480 HydrophobicContact CB-CE2 4.21Å; W322-F480 HydrophobicContact CD2-CE2 4.1Å; W322-F480 AromaticContact CE3-CD2 3.9Å; W322-F480 HydrophobicContact CE3-CD2 3.9Å; W322-F480 AromaticContact CE3-CE2 3.76Å; W322-F480 HydrophobicContact CE3-CE2 3.76Å; W322-F480 AromaticContact CH2-CD2 3.89Å; W322-F480 HydrophobicContact CH2-CD2 3.89Å; W322-F480 HydrophobicContact CH2-CE2 4.3Å; W322-F480 AromaticContact CZ3-CD2 3.54Å; W322-F480 HydrophobicContact CZ3-CD2 3.54Å; W322-F480 AromaticContact CZ3-CE2 3.89Å; W322-F480 HydrophobicContact CZ3-CE2 3.89Å; I426-F480 HydrophobicContact CD1-CB 4.4Å; I426-F480 HydrophobicContact CD1-CG 4.42Å; L429-F480 HydrophobicContact CD1-CD1 3.79Å; L429-F480 HydrophobicContact CD1-CE1 3.4Å; L429-F480 HydrophobicContact CD1-CZ 3.95Å; F471-F480 PolarHBondContact N-O 2.93Å; F471-F480 PolarHBondContact O-N 3.07Å; L476-F480 HydrophobicContact CD2-CB 4.44Å; F480-L482 HydrophobicContact CD1-CD2 3.84Å; F480-L482 HydrophobicContact CD1-CG 4.46Å; F480-L482 HydrophobicContact CE1-CD2 4.28Å
481	D	89.6	Confident	89.9	Confident	80 Å²	80	25.8 Å²	25.8	43%	0.428	14%	0.142	S	C	.	.			trans	-86	112.7	-179.2	-176.4	5.2	0	0	0	110.6	H469 S483	H469-D481 WeakPolarHBondContact CA-OD1 3.5Å; D481-S483 VanDerWaalsContact CG-OG 3.29Å; D481-S483 WeakPolarHBondContact OD1-CB 3.37Å; D481-S483 PolarHBondContact OD1-N 3Å; D481-S483 PolarHBondContact OD1-OG 3.43Å; D481-S483 PolarHBondContact OD2-OG 3.24Å
482	L	89.1	Confident	89.8	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.151	C	C	.	.			trans	-101	6.4	176.1	-59.3	177.1	0	0	0	112.9	I425 L429 V462 N468 F471 F480 Q484 V485	I425-L482 HydrophobicContact CG2-CD1 3.94Å; I425-L482 HydrophobicContact CG2-CD2 4.03Å; L429-L482 HydrophobicContact CD1-CD2 3.68Å; V462-L482 HydrophobicContact CG1-CD1 4.03Å; N468-L482 HydrophobicContact CB-CB 4.21Å; N468-L482 WeakPolarHBondContact O-CB 3.33Å; N468-L482 PolarHBondContact O-N 3.05Å; F471-L482 HydrophobicContact CB-CD1 3.69Å; F471-L482 HydrophobicContact CB-CG 4.11Å; F471-L482 HydrophobicContact CD1-CD1 3.66Å; F471-L482 HydrophobicContact CD1-CG 4.37Å; F471-L482 HydrophobicContact CD2-CD1 4.28Å; F471-L482 HydrophobicContact CE1-CD1 4.36Å; F471-L482 HydrophobicContact CG-CD1 3.6Å; F471-L482 HydrophobicContact CG-CG 4.42Å; F480-L482 HydrophobicContact CD1-CD2 3.84Å; F480-L482 HydrophobicContact CD1-CG 4.46Å; F480-L482 HydrophobicContact CE1-CD2 4.28Å; L482-Q484 PolarHBondContact O-N 2.82Å; L482-V485 HydrophobicContact CB-CG2 4.27Å; L482-V485 HydrophobicContact CD2-CG2 4.1Å; L482-V485 WeakPolarHBondContact O-CB 3.37Å; L482-V485 WeakPolarHBondContact O-CG2 3.32Å; L482-V485 PolarHBondContact O-N 3.39Å; L482-V485 VanDerWaalsContact O-N 3.11Å
483	S	85.9	Confident	89.5	Confident	51 Å²	51	26.3 Å²	26.3	36%	0.357	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-27.2	-174.7	66	0	0	0	0	114.3	D481	D481-S483 VanDerWaalsContact CG-OG 3.29Å; D481-S483 WeakPolarHBondContact OD1-CB 3.37Å; D481-S483 PolarHBondContact OD1-N 3Å; D481-S483 PolarHBondContact OD1-OG 3.43Å; D481-S483 PolarHBondContact OD2-OG 3.24Å
484	Q	85.4	Confident	89.3	Confident	69 Å²	69	29 Å²	29	32%	0.322	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-10.4	-180	-64.1	-60.7	-33.8	0	0	113.9	R394 N436 L482	R394-Q484 PolarHBondContact NH1-O 3.2Å; N436-Q484 HydrophobicContact CB-CB 3.99Å; L482-Q484 PolarHBondContact O-N 2.82Å
485	V	89.1	Confident	88.8	Confident	11 Å²	11	30.3 Å²	30.3	7%	0.067	18%	0.182	C	C	.	.			trans	-78.3	132	-178.6	-176.2	0	0	0	0	109.5	L429 N435 P437 F439 L482 F487	L429-V485 HydrophobicContact CD2-CG2 4.47Å; N435-V485 WeakPolarHBondContact O-CG2 3.22Å; P437-V485 HydrophobicContact CG-CG1 4.39Å; F439-V485 HydrophobicContact CB-CG1 4.31Å; F439-V485 HydrophobicContact CD2-CG1 3.38Å; F439-V485 HydrophobicContact CE2-CG1 3.89Å; F439-V485 HydrophobicContact CG-CG1 4.03Å; L482-V485 HydrophobicContact CB-CG2 4.27Å; L482-V485 HydrophobicContact CD2-CG2 4.1Å; L482-V485 WeakPolarHBondContact O-CB 3.37Å; L482-V485 WeakPolarHBondContact O-CG2 3.32Å; L482-V485 PolarHBondContact O-N 3.39Å; L482-V485 VanDerWaalsContact O-N 3.11Å; V485-F487 HydrophobicContact CB-CE2 3.89Å; V485-F487 HydrophobicContact CB-CZ 4.07Å; V485-F487 HydrophobicContact CG1-CD2 4.34Å; V485-F487 HydrophobicContact CG1-CE1 4.07Å; V485-F487 HydrophobicContact CG1-CE2 3.87Å; V485-F487 HydrophobicContact CG1-CZ 3.72Å
486	L	88.4	Confident	88.5	Confident	13 Å²	13	33.8 Å²	33.8	7%	0.068	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	114.5	173.7	177.5	57.4	0	0	0	109.8	Y356 L392 P437 V438 F439 I488	Y356-L486 HydrophobicContact CE1-CD1 4.16Å; Y356-L486 HydrophobicContact CE1-CD2 4.14Å; Y356-L486 WeakPolarHBondContact OH-CD1 3.47Å; L392-L486 HydrophobicContact CD1-CD2 3.66Å; P437-L486 PolarHBondContact O-N 3.18Å; V438-L486 CarbonylContact C-O 3.47Å; V438-L486 WeakPolarHBondContact CA-O 3.39Å; V438-L486 HydrophobicContact CG1-CD2 4.4Å; V438-L486 HydrophobicContact CG1-CG 4.43Å; V438-L486 HydrophobicContact CG2-CB 4.23Å; V438-L486 HydrophobicContact CG2-CD2 4.15Å; F439-L486 PolarHBondContact N-O 2.85Å; L486-I488 HydrophobicContact CG-CG1 4.4Å
487	F	90.6	Very high	88.5	Confident	12 Å²	12	34 Å²	34	5%	0.053	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	131.2	174.3	-63.4	-83.2	0	0	0	111.1	I370 F439 L441 V462 L463 V485	I370-F487 HydrophobicContact CG2-CB 4.24Å; F439-F487 HydrophobicContact CB-CD1 3.96Å; F439-F487 HydrophobicContact CB-CE1 4.15Å; F439-F487 HydrophobicContact CD2-CD1 4.38Å; F439-F487 AromaticContact CD2-CE1 3.73Å; F439-F487 HydrophobicContact CD2-CE1 3.73Å; F439-F487 HydrophobicContact CD2-CZ 4.28Å; F439-F487 HydrophobicContact CG-CE1 4.45Å; F439-F487 WeakPolarHBondContact O-CA 3.41Å; L441-F487 HydrophobicContact CD1-CD1 4.3Å; L441-F487 HydrophobicContact CG-CD1 4.48Å; V462-F487 HydrophobicContact CG1-CE1 3.64Å; V462-F487 HydrophobicContact CG1-CE2 4.26Å; V462-F487 HydrophobicContact CG1-CZ 3.45Å; V462-F487 VanDerWaalsContact CG1-CZ 3.45Å; L463-F487 HydrophobicContact CD2-CB 3.7Å; L463-F487 HydrophobicContact CD2-CD1 3.86Å; L463-F487 HydrophobicContact CD2-CD2 4.04Å; L463-F487 HydrophobicContact CD2-CG 3.59Å; V485-F487 HydrophobicContact CB-CE2 3.89Å; V485-F487 HydrophobicContact CB-CZ 4.07Å; V485-F487 HydrophobicContact CG1-CD2 4.34Å; V485-F487 HydrophobicContact CG1-CE1 4.07Å; V485-F487 HydrophobicContact CG1-CE2 3.87Å; V485-F487 HydrophobicContact CG1-CZ 3.72Å
488	I	92.3	Very high	88.4	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	125.1	170.2	-58.3	177.3	0	0	0	107	F373 V388 V438 F439 L440 L441 L486	F373-I488 HydrophobicContact CD2-CG2 3.87Å; F373-I488 HydrophobicContact CE2-CG2 3.48Å; F373-I488 VanDerWaalsContact CE2-CG2 3.48Å; F373-I488 HydrophobicContact CZ-CG2 3.97Å; V388-I488 HydrophobicContact CB-CD1 4.31Å; V388-I488 HydrophobicContact CG1-CD1 4.07Å; V438-I488 HydrophobicContact CG1-CD1 3.69Å; V438-I488 HydrophobicContact CG1-CG1 4.19Å; F439-I488 PolarHBondContact O-N 3.31Å; L440-I488 CarbonylContact C-O 3.57Å; L440-I488 VanDerWaalsContact CA-O 3.32Å; L440-I488 WeakPolarHBondContact CA-O 3.45Å; L440-I488 HydrophobicContact CD1-CB 3.85Å; L440-I488 HydrophobicContact CD1-CG2 3.61Å; L441-I488 PolarHBondContact N-O 3.19Å; L486-I488 HydrophobicContact CG-CG1 4.4Å
489	A	93	Very high	88.3	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	149.4	176.2	0	0	0	0	0	111	I370 L371 C372 F373 L441 V444 M505	I370-A489 HydrophobicContact CG2-CB 4.5Å; L371-A489 PolarHBondContact O-N 3.19Å; C372-A489 CarbonylContact C-O 3.55Å; C372-A489 WeakPolarHBondContact CA-O 3.04Å; C372-A489 HydrophobicContact CB-CB 4.14Å; F373-A489 PolarHBondContact N-O 2.69Å; L441-A489 CarbonylContact O-C 3.57Å; L441-A489 WeakPolarHBondContact O-CA 3.08Å; V444-A489 HydrophobicContact CG2-CB 3.9Å; A489-M505 HydrophobicContact CB-CE 4.23Å; A489-M505 HydrophobicContact CB-SD 4.28Å
490	T	93.4	Very high	88.1	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.006	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	144	168.5	69	0	0	0	0	110.8	F373 K381 L440 L441 D442 E443 V444	F373-T490 HydrophobicContact CB-CG2 4.29Å; F373-T490 HydrophobicContact CD2-CG2 4.24Å; F373-T490 WeakPolarHBondContact O-CA 3.45Å; K381-T490 HydrophobicContact CB-CG2 4Å; L440-T490 HydrophobicContact CD1-CG2 3.66Å; L440-T490 HydrophobicContact CG-CG2 4.33Å; L441-T490 PolarHBondContact O-N 2.93Å; D442-T490 WeakPolarHBondContact CA-OG1 3.13Å; D442-T490 PolarHBondContact OD1-OG1 2.72Å; E443-T490 PolarHBondContact N-O 2.81Å; V444-T490 PolarHBondContact N-O 3.11Å; V444-T490 VanDerWaalsContact N-O 3.09Å
491	A	91.3	Very high	87.9	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.008	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	160.7	179	0	0	0	0	0	110.5	F373 V374 G375 K381 D445 I497	F373-A491 PolarHBondContact O-N 3.33Å; V374-A491 WeakPolarHBondContact CA-O 3.29Å; V374-A491 HydrophobicContact CG2-CB 4.26Å; G375-A491 PolarHBondContact N-O 3.03Å; K381-A491 VanDerWaalsContact CE-O 3.31Å; K381-A491 WeakPolarHBondContact CE-O 3.4Å; K381-A491 PolarHBondContact NZ-O 3.28Å; D445-A491 HydrophobicContact CB-CB 3.86Å; A491-I497 HydrophobicContact CB-CD1 3.63Å; A491-I497 HydrophobicContact CB-CG1 4.42Å
492	N	88.6	Confident	87.8	Confident	36 Å²	36	31.8 Å²	31.8	19%	0.193	20%	0.203	C	C	.	.	S	Bend	trans	-95.3	-36.6	172.7	-52.8	-66	0	0	0	112.4	G375 K381 D445	G375-N492 VanDerWaalsContact O-CA 3.24Å; G375-N492 WeakPolarHBondContact O-CA 3.3Å; G375-N492 PolarHBondContact O-OD1 3.1Å; K381-N492 PolarHBondContact NZ-OD1 3.49Å; D445-N492 VanDerWaalsContact CG-N 3.32Å; D445-N492 WeakPolarHBondContact OD2-CA 3.5Å; D445-N492 VanDerWaalsContact OD2-CB 3.25Å; D445-N492 WeakPolarHBondContact OD2-CB 3.41Å; D445-N492 PolarHBondContact OD2-N 3.17Å; D445-N492 PolarHBondContact OD2-ND2 2.9Å
493	T	82.6	Confident	87.6	Confident	29 Å²	29	38.7 Å²	38.7	18%	0.178	24%	0.24	C	C	.	.			trans	-130.8	149	176.5	-176.1	0	0	0	0	110.9	D445 A495 T496	D445-T493 HydrophobicContact CB-CG2 4.35Å; D445-T493 PolarHBondContact OD2-N 3.38Å; T493-A495 PolarHBondContact OG1-N 3.39Å; T493-T496 HydrophobicContact CG2-CG2 3.95Å; T493-T496 WeakPolarHBondContact CG2-OG1 3.4Å
494	T	85.7	Confident	87.6	Confident	58 Å²	58	40.9 Å²	40.9	36%	0.356	24%	0.24	S	C	.	.	S	Bend	trans	-78.6	-24.9	171.1	50	0	0	0	0	112.3	V374 T496 I497 I507	V374-T494 HydrophobicContact CB-CG2 4.49Å; V374-T494 HydrophobicContact CG1-CG2 4.02Å; V374-T494 HydrophobicContact CG2-CG2 4.08Å; T494-T496 VanDerWaalsContact C-N 3.32Å; T494-T496 PolarHBondContact O-N 2.99Å; T494-I497 PolarHBondContact O-N 3.28Å; T494-I507 HydrophobicContact CG2-CD1 4.14Å; T494-I507 HydrophobicContact CG2-CG2 4.16Å
495	A	81.9	Confident	87.7	Confident	88 Å²	88	38.2 Å²	38.2	73%	0.727	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-27.5	-167.7	0	0	0	0	0	114.3	T493	T493-A495 PolarHBondContact OG1-N 3.39Å
496	T	84.8	Confident	87.7	Confident	83 Å²	83	40.1 Å²	40.1	51%	0.509	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	-6.3	-178.4	56.8	0	0	0	0	113.1	D445 T493 T494	D445-T496 VanDerWaalsContact CB-OG1 3.31Å; D445-T496 WeakPolarHBondContact CB-OG1 3.36Å; D445-T496 WeakPolarHBondContact O-CB 3.39Å; D445-T496 PolarHBondContact O-OG1 3.47Å; T493-T496 HydrophobicContact CG2-CG2 3.95Å; T493-T496 WeakPolarHBondContact CG2-OG1 3.4Å; T494-T496 VanDerWaalsContact C-N 3.32Å; T494-T496 PolarHBondContact O-N 2.99Å
497	I	87.4	Confident	87.7	Confident	7 Å²	7	43 Å²	43	4%	0.036	25%	0.251	C	S	.	.	S	Bend	trans	-76.9	132.8	179.7	-55.4	176	0	0	0	108.8	D445 A491 T494 L501 L502	D445-I497 HydrophobicContact CB-CG1 4.12Å; A491-I497 HydrophobicContact CB-CD1 3.63Å; A491-I497 HydrophobicContact CB-CG1 4.42Å; T494-I497 PolarHBondContact O-N 3.28Å; I497-L501 HydrophobicContact CG2-CB 4.19Å; I497-L502 HydrophobicContact CB-CD1 4.31Å; I497-L502 HydrophobicContact CB-CD2 3.86Å; I497-L502 HydrophobicContact CB-CG 3.98Å; I497-L502 HydrophobicContact CD1-CD2 4Å; I497-L502 HydrophobicContact CG2-CD2 3.76Å; I497-L502 HydrophobicContact CG2-CG 3.77Å
498	P	87.3	Confident	87.7	Confident	24 Å²	24	43.1 Å²	43.1	16%	0.156	25%	0.252	C	S	.	.			trans	-55.4	135.9	174.8	-26.7	34.7	0	0	0	112.5	A456 A500 L501 L502	A456-P498 HydrophobicContact CB-CB 4.26Å; A456-P498 HydrophobicContact CB-CG 3.8Å; P498-A500 VanDerWaalsContact C-N 3.28Å; P498-A500 PolarHBondContact O-N 2.96Å; P498-L501 HydrophobicContact CB-CD1 4.35Å; P498-L501 HydrophobicContact CG-CD1 4.14Å; P498-L501 PolarHBondContact O-N 2.77Å; P498-L502 PolarHBondContact O-N 3.07Å
499	P	86.9	Confident	87.3	Confident	95 Å²	95	49.4 Å²	49.4	62%	0.617	28%	0.281	S	S	*	.	H	α-helix	trans	-60.8	-35.7	-175.5	22.7	-32.9	0	0	0	112.9	L501 L502 D503	P499-L501 PolarHBondContact O-N 2.84Å; P499-L502 WeakPolarHBondContact O-CB 3.44Å; P499-L502 PolarHBondContact O-N 3.41Å; P499-L502 VanDerWaalsContact O-N 3.07Å; P499-D503 PolarHBondContact O-N 3.01Å
500	A	86.8	Confident	86.9	Confident	47 Å²	47	49.6 Å²	49.6	39%	0.388	28%	0.283	S	S	.	.	H	α-helix	trans	-61.3	-29.8	177	0	0	0	0	0	113.6	L460 P498	L460-A500 HydrophobicContact CD1-CB 3.81Å; L460-A500 HydrophobicContact CD2-CB 4.35Å; L460-A500 WeakPolarHBondContact CD2-O 3.42Å; P498-A500 VanDerWaalsContact C-N 3.28Å; P498-A500 PolarHBondContact O-N 2.96Å
501	L	86.7	Confident	86.2	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-79.9	-38.8	173.7	-74.2	171.4	0	0	0	111	V444 L447 A456 L459 L460 L463 I497 P498 P499 D503 R504 M505	V444-L501 HydrophobicContact CG1-CD1 4.4Å; L447-L501 HydrophobicContact CD1-CD1 4.4Å; A456-L501 HydrophobicContact CB-CD1 4Å; L459-L501 HydrophobicContact CB-CD2 4.25Å; L460-L501 HydrophobicContact CD2-CD2 3.55Å; L460-L501 HydrophobicContact CD2-CG 4.07Å; L460-L501 HydrophobicContact CG-CD2 3.78Å; L460-L501 HydrophobicContact CG-CG 4.24Å; L463-L501 HydrophobicContact CD1-CD2 3.81Å; I497-L501 HydrophobicContact CG2-CB 4.19Å; P498-L501 HydrophobicContact CB-CD1 4.35Å; P498-L501 HydrophobicContact CG-CD1 4.14Å; P498-L501 PolarHBondContact O-N 2.77Å; P499-L501 PolarHBondContact O-N 2.84Å; L501-D503 VanDerWaalsContact C-N 3.32Å; L501-D503 PolarHBondContact O-N 3.44Å; L501-R504 PolarHBondContact O-N 3Å; L501-M505 HydrophobicContact CB-CE 3.98Å; L501-M505 HydrophobicContact CD2-CE 4.11Å; L501-M505 HydrophobicContact CG-CE 4.49Å; L501-M505 VanDerWaalsContact O-CG 3.24Å; L501-M505 WeakPolarHBondContact O-CG 3.24Å; L501-M505 PolarHBondContact O-N 3.02Å
502	L	86.8	Confident	85.7	Confident	41 Å²	41	52.1 Å²	52.1	22%	0.215	30%	0.301	C	S	.	.	H	α-helix	trans	-59.3	-41.4	178.9	-72.2	174.5	0	0	0	112.3	I497 P498 P499 R504 M505 I507	I497-L502 HydrophobicContact CB-CD1 4.31Å; I497-L502 HydrophobicContact CB-CD2 3.86Å; I497-L502 HydrophobicContact CB-CG 3.98Å; I497-L502 HydrophobicContact CD1-CD2 4Å; I497-L502 HydrophobicContact CG2-CD2 3.76Å; I497-L502 HydrophobicContact CG2-CG 3.77Å; P498-L502 PolarHBondContact O-N 3.07Å; P499-L502 WeakPolarHBondContact O-CB 3.44Å; P499-L502 PolarHBondContact O-N 3.41Å; P499-L502 VanDerWaalsContact O-N 3.07Å; L502-R504 PolarHBondContact O-N 3.06Å; L502-R504 VanDerWaalsContact O-N 3.14Å; L502-M505 PolarHBondContact O-N 3.28Å; L502-M505 VanDerWaalsContact O-O 3.09Å; L502-I507 HydrophobicContact CD2-CD1 3.92Å; L502-I507 HydrophobicContact CD2-CG1 4.5Å
503	D	85.3	Confident	85.6	Confident	145 Å²	145	51.2 Å²	51.2	78%	0.775	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-22.3	-179.9	-69	-18.7	0	0	0	113.4	P499 L501	P499-D503 PolarHBondContact O-N 3.01Å; L501-D503 VanDerWaalsContact C-N 3.32Å; L501-D503 PolarHBondContact O-N 3.44Å
504	R	84.5	Confident	85.6	Confident	97 Å²	97	50.3 Å²	50.3	37%	0.366	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-5	179.4	-63	178.7	176.2	-107.1	17.5	113	I370 D464 L501 L502	I370-R504 PolarHBondContact N-O 3.26Å; D464-R504 IonicContact OD1-CZ 3.84Å; D464-R504 IonicContact OD1-NH1 3.66Å; D464-R504 PolarHBondContact OD1-NH1 2.9Å; D464-R504 IonicContact OD1-NH2 3.28Å; D464-R504 IonicContact OD2-CZ 2.79Å; D464-R504 VanDerWaalsContact OD2-CZ 3.27Å; D464-R504 IonicContact OD2-NH1 2.74Å; D464-R504 PolarHBondContact OD2-NH1 2.87Å; D464-R504 IonicContact OD2-NH2 3.23Å; D464-R504 PolarHBondContact OD2-NH2 3.47Å; L501-R504 PolarHBondContact O-N 3Å; L502-R504 PolarHBondContact O-N 3.06Å; L502-R504 VanDerWaalsContact O-N 3.14Å
505	M	88.7	Confident	85.5	Confident	14 Å²	14	49.9 Å²	49.9	7%	0.069	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	137.7	-177.5	-73.3	178.4	-171.3	0	0	111.1	I370 C372 V444 L463 A489 L501 L502	I370-M505 HydrophobicContact CB-CG 4.31Å; I370-M505 HydrophobicContact CG2-CG 4.47Å; I370-M505 CarbonylContact O-C 3.54Å; I370-M505 WeakPolarHBondContact O-CA 3.47Å; C372-M505 HydrophobicContact CB-CB 3.95Å; C372-M505 HydrophobicContact CB-CG 4.23Å; C372-M505 HydrophobicContact CB-SD 4Å; V444-M505 HydrophobicContact CG1-CE 4.48Å; L463-M505 HydrophobicContact CD1-CE 3.89Å; A489-M505 HydrophobicContact CB-CE 4.23Å; A489-M505 HydrophobicContact CB-SD 4.28Å; L501-M505 HydrophobicContact CB-CE 3.98Å; L501-M505 HydrophobicContact CD2-CE 4.11Å; L501-M505 HydrophobicContact CG-CE 4.49Å; L501-M505 VanDerWaalsContact O-CG 3.24Å; L501-M505 WeakPolarHBondContact O-CG 3.24Å; L501-M505 PolarHBondContact O-N 3.02Å; L502-M505 PolarHBondContact O-N 3.28Å; L502-M505 VanDerWaalsContact O-O 3.09Å
506	E	88.6	Confident	85.7	Confident	51 Å²	51	50.7 Å²	50.7	24%	0.238	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	114.2	166.6	-169.5	179.3	165.6	0	0	109.8	R352 P369 I370 C372	R352-E506 IonicContact CZ-OE1 3.85Å; R352-E506 IonicContact CZ-OE2 2.77Å; R352-E506 VanDerWaalsContact NE-CD 3.35Å; R352-E506 IonicContact NE-OE1 3.89Å; R352-E506 PolarHBondContact NE-OE1 3.04Å; R352-E506 IonicContact NE-OE2 2.71Å; R352-E506 PolarHBondContact NE-OE2 2.85Å; R352-E506 VanDerWaalsContact NH2-CD 3.29Å; R352-E506 IonicContact NH2-OE1 2.74Å; R352-E506 PolarHBondContact NH2-OE1 3.3Å; R352-E506 VanDerWaalsContact NH2-OE1 3.09Å; R352-E506 IonicContact NH2-OE2 3.03Å; R352-E506 PolarHBondContact NH2-OE2 3.37Å; P369-E506 HydrophobicContact CB-CB 4.14Å; P369-E506 HydrophobicContact CG-CB 4.16Å; I370-E506 PolarHBondContact O-N 3.22Å; C372-E506 PolarHBondContact N-O 2.84Å
507	I	89.3	Confident	85.9	Confident	74 Å²	74	48.8 Å²	48.8	38%	0.379	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	119.6	-174.9	-56.9	171	0	0	0	110.1	V374 T494 L502 Q509	V374-I507 HydrophobicContact CB-CG2 4.31Å; V374-I507 HydrophobicContact CG2-CG2 3.76Å; T494-I507 HydrophobicContact CG2-CD1 4.14Å; T494-I507 HydrophobicContact CG2-CG2 4.16Å; L502-I507 HydrophobicContact CD2-CD1 3.92Å; L502-I507 HydrophobicContact CD2-CG1 4.5Å; I507-Q509 HydrophobicContact CG2-CG 4.46Å
508	I	89.4	Confident	86	Confident	14 Å²	14	48.7 Å²	48.7	7%	0.072	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	113.8	173.8	-60.5	162.7	0	0	0	108.3	L349 R352 L371 C372 F373 V374	L349-I508 HydrophobicContact CB-CG2 4.08Å; L349-I508 HydrophobicContact CD1-CG2 4.28Å; L349-I508 HydrophobicContact CG-CG2 4.25Å; R352-I508 HydrophobicContact CB-CD1 4.14Å; R352-I508 HydrophobicContact CG-CD1 3.63Å; R352-I508 HydrophobicContact CG-CG1 4.22Å; L371-I508 HydrophobicContact CD2-CD1 3.98Å; C372-I508 PolarHBondContact O-N 2.96Å; F373-I508 HydrophobicContact CD1-CB 4.09Å; F373-I508 HydrophobicContact CD1-CD1 4.11Å; F373-I508 HydrophobicContact CD1-CG2 4.43Å; F373-I508 HydrophobicContact CE1-CD1 3.78Å; V374-I508 PolarHBondContact N-O 2.75Å
509	Q	83.6	Confident	86.2	Confident	132 Å²	132	48.7 Å²	48.7	62%	0.617	26%	0.255	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.6	122.5	179.1	-64.8	-177.5	-1.7	0	0	111.2	V374 I507 P511	V374-Q509 CarbonylContact O-C 3.58Å; V374-Q509 WeakPolarHBondContact O-CA 3.26Å; I507-Q509 HydrophobicContact CG2-CG 4.46Å; Q509-P511 WeakPolarHBondContact O-CD 3.15Å
510	V	85.1	Confident	86.5	Confident	4 Å²	4	46.9 Å²	46.9	2%	0.024	24%	0.238	C	C	.	.			trans	-107.5	100.7	174.3	-173.8	0	0	0	0	108.1	M346 L349 F373 V374 G375 P376 V379	M346-V510 HydrophobicContact CG-CG1 4.13Å; M346-V510 HydrophobicContact SD-CG1 3.78Å; L349-V510 HydrophobicContact CD1-CG2 3.51Å; F373-V510 HydrophobicContact CB-CG2 4.45Å; V374-V510 PolarHBondContact O-N 3.06Å; G375-V510 VanDerWaalsContact CA-O 3.31Å; G375-V510 WeakPolarHBondContact CA-O 3.49Å; P376-V510 WeakPolarHBondContact CD-O 2.96Å; V379-V510 HydrophobicContact CB-CG1 4.09Å; V379-V510 HydrophobicContact CG2-CB 4.19Å; V379-V510 HydrophobicContact CG2-CG1 3.7Å
511	P	78.5	Confident	86.7	Confident	45 Å²	45	45.1 Å²	45.1	29%	0.292	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-70.6	169.6	-178.6	31.8	-36.8	0	0	0	111.8	Q509	Q509-P511 WeakPolarHBondContact O-CD 3.15Å
512	G	81.8	Confident	87	Confident	10 Å²	10	45 Å²	45	10%	0.103	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-67.1	164.8	167.8	0	0	0	0	0	112.9
513	Y	85.4	Confident	87.2	Confident	16 Å²	16	45.9 Å²	45.9	6%	0.063	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-92.3	150.4	-177.7	-57.5	-64.4	0	0	0	112.9	M346 V379 E517 I521 A559 V561	M346-Y513 HydrophobicContact CG-CE1 4.4Å; V379-Y513 HydrophobicContact CB-CE2 4.15Å; V379-Y513 HydrophobicContact CG1-CE2 4.37Å; V379-Y513 PolarHBondContact O-OH 3.33Å; Y513-E517 VanDerWaalsContact CA-OE2 3.25Å; Y513-E517 WeakPolarHBondContact CA-OE2 3.38Å; Y513-E517 HydrophobicContact CD1-CB 4.5Å; Y513-I521 HydrophobicContact CD1-CD1 3.61Å; Y513-I521 HydrophobicContact CD2-CD1 3.88Å; Y513-I521 HydrophobicContact CE1-CD1 3.64Å; Y513-I521 HydrophobicContact CE2-CD1 3.86Å; Y513-I521 HydrophobicContact CG-CD1 3.74Å; Y513-A559 PolarHBondContact N-O 3.36Å; Y513-V561 HydrophobicContact CD2-CG1 3.97Å; Y513-V561 HydrophobicContact CE2-CG1 4.31Å; Y513-V561 HydrophobicContact CE2-CG2 4.49Å
514	T	83.7	Confident	87.5	Confident	11 Å²	11	45.2 Å²	45.2	7%	0.067	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-72.9	168.4	168.5	74.8	0	0	0	0	111.7	E516 E517 K518 L788 I815	T514-E516 VanDerWaalsContact C-N 3.34Å; T514-E517 HydrophobicContact CG2-CG 4.42Å; T514-E517 PolarHBondContact N-OE2 3.43Å; T514-E517 WeakPolarHBondContact OG1-CB 3.46Å; T514-E517 VanDerWaalsContact OG1-CG 3.22Å; T514-E517 WeakPolarHBondContact OG1-CG 3.47Å; T514-E517 PolarHBondContact OG1-N 3.25Å; T514-K518 WeakPolarHBondContact O-CB 3.47Å; T514-K518 VanDerWaalsContact O-CG 3.23Å; T514-K518 WeakPolarHBondContact O-CG 3.44Å; T514-K518 PolarHBondContact O-N 2.75Å; T514-L788 HydrophobicContact CG2-CD2 4.37Å; T514-I815 HydrophobicContact CG2-CD1 3.27Å; T514-I815 HydrophobicContact CG2-CG1 3.89Å
515	Q	84	Confident	87.8	Confident	49 Å²	49	43 Å²	43	23%	0.229	21%	0.205	C	C	.	.	H	α-helix	trans	-63.2	-42.3	176.7	-68.3	179.9	-1.1	0	0	111.5	K518 I519 I552 R792	Q515-K518 WeakPolarHBondContact O-CB 3.44Å; Q515-K518 PolarHBondContact O-N 3.45Å; Q515-I519 WeakPolarHBondContact O-CG1 3.44Å; Q515-I519 PolarHBondContact O-N 3.49Å; Q515-I519 VanDerWaalsContact O-N 3.07Å; Q515-I552 HydrophobicContact CG-CG2 4.28Å; Q515-R792 PolarHBondContact NE2-O 3.06Å
516	E	85.3	Confident	88	Confident	105 Å²	105	43 Å²	43	49%	0.491	21%	0.205	S	C	.	.	H	α-helix	trans	-64.2	-46	177.4	-58.3	-178.9	159	0	0	111.8	T514 K518 I519 E520	T514-E516 VanDerWaalsContact C-N 3.34Å; E516-K518 VanDerWaalsContact C-N 3.26Å; E516-K518 PolarHBondContact O-N 2.75Å; E516-I519 WeakPolarHBondContact O-CB 3.25Å; E516-I519 PolarHBondContact O-N 3.23Å; E516-I519 VanDerWaalsContact O-N 3.1Å; E516-E520 PolarHBondContact O-N 3.41Å
517	E	88.1	Confident	88.2	Confident	42 Å²	42	41.6 Å²	41.6	20%	0.196	20%	0.199	C	C	.	.	H	α-helix	trans	-59.1	-39.8	175.4	-73.5	171.3	171.9	0	0	111.2	Y344 A345 Y513 T514 I519 E520 I521	Y344-E517 HydrophobicContact CD1-CB 4.43Å; Y344-E517 HydrophobicContact CD1-CG 4.48Å; Y344-E517 HydrophobicContact CE1-CB 4.26Å; Y344-E517 HydrophobicContact CE1-CG 4.01Å; A345-E517 HydrophobicContact CB-CG 4.49Å; Y513-E517 VanDerWaalsContact CA-OE2 3.25Å; Y513-E517 WeakPolarHBondContact CA-OE2 3.38Å; Y513-E517 HydrophobicContact CD1-CB 4.5Å; T514-E517 HydrophobicContact CG2-CG 4.42Å; T514-E517 PolarHBondContact N-OE2 3.43Å; T514-E517 WeakPolarHBondContact OG1-CB 3.46Å; T514-E517 VanDerWaalsContact OG1-CG 3.22Å; T514-E517 WeakPolarHBondContact OG1-CG 3.47Å; T514-E517 PolarHBondContact OG1-N 3.25Å; E517-I519 VanDerWaalsContact C-N 3.35Å; E517-I519 PolarHBondContact O-N 3.06Å; E517-E520 PolarHBondContact O-N 3.22Å; E517-I521 WeakPolarHBondContact O-CB 3.49Å; E517-I521 WeakPolarHBondContact O-CD1 3.22Å; E517-I521 WeakPolarHBondContact O-CG1 3.5Å; E517-I521 PolarHBondContact O-N 2.85Å
518	K	90.9	Very high	88.3	Confident	6 Å²	6	40.4 Å²	40.4	3%	0.026	20%	0.196	C	C	.	.	H	α-helix	trans	-65.5	-35.8	176.2	-73	-177.8	-170.9	-155.7	0	112.9	T514 Q515 E516 A522 I552 E558 A559 G560 V561 L564	T514-K518 WeakPolarHBondContact O-CB 3.47Å; T514-K518 VanDerWaalsContact O-CG 3.23Å; T514-K518 WeakPolarHBondContact O-CG 3.44Å; T514-K518 PolarHBondContact O-N 2.75Å; Q515-K518 WeakPolarHBondContact O-CB 3.44Å; Q515-K518 PolarHBondContact O-N 3.45Å; E516-K518 VanDerWaalsContact C-N 3.26Å; E516-K518 PolarHBondContact O-N 2.75Å; K518-A522 WeakPolarHBondContact O-CB 3.43Å; K518-A522 PolarHBondContact O-N 3.39Å; K518-I552 HydrophobicContact CB-CD1 3.74Å; K518-I552 HydrophobicContact CB-CG1 4.46Å; K518-I552 HydrophobicContact CD-CG2 4.23Å; K518-E558 PolarHBondContact NZ-O 2.94Å; K518-A559 WeakPolarHBondContact CE-O 3.23Å; K518-G560 VanDerWaalsContact CE-O 3.28Å; K518-G560 WeakPolarHBondContact CE-O 3.49Å; K518-G560 PolarHBondContact NZ-O 3.26Å; K518-V561 HydrophobicContact CB-CG1 4.48Å; K518-V561 HydrophobicContact CD-CG1 4.4Å; K518-V561 HydrophobicContact CG-CG1 3.86Å; K518-L564 HydrophobicContact CB-CD2 4.34Å
519	I	91.9	Very high	88.4	Confident	24 Å²	24	44.4 Å²	44.4	12%	0.123	21%	0.213	C	C	.	.	H	α-helix	trans	-64	-48.9	175.7	-66.6	164.2	0	0	0	109.3	Q515 E516 E517 I521 A522 H523 Q545 T548 L549 I552	Q515-I519 WeakPolarHBondContact O-CG1 3.44Å; Q515-I519 PolarHBondContact O-N 3.49Å; Q515-I519 VanDerWaalsContact O-N 3.07Å; E516-I519 WeakPolarHBondContact O-CB 3.25Å; E516-I519 PolarHBondContact O-N 3.23Å; E516-I519 VanDerWaalsContact O-N 3.1Å; E517-I519 VanDerWaalsContact C-N 3.35Å; E517-I519 PolarHBondContact O-N 3.06Å; I519-I521 PolarHBondContact O-N 3.19Å; I519-A522 WeakPolarHBondContact O-CB 3.48Å; I519-A522 PolarHBondContact O-N 3.46Å; I519-H523 PolarHBondContact O-CD2 3.23Å; I519-H523 VanDerWaalsContact O-CD2 3.26Å; I519-H523 PolarHBondContact O-N 2.91Å; I519-Q545 HydrophobicContact CG2-CG 4.26Å; I519-T548 HydrophobicContact CG1-CG2 4.16Å; I519-T548 HydrophobicContact CG2-CG2 4.47Å; I519-L549 HydrophobicContact CD1-CB 4.17Å; I519-L549 HydrophobicContact CD1-CD1 4.21Å; I519-I552 HydrophobicContact CG1-CD1 3.66Å
520	E	91.3	Very high	88.9	Confident	56 Å²	56	38.5 Å²	38.5	26%	0.262	19%	0.185	S	C	.	.	H	α-helix	trans	-61.4	-45.8	177.3	-76.9	-66.4	147.8	0	0	112.2	Y344 E516 E517 A522 H523 R524	Y344-E520 HydrophobicContact CD1-CB 3.95Å; Y344-E520 HydrophobicContact CD2-CB 4.44Å; Y344-E520 HydrophobicContact CE1-CB 3.74Å; Y344-E520 HydrophobicContact CE1-CG 4.19Å; Y344-E520 HydrophobicContact CE2-CB 4.25Å; Y344-E520 HydrophobicContact CE2-CG 4.43Å; Y344-E520 HydrophobicContact CG-CB 4.29Å; E516-E520 PolarHBondContact O-N 3.41Å; E517-E520 PolarHBondContact O-N 3.22Å; E520-A522 VanDerWaalsContact C-N 3.28Å; E520-A522 PolarHBondContact O-N 3.06Å; E520-H523 PolarHBondContact O-N 3.43Å; E520-R524 WeakPolarHBondContact O-CB 3.09Å; E520-R524 WeakPolarHBondContact O-CG 3.38Å; E520-R524 PolarHBondContact O-N 3.17Å; E520-R524 IonicContact OE2-CZ 3.95Å; E520-R524 VanDerWaalsContact OE2-CZ 3.23Å; E520-R524 IonicContact OE2-NE 3.5Å; E520-R524 PolarHBondContact OE2-NE 3.36Å; E520-R524 IonicContact OE2-NH2 3.29Å; E520-R524 PolarHBondContact OE2-NH2 3.26Å
521	I	92.1	Very high	89.2	Confident	10 Å²	10	39 Å²	39	5%	0.051	19%	0.188	C	C	.	.	H	α-helix	trans	-60.1	-40.7	175.9	-69.1	162.9	0	0	0	110.9	Y344 Y513 E517 I519 H525 L526 V561	Y344-I521 HydrophobicContact CD1-CG1 4.11Å; Y344-I521 HydrophobicContact CG-CG1 4.38Å; Y513-I521 HydrophobicContact CD1-CD1 3.61Å; Y513-I521 HydrophobicContact CD2-CD1 3.88Å; Y513-I521 HydrophobicContact CE1-CD1 3.64Å; Y513-I521 HydrophobicContact CE2-CD1 3.86Å; Y513-I521 HydrophobicContact CG-CD1 3.74Å; E517-I521 WeakPolarHBondContact O-CB 3.49Å; E517-I521 WeakPolarHBondContact O-CD1 3.22Å; E517-I521 WeakPolarHBondContact O-CG1 3.5Å; E517-I521 PolarHBondContact O-N 2.85Å; I519-I521 PolarHBondContact O-N 3.19Å; I521-H525 PolarHBondContact O-N 3.03Å; I521-L526 HydrophobicContact CG2-CD1 4.22Å; I521-L526 HydrophobicContact CG2-CG 4.11Å; I521-L526 PolarHBondContact O-N 2.96Å; I521-V561 HydrophobicContact CG2-CG1 4.26Å; I521-V561 HydrophobicContact CG2-CG2 4.4Å
522	A	93.1	Very high	89.8	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	21%	0.209	C	C	.	.	I	π-helix	trans	-61.4	-49.8	178.6	0	0	0	0	0	111.7	K518 I519 E520 L526 I527 T548 L564 F568	K518-A522 WeakPolarHBondContact O-CB 3.43Å; K518-A522 PolarHBondContact O-N 3.39Å; I519-A522 WeakPolarHBondContact O-CB 3.48Å; I519-A522 PolarHBondContact O-N 3.46Å; E520-A522 VanDerWaalsContact C-N 3.28Å; E520-A522 PolarHBondContact O-N 3.06Å; A522-L526 HydrophobicContact CB-CD1 4.34Å; A522-L526 PolarHBondContact O-N 3.24Å; A522-I527 WeakPolarHBondContact O-CB 3.37Å; A522-I527 WeakPolarHBondContact O-CG1 3.32Å; A522-I527 PolarHBondContact O-N 3.02Å; A522-T548 HydrophobicContact CB-CG2 3.94Å; A522-L564 HydrophobicContact CB-CD2 4.31Å; A522-F568 HydrophobicContact CB-CE2 3.58Å; A522-F568 HydrophobicContact CB-CZ 3.84Å
523	H	91.6	Very high	90.3	Very high	58 Å²	58	49.5 Å²	49.5	27%	0.269	23%	0.23	S	C	.	.	I	π-helix	trans	-73.1	-38.1	-177.5	-77.5	-78.4	0	0	0	113.6	I519 E520 P528 I543 T548	I519-H523 PolarHBondContact O-CD2 3.23Å; I519-H523 VanDerWaalsContact O-CD2 3.26Å; I519-H523 PolarHBondContact O-N 2.91Å; E520-H523 PolarHBondContact O-N 3.43Å; H523-P528 WeakPolarHBondContact O-CD 3.28Å; H523-I543 PolarHBondContact CE1-O 3.4Å; H523-I543 VanDerWaalsContact CE1-O 3.31Å; H523-T548 PolarHBondContact NE2-OG1 2.99Å
524	R	90.8	Very high	90.5	Very high	132 Å²	132	51.3 Å²	51.3	50%	0.498	24%	0.239	S	C	.	.	I	π-helix	trans	-77.8	-35.4	-178.9	-65.9	-175.9	-165.5	-160.1	2.6	113.8	E520	E520-R524 WeakPolarHBondContact O-CB 3.09Å; E520-R524 WeakPolarHBondContact O-CG 3.38Å; E520-R524 PolarHBondContact O-N 3.17Å; E520-R524 IonicContact OE2-CZ 3.95Å; E520-R524 VanDerWaalsContact OE2-CZ 3.23Å; E520-R524 IonicContact OE2-NE 3.5Å; E520-R524 PolarHBondContact OE2-NE 3.36Å; E520-R524 IonicContact OE2-NH2 3.29Å; E520-R524 PolarHBondContact OE2-NH2 3.26Å
525	H	90.9	Very high	90.7	Very high	50 Å²	50	53.9 Å²	53.9	23%	0.231	27%	0.268	C	S	.	.	I	π-helix	trans	-126.9	-47.8	-168.4	-52.9	-54.6	0	0	0	114.1	N341 I521 K529	N341-H525 PolarHBondContact O-CE1 3.45Å; I521-H525 PolarHBondContact O-N 3.03Å; H525-K529 WeakPolarHBondContact O-CB 3.29Å; H525-K529 PolarHBondContact O-N 3.29Å
526	L	92.4	Very high	90.8	Very high	15 Å²	15	52.2 Å²	52.2	8%	0.079	26%	0.26	C	S	.	.	I	π-helix	trans	-72.9	-48.7	-171.3	-54.7	177.7	0	0	0	112.1	I521 A522 K529 Q530 V561 L564 D565 F568	I521-L526 HydrophobicContact CG2-CD1 4.22Å; I521-L526 HydrophobicContact CG2-CG 4.11Å; I521-L526 PolarHBondContact O-N 2.96Å; A522-L526 HydrophobicContact CB-CD1 4.34Å; A522-L526 PolarHBondContact O-N 3.24Å; L526-K529 PolarHBondContact O-N 3.14Å; L526-Q530 WeakPolarHBondContact O-CB 3.3Å; L526-Q530 VanDerWaalsContact O-CG 3.25Å; L526-Q530 WeakPolarHBondContact O-CG 3.39Å; L526-Q530 PolarHBondContact O-N 3.34Å; L526-V561 HydrophobicContact CD1-CB 3.9Å; L526-V561 HydrophobicContact CD1-CG1 4.39Å; L526-V561 HydrophobicContact CD1-CG2 4.21Å; L526-V561 HydrophobicContact CD2-CG2 4.33Å; L526-L564 HydrophobicContact CD1-CD2 4Å; L526-L564 HydrophobicContact CD1-CG 4.2Å; L526-D565 HydrophobicContact CD2-CB 4.38Å; L526-F568 HydrophobicContact CB-CD2 4.31Å; L526-F568 HydrophobicContact CD1-CD2 4.48Å; L526-F568 HydrophobicContact CD1-CE2 4.47Å
527	I	92.4	Very high	90.8	Very high	21 Å²	21	50.1 Å²	50.1	11%	0.108	26%	0.255	C	S	.	.	H	α-helix	trans	-62	-53.8	-178.7	-67	168.5	0	0	0	110.1	A522 K529 Q530 L531 I543 F568	A522-I527 WeakPolarHBondContact O-CB 3.37Å; A522-I527 WeakPolarHBondContact O-CG1 3.32Å; A522-I527 PolarHBondContact O-N 3.02Å; I527-K529 VanDerWaalsContact C-N 3.3Å; I527-K529 PolarHBondContact O-N 2.71Å; I527-Q530 PolarHBondContact O-N 3.09Å; I527-Q530 VanDerWaalsContact O-N 3.08Å; I527-L531 HydrophobicContact CG2-CD1 4Å; I527-L531 HydrophobicContact CG2-CG 4.24Å; I527-L531 VanDerWaalsContact O-CG 3.28Å; I527-L531 WeakPolarHBondContact O-CG 3.43Å; I527-L531 PolarHBondContact O-N 3.29Å; I527-I543 HydrophobicContact CD1-CB 4.38Å; I527-I543 HydrophobicContact CD1-CD1 4.32Å; I527-I543 HydrophobicContact CG1-CD1 4.44Å; I527-F568 HydrophobicContact CD1-CE1 4.12Å; I527-F568 HydrophobicContact CD1-CZ 4.19Å; I527-F568 HydrophobicContact CG1-CD1 4.19Å; I527-F568 HydrophobicContact CG1-CE1 4.09Å; I527-F568 HydrophobicContact CG1-CE2 4.42Å; I527-F568 HydrophobicContact CG1-CG 4.42Å; I527-F568 HydrophobicContact CG1-CZ 4.2Å
528	P	92.7	Very high	90.5	Very high	49 Å²	49	53 Å²	53	32%	0.318	28%	0.277	S	S	.	.	H	α-helix	trans	-55.6	-44.5	178.4	-26.3	35.6	0	0	0	113	H523 Q530 L531 E532	H523-P528 WeakPolarHBondContact O-CD 3.28Å; P528-Q530 PolarHBondContact O-N 3.36Å; P528-L531 WeakPolarHBondContact O-CB 3.39Å; P528-L531 PolarHBondContact O-N 3.1Å; P528-E532 WeakPolarHBondContact O-CG 3.4Å; P528-E532 PolarHBondContact O-N 3.23Å
529	K	91.9	Very high	89.9	Confident	98 Å²	98	59 Å²	59	43%	0.426	31%	0.305	S	S	.	.	H	α-helix	trans	-62.1	-41.2	177.2	-177.7	-173.9	174	-162.2	0	112.6	H525 L526 I527 L531 Q533	H525-K529 WeakPolarHBondContact O-CB 3.29Å; H525-K529 PolarHBondContact O-N 3.29Å; L526-K529 PolarHBondContact O-N 3.14Å; I527-K529 VanDerWaalsContact C-N 3.3Å; I527-K529 PolarHBondContact O-N 2.71Å; K529-L531 VanDerWaalsContact C-N 3.35Å; K529-Q533 WeakPolarHBondContact O-CB 3.29Å; K529-Q533 VanDerWaalsContact O-CG 3.24Å; K529-Q533 WeakPolarHBondContact O-CG 3.29Å; K529-Q533 PolarHBondContact O-N 3.26Å; K529-Q533 VanDerWaalsContact O-N 3.07Å
530	Q	93.4	Very high	89.3	Confident	8 Å²	8	60.5 Å²	60.5	4%	0.037	31%	0.312	C	S	.	.	H	α-helix	trans	-68.9	-34.7	177.1	-72.5	-64.1	-30.4	0	0	111.7	L526 I527 P528 Q533 H534 D565 F568	L526-Q530 WeakPolarHBondContact O-CB 3.3Å; L526-Q530 VanDerWaalsContact O-CG 3.25Å; L526-Q530 WeakPolarHBondContact O-CG 3.39Å; L526-Q530 PolarHBondContact O-N 3.34Å; I527-Q530 PolarHBondContact O-N 3.09Å; I527-Q530 VanDerWaalsContact O-N 3.08Å; P528-Q530 PolarHBondContact O-N 3.36Å; Q530-Q533 PolarHBondContact O-N 3.44Å; Q530-H534 PolarHBondContact O-N 2.66Å; Q530-H534 PolarHBondContact O-ND1 2.95Å; Q530-H534 PolarHBondContact OE1-CE1 3.01Å; Q530-D565 VanDerWaalsContact NE2-CG 3.28Å; Q530-D565 PolarHBondContact NE2-OD1 3.09Å; Q530-D565 PolarHBondContact NE2-OD2 3.17Å; Q530-F568 HydrophobicContact CG-CB 4.1Å
531	L	91.2	Very high	89	Confident	13 Å²	13	58.3 Å²	58.3	7%	0.068	30%	0.302	C	S	.	.	H	α-helix	trans	-63.6	-49.4	174.3	-65.8	177.1	0	0	0	111.4	I527 P528 K529 Q533 H534 G535 L536 P538 I541	I527-L531 HydrophobicContact CG2-CD1 4Å; I527-L531 HydrophobicContact CG2-CG 4.24Å; I527-L531 VanDerWaalsContact O-CG 3.28Å; I527-L531 WeakPolarHBondContact O-CG 3.43Å; I527-L531 PolarHBondContact O-N 3.29Å; P528-L531 WeakPolarHBondContact O-CB 3.39Å; P528-L531 PolarHBondContact O-N 3.1Å; K529-L531 VanDerWaalsContact C-N 3.35Å; L531-Q533 VanDerWaalsContact C-N 3.33Å; L531-Q533 PolarHBondContact O-N 3.01Å; L531-H534 CarbonylContact O-C 3.58Å; L531-H534 PolarHBondContact O-N 3.06Å; L531-G535 PolarHBondContact O-N 2.9Å; L531-L536 HydrophobicContact CB-CB 4.46Å; L531-L536 HydrophobicContact CD2-CB 3.7Å; L531-L536 HydrophobicContact CD2-CD1 4.2Å; L531-L536 PolarHBondContact O-N 3.23Å; L531-P538 HydrophobicContact CD1-CG 4.4Å; L531-I541 HydrophobicContact CD1-CG2 4.45Å; L531-I541 HydrophobicContact CD2-CG2 3.2Å; L531-I541 HydrophobicContact CG-CG2 4.44Å
532	E	91.3	Very high	88.7	Confident	157 Å²	157	63 Å²	63	73%	0.734	32%	0.323	S	S	*	.	H	α-helix	trans	-57.7	-44.4	176	-72.8	175.1	-174.5	0	0	111.8	P528 H534 G535	P528-E532 WeakPolarHBondContact O-CG 3.4Å; P528-E532 PolarHBondContact O-N 3.23Å; E532-H534 VanDerWaalsContact C-N 3.26Å; E532-H534 PolarHBondContact O-N 3.18Å; E532-G535 PolarHBondContact O-N 3.11Å
533	Q	91.5	Very high	88.4	Confident	119 Å²	119	63.6 Å²	63.6	56%	0.556	33%	0.327	S	S	*	.	H	α-helix	trans	-64.6	-28	179.6	-76.5	-179.6	-7.1	0	0	114.1	K529 Q530 L531	K529-Q533 WeakPolarHBondContact O-CB 3.29Å; K529-Q533 VanDerWaalsContact O-CG 3.24Å; K529-Q533 WeakPolarHBondContact O-CG 3.29Å; K529-Q533 PolarHBondContact O-N 3.26Å; K529-Q533 VanDerWaalsContact O-N 3.07Å; Q530-Q533 PolarHBondContact O-N 3.44Å; L531-Q533 VanDerWaalsContact C-N 3.33Å; L531-Q533 PolarHBondContact O-N 3.01Å
534	H	91	Very high	88.3	Confident	54 Å²	54	62.7 Å²	62.7	25%	0.25	33%	0.326	C	S	.	.	H	α-helix	trans	-106.1	5.5	-178	-63.7	82.7	0	0	0	112.8	Q530 L531 E532 L536 C572 R573	Q530-H534 PolarHBondContact O-N 2.66Å; Q530-H534 PolarHBondContact O-ND1 2.95Å; Q530-H534 PolarHBondContact OE1-CE1 3.01Å; L531-H534 CarbonylContact O-C 3.58Å; L531-H534 PolarHBondContact O-N 3.06Å; E532-H534 VanDerWaalsContact C-N 3.26Å; E532-H534 PolarHBondContact O-N 3.18Å; H534-L536 VanDerWaalsContact C-N 3.27Å; H534-L536 HydrophobicContact CB-CD1 4.46Å; H534-L536 HydrophobicContact CB-CG 4.38Å; H534-L536 PolarHBondContact O-N 3.04Å; H534-C572 HydrophobicContact CB-CB 4.24Å; H534-R573 VanDerWaalsContact CD2-CG 3.46Å; H534-R573 WeakPolarHBondContact CD2-CG 3.42Å; H534-R573 WeakPolarHBondContact NE2-CG 3.49Å
535	G	87	Confident	88.3	Confident	65 Å²	65	62.1 Å²	62.1	67%	0.67	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.7	25.9	179.7	0	0	0	0	0	114.3	L531 E532	L531-G535 PolarHBondContact O-N 2.9Å; E532-G535 PolarHBondContact O-N 3.11Å
536	L	87.2	Confident	88.2	Confident	14 Å²	14	65.7 Å²	65.7	7%	0.073	35%	0.349	C	S	.	.			trans	-94.3	146.1	178.9	-67.2	176.3	0	0	0	110.9	L531 H534 C572 V575 A576 V579	L531-L536 HydrophobicContact CB-CB 4.46Å; L531-L536 HydrophobicContact CD2-CB 3.7Å; L531-L536 HydrophobicContact CD2-CD1 4.2Å; L531-L536 PolarHBondContact O-N 3.23Å; H534-L536 VanDerWaalsContact C-N 3.27Å; H534-L536 HydrophobicContact CB-CD1 4.46Å; H534-L536 HydrophobicContact CB-CG 4.38Å; H534-L536 PolarHBondContact O-N 3.04Å; L536-C572 HydrophobicContact CD1-CB 3.98Å; L536-C572 WeakPolarHBondContact CD1-O 3.18Å; L536-V575 HydrophobicContact CD1-CB 4.33Å; L536-V575 HydrophobicContact CD1-CG1 4.18Å; L536-V575 HydrophobicContact CD2-CG1 4.42Å; L536-A576 HydrophobicContact CD2-CB 4.2Å; L536-A576 HydrophobicContact CG-CB 4.49Å; L536-V579 HydrophobicContact CD2-CG2 4.33Å
537	T	84.5	Confident	88.1	Confident	62 Å²	62	65.1 Å²	65.1	38%	0.38	35%	0.346	S	S	.	.			trans	-96.3	153.1	173.3	62.5	0	0	0	0	111.5	Q539 Q540	T537-Q539 PolarHBondContact O-N 3.13Å; T537-Q539 VanDerWaalsContact O-N 3.07Å; T537-Q540 PolarHBondContact O-N 3.36Å; T537-Q540 VanDerWaalsContact OG1-CD 3.31Å; T537-Q540 WeakPolarHBondContact OG1-CG 3.31Å; T537-Q540 PolarHBondContact OG1-OE1 3.4Å
538	P	80.9	Confident	88.1	Confident	102 Å²	102	64.1 Å²	64.1	66%	0.662	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-18.7	175.3	-22.5	32.7	0	0	0	114.1	L531	L531-P538 HydrophobicContact CD1-CG 4.4Å
539	Q	79	Confident	88	Confident	131 Å²	131	65.2 Å²	65.2	61%	0.612	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-20.3	176.8	-63.5	-178.7	0.5	0	0	112.7	T537 P626	T537-Q539 PolarHBondContact O-N 3.13Å; T537-Q539 VanDerWaalsContact O-N 3.07Å; Q539-P626 VanDerWaalsContact O-CA 3.24Å; Q539-P626 WeakPolarHBondContact O-CA 3.36Å; Q539-P626 VanDerWaalsContact O-CB 3.22Å; Q539-P626 WeakPolarHBondContact O-CB 3.43Å
540	Q	79.4	Confident	87.8	Confident	56 Å²	56	60.8 Å²	60.8	26%	0.262	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-25.2	-178.5	-73.2	166.5	-20.9	0	0	112.9	T537 I627	T537-Q540 PolarHBondContact O-N 3.36Å; T537-Q540 VanDerWaalsContact OG1-CD 3.31Å; T537-Q540 WeakPolarHBondContact OG1-CG 3.31Å; T537-Q540 PolarHBondContact OG1-OE1 3.4Å; Q540-I627 WeakPolarHBondContact O-CB 3.21Å; Q540-I627 PolarHBondContact O-N 3.48Å
541	I	84.4	Confident	87.7	Confident	11 Å²	11	60.4 Å²	60.4	6%	0.056	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	129.7	-174.8	-175.3	-179.8	0	0	0	111.4	L531 I543 I571 V575 I627 I629	L531-I541 HydrophobicContact CD1-CG2 4.45Å; L531-I541 HydrophobicContact CD2-CG2 3.2Å; L531-I541 HydrophobicContact CG-CG2 4.44Å; I541-I543 HydrophobicContact CD1-CD1 4.21Å; I541-I543 HydrophobicContact CD1-CG1 4.23Å; I541-I543 HydrophobicContact CG1-CG1 4.24Å; I541-I571 HydrophobicContact CD1-CG2 4.11Å; I541-V575 HydrophobicContact CB-CG1 4.29Å; I541-V575 HydrophobicContact CD1-CB 4.27Å; I541-V575 HydrophobicContact CD1-CG1 4.38Å; I541-V575 HydrophobicContact CD1-CG2 3.84Å; I541-V575 HydrophobicContact CG1-CG2 4.38Å; I541-I627 WeakPolarHBondContact CA-O 3.42Å; I541-I629 HydrophobicContact CD1-CG1 4.3Å; I541-I629 HydrophobicContact CG1-CG1 4.14Å
542	Q	85.4	Confident	87.6	Confident	107 Å²	107	60.2 Å²	60.2	50%	0.5	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	122.2	173.4	-166.6	175.9	12.9	0	0	109.8	P626 I627 L628 I629	Q542-P626 HydrophobicContact CB-CB 4.14Å; Q542-I627 PolarHBondContact N-O 2.88Å; Q542-L628 WeakPolarHBondContact O-CA 3.43Å; Q542-I629 PolarHBondContact O-N 3.13Å
543	I	88.6	Confident	87.3	Confident	14 Å²	14	54.7 Å²	54.7	7%	0.072	30%	0.3	C	S	.	.			trans	-108.1	111.1	175.3	-55.3	177.1	0	0	0	107.4	H523 I527 I541 T547 F568 I571 I629	H523-I543 PolarHBondContact CE1-O 3.4Å; H523-I543 VanDerWaalsContact CE1-O 3.31Å; I527-I543 HydrophobicContact CD1-CB 4.38Å; I527-I543 HydrophobicContact CD1-CD1 4.32Å; I527-I543 HydrophobicContact CG1-CD1 4.44Å; I541-I543 HydrophobicContact CD1-CD1 4.21Å; I541-I543 HydrophobicContact CD1-CG1 4.23Å; I541-I543 HydrophobicContact CG1-CG1 4.24Å; I543-T547 HydrophobicContact CG2-CG2 4.37Å; I543-F568 HydrophobicContact CD1-CD1 3.87Å; I543-F568 HydrophobicContact CD1-CE1 3.99Å; I543-F568 HydrophobicContact CG2-CE1 4.34Å; I543-I571 HydrophobicContact CD1-CG2 4.37Å; I543-I629 HydrophobicContact CG1-CB 4.38Å; I543-I629 HydrophobicContact CG1-CG1 4.11Å
544	P	89.3	Confident	87	Confident	38 Å²	38	55.2 Å²	55.2	25%	0.247	30%	0.296	C	S	.	.			trans	-65	151	175.1	-22.1	33.1	0	0	0	112.8	L546 T547 T548 L628 I629	P544-L546 PolarHBondContact O-N 3.32Å; P544-T547 WeakPolarHBondContact O-CB 3.48Å; P544-T547 PolarHBondContact O-N 2.73Å; P544-T548 PolarHBondContact O-N 2.81Å; P544-T548 PolarHBondContact O-OG1 3.04Å; P544-L628 HydrophobicContact CG-CD2 3.91Å; P544-L628 HydrophobicContact CG-CG 4.27Å; P544-I629 WeakPolarHBondContact CD-O 3.15Å
545	Q	90.3	Very high	86.8	Confident	120 Å²	120	53.2 Å²	53.2	56%	0.561	29%	0.287	S	S	*	.	H	α-helix	trans	-57.9	-35.9	176	-73.9	-179.3	-13.7	0	0	112.8	I519 T547 T548 L549	I519-Q545 HydrophobicContact CG2-CG 4.26Å; Q545-T547 VanDerWaalsContact C-N 3.31Å; Q545-T547 PolarHBondContact O-N 2.84Å; Q545-T548 WeakPolarHBondContact O-CB 3.16Å; Q545-T548 PolarHBondContact O-N 2.92Å; Q545-L549 PolarHBondContact O-N 2.82Å
546	L	89.6	Confident	86.8	Confident	126 Å²	126	50.6 Å²	50.6	66%	0.66	26%	0.258	S	S	*	.	H	α-helix	trans	-62.5	-39	175.8	-65.4	177.8	0	0	0	111.9	P544 L549 A550 F631	P544-L546 PolarHBondContact O-N 3.32Å; L546-L549 PolarHBondContact O-N 3.25Å; L546-A550 PolarHBondContact O-N 3.02Å; L546-F631 HydrophobicContact CB-CZ 4.49Å
547	T	89.8	Confident	86.4	Confident	2 Å²	2	56.7 Å²	56.7	1%	0.012	28%	0.28	C	S	.	.	H	α-helix	trans	-68	-41.6	174.7	-51.9	0	0	0	0	110.6	I543 P544 Q545 L549 A550 I551 I629 L634	I543-T547 HydrophobicContact CG2-CG2 4.37Å; P544-T547 WeakPolarHBondContact O-CB 3.48Å; P544-T547 PolarHBondContact O-N 2.73Å; Q545-T547 VanDerWaalsContact C-N 3.31Å; Q545-T547 PolarHBondContact O-N 2.84Å; T547-L549 VanDerWaalsContact C-N 3.34Å; T547-L549 PolarHBondContact O-N 3Å; T547-A550 WeakPolarHBondContact O-CB 3.19Å; T547-A550 PolarHBondContact O-N 3.15Å; T547-A550 VanDerWaalsContact O-N 3.13Å; T547-I551 HydrophobicContact CG2-CD1 4.41Å; T547-I551 WeakPolarHBondContact O-CG1 3.43Å; T547-I551 PolarHBondContact O-N 3.05Å; T547-I629 HydrophobicContact CG2-CG2 4.15Å; T547-I629 VanDerWaalsContact CG2-O 3.3Å; T547-I629 WeakPolarHBondContact CG2-O 3.49Å; T547-I629 PolarHBondContact OG1-O 2.78Å; T547-L634 HydrophobicContact CG2-CD1 4.24Å; T547-L634 HydrophobicContact CG2-CD2 4.23Å
548	T	91.7	Very high	86.2	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-58.1	-45.3	174.5	-60.5	0	0	0	0	111.7	I519 A522 H523 P544 Q545 A550 I551 I552 F568	I519-T548 HydrophobicContact CG1-CG2 4.16Å; I519-T548 HydrophobicContact CG2-CG2 4.47Å; A522-T548 HydrophobicContact CB-CG2 3.94Å; H523-T548 PolarHBondContact NE2-OG1 2.99Å; P544-T548 PolarHBondContact O-N 2.81Å; P544-T548 PolarHBondContact O-OG1 3.04Å; Q545-T548 WeakPolarHBondContact O-CB 3.16Å; Q545-T548 PolarHBondContact O-N 2.92Å; T548-A550 VanDerWaalsContact C-N 3.31Å; T548-A550 PolarHBondContact O-N 2.9Å; T548-I551 WeakPolarHBondContact O-CB 3.49Å; T548-I551 PolarHBondContact O-N 2.85Å; T548-I552 HydrophobicContact CG2-CD1 3.94Å; T548-I552 WeakPolarHBondContact O-CG1 3.38Å; T548-I552 PolarHBondContact O-N 2.9Å; T548-F568 HydrophobicContact CG2-CZ 3.96Å
549	L	90.4	Very high	86.1	Confident	73 Å²	73	51.1 Å²	51.1	38%	0.382	24%	0.243	S	C	.	.	H	α-helix	trans	-59.1	-44.4	174.7	-175.6	149.7	0	0	0	110.9	I519 Q545 L546 T547 I551 I552 T553	I519-L549 HydrophobicContact CD1-CB 4.17Å; I519-L549 HydrophobicContact CD1-CD1 4.21Å; Q545-L549 PolarHBondContact O-N 2.82Å; L546-L549 PolarHBondContact O-N 3.25Å; T547-L549 VanDerWaalsContact C-N 3.34Å; T547-L549 PolarHBondContact O-N 3Å; L549-I551 VanDerWaalsContact C-N 3.33Å; L549-I551 PolarHBondContact O-N 3.46Å; L549-I552 PolarHBondContact O-N 2.78Å; L549-I552 VanDerWaalsContact O-N 3.13Å; L549-T553 HydrophobicContact CD2-CG2 3.98Å; L549-T553 HydrophobicContact CG-CG2 4.42Å; L549-T553 WeakPolarHBondContact O-CG2 3.5Å; L549-T553 PolarHBondContact O-N 2.99Å; L549-T553 PolarHBondContact O-OG1 2.75Å; L549-T553 VanDerWaalsContact O-OG1 3.13Å
550	A	87.8	Confident	86.5	Confident	4 Å²	4	44.9 Å²	44.9	3%	0.033	21%	0.214	C	C	.	.	H	α-helix	trans	-61.3	-39.2	177.7	0	0	0	0	0	113	L546 T547 T548 T553 R554 F631 L634	L546-A550 PolarHBondContact O-N 3.02Å; T547-A550 WeakPolarHBondContact O-CB 3.19Å; T547-A550 PolarHBondContact O-N 3.15Å; T547-A550 VanDerWaalsContact O-N 3.13Å; T548-A550 VanDerWaalsContact C-N 3.31Å; T548-A550 PolarHBondContact O-N 2.9Å; A550-T553 PolarHBondContact O-OG1 2.96Å; A550-R554 VanDerWaalsContact O-CB 3.3Å; A550-R554 WeakPolarHBondContact O-CB 3.43Å; A550-R554 PolarHBondContact O-N 2.99Å; A550-F631 HydrophobicContact CB-CD1 4.05Å; A550-F631 HydrophobicContact CB-CE1 3.49Å; A550-F631 VanDerWaalsContact CB-CE1 3.49Å; A550-F631 HydrophobicContact CB-CZ 4.45Å; A550-L634 HydrophobicContact CB-CD2 4.27Å
551	I	91.4	Very high	87.1	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.1	-48.2	173.3	-65.5	164.6	0	0	0	109.9	T547 T548 L549 T553 Y555 T556 L564 K567 F568 I571 L634 L638	T547-I551 HydrophobicContact CG2-CD1 4.41Å; T547-I551 WeakPolarHBondContact O-CG1 3.43Å; T547-I551 PolarHBondContact O-N 3.05Å; T548-I551 WeakPolarHBondContact O-CB 3.49Å; T548-I551 PolarHBondContact O-N 2.85Å; L549-I551 VanDerWaalsContact C-N 3.33Å; L549-I551 PolarHBondContact O-N 3.46Å; I551-T553 PolarHBondContact O-N 2.63Å; I551-Y555 CarbonylContact O-C 3.6Å; I551-Y555 WeakPolarHBondContact O-CA 3.31Å; I551-Y555 WeakPolarHBondContact O-CB 3.44Å; I551-Y555 PolarHBondContact O-N 2.96Å; I551-T556 HydrophobicContact CG2-CG2 4.39Å; I551-T556 PolarHBondContact O-N 3.09Å; I551-L564 HydrophobicContact CB-CD1 4.4Å; I551-L564 HydrophobicContact CG2-CD1 3.58Å; I551-K567 HydrophobicContact CG2-CB 4.06Å; I551-F568 HydrophobicContact CD1-CD1 4.39Å; I551-F568 HydrophobicContact CD1-CE1 3.81Å; I551-F568 HydrophobicContact CD1-CZ 4.43Å; I551-I571 HydrophobicContact CD1-CD1 3.59Å; I551-L634 HydrophobicContact CD1-CD1 3.83Å; I551-L634 HydrophobicContact CG1-CD1 3.61Å; I551-L634 HydrophobicContact CG1-CD2 3.91Å; I551-L634 HydrophobicContact CG1-CG 4.39Å; I551-L638 HydrophobicContact CG1-CD1 4.44Å
552	I	89.9	Confident	87.4	Confident	10 Å²	10	49.3 Å²	49.3	5%	0.051	23%	0.229	C	C	.	.	H	α-helix	trans	-60.8	-45.8	-179.3	-67.4	163.5	0	0	0	110.7	Q515 K518 I519 T548 L549 T556 L564	Q515-I552 HydrophobicContact CG-CG2 4.28Å; K518-I552 HydrophobicContact CB-CD1 3.74Å; K518-I552 HydrophobicContact CB-CG1 4.46Å; K518-I552 HydrophobicContact CD-CG2 4.23Å; I519-I552 HydrophobicContact CG1-CD1 3.66Å; T548-I552 HydrophobicContact CG2-CD1 3.94Å; T548-I552 WeakPolarHBondContact O-CG1 3.38Å; T548-I552 PolarHBondContact O-N 2.9Å; L549-I552 PolarHBondContact O-N 2.78Å; L549-I552 VanDerWaalsContact O-N 3.13Å; I552-T556 WeakPolarHBondContact CA-OG1 3.49Å; I552-T556 PolarHBondContact O-OG1 3.01Å; I552-L564 HydrophobicContact CD1-CD2 4.31Å; I552-L564 HydrophobicContact CG1-CD1 3.85Å; I552-L564 HydrophobicContact CG1-CD2 4.02Å
553	T	83.9	Confident	87.7	Confident	41 Å²	41	46 Å²	46	25%	0.252	22%	0.218	S	C	.	.	H	α-helix	trans	-79.7	-39.2	-174.6	58.2	0	0	0	0	113.8	L549 A550 I551	L549-T553 HydrophobicContact CD2-CG2 3.98Å; L549-T553 HydrophobicContact CG-CG2 4.42Å; L549-T553 WeakPolarHBondContact O-CG2 3.5Å; L549-T553 PolarHBondContact O-N 2.99Å; L549-T553 PolarHBondContact O-OG1 2.75Å; L549-T553 VanDerWaalsContact O-OG1 3.13Å; A550-T553 PolarHBondContact O-OG1 2.96Å; I551-T553 PolarHBondContact O-N 2.63Å
554	R	85.4	Confident	87.9	Confident	129 Å²	129	45.4 Å²	45.4	49%	0.487	22%	0.215	S	C	.	.	H	α-helix	trans	-102.4	-21.6	-170.3	-61.8	-177.1	-179.6	178.4	-0.9	114.4	A550 P641 L642 Y643	A550-R554 VanDerWaalsContact O-CB 3.3Å; A550-R554 WeakPolarHBondContact O-CB 3.43Å; A550-R554 PolarHBondContact O-N 2.99Å; R554-P641 HydrophobicContact CB-CB 3.92Å; R554-P641 HydrophobicContact CG-CB 4.46Å; R554-L642 PolarHBondContact O-N 3.34Å; R554-Y643 PolarHBondContact O-N 2.63Å
555	Y	87.7	Confident	88.1	Confident	13 Å²	13	45.2 Å²	45.2	5%	0.051	21%	0.212	C	C	.	.	H	α-helix	trans	-119.9	-6.9	-173	-64.7	-88.6	0	0	0	113.9	I551 L634 L638 G639 P640	I551-Y555 CarbonylContact O-C 3.6Å; I551-Y555 WeakPolarHBondContact O-CA 3.31Å; I551-Y555 WeakPolarHBondContact O-CB 3.44Å; I551-Y555 PolarHBondContact O-N 2.96Å; Y555-L634 HydrophobicContact CD2-CD2 4.13Å; Y555-L634 HydrophobicContact CE2-CD2 3.53Å; Y555-L634 HydrophobicContact CE2-CG 3.95Å; Y555-L638 HydrophobicContact CD1-CB 3.92Å; Y555-L638 HydrophobicContact CD1-CD1 4.05Å; Y555-L638 HydrophobicContact CD2-CD1 4.32Å; Y555-L638 HydrophobicContact CE1-CB 3.59Å; Y555-L638 HydrophobicContact CE1-CD1 4.29Å; Y555-L638 HydrophobicContact CG-CD1 4.04Å; Y555-G639 WeakPolarHBondContact CE1-O 3.46Å; Y555-G639 PolarHBondContact OH-O 3.26Å; Y555-P640 WeakPolarHBondContact CE1-O 3.42Å
556	T	86.3	Confident	88.2	Confident	10 Å²	10	46.6 Å²	46.6	6%	0.061	21%	0.212	C	C	.	.			trans	-131.6	143.4	177.8	75.8	0	0	0	0	112.2	I551 I552 L564 K567	I551-T556 HydrophobicContact CG2-CG2 4.39Å; I551-T556 PolarHBondContact O-N 3.09Å; I552-T556 WeakPolarHBondContact CA-OG1 3.49Å; I552-T556 PolarHBondContact O-OG1 3.01Å; T556-L564 HydrophobicContact CG2-CB 4.33Å; T556-L564 HydrophobicContact CG2-CD1 4.33Å; T556-K567 HydrophobicContact CG2-CG 4.34Å
557	R	79.3	Confident	88.4	Confident	141 Å²	141	43 Å²	43	53%	0.532	19%	0.191	S	C	.	.			trans	-141.4	75.7	172.6	-167.1	174.2	-176.2	171.2	4	110.5	Y643	R557-Y643 HydrophobicContact CB-CD1 4.27Å; R557-Y643 HydrophobicContact CB-CD2 4.12Å; R557-Y643 HydrophobicContact CB-CE1 3.85Å; R557-Y643 HydrophobicContact CB-CE2 3.71Å; R557-Y643 HydrophobicContact CB-CG 4.39Å
558	E	80.6	Confident	88.7	Confident	35 Å²	35	42.9 Å²	42.9	16%	0.164	19%	0.19	C	C	.	.			trans	-145.1	164.1	-177.8	57.2	174.9	-166.2	0	0	111.8	K518 G560 V561 R562 S563 L564 R792	K518-E558 PolarHBondContact NZ-O 2.94Å; E558-G560 WeakPolarHBondContact CG-O 3.39Å; E558-V561 WeakPolarHBondContact OE1-CA 3.36Å; E558-R562 PolarHBondContact OE1-N 3.5Å; E558-S563 VanDerWaalsContact CD-OG 3.29Å; E558-S563 WeakPolarHBondContact OE1-CA 3.47Å; E558-S563 WeakPolarHBondContact OE1-CB 3.49Å; E558-S563 PolarHBondContact OE1-N 3.23Å; E558-S563 WeakPolarHBondContact OE2-CB 3.5Å; E558-S563 PolarHBondContact OE2-N 2.85Å; E558-S563 PolarHBondContact OE2-OG 2.88Å; E558-L564 PolarHBondContact OE1-N 3.18Å; E558-R792 PolarHBondContact O-NH1 2.93Å
559	A	79.3	Confident	88.7	Confident	12 Å²	12	43 Å²	43	10%	0.099	19%	0.191	C	C	.	.	S	Bend	trans	-80.6	-37.7	173.3	0	0	0	0	0	112.3	P376 Y513 K518	P376-A559 HydrophobicContact CB-CB 3.98Å; P376-A559 HydrophobicContact CG-CB 3.75Å; Y513-A559 PolarHBondContact N-O 3.36Å; K518-A559 WeakPolarHBondContact CE-O 3.23Å
560	G	86.8	Confident	88.9	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.01	18%	0.183	C	C	.	.	S	Bend	trans	-87	-158.6	177.4	0	0	0	0	0	114.3	G378 K518 E558	G378-G560 WeakPolarHBondContact O-CA 3.44Å; K518-G560 VanDerWaalsContact CE-O 3.28Å; K518-G560 WeakPolarHBondContact CE-O 3.49Å; K518-G560 PolarHBondContact NZ-O 3.26Å; E558-G560 WeakPolarHBondContact CG-O 3.39Å
561	V	92	Very high	89	Confident	16 Å²	16	40.5 Å²	40.5	10%	0.097	18%	0.181	C	C	.	.	S	Bend	trans	-121.8	13.7	-179.1	-65.3	0	0	0	0	114.3	G378 Y513 K518 I521 L526 E558 L564 D565	G378-V561 WeakPolarHBondContact O-CG2 3.43Å; G378-V561 PolarHBondContact O-N 2.86Å; Y513-V561 HydrophobicContact CD2-CG1 3.97Å; Y513-V561 HydrophobicContact CE2-CG1 4.31Å; Y513-V561 HydrophobicContact CE2-CG2 4.49Å; K518-V561 HydrophobicContact CB-CG1 4.48Å; K518-V561 HydrophobicContact CD-CG1 4.4Å; K518-V561 HydrophobicContact CG-CG1 3.86Å; I521-V561 HydrophobicContact CG2-CG1 4.26Å; I521-V561 HydrophobicContact CG2-CG2 4.4Å; L526-V561 HydrophobicContact CD1-CB 3.9Å; L526-V561 HydrophobicContact CD1-CG1 4.39Å; L526-V561 HydrophobicContact CD1-CG2 4.21Å; L526-V561 HydrophobicContact CD2-CG2 4.33Å; E558-V561 WeakPolarHBondContact OE1-CA 3.36Å; V561-L564 HydrophobicContact CB-CB 4.35Å; V561-L564 HydrophobicContact CB-CD2 4.42Å; V561-L564 HydrophobicContact CG1-CD2 4.18Å; V561-L564 WeakPolarHBondContact O-CB 3.49Å; V561-L564 PolarHBondContact O-N 3.37Å; V561-D565 WeakPolarHBondContact O-CB 3.41Å; V561-D565 PolarHBondContact O-N 3Å
562	R	90.9	Very high	89.1	Confident	143 Å²	143	40.6 Å²	40.6	54%	0.54	18%	0.182	S	C	.	.	H	α-helix	trans	-67.7	-44.2	-176	-175	178.5	-174.9	173.4	2.3	112.8	E558 L564 R566	E558-R562 PolarHBondContact OE1-N 3.5Å; R562-L564 VanDerWaalsContact C-N 3.33Å; R562-R566 WeakPolarHBondContact O-CG 3.37Å; R562-R566 PolarHBondContact O-N 3.41Å
563	S	91.2	Very high	89.1	Confident	39 Å²	39	46.5 Å²	46.5	27%	0.273	20%	0.203	S	C	.	.	H	α-helix	trans	-69.7	-36.3	175.2	-55	0	0	0	0	110.6	E558 R566 K567	E558-S563 VanDerWaalsContact CD-OG 3.29Å; E558-S563 WeakPolarHBondContact OE1-CA 3.47Å; E558-S563 WeakPolarHBondContact OE1-CB 3.49Å; E558-S563 PolarHBondContact OE1-N 3.23Å; E558-S563 WeakPolarHBondContact OE2-CB 3.5Å; E558-S563 PolarHBondContact OE2-N 2.85Å; E558-S563 PolarHBondContact OE2-OG 2.88Å; S563-R566 WeakPolarHBondContact O-CB 3.29Å; S563-R566 PolarHBondContact O-N 3.04Å; S563-K567 WeakPolarHBondContact O-CG 3.41Å; S563-K567 PolarHBondContact O-N 3.25Å
564	L	92.8	Very high	89.4	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-59.4	-48.2	174.4	-176.1	61.2	0	0	0	111.6	K518 A522 L526 I551 I552 T556 E558 V561 R562 R566 K567 F568	K518-L564 HydrophobicContact CB-CD2 4.34Å; A522-L564 HydrophobicContact CB-CD2 4.31Å; L526-L564 HydrophobicContact CD1-CD2 4Å; L526-L564 HydrophobicContact CD1-CG 4.2Å; I551-L564 HydrophobicContact CB-CD1 4.4Å; I551-L564 HydrophobicContact CG2-CD1 3.58Å; I552-L564 HydrophobicContact CD1-CD2 4.31Å; I552-L564 HydrophobicContact CG1-CD1 3.85Å; I552-L564 HydrophobicContact CG1-CD2 4.02Å; T556-L564 HydrophobicContact CG2-CB 4.33Å; T556-L564 HydrophobicContact CG2-CD1 4.33Å; E558-L564 PolarHBondContact OE1-N 3.18Å; V561-L564 HydrophobicContact CB-CB 4.35Å; V561-L564 HydrophobicContact CB-CD2 4.42Å; V561-L564 HydrophobicContact CG1-CD2 4.18Å; V561-L564 WeakPolarHBondContact O-CB 3.49Å; V561-L564 PolarHBondContact O-N 3.37Å; R562-L564 VanDerWaalsContact C-N 3.33Å; L564-R566 VanDerWaalsContact C-N 3.32Å; L564-R566 PolarHBondContact O-N 3.39Å; L564-K567 PolarHBondContact O-N 2.81Å; L564-K567 VanDerWaalsContact O-N 3.1Å; L564-F568 HydrophobicContact CD1-CD2 4.15Å; L564-F568 HydrophobicContact CD1-CE2 3.55Å; L564-F568 HydrophobicContact CD1-CZ 4.03Å; L564-F568 HydrophobicContact CD2-CE2 4.07Å; L564-F568 HydrophobicContact CG-CD2 3.95Å; L564-F568 HydrophobicContact CG-CE2 3.51Å; L564-F568 HydrophobicContact CG-CZ 4.43Å; L564-F568 WeakPolarHBondContact O-CD2 3.31Å; L564-F568 PolarHBondContact O-N 2.97Å
565	D	93.4	Very high	89.4	Confident	34 Å²	34	39.7 Å²	39.7	18%	0.182	18%	0.179	C	C	.	.	H	α-helix	trans	-57	-43.2	175.1	-169.9	47.8	0	0	0	111.9	L526 Q530 V561 K567 F568 G569	L526-D565 HydrophobicContact CD2-CB 4.38Å; Q530-D565 VanDerWaalsContact NE2-CG 3.28Å; Q530-D565 PolarHBondContact NE2-OD1 3.09Å; Q530-D565 PolarHBondContact NE2-OD2 3.17Å; V561-D565 WeakPolarHBondContact O-CB 3.41Å; V561-D565 PolarHBondContact O-N 3Å; D565-K567 PolarHBondContact O-N 2.76Å; D565-F568 PolarHBondContact O-N 3.36Å; D565-G569 PolarHBondContact O-N 3.35Å
566	R	92.9	Very high	89.4	Confident	150 Å²	150	40.4 Å²	40.4	57%	0.566	19%	0.188	S	C	*	.	H	α-helix	trans	-62	-38.6	175.1	-72.7	173.1	172.4	179.5	-4.3	113.2	R562 S563 L564 G569 A570	R562-R566 WeakPolarHBondContact O-CG 3.37Å; R562-R566 PolarHBondContact O-N 3.41Å; S563-R566 WeakPolarHBondContact O-CB 3.29Å; S563-R566 PolarHBondContact O-N 3.04Å; L564-R566 VanDerWaalsContact C-N 3.32Å; L564-R566 PolarHBondContact O-N 3.39Å; R566-G569 PolarHBondContact O-N 2.91Å; R566-A570 PolarHBondContact O-N 2.6Å
567	K	94	Very high	89.4	Confident	50 Å²	50	44 Å²	44	22%	0.217	21%	0.209	C	C	.	.	H	α-helix	trans	-70	-41.6	178.1	-66.2	-62.6	-178.2	177.3	0	111	I551 T556 S563 L564 D565 G569 A570 I571 L638	I551-K567 HydrophobicContact CG2-CB 4.06Å; T556-K567 HydrophobicContact CG2-CG 4.34Å; S563-K567 WeakPolarHBondContact O-CG 3.41Å; S563-K567 PolarHBondContact O-N 3.25Å; L564-K567 PolarHBondContact O-N 2.81Å; L564-K567 VanDerWaalsContact O-N 3.1Å; D565-K567 PolarHBondContact O-N 2.76Å; K567-G569 VanDerWaalsContact C-N 3.34Å; K567-G569 PolarHBondContact O-N 3.48Å; K567-A570 WeakPolarHBondContact O-CB 3.45Å; K567-A570 PolarHBondContact O-N 2.73Å; K567-A570 VanDerWaalsContact O-N 3.15Å; K567-I571 WeakPolarHBondContact O-CG1 3.46Å; K567-I571 PolarHBondContact O-N 3.22Å; K567-L638 HydrophobicContact CB-CD1 4.42Å; K567-L638 HydrophobicContact CD-CD1 4.28Å; K567-L638 HydrophobicContact CD-CD2 4.01Å
568	F	94.1	Very high	89.4	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61.5	-41.6	172	-73.8	-54.1	0	0	0	112.5	A522 L526 I527 Q530 I543 T548 I551 L564 D565 A570 I571 C572	A522-F568 HydrophobicContact CB-CE2 3.58Å; A522-F568 HydrophobicContact CB-CZ 3.84Å; L526-F568 HydrophobicContact CB-CD2 4.31Å; L526-F568 HydrophobicContact CD1-CD2 4.48Å; L526-F568 HydrophobicContact CD1-CE2 4.47Å; I527-F568 HydrophobicContact CD1-CE1 4.12Å; I527-F568 HydrophobicContact CD1-CZ 4.19Å; I527-F568 HydrophobicContact CG1-CD1 4.19Å; I527-F568 HydrophobicContact CG1-CE1 4.09Å; I527-F568 HydrophobicContact CG1-CE2 4.42Å; I527-F568 HydrophobicContact CG1-CG 4.42Å; I527-F568 HydrophobicContact CG1-CZ 4.2Å; Q530-F568 HydrophobicContact CG-CB 4.1Å; I543-F568 HydrophobicContact CD1-CD1 3.87Å; I543-F568 HydrophobicContact CD1-CE1 3.99Å; I543-F568 HydrophobicContact CG2-CE1 4.34Å; T548-F568 HydrophobicContact CG2-CZ 3.96Å; I551-F568 HydrophobicContact CD1-CD1 4.39Å; I551-F568 HydrophobicContact CD1-CE1 3.81Å; I551-F568 HydrophobicContact CD1-CZ 4.43Å; L564-F568 HydrophobicContact CD1-CD2 4.15Å; L564-F568 HydrophobicContact CD1-CE2 3.55Å; L564-F568 HydrophobicContact CD1-CZ 4.03Å; L564-F568 HydrophobicContact CD2-CE2 4.07Å; L564-F568 HydrophobicContact CG-CD2 3.95Å; L564-F568 HydrophobicContact CG-CE2 3.51Å; L564-F568 HydrophobicContact CG-CZ 4.43Å; L564-F568 WeakPolarHBondContact O-CD2 3.31Å; L564-F568 PolarHBondContact O-N 2.97Å; D565-F568 PolarHBondContact O-N 3.36Å; F568-A570 VanDerWaalsContact C-N 3.28Å; F568-A570 PolarHBondContact O-N 2.79Å; F568-I571 HydrophobicContact CD1-CD1 4.37Å; F568-I571 PolarHBondContact O-N 3.12Å; F568-I571 VanDerWaalsContact O-N 3.16Å; F568-C572 PolarHBondContact O-N 3.47Å; F568-C572 PolarHBondContact O-SG 2.69Å
569	G	93.5	Very high	89.5	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-61	-35.4	173.4	0	0	0	0	0	113	D565 R566 K567 R573	D565-G569 PolarHBondContact O-N 3.35Å; R566-G569 PolarHBondContact O-N 2.91Å; K567-G569 VanDerWaalsContact C-N 3.34Å; K567-G569 PolarHBondContact O-N 3.48Å; G569-R573 WeakPolarHBondContact O-CB 3.38Å; G569-R573 WeakPolarHBondContact O-CG 3.24Å; G569-R573 PolarHBondContact O-N 3.47Å; G569-R573 PolarHBondContact O-NH1 3.31Å
570	A	93	Very high	89.6	Confident	26 Å²	26	42.1 Å²	42.1	22%	0.215	21%	0.213	C	C	.	.	H	α-helix	trans	-66.2	-40.9	173.8	0	0	0	0	0	112.4	R566 K567 F568 R573 A574 L638	R566-A570 PolarHBondContact O-N 2.6Å; K567-A570 WeakPolarHBondContact O-CB 3.45Å; K567-A570 PolarHBondContact O-N 2.73Å; K567-A570 VanDerWaalsContact O-N 3.15Å; F568-A570 VanDerWaalsContact C-N 3.28Å; F568-A570 PolarHBondContact O-N 2.79Å; A570-R573 PolarHBondContact O-N 3.27Å; A570-A574 PolarHBondContact O-N 3.22Å; A570-L638 HydrophobicContact CB-CD2 3.97Å
571	I	91.7	Very high	89.2	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-63	-48.4	174.6	-63.9	167.2	0	0	0	110.6	I541 I543 I551 K567 F568 R573 A574 V575 I629 L634 I637 L638	I541-I571 HydrophobicContact CD1-CG2 4.11Å; I543-I571 HydrophobicContact CD1-CG2 4.37Å; I551-I571 HydrophobicContact CD1-CD1 3.59Å; K567-I571 WeakPolarHBondContact O-CG1 3.46Å; K567-I571 PolarHBondContact O-N 3.22Å; F568-I571 HydrophobicContact CD1-CD1 4.37Å; F568-I571 PolarHBondContact O-N 3.12Å; F568-I571 VanDerWaalsContact O-N 3.16Å; I571-R573 VanDerWaalsContact C-N 3.34Å; I571-R573 PolarHBondContact O-N 3.46Å; I571-A574 PolarHBondContact O-N 3.23Å; I571-V575 WeakPolarHBondContact O-CG2 3.49Å; I571-V575 PolarHBondContact O-N 3.28Å; I571-I629 HydrophobicContact CG2-CD1 4.16Å; I571-I629 HydrophobicContact CG2-CG1 4.03Å; I571-I629 HydrophobicContact CG2-CG2 4.42Å; I571-L634 HydrophobicContact CD1-CD1 3.86Å; I571-I637 HydrophobicContact CG1-CG2 4.23Å; I571-L638 HydrophobicContact CD1-CD1 4.32Å; I571-L638 HydrophobicContact CG1-CD2 4.22Å; I571-L638 HydrophobicContact CG1-CG 4.36Å
572	C	91.6	Very high	88	Confident	1 Å²	1	47 Å²	47	1%	0.007	24%	0.24	C	C	.	.	H	α-helix	trans	-60.7	-42	178.8	-64.3	0	0	0	0	111.5	H534 L536 F568 A574 V575 A576	H534-C572 HydrophobicContact CB-CB 4.24Å; L536-C572 HydrophobicContact CD1-CB 3.98Å; L536-C572 WeakPolarHBondContact CD1-O 3.18Å; F568-C572 PolarHBondContact O-N 3.47Å; F568-C572 PolarHBondContact O-SG 2.69Å; C572-A574 PolarHBondContact O-N 3.46Å; C572-V575 PolarHBondContact O-N 3.25Å; C572-A576 VanDerWaalsContact O-CB 3.31Å; C572-A576 WeakPolarHBondContact O-CB 3.25Å; C572-A576 PolarHBondContact O-N 3.1Å
573	R	91.6	Very high	86.6	Confident	134 Å²	134	45.8 Å²	45.8	51%	0.506	24%	0.241	S	C	.	.	H	α-helix	trans	-60.8	-44.8	174.2	-76	-171.7	-62.2	-88.4	2.1	112.8	H534 G569 A570 I571 V575 A576 V577	H534-R573 VanDerWaalsContact CD2-CG 3.46Å; H534-R573 WeakPolarHBondContact CD2-CG 3.42Å; H534-R573 WeakPolarHBondContact NE2-CG 3.49Å; G569-R573 WeakPolarHBondContact O-CB 3.38Å; G569-R573 WeakPolarHBondContact O-CG 3.24Å; G569-R573 PolarHBondContact O-N 3.47Å; G569-R573 PolarHBondContact O-NH1 3.31Å; A570-R573 PolarHBondContact O-N 3.27Å; I571-R573 VanDerWaalsContact C-N 3.34Å; I571-R573 PolarHBondContact O-N 3.46Å; R573-V575 VanDerWaalsContact C-N 3.3Å; R573-V575 PolarHBondContact O-N 3.03Å; R573-A576 PolarHBondContact O-N 3.37Å; R573-V577 WeakPolarHBondContact O-CG2 3.44Å; R573-V577 PolarHBondContact O-N 3Å
574	A	88.5	Confident	84.6	Confident	28 Å²	28	50.7 Å²	50.7	23%	0.231	26%	0.259	C	S	.	.	H	α-helix	trans	-63.5	-39	179.5	0	0	0	0	0	111.9	W93 A570 I571 C572 K578 I637	W93-A574 HydrophobicContact CH2-CB 4.41Å; A570-A574 PolarHBondContact O-N 3.22Å; I571-A574 PolarHBondContact O-N 3.23Å; C572-A574 PolarHBondContact O-N 3.46Å; A574-K578 PolarHBondContact O-N 3.49Å; A574-I637 HydrophobicContact CB-CB 4.46Å; A574-I637 HydrophobicContact CB-CD1 4.29Å; A574-I637 HydrophobicContact CB-CG1 4.01Å; A574-I637 HydrophobicContact CB-CG2 3.65Å
575	V	86.9	Confident	82.6	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-69	-42.2	174.8	173	0	0	0	0	111.4	W93 L536 I541 I571 C572 R573 V577 K578 V579 I627 I629	W93-V575 HydrophobicContact CZ3-CG2 4.44Å; L536-V575 HydrophobicContact CD1-CB 4.33Å; L536-V575 HydrophobicContact CD1-CG1 4.18Å; L536-V575 HydrophobicContact CD2-CG1 4.42Å; I541-V575 HydrophobicContact CB-CG1 4.29Å; I541-V575 HydrophobicContact CD1-CB 4.27Å; I541-V575 HydrophobicContact CD1-CG1 4.38Å; I541-V575 HydrophobicContact CD1-CG2 3.84Å; I541-V575 HydrophobicContact CG1-CG2 4.38Å; I571-V575 WeakPolarHBondContact O-CG2 3.49Å; I571-V575 PolarHBondContact O-N 3.28Å; C572-V575 PolarHBondContact O-N 3.25Å; R573-V575 VanDerWaalsContact C-N 3.3Å; R573-V575 PolarHBondContact O-N 3.03Å; V575-V577 VanDerWaalsContact C-N 3.3Å; V575-V577 PolarHBondContact O-N 3.17Å; V575-K578 WeakPolarHBondContact O-CA 3.48Å; V575-K578 WeakPolarHBondContact O-CB 3.43Å; V575-K578 PolarHBondContact O-N 3.41Å; V575-V579 HydrophobicContact CG1-CG2 4.16Å; V575-V579 WeakPolarHBondContact O-CG2 3.31Å; V575-V579 PolarHBondContact O-N 3.3Å; V575-I627 HydrophobicContact CG1-CD1 3.82Å; V575-I627 HydrophobicContact CG2-CG2 4.42Å; V575-I629 HydrophobicContact CG2-CD1 3.9Å
576	A	86.9	Confident	80.1	Confident	28 Å²	28	61.2 Å²	61.2	23%	0.231	31%	0.305	C	S	.	.	H	α-helix	trans	-59	-40.7	177.1	0	0	0	0	0	112.2	L536 C572 R573 K578 V579 A580	L536-A576 HydrophobicContact CD2-CB 4.2Å; L536-A576 HydrophobicContact CG-CB 4.49Å; C572-A576 VanDerWaalsContact O-CB 3.31Å; C572-A576 WeakPolarHBondContact O-CB 3.25Å; C572-A576 PolarHBondContact O-N 3.1Å; R573-A576 PolarHBondContact O-N 3.37Å; A576-K578 VanDerWaalsContact C-N 3.29Å; A576-K578 PolarHBondContact O-N 3.09Å; A576-V579 PolarHBondContact O-N 3.22Å; A576-A580 WeakPolarHBondContact O-CB 3.34Å; A576-A580 PolarHBondContact O-N 3.46Å
577	V	86.3	Confident	77.7	Confident	84 Å²	84	56.7 Å²	56.7	51%	0.509	30%	0.3	S	S	.	.	H	α-helix	trans	-58.7	-42.3	172.7	172.5	0	0	0	0	111	R573 V575 A580 E581	R573-V577 WeakPolarHBondContact O-CG2 3.44Å; R573-V577 PolarHBondContact O-N 3Å; V575-V577 VanDerWaalsContact C-N 3.3Å; V575-V577 PolarHBondContact O-N 3.17Å; V577-A580 PolarHBondContact O-N 3.39Å; V577-E581 WeakPolarHBondContact O-CG 3.24Å; V577-E581 PolarHBondContact O-N 2.88Å
578	K	79.8	Confident	75.3	Confident	79 Å²	79	62.2 Å²	62.2	34%	0.343	32%	0.324	S	S	.	.	H	α-helix	trans	-69.1	-41	179.2	-77.3	-72.2	171.3	-154.4	0	113.9	W93 A574 V575 A576 A580 E581 G582	W93-K578 HydrophobicContact CE3-CG 4.33Å; W93-K578 HydrophobicContact CH2-CG 3.76Å; W93-K578 HydrophobicContact CZ3-CB 4.19Å; W93-K578 HydrophobicContact CZ3-CD 4.43Å; W93-K578 HydrophobicContact CZ3-CG 3.47Å; W93-K578 VanDerWaalsContact CZ3-CG 3.47Å; A574-K578 PolarHBondContact O-N 3.49Å; V575-K578 WeakPolarHBondContact O-CA 3.48Å; V575-K578 WeakPolarHBondContact O-CB 3.43Å; V575-K578 PolarHBondContact O-N 3.41Å; A576-K578 VanDerWaalsContact C-N 3.29Å; A576-K578 PolarHBondContact O-N 3.09Å; K578-A580 VanDerWaalsContact C-N 3.31Å; K578-E581 IonicContact NZ-OE2 3.06Å; K578-E581 PolarHBondContact NZ-OE2 2.77Å; K578-E581 PolarHBondContact O-N 3.31Å; K578-G582 PolarHBondContact O-N 2.92Å
579	V	82.7	Confident	72.9	Confident	24 Å²	24	67.5 Å²	67.5	15%	0.145	35%	0.352	C	S	.	.	H	α-helix	trans	-63	-42.6	176.1	174.7	0	0	0	0	109.9	L536 V575 A576 G582 Q583 I627	L536-V579 HydrophobicContact CD2-CG2 4.33Å; V575-V579 HydrophobicContact CG1-CG2 4.16Å; V575-V579 WeakPolarHBondContact O-CG2 3.31Å; V575-V579 PolarHBondContact O-N 3.3Å; A576-V579 PolarHBondContact O-N 3.22Å; V579-G582 PolarHBondContact O-N 2.83Å; V579-Q583 WeakPolarHBondContact O-CG 3.31Å; V579-Q583 PolarHBondContact O-N 3.43Å; V579-Q583 VanDerWaalsContact O-N 3.13Å; V579-I627 HydrophobicContact CG2-CD1 4.25Å
580	A	80.4	Confident	70.5	Confident	46 Å²	46	73.1 Å²	73.1	38%	0.38	38%	0.381	S	S	.	.	H	α-helix	trans	-64	-41	175.1	0	0	0	0	0	112.7	A576 V577 K578 G582 H584	A576-A580 WeakPolarHBondContact O-CB 3.34Å; A576-A580 PolarHBondContact O-N 3.46Å; V577-A580 PolarHBondContact O-N 3.39Å; K578-A580 VanDerWaalsContact C-N 3.31Å; A580-G582 VanDerWaalsContact C-N 3.32Å; A580-G582 PolarHBondContact O-N 2.86Å; A580-H584 PolarHBondContact O-CD2 3.42Å; A580-H584 VanDerWaalsContact O-CD2 3.25Å; A580-H584 PolarHBondContact O-N 3.35Å
581	E	78.1	Confident	68.1	Low	95 Å²	95	81.9 Å²	81.9	44%	0.444	41%	0.409	S	S	.	.	H	α-helix	trans	-62.6	-36.6	173.4	-76.8	178.9	172.6	0	0	112.7	V577 K578	V577-E581 WeakPolarHBondContact O-CG 3.24Å; V577-E581 PolarHBondContact O-N 2.88Å; K578-E581 IonicContact NZ-OE2 3.06Å; K578-E581 PolarHBondContact NZ-OE2 2.77Å; K578-E581 PolarHBondContact O-N 3.31Å
582	G	67.8	Low	65.4	Low	24 Å²	24	85.6 Å²	85.6	25%	0.247	44%	0.435	C	S	.	.	H	α-helix	trans	-66.5	-49.1	179.7	0	0	0	0	0	112.9	K578 V579 A580 H584 K585 E586	K578-G582 PolarHBondContact O-N 2.92Å; V579-G582 PolarHBondContact O-N 2.83Å; A580-G582 VanDerWaalsContact C-N 3.32Å; A580-G582 PolarHBondContact O-N 2.86Å; G582-H584 PolarHBondContact O-N 2.78Å; G582-K585 WeakPolarHBondContact O-CB 3.46Å; G582-K585 PolarHBondContact O-N 2.86Å; G582-E586 PolarHBondContact O-N 3.35Å
583	Q	60.5	Low	62.8	Low	119 Å²	119	92 Å²	92	56%	0.556	47%	0.469	S	S	*	.	H	α-helix	trans	-58.9	-35.3	178.3	-70.2	176.6	-9.5	0	0	112.6	V579 K585 A587	V579-Q583 WeakPolarHBondContact O-CG 3.31Å; V579-Q583 PolarHBondContact O-N 3.43Å; V579-Q583 VanDerWaalsContact O-N 3.13Å; Q583-K585 VanDerWaalsContact C-N 3.3Å; Q583-K585 PolarHBondContact O-N 3.27Å; Q583-A587 PolarHBondContact O-N 3.43Å; Q583-A587 VanDerWaalsContact O-N 3.15Å
584	H	49.5	Very low	60.3	Low	141 Å²	141	91.6 Å²	91.6	65%	0.653	48%	0.481	S	S	*	.	H	α-helix	trans	-69.3	-23	176.3	-85.1	-59.7	0	0	0	114.4	A580 G582	A580-H584 PolarHBondContact O-CD2 3.42Å; A580-H584 VanDerWaalsContact O-CD2 3.25Å; A580-H584 PolarHBondContact O-N 3.35Å; G582-H584 PolarHBondContact O-N 2.78Å
585	K	50.8	Low	57.7	Low	149 Å²	149	93.9 Å²	93.9	65%	0.648	50%	0.5	S	S	*	.	H	α-helix	trans	-79	-42.7	175.3	-75.6	-179.6	178.7	175.9	0	111.3	G582 Q583 K588 L589	G582-K585 WeakPolarHBondContact O-CB 3.46Å; G582-K585 PolarHBondContact O-N 2.86Å; Q583-K585 VanDerWaalsContact C-N 3.3Å; Q583-K585 PolarHBondContact O-N 3.27Å; K585-K588 PolarHBondContact O-N 3.2Å; K585-L589 WeakPolarHBondContact O-CD1 3.36Å; K585-L589 PolarHBondContact O-N 3.06Å
586	E	41.8	Very low	55.1	Low	107 Å²	107	102.1 Å²	102.1	50%	0.5	54%	0.544	S	S	.	.	H	α-helix	trans	-63.7	-45.2	178.2	-64.5	-174.7	149.9	0	0	111.2	G582 K588 L589 D590	G582-E586 PolarHBondContact O-N 3.35Å; E586-K588 PolarHBondContact O-N 3.23Å; E586-K588 VanDerWaalsContact O-N 3.1Å; E586-L589 PolarHBondContact O-N 3.18Å; E586-D590 PolarHBondContact O-N 3.03Å
587	A	41.5	Very low	52.3	Low	55 Å²	55	104.2 Å²	104.2	46%	0.455	57%	0.568	S	S	.	*	H	α-helix	trans	-63.5	-19.1	176.3	0	0	0	0	0	114.7	Q583	Q583-A587 PolarHBondContact O-N 3.43Å; Q583-A587 VanDerWaalsContact O-N 3.15Å
588	K	43.6	Very low	49.6	Very low	165 Å²	165	110.1 Å²	110.1	72%	0.717	59%	0.59	S	S	*	*	H	α-helix	trans	-84.8	-32.7	173.8	-87.2	-176.4	177.4	-179.4	0	112.8	K585 E586 R591 S592	K585-K588 PolarHBondContact O-N 3.2Å; E586-K588 PolarHBondContact O-N 3.23Å; E586-K588 VanDerWaalsContact O-N 3.1Å; K588-R591 PolarHBondContact O-N 3.05Å; K588-S592 PolarHBondContact O-N 3.46Å; K588-S592 PolarHBondContact O-OG 2.84Å
589	L	45	Very low	47	Very low	112 Å²	112	109.6 Å²	109.6	59%	0.586	61%	0.608	S	S	*	*	H	α-helix	trans	-67.8	-40.4	174.5	-92	121.5	0	0	0	111.1	K585 E586 R591 S592	K585-L589 WeakPolarHBondContact O-CD1 3.36Å; K585-L589 PolarHBondContact O-N 3.06Å; E586-L589 PolarHBondContact O-N 3.18Å; L589-R591 PolarHBondContact O-N 3.14Å; L589-S592 PolarHBondContact O-N 3.41Å; L589-S592 PolarHBondContact O-OG 2.77Å
590	D	42.7	Very low	44.1	Very low	118 Å²	118	114.5 Å²	114.5	63%	0.631	64%	0.642	S	S	*	*	H	α-helix	trans	-67.6	-23.6	178.2	-67.9	-21.6	0	0	0	113.3	E586	E586-D590 PolarHBondContact O-N 3.03Å
591	R	41.4	Very low	41.5	Very low	210 Å²	210	124.3 Å²	124.3	79%	0.792	67%	0.669	S	S	*	*	H	α-helix	trans	-84.6	-24.3	175.8	-78.2	-173	179.1	-176.4	0.6	113.8	K588 L589 D593	K588-R591 PolarHBondContact O-N 3.05Å; L589-R591 PolarHBondContact O-N 3.14Å; R591-D593 VanDerWaalsContact C-N 3.31Å
592	S	35.1	Very low	38.9	Very low	78 Å²	78	128 Å²	128	55%	0.545	69%	0.686	S	S	.	*	H	α-helix	trans	-76.9	-18.4	177.3	47.6	0	0	0	0	113.4	K588 L589	K588-S592 PolarHBondContact O-N 3.46Å; K588-S592 PolarHBondContact O-OG 2.84Å; L589-S592 PolarHBondContact O-N 3.41Å; L589-S592 PolarHBondContact O-OG 2.77Å
593	D	38.8	Very low	36.9	Very low	137 Å²	137	135.1 Å²	135.1	73%	0.733	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	3.2	-179.1	-71.6	-8.9	0	0	0	113.7	R591	R591-D593 VanDerWaalsContact C-N 3.31Å
594	V	37.7	Very low	35.2	Very low	124 Å²	124	135.8 Å²	135.8	75%	0.752	72%	0.724	S	S	*	*	S	Bend	trans	-117.7	-0.4	-177.7	-173.8	0	0	0	0	113.5
595	A	34.4	Very low	34	Very low	77 Å²	77	136.2 Å²	136.2	64%	0.636	73%	0.731	S	S	*	*			trans	-109	68.1	-178.3	0	0	0	0	0	112.5
596	D	31.8	Very low	32.7	Very low	173 Å²	173	138.1 Å²	138.1	93%	0.925	74%	0.742	S	S	*	*	S	Bend	trans	-154	98.1	150.8	-93.7	-30.1	0	0	0	109
597	G	28.5	Very low	32	Very low	71 Å²	71	140.5 Å²	140.5	73%	0.732	76%	0.758	S	S	*	*	S	Bend	trans	153.5	88	171.4	0	0	0	0	0	114.9
598	E	29.2	Very low	31.1	Very low	208 Å²	208	142.5 Å²	142.5	97%	0.972	78%	0.775	S	S	*	*			trans	59.2	138.6	147.2	-55.9	178.3	164.8	0	0	118.2
599	G	25	Very low	30.2	Very low	69 Å²	69	144.5 Å²	144.5	71%	0.711	78%	0.784	S	S	*	*			cis	153	126.7	14	0	0	0	0	0	107.1
600	C	23.4	Very low	29.6	Very low	127 Å²	127	145.1 Å²	145.1	86%	0.858	79%	0.794	S	S	*	*			trans	48.2	108.7	156.7	-63.4	0	0	0	0	121.7
601	R	24.1	Very low	28.8	Very low	251 Å²	251	148.6 Å²	148.6	95%	0.947	81%	0.807	S	S	*	*				158.8	134.7	109.5	-89.8	175.9	176.1	160.3	-0.1	112.3
602	E	25.3	Very low	28	Very low	174 Å²	174	143.5 Å²	143.5	81%	0.813	81%	0.809	S	S	*	*			trans	-77.1	160.5	169.6	-68.5	173	143.8	0	0	112.3
603	H	25.1	Very low	27.7	Very low	172 Å²	172	147.4 Å²	147.4	80%	0.796	82%	0.822	S	S	*	*			trans	105.3	110	150.4	-80.1	-65.5	0	0	0	121
604	V	25.1	Very low	27	Very low	133 Å²	133	145.9 Å²	145.9	81%	0.806	82%	0.823	S	S	*	*				135.3	137.3	125	173.5	0	0	0	0	115.1
605	L	24.7	Very low	26.5	Very low	151 Å²	151	147.2 Å²	147.2	79%	0.791	83%	0.825	S	S	*	*			trans	-60	151.5	-176.2	-58.3	136.8	0	0	0	114.6
606	E	23.7	Very low	26	Very low	188 Å²	188	149 Å²	149	88%	0.879	83%	0.829	S	S	*	*				163.6	157.6	107.5	-103.7	176.1	-176.6	0	0	112.9
607	D	25.1	Very low	25.8	Very low	157 Å²	157	145.5 Å²	145.5	84%	0.84	82%	0.824	S	S	*	*			trans	-50.3	147.5	-171.7	-68.2	-66.1	0	0	0	118.3
608	A	23.7	Very low	25.7	Very low	98 Å²	98	149.2 Å²	149.2	81%	0.81	83%	0.827	S	S	*	*				178.6	127.1	129.8	0	0	0	0	0	112.4
609	K	25.3	Very low	25.7	Very low	207 Å²	207	147.3 Å²	147.3	90%	0.9	82%	0.822	S	S	*	*			trans	-84.5	145.7	147.1	-80.6	-175.8	178.7	-179.9	0	107.1
610	P	31.2	Very low	25.9	Very low	124 Å²	124	148.7 Å²	148.7	81%	0.805	83%	0.827	S	S	*	*				-150	174.5	75.2	34.6	-11.7	0	0	0	116.8
611	E	26.7	Very low	26.3	Very low	192 Å²	192	150.1 Å²	150.1	90%	0.897	83%	0.826	S	S	*	*			trans	-40.5	143.1	-179.4	-59.3	165.5	163.5	0	0	118.2
612	A	23.8	Very low	26.7	Very low	102 Å²	102	143.1 Å²	143.1	84%	0.843	81%	0.812	S	S	*	*			trans	-167.4	138.3	135.6	0	0	0	0	0	111.7
613	I	30.2	Very low	27.3	Very low	160 Å²	160	139.4 Å²	139.4	82%	0.821	80%	0.804	S	S	*	*			trans	-71.2	133.9	179.2	-65.3	153.7	0	0	0	110.5
614	S	23	Very low	28.7	Very low	106 Å²	106	137.2 Å²	137.2	74%	0.741	79%	0.793	S	S	*	*			trans	-148.4	117.1	149.4	65	0	0	0	0	110.5	T616	S614-T616 PolarHBondContact O-N 3.14Å
615	D	27.5	Very low	30.3	Very low	151 Å²	151	134.5 Å²	134.5	81%	0.807	77%	0.773	S	S	*	*			trans	-47.9	114.9	171.1	-63.1	-57.5	0	0	0	112.5
616	T	24.2	Very low	32.5	Very low	116 Å²	116	129.5 Å²	129.5	71%	0.712	75%	0.75	S	S	*	*			trans	-128.2	106.6	144.9	48.4	0	0	0	0	106.9	S614 D618	S614-T616 PolarHBondContact O-N 3.14Å; T616-D618 VanDerWaalsContact C-N 3.29Å; T616-D618 PolarHBondContact O-N 3.49Å
617	A	28	Very low	35	Very low	99 Å²	99	121.6 Å²	121.6	82%	0.818	71%	0.713	S	S	*	*			trans	-55.5	95.6	167.2	0	0	0	0	0	108.6	L619	A617-L619 PolarHBondContact O-N 3.42Å; A617-L619 VanDerWaalsContact O-N 3.07Å
618	D	25.2	Very low	37.7	Very low	148 Å²	148	116.5 Å²	116.5	79%	0.791	69%	0.686	S	S	*	*			trans	-60.5	114.3	166.5	-77.4	-28.5	0	0	0	107.1	T616 A620	T616-D618 VanDerWaalsContact C-N 3.29Å; T616-D618 PolarHBondContact O-N 3.49Å; D618-A620 PolarHBondContact O-N 2.91Å
619	L	29.9	Very low	40.6	Very low	168 Å²	168	111.8 Å²	111.8	88%	0.88	65%	0.647	S	S	*	*			trans	-49.2	100.1	177.6	-79.3	122.5	0	0	0	109.7	A617 L621	A617-L619 PolarHBondContact O-N 3.42Å; A617-L619 VanDerWaalsContact O-N 3.07Å; L619-L621 PolarHBondContact O-N 3.45Å
620	A	28.6	Very low	43.3	Very low	99 Å²	99	105.3 Å²	105.3	82%	0.818	62%	0.622	S	S	*	*			trans	-57.4	104.6	170	0	0	0	0	0	108.9	D618	D618-A620 PolarHBondContact O-N 2.91Å
621	L	31.4	Very low	45.8	Very low	157 Å²	157	104.4 Å²	104.4	82%	0.822	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-53.7	142.2	164.5	-72.5	154	0	0	0	108.5	L619	L619-L621 PolarHBondContact O-N 3.45Å
622	P	32.1	Very low	48.4	Very low	103 Å²	103	101.2 Å²	101.2	67%	0.669	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-61.1	144.2	-172.5	24.6	-32.9	0	0	0	111.1	E624	P622-E624 PolarHBondContact O-N 3.27Å
623	P	39.1	Very low	51.1	Low	97 Å²	97	96.6 Å²	96.6	63%	0.63	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-62.7	134.3	-174.8	25.4	-32.8	0	0	0	110.4	M625	P623-M625 PolarHBondContact O-N 3.29Å
624	E	54.7	Low	53.8	Low	125 Å²	125	89.1 Å²	89.1	58%	0.584	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-48.7	137.4	164.9	-61.2	-169.2	121.6	0	0	109.3	P622	P622-E624 PolarHBondContact O-N 3.27Å
625	M	58.7	Low	56.8	Low	76 Å²	76	90.1 Å²	90.1	37%	0.374	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-54.1	140.6	177.2	-74.8	177.7	64.2	0	0	110.5	L47 N92 Y98 P623 I627	L47-M625 HydrophobicContact CD1-SD 4.12Å; N92-M625 PolarHBondContact ND2-O 2.75Å; Y98-M625 HydrophobicContact CE1-SD 3.83Å; P623-M625 PolarHBondContact O-N 3.29Å; M625-I627 PolarHBondContact O-N 2.91Å
626	P	69.9	Low	59.5	Low	46 Å²	46	86.7 Å²	86.7	30%	0.299	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-54.9	139.5	178.8	19.4	-30.7	0	0	0	110.8	Q539 Q542 L628	Q539-P626 VanDerWaalsContact O-CA 3.24Å; Q539-P626 WeakPolarHBondContact O-CA 3.36Å; Q539-P626 VanDerWaalsContact O-CB 3.22Å; Q539-P626 WeakPolarHBondContact O-CB 3.43Å; Q542-P626 HydrophobicContact CB-CB 4.14Å; P626-L628 PolarHBondContact O-N 3.07Å
627	I	76.1	Confident	62.6	Low	22 Å²	22	82.9 Å²	82.9	11%	0.113	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	105.9	170.4	-62.4	165.7	0	0	0	107.2	N92 W93 Q540 I541 Q542 V575 V579 M625 I629	N92-I627 HydrophobicContact CB-CG1 4.41Å; W93-I627 HydrophobicContact CE3-CG2 3.93Å; Q540-I627 WeakPolarHBondContact O-CB 3.21Å; Q540-I627 PolarHBondContact O-N 3.48Å; I541-I627 WeakPolarHBondContact CA-O 3.42Å; Q542-I627 PolarHBondContact N-O 2.88Å; V575-I627 HydrophobicContact CG1-CD1 3.82Å; V575-I627 HydrophobicContact CG2-CG2 4.42Å; V579-I627 HydrophobicContact CG2-CD1 4.25Å; M625-I627 PolarHBondContact O-N 2.91Å; I627-I629 HydrophobicContact CG2-CD1 3.95Å
628	L	81.8	Confident	65.5	Low	50 Å²	50	79.4 Å²	79.4	26%	0.262	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	121.4	177.9	-165.1	156.9	0	0	0	109.3	Q542 P544 P626 D630	Q542-L628 WeakPolarHBondContact O-CA 3.43Å; P544-L628 HydrophobicContact CG-CD2 3.91Å; P544-L628 HydrophobicContact CG-CG 4.27Å; P626-L628 PolarHBondContact O-N 3.07Å; L628-D630 HydrophobicContact CD2-CB 4.4Å; L628-D630 WeakPolarHBondContact CD2-OD1 3.47Å; L628-D630 PolarHBondContact O-N 2.99Å
629	I	84.6	Confident	68.4	Low	0 Å²	0	73.4 Å²	73.4	0%	0	40%	0.402	C	S	.	.			trans	-87.7	92.2	-179.7	-52.4	-62	0	0	0	109.8	I541 Q542 I543 P544 T547 I571 V575 I627 A633 I637	I541-I629 HydrophobicContact CD1-CG1 4.3Å; I541-I629 HydrophobicContact CG1-CG1 4.14Å; Q542-I629 PolarHBondContact O-N 3.13Å; I543-I629 HydrophobicContact CG1-CB 4.38Å; I543-I629 HydrophobicContact CG1-CG1 4.11Å; P544-I629 WeakPolarHBondContact CD-O 3.15Å; T547-I629 HydrophobicContact CG2-CG2 4.15Å; T547-I629 VanDerWaalsContact CG2-O 3.3Å; T547-I629 WeakPolarHBondContact CG2-O 3.49Å; T547-I629 PolarHBondContact OG1-O 2.78Å; I571-I629 HydrophobicContact CG2-CD1 4.16Å; I571-I629 HydrophobicContact CG2-CG1 4.03Å; I571-I629 HydrophobicContact CG2-CG2 4.42Å; V575-I629 HydrophobicContact CG2-CD1 3.9Å; I627-I629 HydrophobicContact CG2-CD1 3.95Å; I629-A633 HydrophobicContact CG2-CB 4.33Å; I629-I637 HydrophobicContact CD1-CD1 4.2Å
630	D	83.2	Confident	71.1	Confident	70 Å²	70	69.8 Å²	69.8	37%	0.374	39%	0.389	S	S	.	.			trans	-81.8	171.4	172.1	-78	-35.4	0	0	0	112.8	L628 H632 A633 L634	L628-D630 HydrophobicContact CD2-CB 4.4Å; L628-D630 WeakPolarHBondContact CD2-OD1 3.47Å; L628-D630 PolarHBondContact O-N 2.99Å; D630-H632 PolarHBondContact O-N 3.18Å; D630-A633 PolarHBondContact O-N 2.69Å; D630-A633 VanDerWaalsContact O-N 3.16Å; D630-L634 WeakPolarHBondContact O-CB 3.29Å; D630-L634 PolarHBondContact O-N 3.26Å
631	F	83.4	Confident	73.7	Confident	105 Å²	105	67.4 Å²	67.4	46%	0.461	37%	0.365	S	S	.	.	H	α-helix	trans	-56	-32.6	176.1	-66.5	-84	0	0	0	113.9	L546 A550 K635	L546-F631 HydrophobicContact CB-CZ 4.49Å; A550-F631 HydrophobicContact CB-CD1 4.05Å; A550-F631 HydrophobicContact CB-CE1 3.49Å; A550-F631 VanDerWaalsContact CB-CE1 3.49Å; A550-F631 HydrophobicContact CB-CZ 4.45Å; F631-K635 PolarHBondContact O-N 3.35Å; F631-K635 VanDerWaalsContact O-N 3.17Å
632	H	81.1	Confident	75.9	Confident	126 Å²	126	65 Å²	65	58%	0.583	35%	0.352	S	S	*	.	H	α-helix	trans	-68.5	-51.2	175.6	-170	-68.9	0	0	0	110.9	D630 L634 K635 D636	D630-H632 PolarHBondContact O-N 3.18Å; H632-L634 PolarHBondContact O-N 3.28Å; H632-K635 PolarHBondContact O-N 3.39Å; H632-D636 IonicContact CE1-OD1 2.59Å; H632-D636 PolarHBondContact CE1-OD1 3.44Å; H632-D636 IonicContact CE1-OD2 2.76Å; H632-D636 PolarHBondContact CE1-OD2 3.22Å; H632-D636 IonicContact ND1-OD1 2.74Å; H632-D636 IonicContact ND1-OD2 2.6Å; H632-D636 PolarHBondContact ND1-OD2 3.25Å; H632-D636 PolarHBondContact O-N 3.13Å
633	A	80.4	Confident	77.9	Confident	4 Å²	4	64.3 Å²	64.3	3%	0.033	34%	0.337	C	S	.	.	H	α-helix	trans	-57.5	-37.8	175.6	0	0	0	0	0	111.3	W93 I629 D630 K635 D636 I637	W93-A633 HydrophobicContact CB-CB 4.36Å; W93-A633 VanDerWaalsContact CD1-CB 3.5Å; W93-A633 HydrophobicContact CD2-CB 4.4Å; W93-A633 HydrophobicContact CG-CB 3.84Å; I629-A633 HydrophobicContact CG2-CB 4.33Å; D630-A633 PolarHBondContact O-N 2.69Å; D630-A633 VanDerWaalsContact O-N 3.16Å; A633-K635 PolarHBondContact O-N 3.16Å; A633-D636 PolarHBondContact O-N 3.21Å; A633-I637 WeakPolarHBondContact O-CB 3.21Å; A633-I637 WeakPolarHBondContact O-CD1 3.47Å; A633-I637 WeakPolarHBondContact O-CG1 3.4Å; A633-I637 PolarHBondContact O-N 3.42Å
634	L	86.2	Confident	79.2	Confident	3 Å²	3	66.9 Å²	66.9	2%	0.016	34%	0.34	C	S	.	.	H	α-helix	trans	-60.8	-43.6	176.3	-167.1	69.8	0	0	0	112.3	T547 A550 I551 Y555 I571 D630 H632 I637 L638	T547-L634 HydrophobicContact CG2-CD1 4.24Å; T547-L634 HydrophobicContact CG2-CD2 4.23Å; A550-L634 HydrophobicContact CB-CD2 4.27Å; I551-L634 HydrophobicContact CD1-CD1 3.83Å; I551-L634 HydrophobicContact CG1-CD1 3.61Å; I551-L634 HydrophobicContact CG1-CD2 3.91Å; I551-L634 HydrophobicContact CG1-CG 4.39Å; Y555-L634 HydrophobicContact CD2-CD2 4.13Å; Y555-L634 HydrophobicContact CE2-CD2 3.53Å; Y555-L634 HydrophobicContact CE2-CG 3.95Å; I571-L634 HydrophobicContact CD1-CD1 3.86Å; D630-L634 WeakPolarHBondContact O-CB 3.29Å; D630-L634 PolarHBondContact O-N 3.26Å; H632-L634 PolarHBondContact O-N 3.28Å; L634-I637 PolarHBondContact O-N 3.36Å; L634-L638 HydrophobicContact CD1-CD1 3.52Å; L634-L638 HydrophobicContact CD1-CG 4.1Å; L634-L638 HydrophobicContact CG-CD1 4.13Å; L634-L638 WeakPolarHBondContact O-CB 3.34Å; L634-L638 PolarHBondContact O-N 2.94Å
635	K	86.9	Confident	79.4	Confident	128 Å²	128	67 Å²	67	56%	0.557	34%	0.344	S	S	*	.	H	α-helix	trans	-67.8	-37.5	177.5	-170.1	-178.3	178.1	-174.6	0	111.8	F631 H632 A633 G639	F631-K635 PolarHBondContact O-N 3.35Å; F631-K635 VanDerWaalsContact O-N 3.17Å; H632-K635 PolarHBondContact O-N 3.39Å; A633-K635 PolarHBondContact O-N 3.16Å; K635-G639 CarbonylContact O-C 3.53Å; K635-G639 WeakPolarHBondContact O-CA 3.36Å; K635-G639 PolarHBondContact O-N 3.42Å
636	D	84.8	Confident	79.3	Confident	78 Å²	78	67.3 Å²	67.3	42%	0.417	35%	0.345	S	S	.	.	H	α-helix	trans	-66	-40.2	176.9	-63.4	-24.8	0	0	0	111.8	W93 H632 A633	W93-D636 PolarHBondContact NE1-OD2 3.13Å; H632-D636 IonicContact CE1-OD1 2.59Å; H632-D636 PolarHBondContact CE1-OD1 3.44Å; H632-D636 IonicContact CE1-OD2 2.76Å; H632-D636 PolarHBondContact CE1-OD2 3.22Å; H632-D636 IonicContact ND1-OD1 2.74Å; H632-D636 IonicContact ND1-OD2 2.6Å; H632-D636 PolarHBondContact ND1-OD2 3.25Å; H632-D636 PolarHBondContact O-N 3.13Å; A633-D636 PolarHBondContact O-N 3.21Å
637	I	87.7	Confident	78.8	Confident	36 Å²	36	65.9 Å²	65.9	19%	0.185	34%	0.335	C	S	.	.	H	α-helix	trans	-83.5	-49.2	-174.9	-63.3	164.5	0	0	0	112.1	W93 I571 A574 I629 A633 L634	W93-I637 HydrophobicContact CH2-CD1 4.1Å; W93-I637 HydrophobicContact CH2-CG1 4.13Å; W93-I637 HydrophobicContact CZ2-CD1 3.89Å; W93-I637 HydrophobicContact CZ2-CG1 3.64Å; I571-I637 HydrophobicContact CG1-CG2 4.23Å; A574-I637 HydrophobicContact CB-CB 4.46Å; A574-I637 HydrophobicContact CB-CD1 4.29Å; A574-I637 HydrophobicContact CB-CG1 4.01Å; A574-I637 HydrophobicContact CB-CG2 3.65Å; I629-I637 HydrophobicContact CD1-CD1 4.2Å; A633-I637 WeakPolarHBondContact O-CB 3.21Å; A633-I637 WeakPolarHBondContact O-CD1 3.47Å; A633-I637 WeakPolarHBondContact O-CG1 3.4Å; A633-I637 PolarHBondContact O-N 3.42Å; L634-I637 PolarHBondContact O-N 3.36Å
638	L	89.1	Confident	77.9	Confident	26 Å²	26	69.4 Å²	69.4	14%	0.136	36%	0.362	C	S	.	.	H	α-helix	trans	-93.8	-10.2	-174.8	-62.4	-175.1	0	0	0	113.4	I551 Y555 K567 A570 I571 L634	I551-L638 HydrophobicContact CG1-CD1 4.44Å; Y555-L638 HydrophobicContact CD1-CB 3.92Å; Y555-L638 HydrophobicContact CD1-CD1 4.05Å; Y555-L638 HydrophobicContact CD2-CD1 4.32Å; Y555-L638 HydrophobicContact CE1-CB 3.59Å; Y555-L638 HydrophobicContact CE1-CD1 4.29Å; Y555-L638 HydrophobicContact CG-CD1 4.04Å; K567-L638 HydrophobicContact CB-CD1 4.42Å; K567-L638 HydrophobicContact CD-CD1 4.28Å; K567-L638 HydrophobicContact CD-CD2 4.01Å; A570-L638 HydrophobicContact CB-CD2 3.97Å; I571-L638 HydrophobicContact CD1-CD1 4.32Å; I571-L638 HydrophobicContact CG1-CD2 4.22Å; I571-L638 HydrophobicContact CG1-CG 4.36Å; L634-L638 HydrophobicContact CD1-CD1 3.52Å; L634-L638 HydrophobicContact CD1-CG 4.1Å; L634-L638 HydrophobicContact CG-CD1 4.13Å; L634-L638 WeakPolarHBondContact O-CB 3.34Å; L634-L638 PolarHBondContact O-N 2.94Å
639	G	87.3	Confident	76.8	Confident	22 Å²	22	74.5 Å²	74.5	23%	0.227	38%	0.384	C	S	.	.			trans	82.6	-168	-173.9	0	0	0	0	0	113.4	Y555 K635	Y555-G639 WeakPolarHBondContact CE1-O 3.46Å; Y555-G639 PolarHBondContact OH-O 3.26Å; K635-G639 CarbonylContact O-C 3.53Å; K635-G639 WeakPolarHBondContact O-CA 3.36Å; K635-G639 PolarHBondContact O-N 3.42Å
640	P	85.9	Confident	75.7	Confident	93 Å²	93	78.4 Å²	78.4	60%	0.604	40%	0.399	S	S	*	.	S	Bend	trans	-60.3	153	176.9	26.9	-34.4	0	0	0	111.7	Y555 L642	Y555-P640 WeakPolarHBondContact CE1-O 3.42Å; P640-L642 PolarHBondContact O-N 3.22Å
641	P	82.4	Confident	74.8	Confident	49 Å²	49	75.6 Å²	75.6	32%	0.318	38%	0.384	S	S	.	.			trans	-58.5	137	177.3	26.7	-34.4	0	0	0	110.5	R554	R554-P641 HydrophobicContact CB-CB 3.92Å; R554-P641 HydrophobicContact CG-CB 4.46Å
642	L	78.3	Confident	74.1	Confident	105 Å²	105	74.4 Å²	74.4	55%	0.55	39%	0.389	S	S	.	.	S	Bend	trans	-86.8	-25.8	-177.5	-69.2	172.7	0	0	0	112.6	R554 P640	R554-L642 PolarHBondContact O-N 3.34Å; P640-L642 PolarHBondContact O-N 3.22Å
643	Y	74.3	Confident	74	Confident	90 Å²	90	74.9 Å²	74.9	35%	0.353	39%	0.391	S	S	.	.			trans	-128	128.7	-177.6	-53.8	-68.3	0	0	0	109.7	R554 R557	R554-Y643 PolarHBondContact O-N 2.63Å; R557-Y643 HydrophobicContact CB-CD1 4.27Å; R557-Y643 HydrophobicContact CB-CD2 4.12Å; R557-Y643 HydrophobicContact CB-CE1 3.85Å; R557-Y643 HydrophobicContact CB-CE2 3.71Å; R557-Y643 HydrophobicContact CB-CG 4.39Å
644	E	66	Low	74.2	Confident	151 Å²	151	77.4 Å²	77.4	71%	0.706	41%	0.407	S	S	*	.			trans	-105.4	149.9	169.6	-71.5	-178.8	168.7	0	0	110	E646	E644-E646 PolarHBondContact O-N 3.06Å
645	L	60.1	Low	74.2	Confident	126 Å²	126	77.3 Å²	77.3	66%	0.66	41%	0.407	S	S	*	.			trans	-77.5	79	174.6	-82.6	150.9	0	0	0	108.6	V647	L645-V647 PolarHBondContact O-N 3.14Å; L645-V647 VanDerWaalsContact O-N 3.09Å
646	E	56.2	Low	74.4	Confident	84 Å²	84	71.7 Å²	71.7	39%	0.393	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-3.2	-176.3	-64.8	178.8	-178.5	0	0	114.9	E644 S648 R650	E644-E646 PolarHBondContact O-N 3.06Å; E646-S648 VanDerWaalsContact C-N 3.34Å; E646-S648 PolarHBondContact O-N 3.44Å; E646-R650 IonicContact OE1-NH2 3.19Å; E646-R650 IonicContact OE2-CZ 3.97Å; E646-R650 VanDerWaalsContact OE2-CZ 3.28Å; E646-R650 IonicContact OE2-NE 3.31Å; E646-R650 IonicContact OE2-NH2 3.61Å; E646-R650 PolarHBondContact OE2-NH2 3.16Å
647	V	59.3	Low	74.7	Confident	16 Å²	16	68 Å²	68	10%	0.097	36%	0.363	C	S	.	.	H	α-helix	trans	-62.8	-39.1	-168.2	-176.5	0	0	0	0	111.9	L645 L651 I658 I669 F671 L795	L645-V647 PolarHBondContact O-N 3.14Å; L645-V647 VanDerWaalsContact O-N 3.09Å; V647-L651 HydrophobicContact CG1-CD1 4.12Å; V647-L651 VanDerWaalsContact O-CD1 3.22Å; V647-L651 WeakPolarHBondContact O-CD1 3.45Å; V647-I658 HydrophobicContact CG1-CD1 3.82Å; V647-I669 HydrophobicContact CG2-CD1 4.26Å; V647-F671 HydrophobicContact CG2-CZ 4.5Å; V647-L795 HydrophobicContact CG1-CD2 3.89Å
648	S	56.4	Low	74.8	Confident	95 Å²	95	66.3 Å²	66.3	66%	0.664	36%	0.355	S	S	*	.	H	α-helix	trans	-78	-32.5	-172.1	-45.7	0	0	0	0	113.9	E646	E646-S648 VanDerWaalsContact C-N 3.34Å; E646-S648 PolarHBondContact O-N 3.44Å
649	E	58.4	Low	74.8	Confident	158 Å²	158	65 Å²	65	74%	0.738	35%	0.348	S	S	*	.	H	α-helix	trans	-78.9	-30.9	-173.5	-69.9	-174.3	169.4	0	0	113.2	S652	E649-S652 PolarHBondContact O-OG 3.08Å; E649-S652 VanDerWaalsContact O-OG 3.12Å
650	R	62.9	Low	74.9	Confident	82 Å²	82	64.1 Å²	64.1	31%	0.309	34%	0.338	S	S	.	.	H	α-helix	trans	-82.7	-21.7	-176.4	-62.5	-167.2	-173	-174.8	8.4	114.4	E646 S652 V656 E673	E646-R650 IonicContact OE1-NH2 3.19Å; E646-R650 IonicContact OE2-CZ 3.97Å; E646-R650 VanDerWaalsContact OE2-CZ 3.28Å; E646-R650 IonicContact OE2-NE 3.31Å; E646-R650 IonicContact OE2-NH2 3.61Å; E646-R650 PolarHBondContact OE2-NH2 3.16Å; R650-S652 VanDerWaalsContact C-N 3.29Å; R650-S652 PolarHBondContact O-N 2.91Å; R650-V656 WeakPolarHBondContact O-CG2 3.5Å; R650-E673 IonicContact NH1-OE1 3.05Å
651	L	64	Low	74.8	Confident	10 Å²	10	60.7 Å²	60.7	5%	0.052	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	2.5	-178.4	-72.7	156.4	0	0	0	113.4	V647 Q653 V656 I658 S763	V647-L651 HydrophobicContact CG1-CD1 4.12Å; V647-L651 VanDerWaalsContact O-CD1 3.22Å; V647-L651 WeakPolarHBondContact O-CD1 3.45Å; L651-Q653 PolarHBondContact O-N 3.41Å; L651-V656 HydrophobicContact CD2-CB 4.48Å; L651-V656 HydrophobicContact CD2-CG1 4.2Å; L651-I658 HydrophobicContact CD1-CD1 3.49Å; L651-I658 VanDerWaalsContact CD1-CD1 3.49Å; L651-I658 HydrophobicContact CD1-CG1 4.07Å; L651-I658 HydrophobicContact CD2-CG1 4.29Å; L651-I658 HydrophobicContact CG-CD1 4.49Å; L651-S763 VanDerWaalsContact CD1-CA 3.47Å; L651-S763 WeakPolarHBondContact CD1-O 3.31Å
652	S	68.6	Low	74.7	Confident	81 Å²	81	64.4 Å²	64.4	57%	0.566	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-5.9	175.9	67.8	0	0	0	0	113.5	E649 R650	E649-S652 PolarHBondContact O-OG 3.08Å; E649-S652 VanDerWaalsContact O-OG 3.12Å; R650-S652 VanDerWaalsContact C-N 3.29Å; R650-S652 PolarHBondContact O-N 2.91Å
653	Q	78.4	Confident	74.5	Confident	136 Å²	136	60.8 Å²	60.8	64%	0.636	31%	0.308	S	S	*	.	S	Bend	trans	-114.8	137.5	179.6	-64.4	-170.5	-2.3	0	0	111.4	L651 L760	L651-Q653 PolarHBondContact O-N 3.41Å; Q653-L760 VanDerWaalsContact C-CD2 3.43Å
654	P	85.3	Confident	74	Confident	57 Å²	57	60.3 Å²	60.3	37%	0.37	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	145.4	170.3	-20.3	32.1	0	0	0	111	L760	P654-L760 HydrophobicContact CB-CD2 4.42Å; P654-L760 HydrophobicContact CG-CD2 3.8Å
655	G	86.9	Confident	73.8	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.9	18.6	-176.4	0	0	0	0	0	114.2	E673 A674 C751 S754	G655-E673 CarbonylContact O-C 3.55Å; G655-E673 WeakPolarHBondContact O-CA 3.23Å; G655-A674 PolarHBondContact O-N 3.13Å; G655-C751 PolarHBondContact O-SG 3.27Å; G655-S754 PolarHBondContact N-OG 2.95Å
656	V	90.2	Very high	74.3	Confident	11 Å²	11	53.2 Å²	53.2	7%	0.067	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	131.5	173.3	-173.3	0	0	0	0	110.2	R650 L651 F671 V672 E673 V761	R650-V656 WeakPolarHBondContact O-CG2 3.5Å; L651-V656 HydrophobicContact CD2-CB 4.48Å; L651-V656 HydrophobicContact CD2-CG1 4.2Å; V656-F671 HydrophobicContact CG1-CD1 4.45Å; V656-V672 WeakPolarHBondContact CA-O 3.45Å; V656-E673 HydrophobicContact CG1-CG 4.23Å; V656-E673 HydrophobicContact CG2-CG 4.13Å; V656-V761 WeakPolarHBondContact O-CG2 3.47Å
657	A	90.6	Very high	75.3	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	152.6	175.6	0	0	0	0	0	112	V672 T747 C751 V761	A657-V672 PolarHBondContact N-O 2.99Å; A657-V672 PolarHBondContact O-N 2.87Å; A657-T747 HydrophobicContact CB-CG2 4Å; A657-C751 HydrophobicContact CB-CB 3.87Å; A657-V761 HydrophobicContact CB-CG2 4.37Å
658	I	90	Very high	76.3	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	121.6	178	-56.9	175.3	0	0	0	110.6	V647 L651 I669 F671 A766 M767 L795	V647-I658 HydrophobicContact CG1-CD1 3.82Å; L651-I658 HydrophobicContact CD1-CD1 3.49Å; L651-I658 VanDerWaalsContact CD1-CD1 3.49Å; L651-I658 HydrophobicContact CD1-CG1 4.07Å; L651-I658 HydrophobicContact CD2-CG1 4.29Å; L651-I658 HydrophobicContact CG-CD1 4.49Å; I658-I669 HydrophobicContact CG2-CB 4.33Å; I658-I669 HydrophobicContact CG2-CG2 4.45Å; I658-F671 HydrophobicContact CD1-CE1 4.12Å; I658-F671 HydrophobicContact CG1-CD1 4.01Å; I658-F671 HydrophobicContact CG1-CE1 3.82Å; I658-A766 HydrophobicContact CG2-CB 4.13Å; I658-M767 PolarHBondContact O-N 3.25Å; I658-L795 HydrophobicContact CD1-CD1 4.24Å; I658-L795 HydrophobicContact CD1-CD2 3.79Å; I658-L795 HydrophobicContact CG2-CD1 3.92Å
659	G	89.9	Confident	77.6	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	159.8	170.3	0	0	0	0	0	112.8	M670 T747 M767	G659-M670 PolarHBondContact N-O 2.95Å; G659-M670 PolarHBondContact O-N 3.32Å; G659-T747 WeakPolarHBondContact CA-OG1 3.27Å; G659-M767 WeakPolarHBondContact CA-O 3.3Å
660	L	88.6	Confident	78.9	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.01	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	121.8	172	-56.6	173.4	0	0	0	110.7	I669 A766 M767 K786 A790 I798	L660-I669 HydrophobicContact CD2-CG2 3.94Å; L660-A766 HydrophobicContact CD1-CB 4.05Å; L660-A766 HydrophobicContact CD2-CB 3.77Å; L660-A766 HydrophobicContact CG-CB 3.85Å; L660-M767 PolarHBondContact N-O 2.79Å; L660-K786 HydrophobicContact CB-CB 3.83Å; L660-K786 HydrophobicContact CB-CD 4.14Å; L660-K786 HydrophobicContact CB-CG 3.92Å; L660-K786 HydrophobicContact CD1-CB 4.08Å; L660-K786 WeakPolarHBondContact O-CE 3.27Å; L660-A790 HydrophobicContact CD1-CB 4.17Å; L660-A790 HydrophobicContact CD2-CB 3.79Å; L660-I798 HydrophobicContact CD1-CG2 3.93Å
661	A	84	Confident	80.1	Confident	22 Å²	22	39.3 Å²	39.3	18%	0.182	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	148.2	176.3	0	0	0	0	0	110.9	G667 K668 M670	A661-G667 WeakPolarHBondContact O-CA 3.44Å; A661-K668 PolarHBondContact N-O 3.43Å; A661-K668 PolarHBondContact O-N 3.01Å; A661-M670 HydrophobicContact CB-SD 4.01Å
662	W	81.2	Confident	81.3	Confident	126 Å²	126	38.8 Å²	38.8	48%	0.477	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	136.6	170	-177.1	86.2	0	0	0	109.4	P664 D785	W662-P664 HydrophobicContact CZ3-CG 4.49Å; W662-D785 PolarHBondContact NE1-OD2 2.84Å
663	T	73.8	Confident	82.4	Confident	30 Å²	30	37.4 Å²	37.4	18%	0.184	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	160.3	171	72.8	0	0	0	0	109.1	L665 G666	T663-L665 PolarHBondContact O-N 3.34Å; T663-L665 PolarHBondContact OG1-N 3.41Å; T663-G666 WeakPolarHBondContact CB-O 3.35Å; T663-G666 PolarHBondContact N-O 3.18Å; T663-G666 CarbonylContact O-C 3.56Å; T663-G666 WeakPolarHBondContact O-CA 3.37Å; T663-G666 PolarHBondContact O-N 3.49Å; T663-G666 PolarHBondContact OG1-O 3.12Å
664	P	62.4	Low	83	Confident	80 Å²	80	31.5 Å²	31.5	52%	0.519	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-20.2	174.4	-25.4	35	0	0	0	114	W662 G666	W662-P664 HydrophobicContact CZ3-CG 4.49Å; P664-G666 VanDerWaalsContact C-N 3.32Å
665	L	62.4	Low	83.3	Confident	119 Å²	119	31.2 Å²	31.2	62%	0.623	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-1.2	175.8	-62	173.5	0	0	0	113	P377 T663	P377-L665 HydrophobicContact CG-CD2 4.3Å; T663-L665 PolarHBondContact O-N 3.34Å; T663-L665 PolarHBondContact OG1-N 3.41Å
666	G	71.2	Confident	83.3	Confident	8 Å²	8	36.4 Å²	36.4	8%	0.082	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	117.1	-176.3	-176.6	0	0	0	0	0	113.3	T663 P664	T663-G666 WeakPolarHBondContact CB-O 3.35Å; T663-G666 PolarHBondContact N-O 3.18Å; T663-G666 CarbonylContact O-C 3.56Å; T663-G666 WeakPolarHBondContact O-CA 3.37Å; T663-G666 PolarHBondContact O-N 3.49Å; T663-G666 PolarHBondContact OG1-O 3.12Å; P664-G666 VanDerWaalsContact C-N 3.32Å
667	G	76.6	Confident	83.3	Confident	8 Å²	8	40.5 Å²	40.5	8%	0.082	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	149.8	179.8	0	0	0	0	0	113.4	A661 D785 A789 R792	A661-G667 WeakPolarHBondContact O-CA 3.44Å; G667-D785 WeakPolarHBondContact CA-O 3.4Å; G667-A789 WeakPolarHBondContact O-CB 3.47Å; G667-R792 PolarHBondContact O-NH2 3.45Å
668	K	79.7	Confident	83	Confident	81 Å²	81	46.5 Å²	46.5	35%	0.352	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	143.3	176.4	-165.6	-174.5	171.9	-176	0	110.3	A661	A661-K668 PolarHBondContact N-O 3.43Å; A661-K668 PolarHBondContact O-N 3.01Å
669	I	84.8	Confident	82.7	Confident	19 Å²	19	47.7 Å²	47.7	10%	0.097	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	141.9	166.1	59.1	162.6	0	0	0	110.3	V647 I658 L660 F671 A793 L795	V647-I669 HydrophobicContact CG2-CD1 4.26Å; I658-I669 HydrophobicContact CG2-CB 4.33Å; I658-I669 HydrophobicContact CG2-CG2 4.45Å; L660-I669 HydrophobicContact CD2-CG2 3.94Å; I669-F671 HydrophobicContact CD1-CE2 4.08Å; I669-F671 HydrophobicContact CD1-CZ 4.04Å; I669-A793 HydrophobicContact CD1-CB 3.87Å; I669-A793 HydrophobicContact CG1-CB 4.46Å; I669-A793 HydrophobicContact CG2-CB 3.82Å; I669-L795 HydrophobicContact CG2-CD1 4.22Å
670	M	85.5	Confident	82.4	Confident	16 Å²	16	55.9 Å²	55.9	8%	0.079	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	136.9	172.8	76.8	-163.6	-70.2	0	0	109.6	G659 A661 M693 F732 K739 A744	G659-M670 PolarHBondContact N-O 2.95Å; G659-M670 PolarHBondContact O-N 3.32Å; A661-M670 HydrophobicContact CB-SD 4.01Å; M670-M693 HydrophobicContact CE-CE 4.17Å; M670-F732 HydrophobicContact CE-CD1 3.64Å; M670-F732 HydrophobicContact CE-CE1 3.97Å; M670-K739 HydrophobicContact CE-CD 4.11Å; M670-A744 HydrophobicContact CE-CB 4.34Å; M670-A744 HydrophobicContact SD-CB 4.14Å
671	F	87.6	Confident	82.1	Confident	19 Å²	19	56.7 Å²	56.7	8%	0.083	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	138.5	168	-61.4	-82.4	0	0	0	108.4	V647 V656 I658 I669 P733	V647-F671 HydrophobicContact CG2-CZ 4.5Å; V656-F671 HydrophobicContact CG1-CD1 4.45Å; I658-F671 HydrophobicContact CD1-CE1 4.12Å; I658-F671 HydrophobicContact CG1-CD1 4.01Å; I658-F671 HydrophobicContact CG1-CE1 3.82Å; I669-F671 HydrophobicContact CD1-CE2 4.08Å; I669-F671 HydrophobicContact CD1-CZ 4.04Å; F671-P733 HydrophobicContact CB-CG 4.44Å; F671-P733 WeakPolarHBondContact O-CD 3.23Å
672	V	89.8	Confident	82.3	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	120.7	168.9	-173.7	0	0	0	0	106.2	V656 A657 L730 F732 T747 I748 C751	V656-V672 WeakPolarHBondContact CA-O 3.45Å; A657-V672 PolarHBondContact N-O 2.99Å; A657-V672 PolarHBondContact O-N 2.87Å; V672-L730 HydrophobicContact CG1-CD2 4.32Å; V672-F732 HydrophobicContact CB-CD1 4.47Å; V672-F732 HydrophobicContact CB-CE1 4.18Å; V672-F732 HydrophobicContact CG1-CD1 4.29Å; V672-F732 HydrophobicContact CG1-CE1 3.72Å; V672-F732 HydrophobicContact CG1-CE2 4.48Å; V672-F732 HydrophobicContact CG1-CZ 3.85Å; V672-F732 HydrophobicContact CG2-CD1 3.84Å; V672-F732 HydrophobicContact CG2-CE1 3.51Å; V672-F732 HydrophobicContact CG2-CZ 4.42Å; V672-T747 HydrophobicContact CB-CG2 4.22Å; V672-T747 HydrophobicContact CG2-CG2 3.58Å; V672-I748 HydrophobicContact CG1-CG1 4.37Å; V672-C751 HydrophobicContact CB-CB 4.33Å; V672-C751 HydrophobicContact CG1-CB 4.06Å; V672-C751 PolarHBondContact O-SG 3.07Å
673	E	91.3	Very high	82.7	Confident	52 Å²	52	56.6 Å²	56.6	24%	0.243	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	130.1	-177.1	-64.9	171.9	-173	0	0	108.2	R650 G655 V656 L730 H731 P733	R650-E673 IonicContact NH1-OE1 3.05Å; G655-E673 CarbonylContact O-C 3.55Å; G655-E673 WeakPolarHBondContact O-CA 3.23Å; V656-E673 HydrophobicContact CG1-CG 4.23Å; V656-E673 HydrophobicContact CG2-CG 4.13Å; E673-L730 CarbonylContact O-C 3.57Å; E673-L730 WeakPolarHBondContact O-CA 3.25Å; E673-H731 HydrophobicContact CB-CB 4.45Å; E673-H731 PolarHBondContact N-O 2.89Å; E673-H731 PolarHBondContact O-N 3.31Å; E673-H731 IonicContact OE2-CD2 3.34Å; E673-P733 VanDerWaalsContact CD-CG 3.44Å; E673-P733 HydrophobicContact CG-CG 4.2Å; E673-P733 VanDerWaalsContact OE1-CG 3.28Å; E673-P733 WeakPolarHBondContact OE1-CG 3.47Å
674	A	92	Very high	83.6	Confident	11 Å²	11	58.1 Å²	58.1	9%	0.091	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	130.8	177.8	0	0	0	0	0	109.5	G655 H729 L730 C751 L752 L755	G655-A674 PolarHBondContact O-N 3.13Å; A674-H729 WeakPolarHBondContact CA-O 3.45Å; A674-L730 HydrophobicContact CB-CD2 3.56Å; A674-C751 WeakPolarHBondContact CB-SG 3.37Å; A674-L752 HydrophobicContact CB-CD2 4.14Å; A674-L755 HydrophobicContact CB-CB 4.35Å; A674-L755 HydrophobicContact CB-CD2 3.73Å
675	S	90.4	Very high	84.9	Confident	51 Å²	51	56.2 Å²	56.2	36%	0.357	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	144.1	170.5	61.9	0	0	0	0	110	H729	S675-H729 PolarHBondContact N-O 3.35Å; S675-H729 PolarHBondContact O-N 2.84Å
676	R	88.4	Confident	86.1	Confident	109 Å²	109	52.8 Å²	52.8	41%	0.411	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	145.3	172	64.1	-176.4	-175.1	-178.3	2	110.7	T726 D727 L755	R676-T726 HydrophobicContact CB-CG2 3.9Å; R676-D727 CarbonylContact C-O 3.54Å; R676-D727 WeakPolarHBondContact CA-O 3.22Å; R676-L755 HydrophobicContact CB-CD2 4.16Å; R676-L755 HydrophobicContact CG-CD1 4.25Å
677	M	88.6	Confident	86.7	Confident	97 Å²	97	53.7 Å²	53.7	48%	0.478	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	157.2	176.1	-62.6	174.7	-67.5	0	0	108.8	T726 D727 H729	M677-T726 CarbonylContact O-C 3.54Å; M677-T726 WeakPolarHBondContact O-CA 3.43Å; M677-D727 PolarHBondContact N-O 3.06Å; M677-D727 PolarHBondContact O-N 3.39Å; M677-H729 HydrophobicContact CE-CB 4.02Å
678	D	84.4	Confident	87	Confident	127 Å²	127	59.5 Å²	59.5	68%	0.679	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.6	130.2	173	-59.7	-26.9	0	0	0	108.9
679	G	84.8	Confident	87.2	Confident	24 Å²	24	56.6 Å²	56.6	25%	0.247	30%	0.302	C	S	.	.	S	Bend	trans	-176.4	-162.5	-173.3	0	0	0	0	0	114.8	N725 T726	G679-N725 PolarHBondContact N-O 3.38Å; G679-N725 VanDerWaalsContact N-O 3.14Å; G679-N725 CarbonylContact O-C 2.97Å; G679-N725 WeakPolarHBondContact O-CA 3.41Å; G679-T726 PolarHBondContact O-N 3.29Å
680	E	83.3	Confident	87.2	Confident	173 Å²	173	56.4 Å²	56.4	81%	0.808	30%	0.304	S	S	*	.	S	Bend	trans	-92.8	2.3	-172.7	-65.1	-176.1	172.3	0	0	114.2	D727	E680-D727 PolarHBondContact N-OD1 3.31Å
681	G	82.6	Confident	87.2	Confident	19 Å²	19	61.1 Å²	61.1	20%	0.196	33%	0.33	C	S	.	.	S	Bend	trans	98.3	24.6	-178.7	0	0	0	0	0	114.5	L723 T726 D727	G681-L723 WeakPolarHBondContact CA-O 3.38Å; G681-T726 WeakPolarHBondContact CA-O 3.47Å; G681-D727 PolarHBondContact N-OD1 2.89Å
682	Q	88.3	Confident	87.3	Confident	111 Å²	111	63.1 Å²	63.1	52%	0.519	34%	0.344	S	S	.	.			trans	-83	142.7	-178.8	-61.1	-167	4.2	0	0	112.4	D727 I728	Q682-D727 PolarHBondContact N-OD1 2.93Å; Q682-D727 WeakPolarHBondContact O-CA 3.28Å; Q682-I728 PolarHBondContact O-N 2.86Å
683	L	89.7	Confident	87.1	Confident	35 Å²	35	63.4 Å²	63.4	18%	0.183	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	108.2	171.6	-177.9	67	0	0	0	109.7	L685 I701 I728 L730	L683-L685 HydrophobicContact CD1-CD2 4.21Å; L683-L685 HydrophobicContact CD2-CD2 4.03Å; L683-L685 HydrophobicContact CG-CD2 3.89Å; L683-L685 HydrophobicContact CG-CG 4.33Å; L683-I701 HydrophobicContact CD2-CG2 4.14Å; L683-I728 WeakPolarHBondContact CA-O 3.43Å; L683-I728 HydrophobicContact CD1-CB 3.83Å; L683-I728 HydrophobicContact CD1-CG2 3.83Å; L683-L730 HydrophobicContact CD1-CD1 4.02Å; L683-L730 HydrophobicContact CD1-CG 4.32Å
684	T	91.1	Very high	87	Confident	62 Å²	62	64.8 Å²	64.8	38%	0.38	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	132	174.6	-58	0	0	0	0	109.9	T686 I728 H729 L730	T684-T686 HydrophobicContact CG2-CG2 4.3Å; T684-I728 PolarHBondContact N-O 2.97Å; T684-H729 WeakPolarHBondContact O-CA 3.37Å; T684-H729 PolarHBondContact O-CD2 3.17Å; T684-L730 PolarHBondContact O-N 2.88Å
685	L	90.9	Very high	87	Confident	40 Å²	40	70.2 Å²	70.2	21%	0.209	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	121.8	-179.3	-56.5	178.3	0	0	0	110	L683 L689 K694 A697 L730	L683-L685 HydrophobicContact CD1-CD2 4.21Å; L683-L685 HydrophobicContact CD2-CD2 4.03Å; L683-L685 HydrophobicContact CG-CD2 3.89Å; L683-L685 HydrophobicContact CG-CG 4.33Å; L685-L689 HydrophobicContact CB-CD1 3.89Å; L685-K694 HydrophobicContact CD1-CB 3.9Å; L685-K694 HydrophobicContact CD1-CG 3.9Å; L685-A697 HydrophobicContact CD1-CB 3.97Å; L685-A697 HydrophobicContact CD2-CB 3.8Å; L685-L730 HydrophobicContact CD2-CB 3.76Å; L685-L730 HydrophobicContact CD2-CD1 3.76Å; L685-L730 HydrophobicContact CD2-CG 4.3Å
686	T	87.2	Confident	87	Confident	47 Å²	47	68.1 Å²	68.1	29%	0.288	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	152.5	179.3	59.7	0	0	0	0	112.8	T684 H729 L730 H731 F732	T684-T686 HydrophobicContact CG2-CG2 4.3Å; T686-H729 WeakPolarHBondContact CG2-NE2 3.38Å; T686-H729 PolarHBondContact OG1-NE2 3.22Å; T686-L730 PolarHBondContact N-O 2.96Å; T686-H731 PolarHBondContact OG1-ND1 2.89Å; T686-F732 PolarHBondContact O-N 3.45Å; T686-F732 VanDerWaalsContact O-N 3.08Å
687	G	84.4	Confident	87.2	Confident	27 Å²	27	62.9 Å²	62.9	28%	0.278	34%	0.339	S	S	.	.	S	Bend	trans	117.1	31.1	178.3	0	0	0	0	0	116.3
688	Q	82.7	Confident	87.3	Confident	129 Å²	129	62.9 Å²	62.9	60%	0.603	34%	0.338	S	S	*	.	S	Bend	trans	56.5	53.3	177.6	-61.7	-177.8	-10.1	0	0	113.6	K739	Q688-K739 PolarHBondContact O-N 3.4Å
689	L	83.8	Confident	87.6	Confident	20 Å²	20	58.9 Å²	58.9	11%	0.105	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-83.6	137.3	179.8	-58.7	167.2	0	0	0	111	L685 M693 K694 F732 K739	L685-L689 HydrophobicContact CB-CD1 3.89Å; L689-M693 HydrophobicContact CB-CB 4.22Å; L689-M693 HydrophobicContact CD2-CB 4.25Å; L689-M693 HydrophobicContact CD2-CE 3.91Å; L689-K694 HydrophobicContact CB-CG 4.4Å; L689-K694 WeakPolarHBondContact O-CE 3.49Å; L689-F732 HydrophobicContact CD1-CD2 3.65Å; L689-F732 HydrophobicContact CD1-CE2 3.66Å; L689-F732 HydrophobicContact CD2-CB 4.23Å; L689-F732 HydrophobicContact CD2-CD1 4.26Å; L689-F732 HydrophobicContact CD2-CD2 3.76Å; L689-F732 HydrophobicContact CD2-CE2 4.09Å; L689-F732 HydrophobicContact CD2-CG 3.83Å; L689-F732 HydrophobicContact CD2-CZ 4.45Å; L689-F732 HydrophobicContact CG-CD2 4.16Å; L689-F732 HydrophobicContact CG-CE2 4.48Å; L689-K739 HydrophobicContact CD2-CB 4.27Å
690	G	83.8	Confident	88	Confident	15 Å²	15	57.7 Å²	57.7	16%	0.155	30%	0.304	C	S	.	.			trans	-72.8	171.4	167.7	0	0	0	0	0	112.3	V692 M693 K694 K739 D740	G690-V692 VanDerWaalsContact C-N 3.35Å; G690-V692 PolarHBondContact O-N 3.37Å; G690-M693 PolarHBondContact O-N 3.16Å; G690-K694 WeakPolarHBondContact O-CG 3.44Å; G690-K694 PolarHBondContact O-N 3.09Å; G690-K739 PolarHBondContact N-O 3.23Å; G690-K739 VanDerWaalsContact N-O 3.11Å; G690-D740 WeakPolarHBondContact CA-OD1 3.33Å
691	D	86.9	Confident	88.3	Confident	116 Å²	116	49.8 Å²	49.8	62%	0.62	27%	0.268	S	S	*	.	H	α-helix	trans	-68.5	-33.5	-172.9	-64.1	-33.6	0	0	0	112.7	M693 K694 E695	D691-M693 VanDerWaalsContact C-N 3.31Å; D691-M693 PolarHBondContact O-N 2.96Å; D691-K694 PolarHBondContact O-N 3Å; D691-K694 IonicContact OD1-NZ 2.69Å; D691-K694 PolarHBondContact OD1-NZ 2.65Å; D691-E695 PolarHBondContact O-N 2.84Å
692	V	88.3	Confident	88.7	Confident	60 Å²	60	51.4 Å²	51.4	36%	0.364	28%	0.276	S	S	.	.	H	α-helix	trans	-65.5	-36.4	176.8	-174.3	0	0	0	0	111.4	G690 S696 D740 P742	G690-V692 VanDerWaalsContact C-N 3.35Å; G690-V692 PolarHBondContact O-N 3.37Å; V692-S696 WeakPolarHBondContact O-CB 3.37Å; V692-S696 PolarHBondContact O-N 3.05Å; V692-S696 PolarHBondContact O-OG 3.3Å; V692-D740 WeakPolarHBondContact CB-OD1 3.39Å; V692-P742 HydrophobicContact CG1-CB 4.05Å; V692-P742 HydrophobicContact CG1-CG 4.35Å
693	M	87.1	Confident	88.8	Confident	6 Å²	6	46.6 Å²	46.6	3%	0.03	25%	0.253	C	S	.	.	H	α-helix	trans	-70.3	-36.8	175.6	-87.2	-70	-72.4	0	0	112.3	M670 L689 G690 D691 S696 A697 F732 K739 G741 A744 I748	M670-M693 HydrophobicContact CE-CE 4.17Å; L689-M693 HydrophobicContact CB-CB 4.22Å; L689-M693 HydrophobicContact CD2-CB 4.25Å; L689-M693 HydrophobicContact CD2-CE 3.91Å; G690-M693 PolarHBondContact O-N 3.16Å; D691-M693 VanDerWaalsContact C-N 3.31Å; D691-M693 PolarHBondContact O-N 2.96Å; M693-S696 WeakPolarHBondContact O-CB 3.24Å; M693-S696 PolarHBondContact O-N 3.27Å; M693-A697 PolarHBondContact O-N 3.07Å; M693-F732 HydrophobicContact CE-CD1 4.31Å; M693-F732 HydrophobicContact CE-CE1 3.66Å; M693-F732 HydrophobicContact CE-CZ 3.97Å; M693-K739 WeakPolarHBondContact CG-O 3.32Å; M693-G741 WeakPolarHBondContact CG-O 3.48Å; M693-A744 HydrophobicContact CE-CB 3.77Å; M693-A744 HydrophobicContact SD-CB 3.8Å; M693-I748 HydrophobicContact CE-CD1 4.35Å
694	K	89.3	Confident	88.8	Confident	81 Å²	81	45 Å²	45	35%	0.352	24%	0.244	S	C	.	.	H	α-helix	trans	-63.6	-45.1	174	-64.1	173.1	-164.8	156.4	0	110.9	L685 L689 G690 D691 S696 A697 H698	L685-K694 HydrophobicContact CD1-CB 3.9Å; L685-K694 HydrophobicContact CD1-CG 3.9Å; L689-K694 HydrophobicContact CB-CG 4.4Å; L689-K694 WeakPolarHBondContact O-CE 3.49Å; G690-K694 WeakPolarHBondContact O-CG 3.44Å; G690-K694 PolarHBondContact O-N 3.09Å; D691-K694 PolarHBondContact O-N 3Å; D691-K694 IonicContact OD1-NZ 2.69Å; D691-K694 PolarHBondContact OD1-NZ 2.65Å; K694-S696 VanDerWaalsContact C-N 3.32Å; K694-S696 PolarHBondContact O-N 3.29Å; K694-A697 WeakPolarHBondContact O-CB 3Å; K694-A697 PolarHBondContact O-N 3.17Å; K694-A697 VanDerWaalsContact O-N 3.17Å; K694-H698 PolarHBondContact O-CD2 3.24Å; K694-H698 PolarHBondContact O-N 3.02Å
695	E	90.8	Very high	88.6	Confident	126 Å²	126	47.1 Å²	47.1	59%	0.589	25%	0.245	S	C	*	.	H	α-helix	trans	-59	-44.5	174.9	-171.4	174.8	-172.3	0	0	111.3	D691 A697 H698 L699	D691-E695 PolarHBondContact O-N 2.84Å; E695-A697 VanDerWaalsContact C-N 3.28Å; E695-A697 PolarHBondContact O-N 3.23Å; E695-H698 PolarHBondContact O-N 3.41Å; E695-H698 VanDerWaalsContact O-N 3.12Å; E695-L699 HydrophobicContact CG-CD1 4.37Å; E695-L699 WeakPolarHBondContact O-CG 3.26Å; E695-L699 PolarHBondContact O-N 3.38Å
696	S	91.5	Very high	88.5	Confident	6 Å²	6	50.1 Å²	50.1	4%	0.042	27%	0.27	C	S	.	.	H	α-helix	trans	-58.6	-38.2	175.9	-60.6	0	0	0	0	112.8	V692 M693 K694 L699 A700	V692-S696 WeakPolarHBondContact O-CB 3.37Å; V692-S696 PolarHBondContact O-N 3.05Å; V692-S696 PolarHBondContact O-OG 3.3Å; M693-S696 WeakPolarHBondContact O-CB 3.24Å; M693-S696 PolarHBondContact O-N 3.27Å; K694-S696 VanDerWaalsContact C-N 3.32Å; K694-S696 PolarHBondContact O-N 3.29Å; S696-L699 PolarHBondContact O-N 3.43Å; S696-A700 WeakPolarHBondContact O-CB 3.46Å; S696-A700 PolarHBondContact O-N 3.34Å
697	A	91.1	Very high	88.5	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-68	-40.8	175.6	0	0	0	0	0	112.3	L685 M693 K694 E695 A700 I701 L730 I748	L685-A697 HydrophobicContact CD1-CB 3.97Å; L685-A697 HydrophobicContact CD2-CB 3.8Å; M693-A697 PolarHBondContact O-N 3.07Å; K694-A697 WeakPolarHBondContact O-CB 3Å; K694-A697 PolarHBondContact O-N 3.17Å; K694-A697 VanDerWaalsContact O-N 3.17Å; E695-A697 VanDerWaalsContact C-N 3.28Å; E695-A697 PolarHBondContact O-N 3.23Å; A697-A700 PolarHBondContact O-N 3.35Å; A697-I701 PolarHBondContact O-N 3.12Å; A697-I701 VanDerWaalsContact O-N 3.11Å; A697-L730 HydrophobicContact CB-CD1 4.19Å; A697-I748 HydrophobicContact CB-CD1 4.26Å
698	H	91	Very high	88.5	Confident	97 Å²	97	48.3 Å²	48.3	45%	0.449	25%	0.252	S	S	.	.	H	α-helix	trans	-64.7	-38.1	174.2	-73.9	-65.4	0	0	0	112.6	K694 E695 I701 S702	K694-H698 PolarHBondContact O-CD2 3.24Å; K694-H698 PolarHBondContact O-N 3.02Å; E695-H698 PolarHBondContact O-N 3.41Å; E695-H698 VanDerWaalsContact O-N 3.12Å; H698-I701 VanDerWaalsContact O-CG2 3.23Å; H698-I701 WeakPolarHBondContact O-CG2 3.49Å; H698-S702 VanDerWaalsContact O-CB 3.32Å; H698-S702 WeakPolarHBondContact O-CB 3.3Å; H698-S702 PolarHBondContact O-N 2.85Å; H698-S702 PolarHBondContact O-OG 3.23Å
699	L	91.9	Very high	88.5	Confident	42 Å²	42	49.6 Å²	49.6	22%	0.22	26%	0.256	C	S	.	.	H	α-helix	trans	-63.2	-43.7	173.4	-71	173.1	0	0	0	111.6	E695 S696 S702 W703 I771 L773	E695-L699 HydrophobicContact CG-CD1 4.37Å; E695-L699 WeakPolarHBondContact O-CG 3.26Å; E695-L699 PolarHBondContact O-N 3.38Å; S696-L699 PolarHBondContact O-N 3.43Å; L699-S702 PolarHBondContact O-N 2.82Å; L699-W703 WeakPolarHBondContact O-CB 3.41Å; L699-W703 PolarHBondContact O-N 3.45Å; L699-I771 HydrophobicContact CB-CD1 4.29Å; L699-I771 HydrophobicContact CB-CG1 4.47Å; L699-L773 HydrophobicContact CD2-CD1 4.32Å; L699-L773 HydrophobicContact CD2-CD2 3.46Å; L699-L773 VanDerWaalsContact CD2-CD2 3.46Å; L699-L773 HydrophobicContact CD2-CG 3.61Å
700	A	92.4	Very high	88.5	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-61.2	-48.9	179.7	0	0	0	0	0	112.2	S696 A697 W703 L704 I748 V749 L752 I771	S696-A700 WeakPolarHBondContact O-CB 3.46Å; S696-A700 PolarHBondContact O-N 3.34Å; A697-A700 PolarHBondContact O-N 3.35Å; A700-W703 PolarHBondContact O-N 2.98Å; A700-L704 WeakPolarHBondContact O-CG 3.37Å; A700-L704 PolarHBondContact O-N 2.96Å; A700-I748 HydrophobicContact CB-CB 4.13Å; A700-I748 HydrophobicContact CB-CG2 3.68Å; A700-V749 HydrophobicContact CB-CG2 3.56Å; A700-L752 HydrophobicContact CB-CD1 4.48Å; A700-I771 HydrophobicContact CB-CD1 3.71Å
701	I	90.1	Very high	88.3	Confident	7 Å²	7	52.2 Å²	52.2	4%	0.036	26%	0.262	C	S	.	.	H	α-helix	trans	-66.4	-38.6	178.5	-170.3	62.4	0	0	0	111.6	L683 A697 H698 W703 L704 R705 L723 I728 L752 F756	L683-I701 HydrophobicContact CD2-CG2 4.14Å; A697-I701 PolarHBondContact O-N 3.12Å; A697-I701 VanDerWaalsContact O-N 3.11Å; H698-I701 VanDerWaalsContact O-CG2 3.23Å; H698-I701 WeakPolarHBondContact O-CG2 3.49Å; I701-W703 PolarHBondContact O-N 3.38Å; I701-L704 PolarHBondContact O-N 2.89Å; I701-R705 HydrophobicContact CG1-CG 4.47Å; I701-R705 WeakPolarHBondContact O-CG 3.36Å; I701-R705 PolarHBondContact O-N 3.25Å; I701-L723 HydrophobicContact CG1-CD1 4.21Å; I701-L723 HydrophobicContact CG1-CD2 4.4Å; I701-L723 HydrophobicContact CG1-CG 4.38Å; I701-I728 HydrophobicContact CD1-CD1 3.54Å; I701-I728 HydrophobicContact CG1-CD1 4.35Å; I701-L752 HydrophobicContact CB-CD1 4.37Å; I701-L752 HydrophobicContact CD1-CD1 4.25Å; I701-F756 HydrophobicContact CD1-CE2 4.41Å
702	S	90.4	Very high	88	Confident	53 Å²	53	51.9 Å²	51.9	37%	0.371	26%	0.256	S	S	.	.	H	α-helix	trans	-62.2	-45.5	178.1	-60.8	0	0	0	0	111.3	H698 L699 R705 S706	H698-S702 VanDerWaalsContact O-CB 3.32Å; H698-S702 WeakPolarHBondContact O-CB 3.3Å; H698-S702 PolarHBondContact O-N 2.85Å; H698-S702 PolarHBondContact O-OG 3.23Å; L699-S702 PolarHBondContact O-N 2.82Å; S702-R705 PolarHBondContact O-N 3.11Å; S702-S706 PolarHBondContact O-N 2.99Å; S702-S706 VanDerWaalsContact O-N 3.1Å; S702-S706 PolarHBondContact O-OG 3.16Å
703	W	91.4	Very high	87.7	Confident	10 Å²	10	49 Å²	49	4%	0.038	24%	0.239	C	C	.	.	H	α-helix	trans	-63.2	-42.5	176.3	-176.9	86.4	0	0	0	112.3	L699 A700 I701 S706 N707 Y711 V749 L827 L831	L699-W703 WeakPolarHBondContact O-CB 3.41Å; L699-W703 PolarHBondContact O-N 3.45Å; A700-W703 PolarHBondContact O-N 2.98Å; I701-W703 PolarHBondContact O-N 3.38Å; W703-S706 PolarHBondContact O-N 3.05Å; W703-N707 PolarHBondContact NE1-ND2 3.18Å; W703-N707 PolarHBondContact O-N 3.33Å; W703-N707 VanDerWaalsContact O-N 3.11Å; W703-N707 PolarHBondContact O-ND2 3.14Å; W703-Y711 AromaticContact CH2-CE2 3.76Å; W703-Y711 HydrophobicContact CH2-CE2 3.76Å; W703-Y711 HydrophobicContact CZ2-CE2 4.45Å; W703-Y711 HydrophobicContact CZ3-CE2 4.42Å; W703-V749 HydrophobicContact CE3-CG1 3.92Å; W703-V749 HydrophobicContact CZ3-CG1 3.73Å; W703-L827 HydrophobicContact CD2-CD1 3.52Å; W703-L827 HydrophobicContact CE3-CD1 3.7Å; W703-L827 HydrophobicContact CG-CD1 4.06Å; W703-L827 HydrophobicContact CH2-CB 3.64Å; W703-L827 HydrophobicContact CH2-CD1 4.02Å; W703-L827 HydrophobicContact CH2-CG 4.49Å; W703-L827 HydrophobicContact CZ2-CB 3.67Å; W703-L827 HydrophobicContact CZ2-CD1 3.86Å; W703-L827 HydrophobicContact CZ2-CG 4.41Å; W703-L827 HydrophobicContact CZ3-CB 4.23Å; W703-L827 HydrophobicContact CZ3-CD1 3.95Å; W703-L831 HydrophobicContact CH2-CD1 4.19Å; W703-L831 HydrophobicContact CZ3-CD1 4.27Å
704	L	89.1	Confident	87.3	Confident	0 Å²	0	51 Å²	51	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64	-41.4	177.3	-79.7	169.5	0	0	0	112.2	A700 I701 S706 N707 A708 L713 L722 V749 L752 A753	A700-L704 WeakPolarHBondContact O-CG 3.37Å; A700-L704 PolarHBondContact O-N 2.96Å; I701-L704 PolarHBondContact O-N 2.89Å; L704-S706 PolarHBondContact O-N 2.71Å; L704-N707 CarbonylContact O-C 3.42Å; L704-N707 PolarHBondContact O-N 2.77Å; L704-N707 VanDerWaalsContact O-N 3.15Å; L704-A708 WeakPolarHBondContact O-CA 3.44Å; L704-A708 PolarHBondContact O-N 2.87Å; L704-L713 HydrophobicContact CD2-CD1 3.72Å; L704-L722 HydrophobicContact CB-CD1 4.01Å; L704-V749 HydrophobicContact CD1-CG1 4.45Å; L704-V749 HydrophobicContact CD2-CG1 4.14Å; L704-V749 HydrophobicContact CG-CG1 4.25Å; L704-L752 HydrophobicContact CD1-CB 3.28Å; L704-L752 HydrophobicContact CD1-CD1 3.82Å; L704-L752 HydrophobicContact CD1-CG 4.21Å; L704-A753 HydrophobicContact CD2-CB 4.28Å
705	R	87.8	Confident	86.7	Confident	107 Å²	107	47.3 Å²	47.3	40%	0.404	24%	0.236	S	C	.	.	H	α-helix	trans	-60	-45	174.9	-73.8	180	77.3	-166.7	4.1	111.6	I701 S702 N707 A708 D721 L722	I701-R705 HydrophobicContact CG1-CG 4.47Å; I701-R705 WeakPolarHBondContact O-CG 3.36Å; I701-R705 PolarHBondContact O-N 3.25Å; S702-R705 PolarHBondContact O-N 3.11Å; R705-N707 PolarHBondContact O-N 3.15Å; R705-A708 PolarHBondContact O-N 2.71Å; R705-D721 IonicContact CZ-OD1 2.85Å; R705-D721 VanDerWaalsContact CZ-OD1 3.31Å; R705-D721 IonicContact NE-OD1 3.05Å; R705-D721 PolarHBondContact NE-OD1 3.49Å; R705-D721 IonicContact NH2-OD1 2.95Å; R705-D721 PolarHBondContact NH2-OD1 2.73Å; R705-D721 IonicContact NH2-OD2 3.97Å; R705-D721 PolarHBondContact NH2-OD2 3.21Å; R705-L722 HydrophobicContact CG-CB 4.29Å; R705-L722 HydrophobicContact CG-CD1 4.44Å
706	S	88.1	Confident	85.6	Confident	103 Å²	103	44 Å²	44	72%	0.72	23%	0.23	S	C	*	.	H	α-helix	trans	-63.7	-27.2	177.1	-59.9	0	0	0	0	113.4	S702 W703 L704	S702-S706 PolarHBondContact O-N 2.99Å; S702-S706 VanDerWaalsContact O-N 3.1Å; S702-S706 PolarHBondContact O-OG 3.16Å; W703-S706 PolarHBondContact O-N 3.05Å; L704-S706 PolarHBondContact O-N 2.71Å
707	N	87.1	Confident	84.6	Confident	35 Å²	35	49.8 Å²	49.8	19%	0.187	25%	0.254	C	S	.	.	H	α-helix	trans	-107.9	5.9	-177.3	-67.5	-75.5	0	0	0	114.3	W703 L704 R705 K709 K710 Y711	W703-N707 PolarHBondContact NE1-ND2 3.18Å; W703-N707 PolarHBondContact O-N 3.33Å; W703-N707 VanDerWaalsContact O-N 3.11Å; W703-N707 PolarHBondContact O-ND2 3.14Å; L704-N707 CarbonylContact O-C 3.42Å; L704-N707 PolarHBondContact O-N 2.77Å; L704-N707 VanDerWaalsContact O-N 3.15Å; R705-N707 PolarHBondContact O-N 3.15Å; N707-K709 VanDerWaalsContact C-N 3.28Å; N707-K709 PolarHBondContact O-N 2.99Å; N707-K710 WeakPolarHBondContact O-CB 3.46Å; N707-K710 PolarHBondContact O-N 3.31Å; N707-Y711 HydrophobicContact CB-CD2 3.9Å; N707-Y711 HydrophobicContact CB-CE2 4.09Å; N707-Y711 PolarHBondContact O-N 2.91Å
708	A	84.5	Confident	83.6	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.008	28%	0.278	C	S	.	.	H	α-helix	trans	-56.8	-40.4	-174	0	0	0	0	0	112.6	L704 R705 Y711 H712 L713 F720 L722	L704-A708 WeakPolarHBondContact O-CA 3.44Å; L704-A708 PolarHBondContact O-N 2.87Å; R705-A708 PolarHBondContact O-N 2.71Å; A708-Y711 PolarHBondContact O-N 2.85Å; A708-H712 WeakPolarHBondContact O-CA 3.32Å; A708-H712 PolarHBondContact O-N 3.31Å; A708-L713 HydrophobicContact CB-CB 4.33Å; A708-L713 PolarHBondContact O-N 3.41Å; A708-F720 VanDerWaalsContact CB-O 3.26Å; A708-F720 WeakPolarHBondContact CB-O 3.35Å; A708-L722 HydrophobicContact CB-CD1 4.18Å; A708-L722 HydrophobicContact CB-CD2 4.19Å; A708-L722 HydrophobicContact CB-CG 4.05Å
709	K	83.3	Confident	82.9	Confident	156 Å²	156	48.9 Å²	48.9	68%	0.678	27%	0.266	S	S	*	.	H	α-helix	trans	-65.9	-38.2	176.3	-68.2	-178.7	-179.4	176.6	0	113.3	N707 Y711 F720	N707-K709 VanDerWaalsContact C-N 3.28Å; N707-K709 PolarHBondContact O-N 2.99Å; K709-Y711 VanDerWaalsContact C-N 3.26Å; K709-Y711 PolarHBondContact O-N 2.72Å; K709-F720 HydrophobicContact CG-CB 4.05Å; K709-F720 HydrophobicContact CG-CD1 4.12Å; K709-F720 HydrophobicContact CG-CD2 4.4Å; K709-F720 HydrophobicContact CG-CG 3.93Å
710	K	82.1	Confident	82.2	Confident	78 Å²	78	51 Å²	51	34%	0.339	27%	0.274	S	S	.	.	H	α-helix	trans	-64.4	-35.7	179.8	179.5	-177	172.5	-171.6	0	111.1	N707 D828 V841	N707-K710 WeakPolarHBondContact O-CB 3.46Å; N707-K710 PolarHBondContact O-N 3.31Å; K710-D828 IonicContact NZ-OD1 2.64Å; K710-D828 PolarHBondContact NZ-OD1 2.78Å; K710-D828 IonicContact NZ-OD2 3.31Å; K710-D828 PolarHBondContact NZ-OD2 3.3Å; K710-V841 HydrophobicContact CD-CG1 4.45Å; K710-V841 HydrophobicContact CG-CG1 3.88Å
711	Y	80.5	Confident	81.5	Confident	12 Å²	12	54.1 Å²	54.1	5%	0.047	29%	0.291	C	S	.	.	H	α-helix	trans	-102.8	3.3	-175	-73.8	-61.2	0	0	0	114.8	W703 N707 A708 K709 L713 D828 L831 F839 V841	W703-Y711 AromaticContact CH2-CE2 3.76Å; W703-Y711 HydrophobicContact CH2-CE2 3.76Å; W703-Y711 HydrophobicContact CZ2-CE2 4.45Å; W703-Y711 HydrophobicContact CZ3-CE2 4.42Å; N707-Y711 HydrophobicContact CB-CD2 3.9Å; N707-Y711 HydrophobicContact CB-CE2 4.09Å; N707-Y711 PolarHBondContact O-N 2.91Å; A708-Y711 PolarHBondContact O-N 2.85Å; K709-Y711 VanDerWaalsContact C-N 3.26Å; K709-Y711 PolarHBondContact O-N 2.72Å; Y711-L713 PolarHBondContact O-N 2.85Å; Y711-D828 WeakPolarHBondContact OH-CB 3.43Å; Y711-D828 PolarHBondContact OH-OD1 2.94Å; Y711-L831 HydrophobicContact CE1-CD1 4.22Å; Y711-L831 HydrophobicContact CE2-CD1 4.26Å; Y711-F839 AromaticContact CD1-CD1 3.31Å; Y711-F839 HydrophobicContact CD1-CD1 3.31Å; Y711-F839 AromaticContact CD1-CE1 3.33Å; Y711-F839 HydrophobicContact CD1-CE1 3.33Å; Y711-F839 AromaticContact CE1-CD1 3.62Å; Y711-F839 HydrophobicContact CE1-CD1 3.62Å; Y711-F839 HydrophobicContact CE1-CE1 4.06Å; Y711-F839 HydrophobicContact CG-CD1 4.17Å; Y711-F839 AromaticContact CG-CE1 3.74Å; Y711-F839 HydrophobicContact CG-CE1 3.74Å; Y711-V841 HydrophobicContact CD1-CG2 4.16Å; Y711-V841 HydrophobicContact CE1-CG2 3.43Å; Y711-V841 VanDerWaalsContact CE1-CG2 3.43Å
712	H	81.2	Confident	81	Confident	110 Å²	110	53.8 Å²	53.8	51%	0.509	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	39.4	-175.3	-60.3	-69.2	0	0	0	113.5	A708	A708-H712 WeakPolarHBondContact O-CA 3.32Å; A708-H712 PolarHBondContact O-N 3.31Å
713	L	82.1	Confident	80.5	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.277	C	S	.	.			trans	-82.2	126	175.2	-60.1	177.3	0	0	0	109	L704 A708 Y711 F720 L722 F756 F839	L704-L713 HydrophobicContact CD2-CD1 3.72Å; A708-L713 HydrophobicContact CB-CB 4.33Å; A708-L713 PolarHBondContact O-N 3.41Å; Y711-L713 PolarHBondContact O-N 2.85Å; L713-F720 WeakPolarHBondContact O-CD1 3.45Å; L713-L722 HydrophobicContact CB-CD2 3.8Å; L713-L722 HydrophobicContact CD1-CD1 4.5Å; L713-F756 HydrophobicContact CB-CB 4.14Å; L713-F756 HydrophobicContact CD2-CB 4.01Å; L713-F839 HydrophobicContact CD2-CZ 3.99Å
714	T	78.4	Confident	80.1	Confident	47 Å²	47	55.4 Å²	55.4	29%	0.288	29%	0.294	S	S	.	.			trans	-126.8	147.6	179.7	54.9	0	0	0	0	111.5	S719 F720	T714-S719 VanDerWaalsContact CA-O 3.28Å; T714-S719 WeakPolarHBondContact CA-O 3.38Å; T714-F720 HydrophobicContact CG2-CD1 4.17Å; T714-F720 HydrophobicContact CG2-CE1 3.99Å; T714-F720 HydrophobicContact CG2-CZ 4.49Å
715	N	76.9	Confident	79.7	Confident	4 Å²	4	59.6 Å²	59.6	2%	0.021	32%	0.317	C	S	.	.			trans	-71.7	-179.4	168.2	73.1	-1.5	0	0	0	111.2	F717 G718 S719 D724	N715-F717 PolarHBondContact O-N 3.34Å; N715-F717 VanDerWaalsContact O-N 3.16Å; N715-F717 WeakPolarHBondContact OD1-CA 3.32Å; N715-F717 PolarHBondContact OD1-N 3.42Å; N715-G718 PolarHBondContact O-N 2.92Å; N715-G718 VanDerWaalsContact O-N 3.13Å; N715-G718 PolarHBondContact OD1-N 3.18Å; N715-S719 PolarHBondContact N-O 2.83Å; N715-S719 PolarHBondContact ND2-OG 3.11Å; N715-S719 WeakPolarHBondContact OD1-CA 3.43Å; N715-S719 WeakPolarHBondContact OD1-CB 3.5Å; N715-S719 PolarHBondContact OD1-N 3.21Å; N715-S719 PolarHBondContact OD1-O 2.8Å; N715-D724 PolarHBondContact ND2-O 2.93Å
716	A	67.6	Low	79.6	Confident	56 Å²	56	54.6 Å²	54.6	46%	0.463	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-25.1	179	0	0	0	0	0	113.2
717	F	69.5	Low	79.6	Confident	128 Å²	128	51.2 Å²	51.2	56%	0.561	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	6.2	-179	-56	-78.4	0	0	0	113.7	N715 S719 N725	N715-F717 PolarHBondContact O-N 3.34Å; N715-F717 VanDerWaalsContact O-N 3.16Å; N715-F717 WeakPolarHBondContact OD1-CA 3.32Å; N715-F717 PolarHBondContact OD1-N 3.42Å; F717-S719 VanDerWaalsContact C-N 3.27Å; F717-S719 PolarHBondContact O-N 3.05Å; F717-N725 HydrophobicContact CD2-CB 4.04Å; F717-N725 HydrophobicContact CE2-CB 3.72Å; F717-N725 HydrophobicContact CZ-CB 4.47Å
718	G	69.6	Low	79.8	Confident	48 Å²	48	49.5 Å²	49.5	50%	0.495	26%	0.263	S	S	.	.	S	Bend	trans	75.9	8.8	179.5	0	0	0	0	0	115	N715	N715-G718 PolarHBondContact O-N 2.92Å; N715-G718 VanDerWaalsContact O-N 3.13Å; N715-G718 PolarHBondContact OD1-N 3.18Å
719	S	76.9	Confident	80.2	Confident	30 Å²	30	51.7 Å²	51.7	21%	0.21	27%	0.273	C	S	.	.			trans	-79	147.4	174.6	111	0	0	0	0	110.6	T714 N715 F717 D721	T714-S719 VanDerWaalsContact CA-O 3.28Å; T714-S719 WeakPolarHBondContact CA-O 3.38Å; N715-S719 PolarHBondContact N-O 2.83Å; N715-S719 PolarHBondContact ND2-OG 3.11Å; N715-S719 WeakPolarHBondContact OD1-CA 3.43Å; N715-S719 WeakPolarHBondContact OD1-CB 3.5Å; N715-S719 PolarHBondContact OD1-N 3.21Å; N715-S719 PolarHBondContact OD1-O 2.8Å; F717-S719 VanDerWaalsContact C-N 3.27Å; F717-S719 PolarHBondContact O-N 3.05Å; S719-D721 VanDerWaalsContact C-N 3.28Å; S719-D721 PolarHBondContact OG-N 2.86Å; S719-D721 VanDerWaalsContact OG-N 3.17Å; S719-D721 PolarHBondContact OG-O 3.29Å
720	F	76.8	Confident	80.6	Confident	86 Å²	86	44.3 Å²	44.3	38%	0.377	24%	0.24	S	C	.	.	S	Bend	trans	-82.6	-4.6	173.4	-69.4	-72.8	0	0	0	112.9	A708 K709 L713 T714 L722	A708-F720 VanDerWaalsContact CB-O 3.26Å; A708-F720 WeakPolarHBondContact CB-O 3.35Å; K709-F720 HydrophobicContact CG-CB 4.05Å; K709-F720 HydrophobicContact CG-CD1 4.12Å; K709-F720 HydrophobicContact CG-CD2 4.4Å; K709-F720 HydrophobicContact CG-CG 3.93Å; L713-F720 WeakPolarHBondContact O-CD1 3.45Å; T714-F720 HydrophobicContact CG2-CD1 4.17Å; T714-F720 HydrophobicContact CG2-CE1 3.99Å; T714-F720 HydrophobicContact CG2-CZ 4.49Å; F720-L722 PolarHBondContact O-N 2.94Å
721	D	79	Confident	81	Confident	65 Å²	65	43.8 Å²	43.8	35%	0.348	24%	0.239	S	C	.	.			trans	-90.2	102.9	169.4	-166.7	1.2	0	0	0	109.1	R705 S719 L723 D724	R705-D721 IonicContact CZ-OD1 2.85Å; R705-D721 VanDerWaalsContact CZ-OD1 3.31Å; R705-D721 IonicContact NE-OD1 3.05Å; R705-D721 PolarHBondContact NE-OD1 3.49Å; R705-D721 IonicContact NH2-OD1 2.95Å; R705-D721 PolarHBondContact NH2-OD1 2.73Å; R705-D721 IonicContact NH2-OD2 3.97Å; R705-D721 PolarHBondContact NH2-OD2 3.21Å; S719-D721 VanDerWaalsContact C-N 3.28Å; S719-D721 PolarHBondContact OG-N 2.86Å; S719-D721 VanDerWaalsContact OG-N 3.17Å; S719-D721 PolarHBondContact OG-O 3.29Å; D721-L723 PolarHBondContact O-N 3.28Å; D721-L723 VanDerWaalsContact O-N 3.12Å; D721-D724 HydrophobicContact CB-CB 3.98Å; D721-D724 WeakPolarHBondContact O-CB 3.22Å; D721-D724 PolarHBondContact O-N 3.12Å
722	L	78.4	Confident	81.3	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-21.4	-168.7	-58.1	178.3	0	0	0	114.2	L704 R705 A708 L713 F720 F756	L704-L722 HydrophobicContact CB-CD1 4.01Å; R705-L722 HydrophobicContact CG-CB 4.29Å; R705-L722 HydrophobicContact CG-CD1 4.44Å; A708-L722 HydrophobicContact CB-CD1 4.18Å; A708-L722 HydrophobicContact CB-CD2 4.19Å; A708-L722 HydrophobicContact CB-CG 4.05Å; L713-L722 HydrophobicContact CB-CD2 3.8Å; L713-L722 HydrophobicContact CD1-CD1 4.5Å; F720-L722 PolarHBondContact O-N 2.94Å; L722-F756 HydrophobicContact CB-CE1 3.99Å; L722-F756 HydrophobicContact CB-CE2 4.12Å; L722-F756 HydrophobicContact CB-CZ 3.78Å; L722-F756 HydrophobicContact CD1-CD2 4.05Å; L722-F756 HydrophobicContact CD1-CE2 4.11Å; L722-F756 HydrophobicContact CD1-CG 4.49Å; L722-F756 HydrophobicContact CD2-CB 4.43Å; L722-F756 HydrophobicContact CD2-CD1 3.85Å; L722-F756 HydrophobicContact CD2-CD2 4.32Å; L722-F756 HydrophobicContact CD2-CE1 4.15Å; L722-F756 HydrophobicContact CD2-CG 3.95Å
723	L	81.1	Confident	81	Confident	24 Å²	24	39.1 Å²	39.1	13%	0.126	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-4.1	179	-69.1	177.3	0	0	0	113.2	G681 I701 D721 N725 T726 I728	G681-L723 WeakPolarHBondContact CA-O 3.38Å; I701-L723 HydrophobicContact CG1-CD1 4.21Å; I701-L723 HydrophobicContact CG1-CD2 4.4Å; I701-L723 HydrophobicContact CG1-CG 4.38Å; D721-L723 PolarHBondContact O-N 3.28Å; D721-L723 VanDerWaalsContact O-N 3.12Å; L723-N725 PolarHBondContact O-N 3.38Å; L723-T726 PolarHBondContact O-N 3.5Å; L723-I728 HydrophobicContact CD2-CD1 3.49Å; L723-I728 VanDerWaalsContact CD2-CD1 3.49Å; L723-I728 HydrophobicContact CD2-CG1 3.92Å
724	D	81.9	Confident	80.1	Confident	73 Å²	73	43.5 Å²	43.5	39%	0.39	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	122	178.9	-174.6	29	0	0	0	109.8	N715 D721 T726	N715-D724 PolarHBondContact ND2-O 2.93Å; D721-D724 HydrophobicContact CB-CB 3.98Å; D721-D724 WeakPolarHBondContact O-CB 3.22Å; D721-D724 PolarHBondContact O-N 3.12Å; D724-T726 PolarHBondContact O-N 3.17Å; D724-T726 PolarHBondContact O-OG1 3.05Å
725	N	80.7	Confident	78.8	Confident	89 Å²	89	42.5 Å²	42.5	48%	0.476	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.2	21.5	-174.1	-60	-59.2	0	0	0	115.6	G679 F717 L723	G679-N725 PolarHBondContact N-O 3.38Å; G679-N725 VanDerWaalsContact N-O 3.14Å; G679-N725 CarbonylContact O-C 2.97Å; G679-N725 WeakPolarHBondContact O-CA 3.41Å; F717-N725 HydrophobicContact CD2-CB 4.04Å; F717-N725 HydrophobicContact CE2-CB 3.72Å; F717-N725 HydrophobicContact CZ-CB 4.47Å; L723-N725 PolarHBondContact O-N 3.38Å
726	T	85	Confident	77.2	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.006	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	114.3	-172.1	-49.5	0	0	0	0	111.1	R676 M677 G679 G681 L723 D724	R676-T726 HydrophobicContact CB-CG2 3.9Å; M677-T726 CarbonylContact O-C 3.54Å; M677-T726 WeakPolarHBondContact O-CA 3.43Å; G679-T726 PolarHBondContact O-N 3.29Å; G681-T726 WeakPolarHBondContact CA-O 3.47Å; L723-T726 PolarHBondContact O-N 3.5Å; D724-T726 PolarHBondContact O-N 3.17Å; D724-T726 PolarHBondContact O-OG1 3.05Å
727	D	89.3	Confident	76.7	Confident	32 Å²	32	48.5 Å²	48.5	17%	0.171	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	141	170.5	-73.5	-7.2	0	0	0	110.7	R676 M677 E680 G681 Q682	R676-D727 CarbonylContact C-O 3.54Å; R676-D727 WeakPolarHBondContact CA-O 3.22Å; M677-D727 PolarHBondContact N-O 3.06Å; M677-D727 PolarHBondContact O-N 3.39Å; E680-D727 PolarHBondContact N-OD1 3.31Å; G681-D727 PolarHBondContact N-OD1 2.89Å; Q682-D727 PolarHBondContact N-OD1 2.93Å; Q682-D727 WeakPolarHBondContact O-CA 3.28Å
728	I	91.6	Very high	76.1	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	130.5	178.5	-55.1	174.4	0	0	0	108.7	Q682 L683 T684 I701 L723 L730 L752 F756	Q682-I728 PolarHBondContact O-N 2.86Å; L683-I728 WeakPolarHBondContact CA-O 3.43Å; L683-I728 HydrophobicContact CD1-CB 3.83Å; L683-I728 HydrophobicContact CD1-CG2 3.83Å; T684-I728 PolarHBondContact N-O 2.97Å; I701-I728 HydrophobicContact CD1-CD1 3.54Å; I701-I728 HydrophobicContact CG1-CD1 4.35Å; L723-I728 HydrophobicContact CD2-CD1 3.49Å; L723-I728 VanDerWaalsContact CD2-CD1 3.49Å; L723-I728 HydrophobicContact CD2-CG1 3.92Å; I728-L730 HydrophobicContact CG2-CG 4.39Å; I728-L752 HydrophobicContact CD1-CD2 4.45Å; I728-L752 HydrophobicContact CG2-CD2 3.79Å; I728-F756 HydrophobicContact CD1-CE2 3.89Å; I728-F756 HydrophobicContact CD1-CZ 3.55Å; I728-F756 HydrophobicContact CG1-CZ 4.15Å
729	H	92.8	Very high	76.2	Confident	47 Å²	47	46.9 Å²	46.9	22%	0.218	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	114.9	170.9	-176.6	-154.8	0	0	0	109.5	A674 S675 M677 T684 T686	A674-H729 WeakPolarHBondContact CA-O 3.45Å; S675-H729 PolarHBondContact N-O 3.35Å; S675-H729 PolarHBondContact O-N 2.84Å; M677-H729 HydrophobicContact CE-CB 4.02Å; T684-H729 WeakPolarHBondContact O-CA 3.37Å; T684-H729 PolarHBondContact O-CD2 3.17Å; T686-H729 WeakPolarHBondContact CG2-NE2 3.38Å; T686-H729 PolarHBondContact OG1-NE2 3.22Å
730	L	91.6	Very high	75.8	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	117.8	171.1	-73.3	170	0	0	0	109.4	V672 E673 A674 L683 T684 L685 T686 A697 I728 F732 I748 L752	V672-L730 HydrophobicContact CG1-CD2 4.32Å; E673-L730 CarbonylContact O-C 3.57Å; E673-L730 WeakPolarHBondContact O-CA 3.25Å; A674-L730 HydrophobicContact CB-CD2 3.56Å; L683-L730 HydrophobicContact CD1-CD1 4.02Å; L683-L730 HydrophobicContact CD1-CG 4.32Å; T684-L730 PolarHBondContact O-N 2.88Å; L685-L730 HydrophobicContact CD2-CB 3.76Å; L685-L730 HydrophobicContact CD2-CD1 3.76Å; L685-L730 HydrophobicContact CD2-CG 4.3Å; T686-L730 PolarHBondContact N-O 2.96Å; A697-L730 HydrophobicContact CB-CD1 4.19Å; I728-L730 HydrophobicContact CG2-CG 4.39Å; L730-F732 HydrophobicContact CB-CE2 4.12Å; L730-I748 HydrophobicContact CD1-CG2 3.83Å; L730-L752 HydrophobicContact CD1-CD1 4.44Å; L730-L752 HydrophobicContact CD1-CD2 4.44Å; L730-L752 HydrophobicContact CD2-CD2 3.87Å; L730-L752 HydrophobicContact CD2-CG 4.23Å; L730-L752 HydrophobicContact CG-CD2 4.31Å
731	H	90.4	Very high	75.8	Confident	67 Å²	67	47.1 Å²	47.1	31%	0.31	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	137.7	177.3	-173.9	59.8	0	0	0	111	E673 T686 P733	E673-H731 HydrophobicContact CB-CB 4.45Å; E673-H731 PolarHBondContact N-O 2.89Å; E673-H731 PolarHBondContact O-N 3.31Å; E673-H731 IonicContact OE2-CD2 3.34Å; T686-H731 PolarHBondContact OG1-ND1 2.89Å; H731-P733 WeakPolarHBondContact O-CD 3.41Å
732	F	87	Confident	76	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.009	29%	0.288	C	S	.	.			trans	-119.3	89.5	175.9	-66	-100.5	0	0	0	109.6	M670 V672 T686 L689 M693 L730 K739 I748	M670-F732 HydrophobicContact CE-CD1 3.64Å; M670-F732 HydrophobicContact CE-CE1 3.97Å; V672-F732 HydrophobicContact CB-CD1 4.47Å; V672-F732 HydrophobicContact CB-CE1 4.18Å; V672-F732 HydrophobicContact CG1-CD1 4.29Å; V672-F732 HydrophobicContact CG1-CE1 3.72Å; V672-F732 HydrophobicContact CG1-CE2 4.48Å; V672-F732 HydrophobicContact CG1-CZ 3.85Å; V672-F732 HydrophobicContact CG2-CD1 3.84Å; V672-F732 HydrophobicContact CG2-CE1 3.51Å; V672-F732 HydrophobicContact CG2-CZ 4.42Å; T686-F732 PolarHBondContact O-N 3.45Å; T686-F732 VanDerWaalsContact O-N 3.08Å; L689-F732 HydrophobicContact CD1-CD2 3.65Å; L689-F732 HydrophobicContact CD1-CE2 3.66Å; L689-F732 HydrophobicContact CD2-CB 4.23Å; L689-F732 HydrophobicContact CD2-CD1 4.26Å; L689-F732 HydrophobicContact CD2-CD2 3.76Å; L689-F732 HydrophobicContact CD2-CE2 4.09Å; L689-F732 HydrophobicContact CD2-CG 3.83Å; L689-F732 HydrophobicContact CD2-CZ 4.45Å; L689-F732 HydrophobicContact CG-CD2 4.16Å; L689-F732 HydrophobicContact CG-CE2 4.48Å; M693-F732 HydrophobicContact CE-CD1 4.31Å; M693-F732 HydrophobicContact CE-CE1 3.66Å; M693-F732 HydrophobicContact CE-CZ 3.97Å; L730-F732 HydrophobicContact CB-CE2 4.12Å; F732-K739 HydrophobicContact CB-CD 4.34Å; F732-K739 PolarHBondContact O-NZ 3.26Å; F732-I748 HydrophobicContact CE1-CD1 4.46Å; F732-I748 HydrophobicContact CE1-CG1 4.26Å; F732-I748 HydrophobicContact CZ-CD1 3.92Å; F732-I748 HydrophobicContact CZ-CG1 3.89Å
733	P	75.4	Confident	76.3	Confident	22 Å²	22	47 Å²	47	14%	0.143	30%	0.296	C	S	.	.			trans	-49.8	149.4	-175.7	-25.7	28.6	0	0	0	114.9	F671 E673 H731 K739	F671-P733 HydrophobicContact CB-CG 4.44Å; F671-P733 WeakPolarHBondContact O-CD 3.23Å; E673-P733 VanDerWaalsContact CD-CG 3.44Å; E673-P733 HydrophobicContact CG-CG 4.2Å; E673-P733 VanDerWaalsContact OE1-CG 3.28Å; E673-P733 WeakPolarHBondContact OE1-CG 3.47Å; H731-P733 WeakPolarHBondContact O-CD 3.41Å; P733-K739 PolarHBondContact O-NZ 3.28Å
734	A	61.3	Low	76.6	Confident	93 Å²	93	46 Å²	46	77%	0.769	29%	0.292	S	S	*	.			trans	-45.8	148.5	-156.3	0	0	0	0	0	119.7
735	G	52.1	Low	77	Confident	26 Å²	26	42.6 Å²	42.6	27%	0.268	27%	0.273	S	S	.	.			trans	-165	141.6	140.6	0	0	0	0	0	106.8	V737	G735-V737 PolarHBondContact O-N 3.36Å
736	A	43.3	Very low	77.6	Confident	105 Å²	105	38.4 Å²	38.4	87%	0.868	25%	0.251	S	S	*	.	S	Bend	trans	-66.6	25.3	179	0	0	0	0	0	114.3
737	V	56.5	Low	78	Confident	81 Å²	81	38.3 Å²	38.3	49%	0.491	25%	0.25	S	S	.	.	S	Bend	trans	-121.6	122.9	-175.7	-174.6	0	0	0	0	106.3	G735 K739	G735-V737 PolarHBondContact O-N 3.36Å; V737-K739 PolarHBondContact O-N 3.03Å
738	T	57.6	Low	78.2	Confident	106 Å²	106	36.8 Å²	36.8	65%	0.65	24%	0.242	S	C	*	.			trans	-55.5	126.3	175.3	44.1	0	0	0	0	109.6	D740	T738-D740 PolarHBondContact O-N 2.98Å
739	K	71.8	Confident	78.3	Confident	35 Å²	35	36.8 Å²	36.8	15%	0.152	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-94.4	99.7	177.7	-64.9	170.8	-174.2	171	0	106.8	M670 Q688 L689 G690 M693 F732 P733 V737	M670-K739 HydrophobicContact CE-CD 4.11Å; Q688-K739 PolarHBondContact O-N 3.4Å; L689-K739 HydrophobicContact CD2-CB 4.27Å; G690-K739 PolarHBondContact N-O 3.23Å; G690-K739 VanDerWaalsContact N-O 3.11Å; M693-K739 WeakPolarHBondContact CG-O 3.32Å; F732-K739 HydrophobicContact CB-CD 4.34Å; F732-K739 PolarHBondContact O-NZ 3.26Å; P733-K739 PolarHBondContact O-NZ 3.28Å; V737-K739 PolarHBondContact O-N 3.03Å
740	D	68.3	Low	78.4	Confident	101 Å²	101	34.6 Å²	34.6	54%	0.54	23%	0.232	S	C	.	.			trans	-130.9	134.1	-179.2	-156	13.9	0	0	0	110.2	G690 V692 T738	G690-D740 WeakPolarHBondContact CA-OD1 3.33Å; V692-D740 WeakPolarHBondContact CB-OD1 3.39Å; T738-D740 PolarHBondContact O-N 2.98Å
741	G	75.8	Confident	78.5	Confident	20 Å²	20	34.6 Å²	34.6	21%	0.206	23%	0.232	C	C	.	.	S	Bend	trans	133.5	142.6	-177.7	0	0	0	0	0	113.9	M693 S743	M693-G741 WeakPolarHBondContact CG-O 3.48Å; G741-S743 PolarHBondContact O-N 3.1Å; G741-S743 VanDerWaalsContact O-N 3.1Å
742	P	83.9	Confident	78.5	Confident	38 Å²	38	31.4 Å²	31.4	25%	0.247	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-76.8	-2.5	-168	32.5	-36.8	0	0	0	114.3	V692 A744 G745 E770	V692-P742 HydrophobicContact CG1-CB 4.05Å; V692-P742 HydrophobicContact CG1-CG 4.35Å; P742-A744 PolarHBondContact O-N 3.15Å; P742-G745 PolarHBondContact O-N 3.02Å; P742-G745 VanDerWaalsContact O-N 3.15Å; P742-E770 HydrophobicContact CB-CB 4.12Å; P742-E770 HydrophobicContact CB-CG 3.82Å; P742-E770 HydrophobicContact CG-CB 4.33Å; P742-E770 HydrophobicContact CG-CG 4.21Å; P742-E770 VanDerWaalsContact CG-OE2 3.3Å; P742-E770 WeakPolarHBondContact CG-OE2 3.45Å; P742-E770 WeakPolarHBondContact O-CA 3.43Å
743	S	84.4	Confident	78.7	Confident	25 Å²	25	31.3 Å²	31.3	18%	0.175	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-70.9	-2	-168.3	69.6	0	0	0	0	116.4	G741 T768 G769 K786	G741-S743 PolarHBondContact O-N 3.1Å; G741-S743 VanDerWaalsContact O-N 3.1Å; S743-T768 PolarHBondContact O-OG1 2.97Å; S743-T768 VanDerWaalsContact O-OG1 3.11Å; S743-G769 CarbonylContact C-O 3.23Å; S743-G769 PolarHBondContact O-N 3.17Å; S743-K786 PolarHBondContact OG-NZ 3.41Å
744	A	87.5	Confident	79.5	Confident	4 Å²	4	30.2 Å²	30.2	3%	0.033	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-99.8	2.1	175.6	0	0	0	0	0	113.2	M670 M693 P742 V746 T747 I748	M670-A744 HydrophobicContact CE-CB 4.34Å; M670-A744 HydrophobicContact SD-CB 4.14Å; M693-A744 HydrophobicContact CE-CB 3.77Å; M693-A744 HydrophobicContact SD-CB 3.8Å; P742-A744 PolarHBondContact O-N 3.15Å; A744-V746 VanDerWaalsContact C-N 3.3Å; A744-V746 PolarHBondContact O-N 3Å; A744-T747 WeakPolarHBondContact O-CA 3.4Å; A744-T747 WeakPolarHBondContact O-CB 3.26Å; A744-T747 PolarHBondContact O-N 2.93Å; A744-I748 WeakPolarHBondContact O-CG1 3.4Å; A744-I748 PolarHBondContact O-N 3.3Å
745	G	90.6	Very high	80.9	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-54.5	-45.2	-177.2	0	0	0	0	0	112.9	P742 T747 I748 V749 G769 I771	P742-G745 PolarHBondContact O-N 3.02Å; P742-G745 VanDerWaalsContact O-N 3.15Å; G745-T747 VanDerWaalsContact C-N 3.31Å; G745-T747 PolarHBondContact O-N 2.96Å; G745-I748 PolarHBondContact O-N 3.08Å; G745-V749 WeakPolarHBondContact O-CG2 3.39Å; G745-V749 PolarHBondContact O-N 3.11Å; G745-G769 PolarHBondContact N-O 3.03Å; G745-I771 VanDerWaalsContact C-CG2 3.47Å
746	V	93.8	Very high	82.6	Confident	1 Å²	1	25.8 Å²	25.8	1%	0.006	17%	0.167	C	C	.	.	H	α-helix	trans	-62.5	-38.4	177.6	176.9	0	0	0	0	112	A744 T750 M767 G769 I771 V777 L827 V830	A744-V746 VanDerWaalsContact C-N 3.3Å; A744-V746 PolarHBondContact O-N 3Å; V746-T750 PolarHBondContact O-N 2.8Å; V746-T750 VanDerWaalsContact O-N 3.09Å; V746-T750 PolarHBondContact O-OG1 3.46Å; V746-M767 HydrophobicContact CG1-CB 4.4Å; V746-M767 HydrophobicContact CG1-CG 4.28Å; V746-M767 HydrophobicContact CG1-SD 4.11Å; V746-G769 WeakPolarHBondContact CG2-O 3.13Å; V746-G769 PolarHBondContact N-O 3.3Å; V746-I771 HydrophobicContact CB-CG2 4.37Å; V746-I771 HydrophobicContact CG2-CG2 3.6Å; V746-V777 HydrophobicContact CG2-CG1 3.89Å; V746-V777 HydrophobicContact CG2-CG2 4.1Å; V746-L827 HydrophobicContact CG1-CD2 4.43Å; V746-L827 HydrophobicContact CG2-CD2 4.06Å; V746-V830 HydrophobicContact CG1-CB 3.91Å; V746-V830 HydrophobicContact CG1-CG1 3.12Å; V746-V830 HydrophobicContact CG1-CG2 3.69Å
747	T	93.3	Very high	84.6	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-64.8	-42.9	176.7	-44.5	0	0	0	0	111.6	A657 G659 V672 A744 G745 T750 C751 M767	A657-T747 HydrophobicContact CB-CG2 4Å; G659-T747 WeakPolarHBondContact CA-OG1 3.27Å; V672-T747 HydrophobicContact CB-CG2 4.22Å; V672-T747 HydrophobicContact CG2-CG2 3.58Å; A744-T747 WeakPolarHBondContact O-CA 3.4Å; A744-T747 WeakPolarHBondContact O-CB 3.26Å; A744-T747 PolarHBondContact O-N 2.93Å; G745-T747 VanDerWaalsContact C-N 3.31Å; G745-T747 PolarHBondContact O-N 2.96Å; T747-T750 PolarHBondContact O-N 3.07Å; T747-C751 VanDerWaalsContact O-CB 3.27Å; T747-C751 WeakPolarHBondContact O-CB 3.44Å; T747-C751 PolarHBondContact O-N 3.2Å; T747-M767 HydrophobicContact CG2-CG 4.28Å; T747-M767 WeakPolarHBondContact OG1-CG 3.48Å
748	I	93.7	Very high	85.9	Confident	0 Å²	0	21 Å²	21	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-65.2	-44.3	179.7	-61.6	165.4	0	0	0	110.4	V672 M693 A697 A700 L730 F732 A744 G745 T750 C751 L752	V672-I748 HydrophobicContact CG1-CG1 4.37Å; M693-I748 HydrophobicContact CE-CD1 4.35Å; A697-I748 HydrophobicContact CB-CD1 4.26Å; A700-I748 HydrophobicContact CB-CB 4.13Å; A700-I748 HydrophobicContact CB-CG2 3.68Å; L730-I748 HydrophobicContact CD1-CG2 3.83Å; F732-I748 HydrophobicContact CE1-CD1 4.46Å; F732-I748 HydrophobicContact CE1-CG1 4.26Å; F732-I748 HydrophobicContact CZ-CD1 3.92Å; F732-I748 HydrophobicContact CZ-CG1 3.89Å; A744-I748 WeakPolarHBondContact O-CG1 3.4Å; A744-I748 PolarHBondContact O-N 3.3Å; G745-I748 PolarHBondContact O-N 3.08Å; I748-T750 VanDerWaalsContact C-N 3.33Å; I748-T750 PolarHBondContact O-N 2.73Å; I748-C751 PolarHBondContact O-N 3.36Å; I748-L752 HydrophobicContact CG2-CD1 3.98Å; I748-L752 HydrophobicContact CG2-CG 4.42Å; I748-L752 WeakPolarHBondContact O-CB 3.32Å; I748-L752 WeakPolarHBondContact O-CG 3.49Å; I748-L752 PolarHBondContact O-N 2.99Å
749	V	94.4	Very high	87.4	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-58.5	-46.3	176.1	172.1	0	0	0	0	110.9	A700 W703 L704 G745 L752 A753 I771 L827 L831	A700-V749 HydrophobicContact CB-CG2 3.56Å; W703-V749 HydrophobicContact CE3-CG1 3.92Å; W703-V749 HydrophobicContact CZ3-CG1 3.73Å; L704-V749 HydrophobicContact CD1-CG1 4.45Å; L704-V749 HydrophobicContact CD2-CG1 4.14Å; L704-V749 HydrophobicContact CG-CG1 4.25Å; G745-V749 WeakPolarHBondContact O-CG2 3.39Å; G745-V749 PolarHBondContact O-N 3.11Å; V749-L752 PolarHBondContact O-N 2.84Å; V749-A753 VanDerWaalsContact O-CB 3.26Å; V749-A753 WeakPolarHBondContact O-CB 3.49Å; V749-A753 PolarHBondContact O-N 3.37Å; V749-I771 HydrophobicContact CG2-CD1 3.69Å; V749-L827 HydrophobicContact CB-CD2 4.36Å; V749-L827 HydrophobicContact CG1-CD1 4.27Å; V749-L827 HydrophobicContact CG1-CD2 4.28Å; V749-L827 HydrophobicContact CG2-CD1 4.11Å; V749-L827 HydrophobicContact CG2-CD2 4.38Å; V749-L831 HydrophobicContact CG1-CD2 4.49Å
750	T	93.5	Very high	88.2	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-67.2	-39.8	-178.4	-53.4	0	0	0	0	112.1	V746 T747 I748 A753 S754 V761 M767 L831 A834 F835	V746-T750 PolarHBondContact O-N 2.8Å; V746-T750 VanDerWaalsContact O-N 3.09Å; V746-T750 PolarHBondContact O-OG1 3.46Å; T747-T750 PolarHBondContact O-N 3.07Å; I748-T750 VanDerWaalsContact C-N 3.33Å; I748-T750 PolarHBondContact O-N 2.73Å; T750-A753 PolarHBondContact O-N 3.32Å; T750-S754 WeakPolarHBondContact O-CB 3.36Å; T750-S754 PolarHBondContact O-N 3.41Å; T750-V761 HydrophobicContact CG2-CG1 4.25Å; T750-V761 HydrophobicContact CG2-CG2 4.01Å; T750-M767 HydrophobicContact CG2-CE 3.94Å; T750-M767 HydrophobicContact CG2-SD 4.08Å; T750-M767 PolarHBondContact OG1-SD 3.08Å; T750-L831 HydrophobicContact CG2-CD2 4.45Å; T750-A834 HydrophobicContact CG2-CB 3.63Å; T750-F835 HydrophobicContact CG2-CE2 3.94Å; T750-F835 HydrophobicContact CG2-CZ 4.22Å
751	C	93.1	Very high	89.2	Confident	0 Å²	0	19 Å²	19	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-59.6	-50.2	174.4	179.4	0	0	0	0	111.7	G655 A657 V672 A674 T747 I748 S754 L755	G655-C751 PolarHBondContact O-SG 3.27Å; A657-C751 HydrophobicContact CB-CB 3.87Å; V672-C751 HydrophobicContact CB-CB 4.33Å; V672-C751 HydrophobicContact CG1-CB 4.06Å; V672-C751 PolarHBondContact O-SG 3.07Å; A674-C751 WeakPolarHBondContact CB-SG 3.37Å; T747-C751 VanDerWaalsContact O-CB 3.27Å; T747-C751 WeakPolarHBondContact O-CB 3.44Å; T747-C751 PolarHBondContact O-N 3.2Å; I748-C751 PolarHBondContact O-N 3.36Å; C751-S754 WeakPolarHBondContact O-CB 3.41Å; C751-S754 PolarHBondContact O-N 3.04Å; C751-L755 PolarHBondContact O-N 3.1Å
752	L	92	Very high	89.7	Confident	0 Å²	0	21 Å²	21	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-66.1	-40.2	177.3	-70.4	173.8	0	0	0	112	A674 A700 I701 L704 I728 L730 I748 V749 S754 L755 F756	A674-L752 HydrophobicContact CB-CD2 4.14Å; A700-L752 HydrophobicContact CB-CD1 4.48Å; I701-L752 HydrophobicContact CB-CD1 4.37Å; I701-L752 HydrophobicContact CD1-CD1 4.25Å; L704-L752 HydrophobicContact CD1-CB 3.28Å; L704-L752 HydrophobicContact CD1-CD1 3.82Å; L704-L752 HydrophobicContact CD1-CG 4.21Å; I728-L752 HydrophobicContact CD1-CD2 4.45Å; I728-L752 HydrophobicContact CG2-CD2 3.79Å; L730-L752 HydrophobicContact CD1-CD1 4.44Å; L730-L752 HydrophobicContact CD1-CD2 4.44Å; L730-L752 HydrophobicContact CD2-CD2 3.87Å; L730-L752 HydrophobicContact CD2-CG 4.23Å; L730-L752 HydrophobicContact CG-CD2 4.31Å; I748-L752 HydrophobicContact CG2-CD1 3.98Å; I748-L752 HydrophobicContact CG2-CG 4.42Å; I748-L752 WeakPolarHBondContact O-CB 3.32Å; I748-L752 WeakPolarHBondContact O-CG 3.49Å; I748-L752 PolarHBondContact O-N 2.99Å; V749-L752 PolarHBondContact O-N 2.84Å; L752-S754 VanDerWaalsContact C-N 3.29Å; L752-S754 PolarHBondContact O-N 3.4Å; L752-L755 WeakPolarHBondContact O-CB 3.41Å; L752-L755 PolarHBondContact O-N 3.42Å; L752-F756 WeakPolarHBondContact O-CD2 3.3Å; L752-F756 PolarHBondContact O-N 3.23Å
753	A	91.1	Very high	89.7	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-61.3	-39.2	174.8	0	0	0	0	0	111.7	L704 V749 T750 S757 L831 F839	L704-A753 HydrophobicContact CD2-CB 4.28Å; V749-A753 VanDerWaalsContact O-CB 3.26Å; V749-A753 WeakPolarHBondContact O-CB 3.49Å; V749-A753 PolarHBondContact O-N 3.37Å; T750-A753 PolarHBondContact O-N 3.32Å; A753-S757 WeakPolarHBondContact O-CB 3.43Å; A753-S757 PolarHBondContact O-N 3.14Å; A753-S757 PolarHBondContact O-OG 3.24Å; A753-L831 HydrophobicContact CB-CD2 3.77Å; A753-F839 HydrophobicContact CB-CZ 4.33Å
754	S	91.6	Very high	89.8	Confident	0 Å²	0	23 Å²	23	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-62.6	-45.6	173	173.6	0	0	0	0	111.6	G655 T750 C751 L752 F756 S757 G758 R759	G655-S754 PolarHBondContact N-OG 2.95Å; T750-S754 WeakPolarHBondContact O-CB 3.36Å; T750-S754 PolarHBondContact O-N 3.41Å; C751-S754 WeakPolarHBondContact O-CB 3.41Å; C751-S754 PolarHBondContact O-N 3.04Å; L752-S754 VanDerWaalsContact C-N 3.29Å; L752-S754 PolarHBondContact O-N 3.4Å; S754-F756 PolarHBondContact O-N 3.48Å; S754-S757 PolarHBondContact O-OG 2.89Å; S754-G758 WeakPolarHBondContact O-CA 3.49Å; S754-G758 PolarHBondContact O-N 2.87Å; S754-R759 WeakPolarHBondContact CB-O 3.32Å; S754-R759 PolarHBondContact O-N 2.87Å; S754-R759 PolarHBondContact OG-O 3.36Å
755	L	90.6	Very high	89.9	Confident	18 Å²	18	22.9 Å²	22.9	9%	0.094	13%	0.129	C	C	.	.	H	α-helix	trans	-59.3	-47.2	178.5	179.5	64.7	0	0	0	112.4	A674 R676 C751 L752	A674-L755 HydrophobicContact CB-CB 4.35Å; A674-L755 HydrophobicContact CB-CD2 3.73Å; R676-L755 HydrophobicContact CB-CD2 4.16Å; R676-L755 HydrophobicContact CG-CD1 4.25Å; C751-L755 PolarHBondContact O-N 3.1Å; L752-L755 WeakPolarHBondContact O-CB 3.41Å; L752-L755 PolarHBondContact O-N 3.42Å
756	F	87.8	Confident	90	Very high	8 Å²	8	22.9 Å²	22.9	4%	0.035	13%	0.129	C	C	.	.	H	α-helix	trans	-79.1	-29.7	-177.1	-72.9	-66.2	0	0	0	113.9	I701 L713 L722 I728 L752 S754	I701-F756 HydrophobicContact CD1-CE2 4.41Å; L713-F756 HydrophobicContact CB-CB 4.14Å; L713-F756 HydrophobicContact CD2-CB 4.01Å; L722-F756 HydrophobicContact CB-CE1 3.99Å; L722-F756 HydrophobicContact CB-CE2 4.12Å; L722-F756 HydrophobicContact CB-CZ 3.78Å; L722-F756 HydrophobicContact CD1-CD2 4.05Å; L722-F756 HydrophobicContact CD1-CE2 4.11Å; L722-F756 HydrophobicContact CD1-CG 4.49Å; L722-F756 HydrophobicContact CD2-CB 4.43Å; L722-F756 HydrophobicContact CD2-CD1 3.85Å; L722-F756 HydrophobicContact CD2-CD2 4.32Å; L722-F756 HydrophobicContact CD2-CE1 4.15Å; L722-F756 HydrophobicContact CD2-CG 3.95Å; I728-F756 HydrophobicContact CD1-CE2 3.89Å; I728-F756 HydrophobicContact CD1-CZ 3.55Å; I728-F756 HydrophobicContact CG1-CZ 4.15Å; L752-F756 WeakPolarHBondContact O-CD2 3.3Å; L752-F756 PolarHBondContact O-N 3.23Å; S754-F756 PolarHBondContact O-N 3.48Å
757	S	85.9	Confident	90	Very high	35 Å²	35	22.8 Å²	22.8	25%	0.245	13%	0.128	C	C	.	.	H	α-helix	trans	-84.3	-17	176.9	65.6	0	0	0	0	113.5	A753 S754 R759	A753-S757 WeakPolarHBondContact O-CB 3.43Å; A753-S757 PolarHBondContact O-N 3.14Å; A753-S757 PolarHBondContact O-OG 3.24Å; S754-S757 PolarHBondContact O-OG 2.89Å; S757-R759 PolarHBondContact O-N 2.6Å; S757-R759 WeakPolarHBondContact OG-CB 3.46Å; S757-R759 PolarHBondContact OG-N 2.94Å
758	G	84.4	Confident	90	Very high	49 Å²	49	22.9 Å²	22.9	51%	0.505	13%	0.129	S	C	.	.			trans	67.7	8.2	-171.1	0	0	0	0	0	113.9	S754	S754-G758 WeakPolarHBondContact O-CA 3.49Å; S754-G758 PolarHBondContact O-N 2.87Å
759	R	87.3	Confident	89.9	Confident	109 Å²	109	22.9 Å²	22.9	41%	0.411	13%	0.129	S	C	.	.	P	Polyproline II helix	trans	-87	142.3	179.2	-61.7	-176.4	-177.2	-166.6	1.8	110.4	S754 S757 F835 G838	S754-R759 WeakPolarHBondContact CB-O 3.32Å; S754-R759 PolarHBondContact O-N 2.87Å; S754-R759 PolarHBondContact OG-O 3.36Å; S757-R759 PolarHBondContact O-N 2.6Å; S757-R759 WeakPolarHBondContact OG-CB 3.46Å; S757-R759 PolarHBondContact OG-N 2.94Å; R759-F835 HydrophobicContact CB-CD1 3.76Å; R759-F835 HydrophobicContact CB-CE1 3.81Å; R759-G838 PolarHBondContact NH1-O 2.93Å
760	L	88.7	Confident	89.8	Confident	85 Å²	85	26 Å²	26	45%	0.445	14%	0.143	S	C	.	.	P	Polyproline II helix	trans	-78.9	135.4	175.5	-62.5	175.6	0	0	0	110.5	Q653 P654 F835	Q653-L760 VanDerWaalsContact C-CD2 3.43Å; P654-L760 HydrophobicContact CB-CD2 4.42Å; P654-L760 HydrophobicContact CG-CD2 3.8Å; L760-F835 VanDerWaalsContact O-CD1 3.25Å; L760-F835 WeakPolarHBondContact O-CD1 3.44Å
761	V	89.4	Confident	89.9	Confident	7 Å²	7	26.2 Å²	26.2	4%	0.042	14%	0.144	C	C	.	.	B	Isolated β-bridge	trans	-71.9	142.6	168	-175.6	0	0	0	0	108.1	V656 A657 T750 S763 M767 A834 F835	V656-V761 WeakPolarHBondContact O-CG2 3.47Å; A657-V761 HydrophobicContact CB-CG2 4.37Å; T750-V761 HydrophobicContact CG2-CG1 4.25Å; T750-V761 HydrophobicContact CG2-CG2 4.01Å; V761-S763 PolarHBondContact O-N 3.09Å; V761-M767 HydrophobicContact CG1-CE 4.47Å; V761-A834 HydrophobicContact CG1-CB 4.45Å; V761-F835 HydrophobicContact CG2-CE1 3.96Å; V761-F835 HydrophobicContact CG2-CZ 4Å
762	R	86.9	Confident	89.8	Confident	61 Å²	61	27.9 Å²	27.9	23%	0.23	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-55.9	131.3	176.3	-78	-178.1	62.2	154	-1.3	111.5	D764 V765 H797 A834 D836	R762-D764 IonicContact CZ-OD1 3.65Å; R762-D764 IonicContact CZ-OD2 3.75Å; R762-D764 IonicContact NE-OD1 3.83Å; R762-D764 PolarHBondContact NE-OD1 2.9Å; R762-D764 IonicContact NH2-OD1 3.22Å; R762-D764 PolarHBondContact NH2-OD1 3.36Å; R762-D764 IonicContact NH2-OD2 3.97Å; R762-D764 PolarHBondContact NH2-OD2 3.05Å; R762-D764 PolarHBondContact O-N 3.43Å; R762-V765 HydrophobicContact CB-CB 4.1Å; R762-V765 HydrophobicContact CB-CG2 3.5Å; R762-V765 HydrophobicContact CG-CG2 4.36Å; R762-V765 PolarHBondContact O-N 3.42Å; R762-H797 PolarHBondContact NH2-CE1 3.45Å; R762-H797 PolarHBondContact NH2-ND1 3.44Å; R762-A834 WeakPolarHBondContact CB-O 3.49Å; R762-A834 WeakPolarHBondContact CG-O 3.49Å; R762-A834 PolarHBondContact N-O 3.12Å; R762-D836 VanDerWaalsContact CD-OD1 3.23Å; R762-D836 WeakPolarHBondContact CD-OD1 3.05Å; R762-D836 VanDerWaalsContact CG-OD1 3.25Å; R762-D836 WeakPolarHBondContact CG-OD1 3.42Å; R762-D836 IonicContact CZ-OD1 3.7Å; R762-D836 IonicContact NE-OD1 2.84Å; R762-D836 IonicContact NH1-OD1 3.8Å
763	S	84.3	Confident	89.6	Confident	69 Å²	69	33.2 Å²	33.2	48%	0.483	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-17.6	-175.2	56.6	0	0	0	0	114.1	L651 V761	L651-S763 VanDerWaalsContact CD1-CA 3.47Å; L651-S763 WeakPolarHBondContact CD1-O 3.31Å; V761-S763 PolarHBondContact O-N 3.09Å
764	D	85.9	Confident	89.5	Confident	36 Å²	36	44 Å²	44	19%	0.193	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	5.4	-177.7	68.5	-30.4	0	0	0	113.9	R762 K796 H797	R762-D764 IonicContact CZ-OD1 3.65Å; R762-D764 IonicContact CZ-OD2 3.75Å; R762-D764 IonicContact NE-OD1 3.83Å; R762-D764 PolarHBondContact NE-OD1 2.9Å; R762-D764 IonicContact NH2-OD1 3.22Å; R762-D764 PolarHBondContact NH2-OD1 3.36Å; R762-D764 IonicContact NH2-OD2 3.97Å; R762-D764 PolarHBondContact NH2-OD2 3.05Å; R762-D764 PolarHBondContact O-N 3.43Å; D764-K796 PolarHBondContact O-N 3.42Å; D764-K796 VanDerWaalsContact O-N 3.12Å; D764-H797 PolarHBondContact O-N 3.28Å; D764-H797 IonicContact OD2-CE1 2.86Å; D764-H797 PolarHBondContact OD2-CE1 2.96Å; D764-H797 IonicContact OD2-CG 3.62Å; D764-H797 IonicContact OD2-ND1 3.46Å; D764-H797 PolarHBondContact OD2-ND1 3.04Å
765	V	90	Very high	89.2	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.012	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	130.5	-176.3	175.8	0	0	0	0	111.5	R762 M767 H797 I799	R762-V765 HydrophobicContact CB-CB 4.1Å; R762-V765 HydrophobicContact CB-CG2 3.5Å; R762-V765 HydrophobicContact CG-CG2 4.36Å; R762-V765 PolarHBondContact O-N 3.42Å; V765-M767 HydrophobicContact CG1-CE 4.04Å; V765-H797 WeakPolarHBondContact CA-O 3.48Å; V765-H797 HydrophobicContact CB-CB 4.47Å; V765-H797 HydrophobicContact CG2-CB 3.74Å; V765-I799 HydrophobicContact CG1-CD1 3.71Å; V765-I799 HydrophobicContact CG1-CG1 4.01Å
766	A	91.6	Very high	89.4	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	150.4	164	0	0	0	0	0	110.8	I658 L660 A790 L795 H797 I798 I799	I658-A766 HydrophobicContact CG2-CB 4.13Å; L660-A766 HydrophobicContact CD1-CB 4.05Å; L660-A766 HydrophobicContact CD2-CB 3.77Å; L660-A766 HydrophobicContact CG-CB 3.85Å; A766-A790 HydrophobicContact CB-CB 4.37Å; A766-L795 HydrophobicContact CB-CD1 3.44Å; A766-L795 VanDerWaalsContact CB-CD1 3.44Å; A766-H797 PolarHBondContact N-O 2.85Å; A766-I798 CarbonylContact O-C 3.34Å; A766-I798 WeakPolarHBondContact O-CA 3.14Å; A766-I799 PolarHBondContact O-N 3.37Å
767	M	94.1	Very high	89.7	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	153.9	179.8	66.1	-159.9	69.2	0	0	113.3	I658 G659 L660 V746 T747 T750 V761 V765 I799 V830 A834	I658-M767 PolarHBondContact O-N 3.25Å; G659-M767 WeakPolarHBondContact CA-O 3.3Å; L660-M767 PolarHBondContact N-O 2.79Å; V746-M767 HydrophobicContact CG1-CB 4.4Å; V746-M767 HydrophobicContact CG1-CG 4.28Å; V746-M767 HydrophobicContact CG1-SD 4.11Å; T747-M767 HydrophobicContact CG2-CG 4.28Å; T747-M767 WeakPolarHBondContact OG1-CG 3.48Å; T750-M767 HydrophobicContact CG2-CE 3.94Å; T750-M767 HydrophobicContact CG2-SD 4.08Å; T750-M767 PolarHBondContact OG1-SD 3.08Å; V761-M767 HydrophobicContact CG1-CE 4.47Å; V765-M767 HydrophobicContact CG1-CE 4.04Å; M767-I799 WeakPolarHBondContact CA-O 3.46Å; M767-I799 HydrophobicContact CB-CB 3.88Å; M767-I799 HydrophobicContact CB-CD1 4.39Å; M767-I799 HydrophobicContact CE-CD1 4.37Å; M767-V830 HydrophobicContact SD-CG1 4.3Å; M767-A834 HydrophobicContact CE-CB 4.06Å
768	T	93.3	Very high	90	Very high	2 Å²	2	48 Å²	48	1%	0.012	24%	0.243	C	C	.	.			trans	-148.7	145.1	169.5	-169.4	0	0	0	0	109.8	S743 V780 I783 K786 I799 P801	S743-T768 PolarHBondContact O-OG1 2.97Å; S743-T768 VanDerWaalsContact O-OG1 3.11Å; T768-V780 HydrophobicContact CG2-CG2 3.84Å; T768-I783 HydrophobicContact CG2-CD1 4.11Å; T768-K786 HydrophobicContact CG2-CD 4.12Å; T768-K786 PolarHBondContact OG1-NZ 2.99Å; T768-I799 PolarHBondContact N-O 3.01Å; T768-P801 WeakPolarHBondContact O-CD 3.38Å
769	G	92.3	Very high	90.4	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.236	C	C	.	.			trans	164.7	144.4	179.4	0	0	0	0	0	111	S743 G745 V746	S743-G769 CarbonylContact C-O 3.23Å; S743-G769 PolarHBondContact O-N 3.17Å; G745-G769 PolarHBondContact N-O 3.03Å; V746-G769 WeakPolarHBondContact CG2-O 3.13Å; V746-G769 PolarHBondContact N-O 3.3Å
770	E	93.1	Very high	90.5	Very high	64 Å²	64	43.6 Å²	43.6	30%	0.299	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	151.7	168.5	168.1	175.5	177.4	0	0	109.7	P742 V777 L778 V780	P742-E770 HydrophobicContact CB-CB 4.12Å; P742-E770 HydrophobicContact CB-CG 3.82Å; P742-E770 HydrophobicContact CG-CB 4.33Å; P742-E770 HydrophobicContact CG-CG 4.21Å; P742-E770 VanDerWaalsContact CG-OE2 3.3Å; P742-E770 WeakPolarHBondContact CG-OE2 3.45Å; P742-E770 WeakPolarHBondContact O-CA 3.43Å; E770-V777 CarbonylContact O-C 3.6Å; E770-V777 WeakPolarHBondContact O-CA 3.49Å; E770-L778 HydrophobicContact CB-CB 3.96Å; E770-L778 HydrophobicContact CG-CB 4.03Å; E770-L778 HydrophobicContact CG-CD1 4.12Å; E770-L778 PolarHBondContact N-O 2.9Å; E770-L778 PolarHBondContact O-N 2.78Å; E770-V780 HydrophobicContact CB-CG1 4.29Å
771	I	93.9	Very high	90.4	Very high	5 Å²	5	42.3 Å²	42.3	3%	0.026	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	153.6	-175.8	65.3	174.1	0	0	0	111	L699 A700 G745 V746 V749 L827	L699-I771 HydrophobicContact CB-CD1 4.29Å; L699-I771 HydrophobicContact CB-CG1 4.47Å; A700-I771 HydrophobicContact CB-CD1 3.71Å; G745-I771 VanDerWaalsContact C-CG2 3.47Å; V746-I771 HydrophobicContact CB-CG2 4.37Å; V746-I771 HydrophobicContact CG2-CG2 3.6Å; V749-I771 HydrophobicContact CG2-CD1 3.69Å; I771-L827 HydrophobicContact CB-CD1 4.5Å; I771-L827 HydrophobicContact CG2-CD1 4.29Å; I771-L827 HydrophobicContact CG2-CD2 3.77Å; I771-L827 HydrophobicContact CG2-CG 4.37Å
772	T	91.8	Very high	90.1	Very high	36 Å²	36	43.4 Å²	43.4	22%	0.221	24%	0.24	C	C	.	.			trans	-117.2	163.1	171.8	60.6	0	0	0	0	110.5	R774 G775 L776 L778	T772-R774 PolarHBondContact O-N 2.83Å; T772-G775 PolarHBondContact O-N 2.97Å; T772-L776 PolarHBondContact N-O 3.35Å; T772-L776 WeakPolarHBondContact OG1-CB 3.25Å; T772-L776 PolarHBondContact OG1-N 3.44Å; T772-L776 VanDerWaalsContact OG1-N 3.12Å; T772-L776 PolarHBondContact OG1-O 2.94Å; T772-L778 HydrophobicContact CG2-CD1 3.6Å; T772-L778 HydrophobicContact CG2-CD2 4.41Å; T772-L778 HydrophobicContact CG2-CG 3.9Å
773	L	87.9	Confident	90.2	Very high	112 Å²	112	40.7 Å²	40.7	59%	0.586	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-19.7	172.1	-71.1	174.5	0	0	0	113.8	L699	L699-L773 HydrophobicContact CD2-CD1 4.32Å; L699-L773 HydrophobicContact CD2-CD2 3.46Å; L699-L773 VanDerWaalsContact CD2-CD2 3.46Å; L699-L773 HydrophobicContact CD2-CG 3.61Å
774	R	88.1	Confident	90.2	Very high	225 Å²	225	39 Å²	39	85%	0.849	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-5.6	177	-63.2	-175.2	-178.2	-175.5	0.9	113.2	T772	T772-R774 PolarHBondContact O-N 2.83Å
775	G	87.1	Confident	90	Very high	5 Å²	5	39.2 Å²	39.2	5%	0.052	22%	0.215	C	C	.	.			trans	80.4	16.1	-178.2	0	0	0	0	0	115.2	T772 C826 L827	T772-G775 PolarHBondContact O-N 2.97Å; G775-C826 CarbonylContact O-C 3.58Å; G775-C826 WeakPolarHBondContact O-CA 3.32Å; G775-L827 PolarHBondContact O-N 2.78Å
776	L	93.3	Very high	89.9	Confident	83 Å²	83	39.2 Å²	39.2	44%	0.435	22%	0.215	S	C	.	.	B	Isolated β-bridge	trans	-76.8	142.3	169.3	-60.9	173.9	0	0	0	110.3	T772	T772-L776 PolarHBondContact N-O 3.35Å; T772-L776 WeakPolarHBondContact OG1-CB 3.25Å; T772-L776 PolarHBondContact OG1-N 3.44Å; T772-L776 VanDerWaalsContact OG1-N 3.12Å; T772-L776 PolarHBondContact OG1-O 2.94Å
777	V	94.3	Very high	89.7	Confident	11 Å²	11	39.3 Å²	39.3	7%	0.067	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	119.4	174.9	-176	0	0	0	0	109.3	V746 E770 P801 S825 L827 V830	V746-V777 HydrophobicContact CG2-CG1 3.89Å; V746-V777 HydrophobicContact CG2-CG2 4.1Å; E770-V777 CarbonylContact O-C 3.6Å; E770-V777 WeakPolarHBondContact O-CA 3.49Å; V777-P801 HydrophobicContact CG1-CB 3.92Å; V777-P801 HydrophobicContact CG1-CG 3.89Å; V777-S825 PolarHBondContact N-O 3.06Å; V777-L827 HydrophobicContact CG2-CD2 4.29Å; V777-L827 HydrophobicContact CG2-CG 4.49Å; V777-V830 HydrophobicContact CG2-CG2 3.99Å
778	L	92.8	Very high	89.2	Confident	46 Å²	46	40 Å²	40	24%	0.241	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	152	-177.8	-65	-177.1	0	0	0	111.9	E770 T772 P801	E770-L778 HydrophobicContact CB-CB 3.96Å; E770-L778 HydrophobicContact CG-CB 4.03Å; E770-L778 HydrophobicContact CG-CD1 4.12Å; E770-L778 PolarHBondContact N-O 2.9Å; E770-L778 PolarHBondContact O-N 2.78Å; T772-L778 HydrophobicContact CG2-CD1 3.6Å; T772-L778 HydrophobicContact CG2-CD2 4.41Å; T772-L778 HydrophobicContact CG2-CG 3.9Å; L778-P801 VanDerWaalsContact O-CG 3.26Å; L778-P801 WeakPolarHBondContact O-CG 3.48Å
779	P	92.2	Very high	88.7	Confident	55 Å²	55	40.1 Å²	40.1	36%	0.357	22%	0.22	S	C	.	.	P	Polyproline II helix	trans	-67.6	148.7	-177.7	26.8	-32.7	0	0	0	112.1	R803 N804	P779-R803 HydrophobicContact CB-CB 3.99Å; P779-R803 HydrophobicContact CG-CB 4.24Å; P779-N804 WeakPolarHBondContact CA-OD1 3.43Å; P779-N804 WeakPolarHBondContact CB-OD1 3.45Å
780	V	90.4	Very high	88.4	Confident	12 Å²	12	40.1 Å²	40.1	7%	0.073	22%	0.22	C	C	.	.			trans	-127	152.1	-178.8	-62	0	0	0	0	111.1	T768 E770 I783 P801 N804	T768-V780 HydrophobicContact CG2-CG2 3.84Å; E770-V780 HydrophobicContact CB-CG1 4.29Å; V780-I783 HydrophobicContact CG2-CD1 3.71Å; V780-P801 HydrophobicContact CG2-CG 4.26Å; V780-N804 PolarHBondContact N-OD1 2.87Å; V780-N804 PolarHBondContact O-ND2 3.47Å
781	G	85.9	Confident	88	Confident	58 Å²	58	38.5 Å²	38.5	60%	0.598	21%	0.213	S	C	*	.	S	Bend	trans	-79.6	165.7	175.2	0	0	0	0	0	113.7	K786	G781-K786 PolarHBondContact O-NZ 2.9Å
782	G	83.9	Confident	87.2	Confident	29 Å²	29	41.3 Å²	41.3	30%	0.299	22%	0.223	S	C	.	.			trans	71.8	28.5	170.1	0	0	0	0	0	115	K784 D785 K786	G782-K784 VanDerWaalsContact C-N 3.33Å; G782-K784 PolarHBondContact O-N 3.17Å; G782-D785 PolarHBondContact O-N 3.47Å; G782-K786 WeakPolarHBondContact O-CB 3.47Å; G782-K786 VanDerWaalsContact O-CG 3.3Å; G782-K786 WeakPolarHBondContact O-CG 3.35Å; G782-K786 PolarHBondContact O-N 2.99Å
783	I	88	Confident	86.5	Confident	5 Å²	5	40.3 Å²	40.3	3%	0.026	22%	0.218	C	C	.	.	H	α-helix	trans	-55.8	-46.5	-176.8	-66.3	-67.9	0	0	0	111.7	T768 V780 D785 K786 V787 N804 D807	T768-I783 HydrophobicContact CG2-CD1 4.11Å; V780-I783 HydrophobicContact CG2-CD1 3.71Å; I783-D785 PolarHBondContact O-N 2.97Å; I783-K786 WeakPolarHBondContact O-CB 3.37Å; I783-K786 PolarHBondContact O-N 3.22Å; I783-V787 HydrophobicContact CG2-CG2 4.07Å; I783-V787 WeakPolarHBondContact O-CB 3.43Å; I783-V787 VanDerWaalsContact O-CG2 3.26Å; I783-V787 WeakPolarHBondContact O-CG2 3.48Å; I783-V787 PolarHBondContact O-N 3.17Å; I783-N804 HydrophobicContact CD1-CB 4.04Å; I783-N804 HydrophobicContact CG1-CB 3.95Å; I783-D807 HydrophobicContact CB-CB 4.21Å; I783-D807 HydrophobicContact CG1-CB 4.44Å; I783-D807 HydrophobicContact CG2-CB 4.43Å
784	K	83.9	Confident	86	Confident	33 Å²	33	37.8 Å²	37.8	14%	0.143	22%	0.219	C	C	.	.	H	α-helix	trans	-53.9	-54.1	178.7	-179.8	175.4	-178.7	156.2	0	112.6	G782 K786 V787 L788 E810	G782-K784 VanDerWaalsContact C-N 3.33Å; G782-K784 PolarHBondContact O-N 3.17Å; K784-K786 VanDerWaalsContact C-N 3.33Å; K784-K786 PolarHBondContact O-N 3.41Å; K784-V787 PolarHBondContact O-N 3.29Å; K784-L788 HydrophobicContact CG-CD1 4.22Å; K784-L788 VanDerWaalsContact O-CG 3.27Å; K784-L788 WeakPolarHBondContact O-CG 3.49Å; K784-L788 PolarHBondContact O-N 2.52Å; K784-E810 HydrophobicContact CD-CB 4.19Å; K784-E810 WeakPolarHBondContact CE-O 3.44Å; K784-E810 PolarHBondContact NZ-O 3.44Å
785	D	82.4	Confident	85.9	Confident	40 Å²	40	27.3 Å²	27.3	21%	0.214	18%	0.18	C	C	.	.	H	α-helix	trans	-64.3	-37.8	-179.2	-72.3	-40.6	0	0	0	112.5	W662 G667 G782 I783 A789	W662-D785 PolarHBondContact NE1-OD2 2.84Å; G667-D785 WeakPolarHBondContact CA-O 3.4Å; G782-D785 PolarHBondContact O-N 3.47Å; I783-D785 PolarHBondContact O-N 2.97Å; D785-A789 PolarHBondContact O-N 2.86Å
786	K	87.1	Confident	86	Confident	3 Å²	3	33.4 Å²	33.4	1%	0.013	21%	0.205	C	C	.	.	H	α-helix	trans	-63.3	-45.8	175.9	-76.5	176.3	176.3	179.7	0	111.4	L660 S743 T768 G781 G782 I783 K784 A789 A790	L660-K786 HydrophobicContact CB-CB 3.83Å; L660-K786 HydrophobicContact CB-CD 4.14Å; L660-K786 HydrophobicContact CB-CG 3.92Å; L660-K786 HydrophobicContact CD1-CB 4.08Å; L660-K786 WeakPolarHBondContact O-CE 3.27Å; S743-K786 PolarHBondContact OG-NZ 3.41Å; T768-K786 HydrophobicContact CG2-CD 4.12Å; T768-K786 PolarHBondContact OG1-NZ 2.99Å; G781-K786 PolarHBondContact O-NZ 2.9Å; G782-K786 WeakPolarHBondContact O-CB 3.47Å; G782-K786 VanDerWaalsContact O-CG 3.3Å; G782-K786 WeakPolarHBondContact O-CG 3.35Å; G782-K786 PolarHBondContact O-N 2.99Å; I783-K786 WeakPolarHBondContact O-CB 3.37Å; I783-K786 PolarHBondContact O-N 3.22Å; K784-K786 VanDerWaalsContact C-N 3.33Å; K784-K786 PolarHBondContact O-N 3.41Å; K786-A789 WeakPolarHBondContact O-CB 3.39Å; K786-A789 PolarHBondContact O-N 3.08Å; K786-A789 VanDerWaalsContact O-N 3.16Å; K786-A790 PolarHBondContact O-N 3.41Å
787	V	88.8	Confident	85.9	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.006	20%	0.195	C	C	.	.	H	α-helix	trans	-65.5	-42.6	177.5	172.4	0	0	0	0	111.2	I783 K784 A789 A790 H791 I798 I811 I815 L819 F821	I783-V787 HydrophobicContact CG2-CG2 4.07Å; I783-V787 WeakPolarHBondContact O-CB 3.43Å; I783-V787 VanDerWaalsContact O-CG2 3.26Å; I783-V787 WeakPolarHBondContact O-CG2 3.48Å; I783-V787 PolarHBondContact O-N 3.17Å; K784-V787 PolarHBondContact O-N 3.29Å; V787-A789 PolarHBondContact O-N 3.06Å; V787-A790 WeakPolarHBondContact O-CB 3.41Å; V787-A790 PolarHBondContact O-N 3.41Å; V787-A790 VanDerWaalsContact O-N 3.13Å; V787-H791 PolarHBondContact O-N 3.22Å; V787-I798 HydrophobicContact CB-CD1 4.19Å; V787-I798 HydrophobicContact CG1-CD1 3.8Å; V787-I798 HydrophobicContact CG2-CD1 4Å; V787-I811 HydrophobicContact CB-CD1 3.92Å; V787-I811 HydrophobicContact CG1-CD1 3.87Å; V787-I811 HydrophobicContact CG1-CG2 4.45Å; V787-I811 HydrophobicContact CG2-CD1 3.88Å; V787-I815 HydrophobicContact CG1-CG2 4.46Å; V787-L819 HydrophobicContact CG1-CD1 3.43Å; V787-L819 VanDerWaalsContact CG1-CD1 3.43Å; V787-F821 HydrophobicContact CG1-CE1 3.99Å; V787-F821 HydrophobicContact CG1-CZ 3.88Å; V787-F821 HydrophobicContact CG2-CE1 3.84Å
788	L	82.9	Confident	85.8	Confident	14 Å²	14	31.2 Å²	31.2	7%	0.073	19%	0.192	C	C	.	.	H	α-helix	trans	-59.9	-32.9	173.1	-70.3	175.2	0	0	0	112.3	T514 K784 R792 I815	T514-L788 HydrophobicContact CG2-CD2 4.37Å; K784-L788 HydrophobicContact CG-CD1 4.22Å; K784-L788 VanDerWaalsContact O-CG 3.27Å; K784-L788 WeakPolarHBondContact O-CG 3.49Å; K784-L788 PolarHBondContact O-N 2.52Å; L788-R792 WeakPolarHBondContact O-CB 3.38Å; L788-R792 VanDerWaalsContact O-CG 3.23Å; L788-R792 WeakPolarHBondContact O-CG 3.49Å; L788-R792 PolarHBondContact O-N 3.29Å; L788-R792 VanDerWaalsContact O-N 3.16Å; L788-R792 PolarHBondContact O-NE 3.34Å; L788-R792 VanDerWaalsContact O-NE 3.08Å; L788-I815 HydrophobicContact CD2-CD1 3.2Å
789	A	82	Confident	85.9	Confident	5 Å²	5	29.2 Å²	29.2	4%	0.041	18%	0.181	C	C	.	.	H	α-helix	trans	-71	-41.5	174.1	0	0	0	0	0	112.8	G667 D785 K786 V787 R792 A793	G667-A789 WeakPolarHBondContact O-CB 3.47Å; D785-A789 PolarHBondContact O-N 2.86Å; K786-A789 WeakPolarHBondContact O-CB 3.39Å; K786-A789 PolarHBondContact O-N 3.08Å; K786-A789 VanDerWaalsContact O-N 3.16Å; V787-A789 PolarHBondContact O-N 3.06Å; A789-R792 PolarHBondContact O-N 3.49Å; A789-A793 PolarHBondContact O-N 2.66Å; A789-A793 VanDerWaalsContact O-N 3.12Å
790	A	86.3	Confident	86.1	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-61.4	-47.5	175.7	0	0	0	0	0	111.5	L660 A766 K786 V787 R792 A793 G794 L795 I798	L660-A790 HydrophobicContact CD1-CB 4.17Å; L660-A790 HydrophobicContact CD2-CB 3.79Å; A766-A790 HydrophobicContact CB-CB 4.37Å; K786-A790 PolarHBondContact O-N 3.41Å; V787-A790 WeakPolarHBondContact O-CB 3.41Å; V787-A790 PolarHBondContact O-N 3.41Å; V787-A790 VanDerWaalsContact O-N 3.13Å; A790-R792 PolarHBondContact O-N 3.12Å; A790-A793 CarbonylContact O-C 3.57Å; A790-A793 WeakPolarHBondContact O-CA 3.46Å; A790-A793 WeakPolarHBondContact O-CB 3.41Å; A790-A793 PolarHBondContact O-N 2.91Å; A790-G794 PolarHBondContact O-N 2.96Å; A790-L795 HydrophobicContact CB-CB 4.38Å; A790-L795 HydrophobicContact CB-CD1 4.32Å; A790-L795 PolarHBondContact O-N 3.36Å; A790-L795 VanDerWaalsContact O-N 3.14Å; A790-I798 HydrophobicContact CB-CD1 3.5Å; A790-I798 HydrophobicContact CB-CG1 4.11Å
791	H	84.6	Confident	86.3	Confident	31 Å²	31	26.1 Å²	26.1	14%	0.144	16%	0.161	C	C	.	.	H	α-helix	trans	-58.7	-46	176.5	-176.3	-103.9	0	0	0	112	V787 A793 G794 I815 D818 L819	V787-H791 PolarHBondContact O-N 3.22Å; H791-A793 PolarHBondContact O-N 3.24Å; H791-G794 PolarHBondContact O-N 3.48Å; H791-I815 HydrophobicContact CB-CG2 4.13Å; H791-D818 IonicContact NE2-OD2 3.63Å; H791-L819 HydrophobicContact CB-CD1 4.27Å
792	R	77.7	Confident	86.7	Confident	64 Å²	64	28.2 Å²	28.2	24%	0.242	16%	0.155	C	C	.	.	H	α-helix	trans	-61.6	-27.6	176.3	-76.6	179.7	-63.3	161.1	4	113.4	Q515 E558 G667 L788 A789 A790 G794	Q515-R792 PolarHBondContact NE2-O 3.06Å; E558-R792 PolarHBondContact O-NH1 2.93Å; G667-R792 PolarHBondContact O-NH2 3.45Å; L788-R792 WeakPolarHBondContact O-CB 3.38Å; L788-R792 VanDerWaalsContact O-CG 3.23Å; L788-R792 WeakPolarHBondContact O-CG 3.49Å; L788-R792 PolarHBondContact O-N 3.29Å; L788-R792 VanDerWaalsContact O-N 3.16Å; L788-R792 PolarHBondContact O-NE 3.34Å; L788-R792 VanDerWaalsContact O-NE 3.08Å; A789-R792 PolarHBondContact O-N 3.49Å; A790-R792 PolarHBondContact O-N 3.12Å; R792-G794 VanDerWaalsContact C-N 3.29Å
793	A	76.9	Confident	87	Confident	15 Å²	15	35.3 Å²	35.3	12%	0.124	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-3.3	175.6	0	0	0	0	0	113.3	I669 A789 A790 H791 L795	I669-A793 HydrophobicContact CD1-CB 3.87Å; I669-A793 HydrophobicContact CG1-CB 4.46Å; I669-A793 HydrophobicContact CG2-CB 3.82Å; A789-A793 PolarHBondContact O-N 2.66Å; A789-A793 VanDerWaalsContact O-N 3.12Å; A790-A793 CarbonylContact O-C 3.57Å; A790-A793 WeakPolarHBondContact O-CA 3.46Å; A790-A793 WeakPolarHBondContact O-CB 3.41Å; A790-A793 PolarHBondContact O-N 2.91Å; H791-A793 PolarHBondContact O-N 3.24Å; A793-L795 HydrophobicContact CB-CD1 4.37Å; A793-L795 HydrophobicContact CB-CG 4.24Å
794	G	78.4	Confident	87.2	Confident	58 Å²	58	35.4 Å²	35.4	60%	0.598	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	78	18.3	-179.3	0	0	0	0	0	114.3	A790 H791 R792	A790-G794 PolarHBondContact O-N 2.96Å; H791-G794 PolarHBondContact O-N 3.48Å; R792-G794 VanDerWaalsContact C-N 3.29Å
795	L	85.8	Confident	87.5	Confident	5 Å²	5	38.8 Å²	38.8	3%	0.026	19%	0.19	C	C	.	.			trans	-78.9	139.3	177	-59.7	173.3	0	0	0	110	V647 I658 I669 A766 A790 A793 L819	V647-L795 HydrophobicContact CG1-CD2 3.89Å; I658-L795 HydrophobicContact CD1-CD1 4.24Å; I658-L795 HydrophobicContact CD1-CD2 3.79Å; I658-L795 HydrophobicContact CG2-CD1 3.92Å; I669-L795 HydrophobicContact CG2-CD1 4.22Å; A766-L795 HydrophobicContact CB-CD1 3.44Å; A766-L795 VanDerWaalsContact CB-CD1 3.44Å; A790-L795 HydrophobicContact CB-CB 4.38Å; A790-L795 HydrophobicContact CB-CD1 4.32Å; A790-L795 PolarHBondContact O-N 3.36Å; A790-L795 VanDerWaalsContact O-N 3.14Å; A793-L795 HydrophobicContact CB-CD1 4.37Å; A793-L795 HydrophobicContact CB-CG 4.24Å; L795-L819 WeakPolarHBondContact O-CD2 3.48Å
796	K	87.6	Confident	87.8	Confident	134 Å²	134	44 Å²	44	58%	0.583	21%	0.211	S	C	*	.			trans	-102.4	-29.6	-174.7	-66.7	-173.3	177.4	-175	0	113.2	D764 S820	D764-K796 PolarHBondContact O-N 3.42Å; D764-K796 VanDerWaalsContact O-N 3.12Å; K796-S820 PolarHBondContact O-N 3.34Å
797	H	91.1	Very high	87.8	Confident	48 Å²	48	45.8 Å²	45.8	22%	0.222	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	130.7	-174.9	-65.9	81.7	0	0	0	109.9	R762 D764 V765 A766 S820	R762-H797 PolarHBondContact NH2-CE1 3.45Å; R762-H797 PolarHBondContact NH2-ND1 3.44Å; D764-H797 PolarHBondContact O-N 3.28Å; D764-H797 IonicContact OD2-CE1 2.86Å; D764-H797 PolarHBondContact OD2-CE1 2.96Å; D764-H797 IonicContact OD2-CG 3.62Å; D764-H797 IonicContact OD2-ND1 3.46Å; D764-H797 PolarHBondContact OD2-ND1 3.04Å; V765-H797 WeakPolarHBondContact CA-O 3.48Å; V765-H797 HydrophobicContact CB-CB 4.47Å; V765-H797 HydrophobicContact CG2-CB 3.74Å; A766-H797 PolarHBondContact N-O 2.85Å; H797-S820 WeakPolarHBondContact CA-O 3.49Å
798	I	93.9	Very high	87.6	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	122.6	179.4	-53.2	-177.3	0	0	0	110.1	L660 A766 V787 A790 I800 L819 S820 F821 V822	L660-I798 HydrophobicContact CD1-CG2 3.93Å; A766-I798 CarbonylContact O-C 3.34Å; A766-I798 WeakPolarHBondContact O-CA 3.14Å; V787-I798 HydrophobicContact CB-CD1 4.19Å; V787-I798 HydrophobicContact CG1-CD1 3.8Å; V787-I798 HydrophobicContact CG2-CD1 4Å; A790-I798 HydrophobicContact CB-CD1 3.5Å; A790-I798 HydrophobicContact CB-CG1 4.11Å; I798-I800 HydrophobicContact CG2-CG2 3.75Å; I798-L819 HydrophobicContact CD1-CD1 3.71Å; I798-L819 HydrophobicContact CD1-CD2 4.32Å; I798-S820 PolarHBondContact N-O 3.49Å; I798-F821 HydrophobicContact CB-CD1 4.18Å; I798-F821 HydrophobicContact CB-CE1 4.32Å; I798-F821 HydrophobicContact CD1-CE1 4.17Å; I798-F821 WeakPolarHBondContact O-CA 3.43Å; I798-V822 PolarHBondContact O-N 3.22Å
799	I	94.7	Very high	87.6	Confident	3 Å²	3	53.1 Å²	53.1	2%	0.015	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	122.4	173.2	-53.6	171.3	0	0	0	108.9	V765 A766 M767 T768 V822 A824 V830 A833 A834	V765-I799 HydrophobicContact CG1-CD1 3.71Å; V765-I799 HydrophobicContact CG1-CG1 4.01Å; A766-I799 PolarHBondContact O-N 3.37Å; M767-I799 WeakPolarHBondContact CA-O 3.46Å; M767-I799 HydrophobicContact CB-CB 3.88Å; M767-I799 HydrophobicContact CB-CD1 4.39Å; M767-I799 HydrophobicContact CE-CD1 4.37Å; T768-I799 PolarHBondContact N-O 3.01Å; I799-V822 WeakPolarHBondContact CA-O 3.23Å; I799-V822 HydrophobicContact CG1-CB 4.31Å; I799-A824 HydrophobicContact CG2-CB 4.13Å; I799-V830 HydrophobicContact CD1-CG1 4.03Å; I799-V830 HydrophobicContact CG2-CB 4.47Å; I799-V830 HydrophobicContact CG2-CG1 4.17Å; I799-V830 HydrophobicContact CG2-CG2 4.1Å; I799-A833 HydrophobicContact CD1-CB 3.76Å; I799-A833 HydrophobicContact CG1-CB 4.14Å; I799-A834 HydrophobicContact CD1-CB 4.11Å
800	I	94.8	Very high	87.5	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.01	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	157.4	179.5	66.6	178.6	0	0	0	111.1	I798 L808 F821 V822 T823 A824	I798-I800 HydrophobicContact CG2-CG2 3.75Å; I800-L808 HydrophobicContact CD1-CD1 3.89Å; I800-L808 HydrophobicContact CD1-CD2 3.81Å; I800-L808 HydrophobicContact CD1-CG 3.98Å; I800-F821 HydrophobicContact CD1-CD1 4.33Å; I800-V822 PolarHBondContact N-O 3.1Å; I800-T823 HydrophobicContact CD1-CG2 4.2Å; I800-T823 HydrophobicContact CG1-CG2 4.04Å; I800-T823 CarbonylContact O-C 3.58Å; I800-T823 WeakPolarHBondContact O-CA 3.35Å; I800-A824 PolarHBondContact O-N 2.73Å
801	P	95.4	Very high	87.3	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	140	172.4	-19.9	34.3	0	0	0	110.9	T768 V777 L778 V780 R803 N804 A824	T768-P801 WeakPolarHBondContact O-CD 3.38Å; V777-P801 HydrophobicContact CG1-CB 3.92Å; V777-P801 HydrophobicContact CG1-CG 3.89Å; L778-P801 VanDerWaalsContact O-CG 3.26Å; L778-P801 WeakPolarHBondContact O-CG 3.48Å; V780-P801 HydrophobicContact CG2-CG 4.26Å; P801-R803 PolarHBondContact O-N 3.32Å; P801-R803 VanDerWaalsContact O-N 3.17Å; P801-N804 WeakPolarHBondContact CG-OD1 3.19Å; P801-N804 WeakPolarHBondContact O-CB 3.47Å; P801-N804 PolarHBondContact O-N 3Å; P801-A824 CarbonylContact C-O 3.54Å; P801-A824 WeakPolarHBondContact CA-O 3.47Å
802	Q	94.1	Very high	87	Confident	103 Å²	103	58 Å²	58	48%	0.481	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-55.7	-36.7	179.9	-171.6	-179.1	28.3	0	0	112.8	N804 E805 A824	Q802-N804 PolarHBondContact O-N 3.11Å; Q802-N804 VanDerWaalsContact O-N 3.17Å; Q802-E805 WeakPolarHBondContact O-CB 3.26Å; Q802-E805 PolarHBondContact O-N 3.12Å; Q802-E805 VanDerWaalsContact O-N 3.15Å; Q802-A824 PolarHBondContact N-O 3.21Å
803	R	91.6	Very high	87	Confident	178 Å²	178	58.4 Å²	58.4	67%	0.672	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-68.2	-12.7	179.3	-65.4	-174.2	-175.2	-177.8	1.1	114.4	P779 P801	P779-R803 HydrophobicContact CB-CB 3.99Å; P779-R803 HydrophobicContact CG-CB 4.24Å; P801-R803 PolarHBondContact O-N 3.32Å; P801-R803 VanDerWaalsContact O-N 3.17Å
804	N	92.3	Very high	87	Confident	6 Å²	6	62 Å²	62	3%	0.032	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-93.4	3.6	175.7	-75.7	114.6	0	0	0	113.2	P779 V780 I783 P801 Q802 K806 D807	P779-N804 WeakPolarHBondContact CA-OD1 3.43Å; P779-N804 WeakPolarHBondContact CB-OD1 3.45Å; V780-N804 PolarHBondContact N-OD1 2.87Å; V780-N804 PolarHBondContact O-ND2 3.47Å; I783-N804 HydrophobicContact CD1-CB 4.04Å; I783-N804 HydrophobicContact CG1-CB 3.95Å; P801-N804 WeakPolarHBondContact CG-OD1 3.19Å; P801-N804 WeakPolarHBondContact O-CB 3.47Å; P801-N804 PolarHBondContact O-N 3Å; Q802-N804 PolarHBondContact O-N 3.11Å; Q802-N804 VanDerWaalsContact O-N 3.17Å; N804-K806 PolarHBondContact O-N 3.05Å; N804-D807 PolarHBondContact ND2-OD2 2.92Å; N804-D807 WeakPolarHBondContact O-CB 3.49Å; N804-D807 PolarHBondContact O-N 2.83Å
805	E	89.8	Confident	87.1	Confident	104 Å²	104	59.4 Å²	59.4	49%	0.486	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-56.9	-37.5	-179.8	-174.3	175.7	-176.1	0	0	112.7	Q802 D807 L808 T823	Q802-E805 WeakPolarHBondContact O-CB 3.26Å; Q802-E805 PolarHBondContact O-N 3.12Å; Q802-E805 VanDerWaalsContact O-N 3.15Å; E805-D807 PolarHBondContact O-N 2.87Å; E805-L808 HydrophobicContact CG-CD1 4.37Å; E805-L808 VanDerWaalsContact O-CB 3.24Å; E805-L808 WeakPolarHBondContact O-CB 3.48Å; E805-L808 WeakPolarHBondContact O-CG 3.18Å; E805-L808 PolarHBondContact O-N 3.13Å; E805-L808 VanDerWaalsContact O-N 3.11Å; E805-T823 HydrophobicContact CB-CG2 4.33Å; E805-T823 HydrophobicContact CG-CG2 4.41Å
806	K	88.7	Confident	87	Confident	151 Å²	151	64.7 Å²	64.7	66%	0.657	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-57.4	-29.9	174.2	62.6	178.2	-175.7	173	0	113.8	N804 L808 E809	N804-K806 PolarHBondContact O-N 3.05Å; K806-L808 PolarHBondContact O-N 2.88Å; K806-E809 PolarHBondContact O-N 2.64Å
807	D	87.1	Confident	86.8	Confident	40 Å²	40	65.9 Å²	65.9	21%	0.214	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-78	-11.3	-176.8	-52.7	-37	0	0	0	111.4	I783 N804 E805 E809 E810	I783-D807 HydrophobicContact CB-CB 4.21Å; I783-D807 HydrophobicContact CG1-CB 4.44Å; I783-D807 HydrophobicContact CG2-CB 4.43Å; N804-D807 PolarHBondContact ND2-OD2 2.92Å; N804-D807 WeakPolarHBondContact O-CB 3.49Å; N804-D807 PolarHBondContact O-N 2.83Å; E805-D807 PolarHBondContact O-N 2.87Å; D807-E809 PolarHBondContact O-N 2.97Å; D807-E810 PolarHBondContact O-N 3.44Å
808	L	84.8	Confident	86.5	Confident	7 Å²	7	68 Å²	68	4%	0.037	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-67	-21.1	174.7	-64.1	178.2	0	0	0	112.8	I800 E805 K806 E810 I811 F821	I800-L808 HydrophobicContact CD1-CD1 3.89Å; I800-L808 HydrophobicContact CD1-CD2 3.81Å; I800-L808 HydrophobicContact CD1-CG 3.98Å; E805-L808 HydrophobicContact CG-CD1 4.37Å; E805-L808 VanDerWaalsContact O-CB 3.24Å; E805-L808 WeakPolarHBondContact O-CB 3.48Å; E805-L808 WeakPolarHBondContact O-CG 3.18Å; E805-L808 PolarHBondContact O-N 3.13Å; E805-L808 VanDerWaalsContact O-N 3.11Å; K806-L808 PolarHBondContact O-N 2.88Å; L808-E810 PolarHBondContact O-N 2.91Å; L808-I811 HydrophobicContact CD2-CD1 3.67Å; L808-I811 WeakPolarHBondContact O-CB 3.48Å; L808-I811 PolarHBondContact O-N 3.46Å; L808-F821 HydrophobicContact CD1-CB 4.44Å; L808-F821 HydrophobicContact CD1-CD1 4.48Å; L808-F821 HydrophobicContact CD1-CG 4.26Å; L808-F821 HydrophobicContact CD2-CD1 3.67Å; L808-F821 HydrophobicContact CD2-CE1 3.58Å; L808-F821 HydrophobicContact CD2-CE2 4.49Å; L808-F821 HydrophobicContact CD2-CG 4.17Å; L808-F821 HydrophobicContact CD2-CZ 4.02Å
809	E	83.3	Confident	86.2	Confident	162 Å²	162	68.5 Å²	68.5	76%	0.757	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-67.1	-21.7	174.7	-64.5	-175.4	178.9	0	0	112.6	K806 D807 I811	K806-E809 PolarHBondContact O-N 2.64Å; D807-E809 PolarHBondContact O-N 2.97Å; E809-I811 PolarHBondContact O-N 3.26Å
810	E	79.1	Confident	86	Confident	82 Å²	82	71 Å²	71	38%	0.383	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-78.8	-10.2	178.1	-57.7	-165.7	158.2	0	0	113.9	K784 D807 L808	K784-E810 HydrophobicContact CD-CB 4.19Å; K784-E810 WeakPolarHBondContact CE-O 3.44Å; K784-E810 PolarHBondContact NZ-O 3.44Å; D807-E810 PolarHBondContact O-N 3.44Å; L808-E810 PolarHBondContact O-N 2.91Å
811	I	82.8	Confident	85.9	Confident	10 Å²	10	73 Å²	73	5%	0.051	35%	0.352	C	S	.	.	S	Bend	trans	-89.2	133.4	-176.6	-53.9	178.8	0	0	0	109.1	V787 L808 E809 I815 F821	V787-I811 HydrophobicContact CB-CD1 3.92Å; V787-I811 HydrophobicContact CG1-CD1 3.87Å; V787-I811 HydrophobicContact CG1-CG2 4.45Å; V787-I811 HydrophobicContact CG2-CD1 3.88Å; L808-I811 HydrophobicContact CD2-CD1 3.67Å; L808-I811 WeakPolarHBondContact O-CB 3.48Å; L808-I811 PolarHBondContact O-N 3.46Å; E809-I811 PolarHBondContact O-N 3.26Å; I811-I815 HydrophobicContact CG2-CB 4.1Å; I811-I815 HydrophobicContact CG2-CG2 4.2Å; I811-F821 HydrophobicContact CD1-CE1 4.48Å; I811-F821 HydrophobicContact CD1-CZ 4.3Å
812	P	76.9	Confident	85.8	Confident	46 Å²	46	75.2 Å²	75.2	30%	0.299	37%	0.365	S	S	.	.			trans	-54.7	142.1	175.8	-25.5	34.5	0	0	0	112.8	N814 I815 R816	P812-N814 VanDerWaalsContact C-N 3.27Å; P812-N814 PolarHBondContact O-N 3.04Å; P812-I815 HydrophobicContact CB-CD1 4.16Å; P812-I815 HydrophobicContact CB-CG1 4.33Å; P812-I815 HydrophobicContact CG-CD1 3.96Å; P812-I815 PolarHBondContact O-N 3.41Å; P812-R816 PolarHBondContact O-N 3.48Å; P812-R816 VanDerWaalsContact O-N 3.16Å
813	S	78.6	Confident	85.8	Confident	73 Å²	73	72.7 Å²	72.7	51%	0.51	36%	0.357	S	S	.	.	H	α-helix	trans	-56.2	-39.2	-177	48	0	0	0	0	113.4	I815 R816 Q817	S813-I815 VanDerWaalsContact C-N 3.33Å; S813-I815 PolarHBondContact O-N 3.21Å; S813-R816 PolarHBondContact O-N 2.87Å; S813-Q817 WeakPolarHBondContact O-CG 3.34Å; S813-Q817 PolarHBondContact O-N 3.25Å
814	N	76.4	Confident	85.8	Confident	89 Å²	89	64.2 Å²	64.2	48%	0.476	33%	0.325	S	S	.	.	H	α-helix	trans	-60.3	-45.7	-177.7	-53.7	2.2	0	0	0	110.4	P812 R816 Q817 D818	P812-N814 VanDerWaalsContact C-N 3.27Å; P812-N814 PolarHBondContact O-N 3.04Å; N814-R816 VanDerWaalsContact C-N 3.34Å; N814-R816 PolarHBondContact O-N 2.9Å; N814-Q817 PolarHBondContact O-N 3.39Å; N814-D818 PolarHBondContact O-N 3.15Å
815	I	81.1	Confident	85.9	Confident	4 Å²	4	65.7 Å²	65.7	2%	0.021	34%	0.336	C	S	.	.	H	α-helix	trans	-69.4	-35.4	179.3	-52.7	174.7	0	0	0	111.1	T514 V787 L788 H791 I811 P812 S813 Q817 D818 L819	T514-I815 HydrophobicContact CG2-CD1 3.27Å; T514-I815 HydrophobicContact CG2-CG1 3.89Å; V787-I815 HydrophobicContact CG1-CG2 4.46Å; L788-I815 HydrophobicContact CD2-CD1 3.2Å; H791-I815 HydrophobicContact CB-CG2 4.13Å; I811-I815 HydrophobicContact CG2-CB 4.1Å; I811-I815 HydrophobicContact CG2-CG2 4.2Å; P812-I815 HydrophobicContact CB-CD1 4.16Å; P812-I815 HydrophobicContact CB-CG1 4.33Å; P812-I815 HydrophobicContact CG-CD1 3.96Å; P812-I815 PolarHBondContact O-N 3.41Å; S813-I815 VanDerWaalsContact C-N 3.33Å; S813-I815 PolarHBondContact O-N 3.21Å; I815-Q817 VanDerWaalsContact C-N 3.26Å; I815-Q817 PolarHBondContact O-N 2.83Å; I815-D818 PolarHBondContact O-N 3.3Å; I815-L819 HydrophobicContact CG2-CD1 3.65Å; I815-L819 HydrophobicContact CG2-CG 4.34Å; I815-L819 WeakPolarHBondContact O-CG 3.36Å; I815-L819 PolarHBondContact O-N 3.11Å
816	R	83.7	Confident	86.1	Confident	117 Å²	117	62.6 Å²	62.6	44%	0.442	33%	0.325	S	S	.	.	H	α-helix	trans	-67.7	-28.7	178.4	-171	176.4	178	173.9	0.1	112.1	P812 S813 N814 L819 F821	P812-R816 PolarHBondContact O-N 3.48Å; P812-R816 VanDerWaalsContact O-N 3.16Å; S813-R816 PolarHBondContact O-N 2.87Å; N814-R816 VanDerWaalsContact C-N 3.34Å; N814-R816 PolarHBondContact O-N 2.9Å; R816-L819 VanDerWaalsContact O-O 3.12Å; R816-F821 HydrophobicContact CG-CE2 4.02Å
817	Q	83.8	Confident	86.2	Confident	159 Å²	159	55.5 Å²	55.5	74%	0.743	29%	0.294	S	S	*	.	H	α-helix	trans	-76.6	-32.7	175.9	-71.6	174.8	-1	0	0	112.3	S813 N814 I815 L819	S813-Q817 WeakPolarHBondContact O-CG 3.34Å; S813-Q817 PolarHBondContact O-N 3.25Å; N814-Q817 PolarHBondContact O-N 3.39Å; I815-Q817 VanDerWaalsContact C-N 3.26Å; I815-Q817 PolarHBondContact O-N 2.83Å; Q817-L819 VanDerWaalsContact C-N 3.35Å
818	D	83.3	Confident	86.3	Confident	91 Å²	91	55.8 Å²	55.8	49%	0.487	30%	0.296	S	S	.	.	H	α-helix	trans	-78	-18.6	179.4	-70.7	-19.4	0	0	0	113.9	H791 N814 I815	H791-D818 IonicContact NE2-OD2 3.63Å; N814-D818 PolarHBondContact O-N 3.15Å; I815-D818 PolarHBondContact O-N 3.3Å
819	L	88.5	Confident	86.6	Confident	12 Å²	12	59.4 Å²	59.4	6%	0.063	31%	0.313	C	S	.	.			trans	-113.1	139.2	-175.3	-63.8	175.1	0	0	0	112.7	V787 H791 L795 I798 I815 R816 Q817 F821	V787-L819 HydrophobicContact CG1-CD1 3.43Å; V787-L819 VanDerWaalsContact CG1-CD1 3.43Å; H791-L819 HydrophobicContact CB-CD1 4.27Å; L795-L819 WeakPolarHBondContact O-CD2 3.48Å; I798-L819 HydrophobicContact CD1-CD1 3.71Å; I798-L819 HydrophobicContact CD1-CD2 4.32Å; I815-L819 HydrophobicContact CG2-CD1 3.65Å; I815-L819 HydrophobicContact CG2-CG 4.34Å; I815-L819 WeakPolarHBondContact O-CG 3.36Å; I815-L819 PolarHBondContact O-N 3.11Å; R816-L819 VanDerWaalsContact O-O 3.12Å; Q817-L819 VanDerWaalsContact C-N 3.35Å; L819-F821 HydrophobicContact CB-CE2 3.82Å; L819-F821 HydrophobicContact CB-CZ 3.95Å; L819-F821 HydrophobicContact CD1-CZ 3.97Å
820	S	91.3	Very high	87	Confident	56 Å²	56	51.8 Å²	51.8	39%	0.392	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	120	169.3	-177	0	0	0	0	110.4	K796 H797 I798	K796-S820 PolarHBondContact O-N 3.34Å; H797-S820 WeakPolarHBondContact CA-O 3.49Å; I798-S820 PolarHBondContact N-O 3.49Å
821	F	92.5	Very high	87.6	Confident	42 Å²	42	47.9 Å²	47.9	18%	0.184	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	132.8	177.3	-63.8	-85.8	0	0	0	111.1	V787 I798 I800 L808 I811 R816 L819	V787-F821 HydrophobicContact CG1-CE1 3.99Å; V787-F821 HydrophobicContact CG1-CZ 3.88Å; V787-F821 HydrophobicContact CG2-CE1 3.84Å; I798-F821 HydrophobicContact CB-CD1 4.18Å; I798-F821 HydrophobicContact CB-CE1 4.32Å; I798-F821 HydrophobicContact CD1-CE1 4.17Å; I798-F821 WeakPolarHBondContact O-CA 3.43Å; I800-F821 HydrophobicContact CD1-CD1 4.33Å; L808-F821 HydrophobicContact CD1-CB 4.44Å; L808-F821 HydrophobicContact CD1-CD1 4.48Å; L808-F821 HydrophobicContact CD1-CG 4.26Å; L808-F821 HydrophobicContact CD2-CD1 3.67Å; L808-F821 HydrophobicContact CD2-CE1 3.58Å; L808-F821 HydrophobicContact CD2-CE2 4.49Å; L808-F821 HydrophobicContact CD2-CG 4.17Å; L808-F821 HydrophobicContact CD2-CZ 4.02Å; I811-F821 HydrophobicContact CD1-CE1 4.48Å; I811-F821 HydrophobicContact CD1-CZ 4.3Å; R816-F821 HydrophobicContact CG-CE2 4.02Å; L819-F821 HydrophobicContact CB-CE2 3.82Å; L819-F821 HydrophobicContact CB-CZ 3.95Å; L819-F821 HydrophobicContact CD1-CZ 3.97Å
822	V	92.6	Very high	87.9	Confident	47 Å²	47	50.8 Å²	50.8	29%	0.285	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	114.7	170.3	-176.8	0	0	0	0	108.2	I798 I799 I800 A833	I798-V822 PolarHBondContact O-N 3.22Å; I799-V822 WeakPolarHBondContact CA-O 3.23Å; I799-V822 HydrophobicContact CG1-CB 4.31Å; I800-V822 PolarHBondContact N-O 3.1Å; V822-A833 HydrophobicContact CB-CB 4.39Å; V822-A833 HydrophobicContact CG1-CB 3.8Å; V822-A833 HydrophobicContact CG2-CB 4.43Å
823	T	93.6	Very high	88.5	Confident	51 Å²	51	49.7 Å²	49.7	31%	0.313	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	125.8	175.6	50.5	0	0	0	0	110	I800 E805	I800-T823 HydrophobicContact CD1-CG2 4.2Å; I800-T823 HydrophobicContact CG1-CG2 4.04Å; I800-T823 CarbonylContact O-C 3.58Å; I800-T823 WeakPolarHBondContact O-CA 3.35Å; E805-T823 HydrophobicContact CB-CG2 4.33Å; E805-T823 HydrophobicContact CG-CG2 4.41Å
824	A	92.4	Very high	89	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	135.4	179.3	0	0	0	0	0	111.9	I799 I800 P801 Q802 E829 V830	I799-A824 HydrophobicContact CG2-CB 4.13Å; I800-A824 PolarHBondContact O-N 2.73Å; P801-A824 CarbonylContact C-O 3.54Å; P801-A824 WeakPolarHBondContact CA-O 3.47Å; Q802-A824 PolarHBondContact N-O 3.21Å; A824-E829 WeakPolarHBondContact CA-OE2 3.39Å; A824-E829 HydrophobicContact CB-CB 4.06Å; A824-V830 HydrophobicContact CB-CG2 3.56Å
825	S	93.9	Very high	89.6	Confident	36 Å²	36	42.2 Å²	42.2	25%	0.252	22%	0.224	S	C	.	.	S	Bend	trans	-98.5	-31	172.6	68.6	0	0	0	0	112	V777 E829	V777-S825 PolarHBondContact N-O 3.06Å; S825-E829 PolarHBondContact N-OE2 2.95Å; S825-E829 PolarHBondContact OG-OE1 3.2Å; S825-E829 PolarHBondContact OG-OE2 3.49Å; S825-E829 VanDerWaalsContact OG-OE2 3.07Å
826	C	93.3	Very high	89.5	Confident	40 Å²	40	47.8 Å²	47.8	27%	0.27	25%	0.253	S	S	.	.	B	Isolated β-bridge	trans	-130.4	154.4	-176	-65.5	0	0	0	0	111.4	G775 D828 E829 V830	G775-C826 CarbonylContact O-C 3.58Å; G775-C826 WeakPolarHBondContact O-CA 3.32Å; C826-D828 PolarHBondContact O-N 3.14Å; C826-E829 PolarHBondContact O-N 2.8Å; C826-E829 VanDerWaalsContact O-N 3.14Å; C826-V830 PolarHBondContact O-N 3.43Å
827	L	91.3	Very high	89	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-60.6	-29.1	177.1	-76.9	176.6	0	0	0	113.4	W703 V746 V749 I771 G775 V777 E829 V830 L831	W703-L827 HydrophobicContact CD2-CD1 3.52Å; W703-L827 HydrophobicContact CE3-CD1 3.7Å; W703-L827 HydrophobicContact CG-CD1 4.06Å; W703-L827 HydrophobicContact CH2-CB 3.64Å; W703-L827 HydrophobicContact CH2-CD1 4.02Å; W703-L827 HydrophobicContact CH2-CG 4.49Å; W703-L827 HydrophobicContact CZ2-CB 3.67Å; W703-L827 HydrophobicContact CZ2-CD1 3.86Å; W703-L827 HydrophobicContact CZ2-CG 4.41Å; W703-L827 HydrophobicContact CZ3-CB 4.23Å; W703-L827 HydrophobicContact CZ3-CD1 3.95Å; V746-L827 HydrophobicContact CG1-CD2 4.43Å; V746-L827 HydrophobicContact CG2-CD2 4.06Å; V749-L827 HydrophobicContact CB-CD2 4.36Å; V749-L827 HydrophobicContact CG1-CD1 4.27Å; V749-L827 HydrophobicContact CG1-CD2 4.28Å; V749-L827 HydrophobicContact CG2-CD1 4.11Å; V749-L827 HydrophobicContact CG2-CD2 4.38Å; I771-L827 HydrophobicContact CB-CD1 4.5Å; I771-L827 HydrophobicContact CG2-CD1 4.29Å; I771-L827 HydrophobicContact CG2-CD2 3.77Å; I771-L827 HydrophobicContact CG2-CG 4.37Å; G775-L827 PolarHBondContact O-N 2.78Å; V777-L827 HydrophobicContact CG2-CD2 4.29Å; V777-L827 HydrophobicContact CG2-CG 4.49Å; L827-E829 VanDerWaalsContact C-N 3.3Å; L827-E829 PolarHBondContact O-N 3Å; L827-V830 WeakPolarHBondContact O-CB 3.47Å; L827-V830 PolarHBondContact O-N 3.28Å; L827-L831 WeakPolarHBondContact O-CG 3.48Å; L827-L831 PolarHBondContact O-N 3.13Å
828	D	89.9	Confident	88.5	Confident	46 Å²	46	39.4 Å²	39.4	25%	0.246	25%	0.246	C	C	.	.	H	α-helix	trans	-58.8	-41.5	175.5	-63	1.6	0	0	0	111.6	K710 Y711 C826 N832	K710-D828 IonicContact NZ-OD1 2.64Å; K710-D828 PolarHBondContact NZ-OD1 2.78Å; K710-D828 IonicContact NZ-OD2 3.31Å; K710-D828 PolarHBondContact NZ-OD2 3.3Å; Y711-D828 WeakPolarHBondContact OH-CB 3.43Å; Y711-D828 PolarHBondContact OH-OD1 2.94Å; C826-D828 PolarHBondContact O-N 3.14Å; D828-N832 WeakPolarHBondContact O-CB 3.28Å; D828-N832 PolarHBondContact O-N 3.16Å; D828-N832 PolarHBondContact O-ND2 2.79Å; D828-N832 VanDerWaalsContact O-ND2 3.08Å
829	E	90.9	Very high	88.1	Confident	84 Å²	84	35.3 Å²	35.3	39%	0.393	22%	0.224	S	C	.	.	H	α-helix	trans	-69.3	-38.2	178	-65.4	170.7	172.6	0	0	111.3	A824 S825 C826 L827 N832 A833	A824-E829 WeakPolarHBondContact CA-OE2 3.39Å; A824-E829 HydrophobicContact CB-CB 4.06Å; S825-E829 PolarHBondContact N-OE2 2.95Å; S825-E829 PolarHBondContact OG-OE1 3.2Å; S825-E829 PolarHBondContact OG-OE2 3.49Å; S825-E829 VanDerWaalsContact OG-OE2 3.07Å; C826-E829 PolarHBondContact O-N 2.8Å; C826-E829 VanDerWaalsContact O-N 3.14Å; L827-E829 VanDerWaalsContact C-N 3.3Å; L827-E829 PolarHBondContact O-N 3Å; E829-N832 PolarHBondContact O-N 3.43Å; E829-A833 WeakPolarHBondContact O-CB 3.26Å; E829-A833 PolarHBondContact O-N 3.39Å
830	V	91.5	Very high	86.7	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.006	25%	0.246	C	C	.	.	H	α-helix	trans	-61.7	-51.7	175.3	-178.4	0	0	0	0	110.4	V746 M767 V777 I799 A824 C826 L827 N832 A833 A834	V746-V830 HydrophobicContact CG1-CB 3.91Å; V746-V830 HydrophobicContact CG1-CG1 3.12Å; V746-V830 HydrophobicContact CG1-CG2 3.69Å; M767-V830 HydrophobicContact SD-CG1 4.3Å; V777-V830 HydrophobicContact CG2-CG2 3.99Å; I799-V830 HydrophobicContact CD1-CG1 4.03Å; I799-V830 HydrophobicContact CG2-CB 4.47Å; I799-V830 HydrophobicContact CG2-CG1 4.17Å; I799-V830 HydrophobicContact CG2-CG2 4.1Å; A824-V830 HydrophobicContact CB-CG2 3.56Å; C826-V830 PolarHBondContact O-N 3.43Å; L827-V830 WeakPolarHBondContact O-CB 3.47Å; L827-V830 PolarHBondContact O-N 3.28Å; V830-N832 VanDerWaalsContact C-N 3.27Å; V830-N832 PolarHBondContact O-N 3.01Å; V830-A833 PolarHBondContact O-N 3.04Å; V830-A833 VanDerWaalsContact O-N 3.1Å; V830-A834 VanDerWaalsContact O-CB 3.3Å; V830-A834 WeakPolarHBondContact O-CB 3.48Å; V830-A834 PolarHBondContact O-N 2.95Å
831	L	90.8	Very high	85.1	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-60.2	-41.6	180	-67.6	174.8	0	0	0	110.3	W703 Y711 V749 T750 A753 L827 A833 A834 F835 F839	W703-L831 HydrophobicContact CH2-CD1 4.19Å; W703-L831 HydrophobicContact CZ3-CD1 4.27Å; Y711-L831 HydrophobicContact CE1-CD1 4.22Å; Y711-L831 HydrophobicContact CE2-CD1 4.26Å; V749-L831 HydrophobicContact CG1-CD2 4.49Å; T750-L831 HydrophobicContact CG2-CD2 4.45Å; A753-L831 HydrophobicContact CB-CD2 3.77Å; L827-L831 WeakPolarHBondContact O-CG 3.48Å; L827-L831 PolarHBondContact O-N 3.13Å; L831-A833 VanDerWaalsContact C-N 3.3Å; L831-A833 PolarHBondContact O-N 2.85Å; L831-A834 PolarHBondContact O-N 3.06Å; L831-F835 HydrophobicContact CD2-CE2 3.98Å; L831-F835 VanDerWaalsContact O-CD2 3.31Å; L831-F835 WeakPolarHBondContact O-CD2 3.38Å; L831-F835 PolarHBondContact O-N 3.02Å; L831-F839 HydrophobicContact CB-CB 3.83Å; L831-F839 HydrophobicContact CB-CD1 4.05Å; L831-F839 HydrophobicContact CB-CG 4.03Å; L831-F839 HydrophobicContact CD1-CD1 4.04Å; L831-F839 HydrophobicContact CD1-CE1 4.25Å
832	N	90.2	Very high	82.8	Confident	71 Å²	71	44.3 Å²	44.3	38%	0.38	27%	0.266	S	S	.	.	H	α-helix	trans	-62	-35.9	175.6	-77.1	-36.9	0	0	0	113.8	D828 E829 V830 F839	D828-N832 WeakPolarHBondContact O-CB 3.28Å; D828-N832 PolarHBondContact O-N 3.16Å; D828-N832 PolarHBondContact O-ND2 2.79Å; D828-N832 VanDerWaalsContact O-ND2 3.08Å; E829-N832 PolarHBondContact O-N 3.43Å; V830-N832 VanDerWaalsContact C-N 3.27Å; V830-N832 PolarHBondContact O-N 3.01Å; N832-F839 WeakPolarHBondContact OD1-CA 3.06Å; N832-F839 PolarHBondContact OD1-N 2.96Å; N832-F839 PolarHBondContact OD1-O 3.03Å
833	A	88.8	Confident	80.1	Confident	23 Å²	23	47.8 Å²	47.8	19%	0.19	29%	0.287	C	S	.	.	H	α-helix	trans	-79.5	-26	178.6	0	0	0	0	0	113.6	I799 V822 E829 V830 L831	I799-A833 HydrophobicContact CD1-CB 3.76Å; I799-A833 HydrophobicContact CG1-CB 4.14Å; V822-A833 HydrophobicContact CB-CB 4.39Å; V822-A833 HydrophobicContact CG1-CB 3.8Å; V822-A833 HydrophobicContact CG2-CB 4.43Å; E829-A833 WeakPolarHBondContact O-CB 3.26Å; E829-A833 PolarHBondContact O-N 3.39Å; V830-A833 PolarHBondContact O-N 3.04Å; V830-A833 VanDerWaalsContact O-N 3.1Å; L831-A833 VanDerWaalsContact C-N 3.3Å; L831-A833 PolarHBondContact O-N 2.85Å
834	A	89.9	Confident	77.2	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-83.6	-20.7	-173.1	0	0	0	0	0	114.8	T750 V761 R762 M767 I799 V830 L831	T750-A834 HydrophobicContact CG2-CB 3.63Å; V761-A834 HydrophobicContact CG1-CB 4.45Å; R762-A834 WeakPolarHBondContact CB-O 3.49Å; R762-A834 WeakPolarHBondContact CG-O 3.49Å; R762-A834 PolarHBondContact N-O 3.12Å; M767-A834 HydrophobicContact CE-CB 4.06Å; I799-A834 HydrophobicContact CD1-CB 4.11Å; V830-A834 VanDerWaalsContact O-CB 3.3Å; V830-A834 WeakPolarHBondContact O-CB 3.48Å; V830-A834 PolarHBondContact O-N 2.95Å; L831-A834 PolarHBondContact O-N 3.06Å
835	F	88.4	Confident	74.5	Confident	6 Å²	6	63 Å²	63	3%	0.026	36%	0.357	C	S	.	.	B	Isolated β-bridge	trans	-113.5	145.1	-177.2	-67.5	-87.5	0	0	0	112.1	T750 R759 L760 V761 L831 G837 G838 F839	T750-F835 HydrophobicContact CG2-CE2 3.94Å; T750-F835 HydrophobicContact CG2-CZ 4.22Å; R759-F835 HydrophobicContact CB-CD1 3.76Å; R759-F835 HydrophobicContact CB-CE1 3.81Å; L760-F835 VanDerWaalsContact O-CD1 3.25Å; L760-F835 WeakPolarHBondContact O-CD1 3.44Å; V761-F835 HydrophobicContact CG2-CE1 3.96Å; V761-F835 HydrophobicContact CG2-CZ 4Å; L831-F835 HydrophobicContact CD2-CE2 3.98Å; L831-F835 VanDerWaalsContact O-CD2 3.31Å; L831-F835 WeakPolarHBondContact O-CD2 3.38Å; L831-F835 PolarHBondContact O-N 3.02Å; F835-G837 PolarHBondContact O-N 3.17Å; F835-G838 PolarHBondContact O-N 3.05Å; F835-F839 HydrophobicContact CB-CD2 4.42Å; F835-F839 HydrophobicContact CD1-CD2 4.43Å; F835-F839 HydrophobicContact CD2-CB 4.29Å; F835-F839 AromaticContact CD2-CD2 3.47Å; F835-F839 HydrophobicContact CD2-CD2 3.47Å; F835-F839 VanDerWaalsContact CD2-CD2 3.47Å; F835-F839 HydrophobicContact CD2-CE2 4.12Å; F835-F839 HydrophobicContact CD2-CG 4.16Å; F835-F839 AromaticContact CE2-CD2 3.73Å; F835-F839 HydrophobicContact CE2-CD2 3.73Å; F835-F839 AromaticContact CE2-CE2 3.94Å; F835-F839 HydrophobicContact CE2-CE2 3.94Å; F835-F839 HydrophobicContact CE2-CG 4.49Å; F835-F839 AromaticContact CG-CD2 3.86Å; F835-F839 HydrophobicContact CG-CD2 3.86Å; F835-F839 HydrophobicContact CG-CE2 4.5Å; F835-F839 HydrophobicContact CZ-CD2 4.32Å; F835-F839 HydrophobicContact CZ-CE2 4.15Å
836	D	79.2	Confident	71.8	Confident	121 Å²	121	64.1 Å²	64.1	65%	0.647	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	128.1	174.7	-76.9	-34.9	0	0	0	111.3	R762 G838	R762-D836 VanDerWaalsContact CD-OD1 3.23Å; R762-D836 WeakPolarHBondContact CD-OD1 3.05Å; R762-D836 VanDerWaalsContact CG-OD1 3.25Å; R762-D836 WeakPolarHBondContact CG-OD1 3.42Å; R762-D836 IonicContact CZ-OD1 3.7Å; R762-D836 IonicContact NE-OD1 2.84Å; R762-D836 IonicContact NH1-OD1 3.8Å; D836-G838 VanDerWaalsContact C-N 3.28Å; D836-G838 PolarHBondContact O-N 3.04Å
837	G	72.4	Confident	69	Low	82 Å²	82	70.1 Å²	70.1	85%	0.845	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	6	-176.4	0	0	0	0	0	115.1	F835	F835-G837 PolarHBondContact O-N 3.17Å
838	G	74.4	Confident	66.4	Low	17 Å²	17	77.4 Å²	77.4	18%	0.175	44%	0.44	C	S	.	.			trans	79.6	163.4	179.9	0	0	0	0	0	114.2	R759 F835 D836 T840	R759-G838 PolarHBondContact NH1-O 2.93Å; F835-G838 PolarHBondContact O-N 3.05Å; D836-G838 VanDerWaalsContact C-N 3.28Å; D836-G838 PolarHBondContact O-N 3.04Å; G838-T840 PolarHBondContact O-N 3.37Å
839	F	75.1	Confident	64.1	Low	6 Å²	6	83.2 Å²	83.2	3%	0.026	47%	0.471	C	S	.	.			trans	-101.9	73.5	-179.6	-153.9	-102.2	0	0	0	108.8	Y711 L713 A753 L831 N832 F835 V841	Y711-F839 AromaticContact CD1-CD1 3.31Å; Y711-F839 HydrophobicContact CD1-CD1 3.31Å; Y711-F839 AromaticContact CD1-CE1 3.33Å; Y711-F839 HydrophobicContact CD1-CE1 3.33Å; Y711-F839 AromaticContact CE1-CD1 3.62Å; Y711-F839 HydrophobicContact CE1-CD1 3.62Å; Y711-F839 HydrophobicContact CE1-CE1 4.06Å; Y711-F839 HydrophobicContact CG-CD1 4.17Å; Y711-F839 AromaticContact CG-CE1 3.74Å; Y711-F839 HydrophobicContact CG-CE1 3.74Å; L713-F839 HydrophobicContact CD2-CZ 3.99Å; A753-F839 HydrophobicContact CB-CZ 4.33Å; L831-F839 HydrophobicContact CB-CB 3.83Å; L831-F839 HydrophobicContact CB-CD1 4.05Å; L831-F839 HydrophobicContact CB-CG 4.03Å; L831-F839 HydrophobicContact CD1-CD1 4.04Å; L831-F839 HydrophobicContact CD1-CE1 4.25Å; N832-F839 WeakPolarHBondContact OD1-CA 3.06Å; N832-F839 PolarHBondContact OD1-N 2.96Å; N832-F839 PolarHBondContact OD1-O 3.03Å; F835-F839 HydrophobicContact CB-CD2 4.42Å; F835-F839 HydrophobicContact CD1-CD2 4.43Å; F835-F839 HydrophobicContact CD2-CB 4.29Å; F835-F839 AromaticContact CD2-CD2 3.47Å; F835-F839 HydrophobicContact CD2-CD2 3.47Å; F835-F839 VanDerWaalsContact CD2-CD2 3.47Å; F835-F839 HydrophobicContact CD2-CE2 4.12Å; F835-F839 HydrophobicContact CD2-CG 4.16Å; F835-F839 AromaticContact CE2-CD2 3.73Å; F835-F839 HydrophobicContact CE2-CD2 3.73Å; F835-F839 AromaticContact CE2-CE2 3.94Å; F835-F839 HydrophobicContact CE2-CE2 3.94Å; F835-F839 HydrophobicContact CE2-CG 4.49Å; F835-F839 AromaticContact CG-CD2 3.86Å; F835-F839 HydrophobicContact CG-CD2 3.86Å; F835-F839 HydrophobicContact CG-CE2 4.5Å; F835-F839 HydrophobicContact CZ-CD2 4.32Å; F835-F839 HydrophobicContact CZ-CE2 4.15Å; F839-V841 PolarHBondContact O-N 3.45Å
840	T	59.6	Low	61.6	Low	86 Å²	86	83.7 Å²	83.7	53%	0.528	48%	0.484	S	S	.	.			trans	-50.3	111.4	-170.1	54.4	0	0	0	0	113.3	G838 K842	G838-T840 PolarHBondContact O-N 3.37Å; T840-K842 PolarHBondContact O-N 2.83Å
841	V	57.3	Low	59.2	Low	45 Å²	45	93 Å²	93	27%	0.273	52%	0.524	S	S	.	.			trans	-78	110.2	159.9	-178.7	0	0	0	0	106.4	K710 Y711 F839 T843	K710-V841 HydrophobicContact CD-CG1 4.45Å; K710-V841 HydrophobicContact CG-CG1 3.88Å; Y711-V841 HydrophobicContact CD1-CG2 4.16Å; Y711-V841 HydrophobicContact CE1-CG2 3.43Å; Y711-V841 VanDerWaalsContact CE1-CG2 3.43Å; F839-V841 PolarHBondContact O-N 3.45Å; V841-T843 VanDerWaalsContact C-N 3.26Å; V841-T843 PolarHBondContact O-N 3.25Å
842	K	42.8	Very low	56.5	Low	168 Å²	168	104.8 Å²	104.8	73%	0.73	59%	0.586	S	S	*	*			trans	-70.8	92.4	165.2	-81.6	-173	177.9	179.7	0	107.3	T840 R844	T840-K842 PolarHBondContact O-N 2.83Å; K842-R844 PolarHBondContact O-N 2.95Å
843	T	36.8	Very low	54.8	Low	119 Å²	119	106.5 Å²	106.5	73%	0.73	60%	0.596	S	S	*	*			trans	-54.4	128.1	159.9	36	0	0	0	0	107.5	V841	V841-T843 VanDerWaalsContact C-N 3.26Å; V841-T843 PolarHBondContact O-N 3.25Å
844	R	32	Very low	53.1	Low	233 Å²	233	110.8 Å²	110.8	88%	0.879	62%	0.617	S	S	*	*			trans	-47.3	128.9	173.9	-75.6	177.9	173.5	175.1	-3.1	108.8	K842 G846	K842-R844 PolarHBondContact O-N 2.95Å; R844-G846 PolarHBondContact O-N 3.09Å; R844-G846 VanDerWaalsContact O-N 3.09Å
845	P	35.4	Very low	51	Low	138 Å²	138	117 Å²	117	90%	0.896	65%	0.652	S	S	*	*	S	Bend	trans	-71.6	106.3	168.2	29	-28	0	0	0	106.8
846	G	38.5	Very low	48.8	Very low	59 Å²	59	123.5 Å²	123.5	61%	0.608	69%	0.688	S	S	*	*			trans	145.7	78.6	175.7	0	0	0	0	0	113.8	R844	R844-G846 PolarHBondContact O-N 3.09Å; R844-G846 VanDerWaalsContact O-N 3.09Å
847	L	33.3	Very low	46.9	Very low	167 Å²	167	123.7 Å²	123.7	87%	0.874	69%	0.691	S	S	*	*			trans	-168.2	83	135.1	-99.3	151.8	0	0	0	105.8
848	I	36.4	Very low	45.2	Very low	153 Å²	153	126.5 Å²	126.5	79%	0.785	68%	0.681	S	S	*	*			trans	-52.7	136.9	160.7	-68.5	164	0	0	0	107	S850	I848-S850 PolarHBondContact O-N 3.03Å
849	D	42.9	Very low	43.1	Very low	168 Å²	168	134.3 Å²	134.3	90%	0.898	72%	0.717	S	S	*	*			trans	-39.9	107.2	166	-75.9	-43.9	0	0	0	110.6
850	S	38.7	Very low	40.7	Very low	94 Å²	94	144.2 Å²	144.2	66%	0.657	77%	0.77	S	S	*	*			trans	-135.3	96.8	165	72.1	0	0	0	0	109	I848	I848-S850 PolarHBondContact O-N 3.03Å
851	K	39.9	Very low	39.1	Very low	196 Å²	196	149 Å²	149	85%	0.852	79%	0.79	S	S	*	*			trans	94.3	117.4	157.7	-60.7	-178.6	176.3	179.8	0	117.8
852	L	35.1	Very low	37.4	Very low	248 Å²	248	158.5 Å²	158.5	100%	1.298	84%	0.837	S	S	*	*			trans	91.8	0	153.6	-68.4	160.6	0	0	0	117.1

Retrieved 852 of 852 residues in 653.1 ms (Link to these results)

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